#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4m h PRO 6 N 0.00 0.05 0.00 3.69 0.11 -2.02 -3.37 132.00 130.45 2c4m h PRO 6 Ca 0.00 -0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.89 2c4m h PRO 6 Cb 0.00 -0.01 -0.14 0.00 0.11 0.00 0.00 31.00 30.95 2c4m h PRO 6 CO 0.00 0.03 -0.41 -0.11 -0.21 0.00 0.00 178.00 177.31 2c4m n LEU 7 N -5.41 -2.38 -4.76 2.35 7.94 -1.26 -5.09 117.00 108.40 2c4m n LEU 7 Ca 0.11 -3.44 -0.32 0.00 -1.11 0.00 0.00 56.01 51.25 2c4m n LEU 7 Cb 0.42 0.91 0.07 0.00 0.53 0.00 0.00 43.42 45.35 2c4m n LEU 7 CO 0.03 2.01 0.72 -2.16 -1.11 0.00 0.00 177.39 176.89 2c4m s PRO 8 N 0.35 2.47 0.43 1.96 0.04 -1.26 -4.60 135.00 134.40 2c4m s PRO 8 Ca 0.24 1.30 0.11 0.00 0.04 0.00 0.00 61.00 62.70 2c4m s PRO 8 Cb 0.27 -1.91 0.99 0.00 0.04 0.00 0.00 34.50 33.88 2c4m s PRO 8 CO -0.11 -1.49 2.04 0.00 0.04 0.00 0.00 177.00 177.48 2c4m h ALA 9 N -0.57 1.88 -0.40 8.56 0.00 -1.91 -1.48 119.26 125.34 2c4m h ALA 9 Ca -0.45 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.50 2c4m h ALA 9 Cb 1.24 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 2c4m h ALA 9 CO 0.52 0.06 0.09 0.00 0.00 0.00 0.00 179.25 179.92 2c4m h ALA 10 N 1.75 0.44 0.52 0.00 0.00 -1.96 0.73 119.26 120.74 2c4m h ALA 10 Ca 0.18 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2c4m h ALA 10 Cb 0.20 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2c4m h ALA 10 CO -0.04 -0.31 -0.25 1.25 0.00 0.00 0.00 179.25 179.89 2c4m h LEU 11 N 0.22 -0.60 -0.67 0.00 5.85 -1.66 -2.50 115.31 115.96 2c4m h LEU 11 Ca 0.19 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.96 2c4m h LEU 11 Cb 0.22 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.32 2c4m h LEU 11 CO -0.24 -0.24 0.27 0.58 -0.34 0.00 0.00 178.44 178.46 2c4m h VAL 12 N -0.99 0.75 -0.83 1.05 2.07 -1.25 -1.65 116.25 115.40 2c4m h VAL 12 Ca -0.07 -0.15 0.07 0.00 0.82 0.00 0.00 66.70 67.37 2c4m h VAL 12 Cb 0.62 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 2c4m h VAL 12 CO 0.12 0.08 0.50 1.23 0.02 0.00 0.00 177.57 179.52 2c4m h GLY 13 N 0.45 1.26 0.95 2.17 0.00 0.49 -0.93 103.07 107.46 2c4m h GLY 13 Ca 0.35 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 2c4m h GLY 13 CO -0.33 0.21 0.13 0.23 0.00 0.00 0.00 176.54 176.78 2c4m h SER 14 N 0.88 0.29 -0.10 0.19 0.87 -0.84 -0.87 113.55 113.98 2c4m h SER 14 Ca 0.37 -0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.74 2c4m h SER 14 Cb 0.23 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 2c4m h SER 14 CO -0.20 0.29 -0.30 0.45 -0.53 0.00 0.00 176.83 176.54 2c4m h HIS 15 N 0.27 0.65 -0.45 2.24 3.86 -1.18 -2.28 115.15 118.26 2c4m h HIS 15 Ca 0.08 -0.16 -0.09 0.00 -1.16 0.00 0.00 60.37 59.05 2c4m h HIS 15 Cb 0.06 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 2c4m h HIS 15 CO -0.04 0.80 -0.06 0.28 0.86 0.00 0.00 177.93 179.78 2c4m h VAL 16 N 0.49 1.27 -0.58 2.45 2.07 -0.97 -2.56 116.25 118.42 2c4m h VAL 16 Ca 0.06 -1.15 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 2c4m h VAL 16 Cb 0.76 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2c4m h VAL 16 CO 0.06 0.39 0.24 0.03 0.02 0.00 0.00 177.57 178.32 2c4m h ARG 17 N 0.68 0.83 0.00 1.57 3.08 -0.98 0.10 114.38 119.65 2c4m h ARG 17 Ca 0.12 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 2c4m h ARG 17 Cb 0.58 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2c4m h ARG 17 CO 0.03 0.67 -0.32 0.00 -1.07 0.00 0.00 179.97 179.28 2c4m h ALA 18 N 1.45 1.23 0.10 0.04 0.00 -1.21 0.24 119.26 121.10 2c4m h ALA 18 Ca 0.20 -0.29 -0.30 0.00 0.00 0.00 0.00 54.91 54.51 2c4m h ALA 18 Cb 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2c4m h ALA 18 CO -0.02 0.40 -1.56 0.00 0.00 0.00 0.00 179.25 178.07 2c4m h ALA 19 N 1.68 0.35 0.00 0.00 0.00 -0.90 -3.38 119.26 117.01 2c4m h ALA 19 Ca -0.00 -1.17 -0.01 0.00 0.00 0.00 0.00 54.91 53.73 2c4m h ALA 19 Cb 0.67 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2c4m h ALA 19 CO 0.04 1.22 -1.77 0.00 0.00 0.00 0.00 179.25 178.73 2c4m n ALA 20 N -2.66 2.70 -2.60 0.00 0.00 0.26 -4.96 120.51 113.26 2c4m n ALA 20 Ca -0.17 -0.47 -0.16 0.00 0.00 0.00 0.00 53.44 52.64 2c4m n ALA 20 Cb 1.04 -0.82 0.01 0.00 0.00 0.00 0.00 19.45 19.68 2c4m n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c4m n GLY 21 N 1.25 -0.24 3.50 0.00 0.00 0.07 -4.96 105.19 104.80 2c4m n GLY 21 Ca -0.04 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2c4m n GLY 21 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2c4m s THR 22 N -2.92 0.00 0.53 2.61 -1.32 -1.25 -5.11 115.64 108.19 2c4m s THR 22 Ca 0.13 -0.08 -0.22 0.00 -1.21 0.00 0.00 61.69 60.32 2c4m s THR 22 Cb -0.06 -1.09 -0.06 0.00 -1.51 0.00 0.00 72.50 69.78 2c4m s THR 22 CO 0.16 0.00 1.19 -0.81 -2.21 0.00 0.00 174.62 172.95 2c4m n PRO 23 N -0.32 1.44 -0.30 7.08 -0.04 -1.26 -4.34 135.00 137.25 2c4m n PRO 23 Ca -0.12 0.53 0.09 0.00 -0.04 0.00 0.00 63.50 63.96 2c4m n PRO 23 Cb 0.63 -2.36 0.25 0.00 -0.04 0.00 0.00 33.50 31.98 2c4m n PRO 23 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c4m h ALA 24 N 1.24 1.33 0.00 0.55 0.00 -1.91 -0.34 119.26 120.13 2c4m h ALA 24 Ca -0.49 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2c4m h ALA 24 Cb 1.33 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2c4m h ALA 24 CO 0.55 -0.17 0.00 0.38 0.00 0.00 0.00 179.25 180.01 2c4m h ASP 25 N 0.55 0.00 0.00 0.00 2.03 -1.91 -2.77 116.42 114.32 2c4m h ASP 25 Ca 0.50 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.80 2c4m h ASP 25 Cb 0.79 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.29 2c4m h ASP 25 CO -0.42 0.00 -0.85 0.18 -1.03 0.00 0.00 179.24 177.12 2c4m n LEU 26 N -2.45 0.80 -4.74 0.15 4.77 -0.18 -4.85 117.00 110.50 2c4m n LEU 26 Ca 0.01 -0.49 -0.35 0.00 -0.03 0.00 0.00 56.01 55.15 2c4m n LEU 26 Cb 0.20 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.36 2c4m n LEU 26 CO 0.19 0.20 0.83 0.00 -1.33 0.00 0.00 177.39 177.29 2c4m s ALA 27 N -2.66 2.34 0.82 -1.18 0.00 -0.95 -4.98 121.76 115.15 2c4m s ALA 27 Ca 0.06 0.98 -0.11 0.00 0.00 0.00 0.00 51.96 52.90 2c4m s ALA 27 Cb 0.13 -3.47 0.08 0.00 0.00 0.00 0.00 23.12 19.86 2c4m s ALA 27 CO 0.72 -1.53 1.09 0.95 0.00 0.00 0.00 175.76 176.99 2c4m s THR 28 N -1.73 3.10 0.37 0.00 -4.23 -1.26 -4.80 115.64 107.08 2c4m s THR 28 Ca 0.77 0.36 0.04 0.00 -1.18 0.00 0.00 61.69 61.67 2c4m s THR 28 Cb -0.31 -2.93 0.27 0.00 1.34 0.00 0.00 72.50 70.87 2c4m s THR 28 CO 0.39 -0.47 2.02 0.44 -0.54 0.00 0.00 174.62 176.46 2c4m h ASP 29 N -1.23 0.66 0.46 3.99 3.32 -1.96 -0.54 116.42 121.12 2c4m h ASP 29 Ca -0.46 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 2c4m h ASP 29 Cb 1.26 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2c4m h ASP 29 CO 0.55 0.48 -0.26 -0.09 -1.72 0.00 0.00 179.24 178.20 2c4m h ARG 30 N 0.78 -0.65 -0.44 3.56 9.65 -1.94 0.13 114.38 125.48 2c4m h ARG 30 Ca 0.22 0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 59.09 2c4m h ARG 30 Cb -0.05 0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.66 2c4m h ARG 30 CO -0.05 -0.43 0.05 0.87 2.80 0.00 0.00 179.97 183.20 2c4m h LYS 31 N -0.67 0.68 -0.58 0.20 1.79 -1.82 -1.37 116.57 114.80 2c4m h LYS 31 Ca -0.06 -0.15 -0.08 0.00 -2.18 0.00 0.00 60.65 58.19 2c4m h LYS 31 Cb 0.54 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.07 2c4m h LYS 31 CO 0.07 0.66 0.04 0.35 -1.08 0.00 0.00 179.45 179.50 2c4m h PHE 32 N 0.65 1.04 -0.55 -1.35 3.04 -0.89 0.20 116.94 119.08 2c4m h PHE 32 Ca 0.14 -0.15 -0.03 0.00 3.98 0.00 0.00 57.97 61.91 2c4m h PHE 32 Cb 0.33 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.54 2c4m h PHE 32 CO 0.02 0.91 0.23 2.35 -2.02 0.00 0.00 178.31 179.79 2c4m h TRP 33 N 0.91 0.83 -0.40 0.41 7.01 -0.47 0.11 115.95 124.34 2c4m h TRP 33 Ca 0.17 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 2c4m h TRP 33 Cb 0.47 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 27.26 2c4m h TRP 33 CO 0.03 0.67 0.21 1.15 -2.79 0.00 0.00 178.44 177.71 2c4m h THR 34 N 0.75 1.16 -0.42 2.65 2.02 -0.52 -1.50 112.91 117.05 2c4m h THR 34 Ca 0.18 -0.42 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 2c4m h THR 34 Cb 0.19 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2c4m h THR 34 CO -0.02 0.17 0.10 1.23 0.37 0.00 0.00 175.52 177.37 2c4m h GLY 35 N 0.52 0.71 1.00 2.16 0.00 -0.34 -1.20 103.07 105.92 2c4m h GLY 35 Ca 0.14 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2c4m h GLY 35 CO -0.02 0.42 0.36 -2.00 0.00 0.00 0.00 176.54 175.29 2c4m h LEU 36 N 0.53 0.80 -1.10 3.11 5.85 -0.71 -0.54 115.31 123.26 2c4m h LEU 36 Ca 0.13 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 2c4m h LEU 36 Cb 0.31 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2c4m h LEU 36 CO 0.00 0.66 -0.01 0.28 -0.34 0.00 0.00 178.44 179.03 2c4m h SER 37 N 0.88 0.59 -0.47 1.25 0.02 -1.11 -1.64 113.55 113.07 2c4m h SER 37 Ca 0.23 -0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 2c4m h SER 37 Cb 0.03 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2c4m h SER 37 CO -0.04 0.67 -0.05 0.03 -1.14 0.00 0.00 176.83 176.30 2c4m h ARG 38 N 0.59 0.91 -0.66 3.45 2.47 -0.65 -1.79 114.38 118.71 2c4m h ARG 38 Ca 0.12 -0.29 -0.05 0.00 -1.26 0.00 0.00 59.98 58.50 2c4m h ARG 38 Cb 0.39 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.60 2c4m h ARG 38 CO 0.02 0.94 0.22 0.00 0.56 0.00 0.00 179.97 181.70 2c4m h ALA 39 N 1.10 1.14 -0.56 0.04 0.00 -0.30 -0.81 119.26 119.86 2c4m h ALA 39 Ca 0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2c4m h ALA 39 Cb 0.57 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2c4m h ALA 39 CO 0.03 0.60 -0.03 0.28 0.00 0.00 0.00 179.25 180.13 2c4m h VAL 40 N 0.96 1.27 -0.75 0.00 2.07 -1.00 -2.13 116.25 116.66 2c4m h VAL 40 Ca 0.22 -1.17 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 2c4m h VAL 40 Cb 0.26 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2c4m h VAL 40 CO -0.01 0.42 0.24 1.56 0.02 0.00 0.00 177.57 179.80 2c4m h GLN 41 N 0.90 1.16 -0.66 1.57 1.08 -0.87 -2.27 115.11 116.03 2c4m h GLN 41 Ca 0.16 -0.25 -0.03 0.00 -1.45 0.00 0.00 58.65 57.08 2c4m h GLN 41 Cb 0.58 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.81 2c4m h GLN 41 CO 0.03 0.98 0.28 1.49 -0.95 0.00 0.00 178.83 180.67 2c4m h GLU 42 N 1.12 0.97 0.00 1.46 4.22 -1.00 -1.73 114.58 119.62 2c4m h GLU 42 Ca 0.24 -0.17 -0.00 0.00 0.08 0.00 0.00 59.36 59.51 2c4m h GLU 42 Cb 0.30 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2c4m h GLU 42 CO -0.01 0.80 -0.01 -0.09 -2.18 0.00 0.00 179.01 177.52 2c4m h ARG 43 N 0.92 0.00 -0.01 1.92 2.43 -0.91 -3.09 114.38 115.64 2c4m h ARG 43 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2c4m h ARG 43 Cb 0.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2c4m h ARG 43 CO -0.02 0.01 -0.01 0.44 -1.51 0.00 0.00 179.97 178.89 2c4m n ILE 44 N -3.11 0.00 -0.23 1.20 -5.35 -0.90 -4.66 119.36 106.31 2c4m n ILE 44 Ca 0.01 -0.50 0.01 0.00 -0.27 0.00 0.00 62.75 62.00 2c4m n ILE 44 Cb 0.31 1.24 0.13 0.00 -1.74 0.00 0.00 39.64 39.58 2c4m n ILE 44 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c4m h ALA 45 N 2.29 0.90 -0.07 -1.28 0.00 -1.23 -0.19 119.26 119.68 2c4m h ALA 45 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2c4m h ALA 45 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2c4m h ALA 45 CO 0.00 -0.12 0.01 -0.44 0.00 0.00 0.00 179.25 178.70 2c4m h ASP 46 N 0.51 0.12 -0.75 0.00 3.32 -1.83 -2.30 116.42 115.49 2c4m h ASP 46 Ca 0.34 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2c4m h ASP 46 Cb 0.39 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 2c4m h ASP 46 CO -0.29 0.36 0.38 0.44 -1.72 0.00 0.00 179.24 178.41 2c4m h ASP 47 N -0.13 0.99 -0.39 6.45 3.32 -1.81 -1.38 116.42 123.47 2c4m h ASP 47 Ca 0.02 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 56.98 2c4m h ASP 47 Cb 0.29 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 2c4m h ASP 47 CO 0.00 0.83 0.22 -0.25 -1.72 0.00 0.00 179.24 178.32 2c4m h TRP 48 N 1.09 0.42 -0.55 4.55 2.91 -0.92 0.11 115.95 123.55 2c4m h TRP 48 Ca 0.27 0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.22 2c4m h TRP 48 Cb 0.10 -0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 28.59 2c4m h TRP 48 CO 0.01 0.24 0.04 1.49 -1.03 0.00 0.00 178.44 179.20 2c4m h GLU 49 N 0.46 0.94 0.00 2.65 4.57 -1.05 -1.75 114.58 120.40 2c4m h GLU 49 Ca 0.16 -0.28 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 2c4m h GLU 49 Cb 0.02 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 2c4m h GLU 49 CO -0.08 0.93 -0.21 0.00 -1.18 0.00 0.00 179.01 178.47 2c4m h ARG 50 N 0.83 0.00 -0.11 1.92 3.08 -0.75 -1.28 114.38 118.07 2c4m h ARG 50 Ca 0.16 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.02 2c4m h ARG 50 Cb 0.48 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 2c4m h ARG 50 CO 0.02 0.21 -0.71 1.15 -1.07 0.00 0.00 179.97 179.57 2c4m h THR 51 N 0.00 1.35 -0.47 2.04 2.02 -0.35 -2.67 112.91 114.84 2c4m h THR 51 Ca -0.00 -2.06 -0.05 0.00 0.77 0.00 0.00 66.41 65.07 2c4m h THR 51 Cb 0.42 2.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 2c4m h THR 51 CO 0.03 0.63 0.09 0.03 0.37 0.00 0.00 175.52 176.66 2c4m h ARG 52 N 0.35 0.76 -0.23 6.66 3.08 -0.39 -0.09 114.38 124.52 2c4m h ARG 52 Ca -0.03 -0.20 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 2c4m h ARG 52 Cb 1.29 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 2c4m h ARG 52 CO 0.13 0.77 -0.19 0.93 -1.07 0.00 0.00 179.97 180.54 2c4m h GLU 53 N 0.63 0.40 0.13 0.04 5.08 -1.28 -0.34 114.58 119.24 2c4m h GLU 53 Ca 0.14 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2c4m h GLU 53 Cb 0.37 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2c4m h GLU 53 CO 0.01 0.57 -0.06 0.00 -1.00 0.00 0.00 179.01 178.53 2c4m h ALA 54 N 1.44 -0.18 -0.65 3.43 0.00 -1.26 -3.15 119.26 118.90 2c4m h ALA 54 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2c4m h ALA 54 Cb 0.54 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2c4m h ALA 54 CO 0.04 -0.24 0.42 1.88 0.00 0.00 0.00 179.25 181.34 2c4m h TYR 55 N -0.89 0.82 -0.20 0.00 -1.99 -1.02 -2.59 116.97 111.10 2c4m h TYR 55 Ca -0.02 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2c4m h TYR 55 Cb 0.53 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 2c4m h TYR 55 CO 0.10 0.52 0.10 0.78 -0.00 0.00 0.00 178.16 179.65 2c4m h GLY 56 N 0.88 0.29 -0.29 3.88 0.00 -1.12 -2.17 103.07 104.54 2c4m h GLY 56 Ca 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2c4m h GLY 56 CO -0.05 0.12 -0.12 0.00 0.00 0.00 0.00 176.54 176.48 2c4m n ALA 57 N -2.50 2.81 -2.35 3.60 0.00 -0.99 -4.94 120.51 116.15 2c4m n ALA 57 Ca 0.00 -0.45 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 2c4m n ALA 57 Cb 0.11 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2c4m n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4m s ALA 58 N -2.22 4.45 0.02 0.00 0.00 -0.82 -5.09 121.76 118.09 2c4m s ALA 58 Ca 0.31 -1.38 -0.28 0.00 0.00 0.00 0.00 51.96 50.62 2c4m s ALA 58 Cb 0.20 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2c4m s ALA 58 CO 0.42 -0.48 0.88 0.50 0.00 0.00 0.00 175.76 177.07 2c4m s ARG 59 N -4.32 4.55 0.38 0.00 3.52 -1.26 -4.93 118.95 116.90 2c4m s ARG 59 Ca 0.37 1.25 0.06 0.00 -0.13 0.00 0.00 55.73 57.28 2c4m s ARG 59 Cb -0.03 -3.42 -0.08 0.00 -1.56 0.00 0.00 34.95 29.87 2c4m s ARG 59 CO 0.23 0.10 0.02 -0.65 -0.81 0.00 0.00 175.30 174.19 2c4m s GLN 60 N 0.54 1.87 -0.05 5.12 -0.21 -0.26 -4.75 119.66 121.91 2c4m s GLN 60 Ca 0.45 -2.05 0.05 0.00 0.02 0.00 0.00 55.36 53.84 2c4m s GLN 60 Cb -0.21 -1.41 -0.02 0.00 1.00 0.00 0.00 33.01 32.37 2c4m s GLN 60 CO 0.25 -0.09 -0.22 -1.14 -2.12 0.00 0.00 175.29 171.98 2c4m s GLN 61 N -3.76 2.51 -0.31 2.91 2.00 -0.56 -0.62 119.66 121.84 2c4m s GLN 61 Ca 0.35 -0.85 0.02 0.00 -2.00 0.00 0.00 55.36 52.88 2c4m s GLN 61 Cb 0.10 -2.22 0.09 0.00 0.80 0.00 0.00 33.01 31.78 2c4m s GLN 61 CO 0.17 0.46 0.04 -1.01 -0.50 0.00 0.00 175.29 174.45 2c4m s HIS 62 N -0.33 2.95 -0.54 1.67 3.76 0.12 -1.69 115.29 121.24 2c4m s HIS 62 Ca 0.02 -2.42 -0.26 0.00 -0.15 0.00 0.00 55.06 52.25 2c4m s HIS 62 Cb -0.12 -2.33 0.03 0.00 1.11 0.00 0.00 32.58 31.27 2c4m s HIS 62 CO 0.02 -0.90 1.02 -0.47 -0.85 0.00 0.00 174.74 173.56 2c4m s TYR 63 N 1.19 2.77 -0.20 1.40 5.04 0.44 -2.37 117.35 125.62 2c4m s TYR 63 Ca 0.07 0.23 -0.20 0.00 -2.44 0.00 0.00 57.07 54.73 2c4m s TYR 63 Cb -0.19 -4.19 -0.03 0.00 0.35 0.00 0.00 41.96 37.91 2c4m s TYR 63 CO -0.12 -1.36 0.57 -0.06 -1.34 0.00 0.00 175.55 173.24 2c4m s PHE 64 N 4.20 3.38 -0.11 4.97 0.40 -0.77 -0.81 117.98 129.24 2c4m s PHE 64 Ca 0.36 0.85 -0.08 0.00 -0.60 0.00 0.00 56.93 57.46 2c4m s PHE 64 Cb -0.10 -2.73 0.04 0.00 0.51 0.00 0.00 43.02 40.73 2c4m s PHE 64 CO 0.23 -0.14 0.29 0.45 0.70 0.00 0.00 175.22 176.75 2c4m s SER 65 N 1.17 -0.31 0.00 1.36 0.15 -0.80 -2.55 113.70 112.72 2c4m s SER 65 Ca 0.26 0.59 0.15 0.00 0.70 0.00 0.00 55.95 57.66 2c4m s SER 65 Cb -0.16 0.54 0.93 0.00 -1.71 0.00 0.00 66.02 65.62 2c4m s SER 65 CO 0.10 -0.13 1.46 0.00 1.20 0.00 0.00 173.24 175.87 2c4m n ALA 66 N 3.51 2.40 -3.62 5.45 0.00 -1.26 -4.25 120.51 122.73 2c4m n ALA 66 Ca -0.18 -0.10 -0.13 0.00 0.00 0.00 0.00 53.44 53.04 2c4m n ALA 66 Cb 0.56 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 2c4m n ALA 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2c4m s GLU 67 N -2.00 0.73 -0.15 0.00 -1.05 -1.26 -4.81 118.70 110.16 2c4m s GLU 67 Ca 0.23 0.78 -0.04 0.00 -0.15 0.00 0.00 54.97 55.79 2c4m s GLU 67 Cb 0.11 0.36 0.05 0.00 -0.44 0.00 0.00 34.13 34.21 2c4m s GLU 67 CO 0.18 -0.11 0.08 -0.06 0.95 0.00 0.00 175.26 176.30 2c4m s PHE 68 N 0.16 0.22 -1.20 4.83 0.40 -0.54 -4.32 117.98 117.52 2c4m s PHE 68 Ca 0.00 -0.24 -0.14 0.00 -0.60 0.00 0.00 56.93 55.96 2c4m s PHE 68 Cb -0.04 -0.67 0.17 0.00 0.51 0.00 0.00 43.02 42.98 2c4m s PHE 68 CO -0.01 -0.46 1.44 -1.17 0.70 0.00 0.00 175.22 175.72 2c4m s LEU 69 N 2.13 5.01 0.41 -0.37 2.96 -0.56 -2.31 118.68 125.96 2c4m s LEU 69 Ca 0.02 -2.96 0.22 0.00 -0.22 0.00 0.00 54.13 51.20 2c4m s LEU 69 Cb -0.15 -2.41 0.78 0.00 0.50 0.00 0.00 46.19 44.91 2c4m s LEU 69 CO -0.08 -0.76 1.77 0.24 -1.32 0.00 0.00 176.35 176.19 2c4m h MET 70 N 7.20 0.00 0.00 1.98 2.86 -1.87 -3.42 114.93 121.68 2c4m h MET 70 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 2c4m h MET 70 Cb 0.88 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2c4m h MET 70 CO 1.25 0.27 0.00 0.41 1.06 0.00 0.00 176.91 179.90 2c4m n GLY 71 N 0.30 0.47 3.84 8.32 0.00 -1.26 -4.73 105.19 112.14 2c4m n GLY 71 Ca 0.00 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 2c4m n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c4m s ARG 72 N 0.00 4.02 -0.20 1.61 0.52 -1.26 -1.51 118.95 122.13 2c4m s ARG 72 Ca 0.00 0.84 0.06 0.00 -0.52 0.00 0.00 55.73 56.11 2c4m s ARG 72 Cb 0.00 -2.28 -0.16 0.00 0.52 0.00 0.00 34.95 33.03 2c4m s ARG 72 CO 0.00 -0.04 -0.12 0.00 0.02 0.00 0.00 175.30 175.16 2c4m n ALA 73 N -0.91 1.55 0.15 2.13 0.00 -1.26 -4.62 120.51 117.54 2c4m n ALA 73 Ca 0.05 -0.98 -0.15 0.00 0.00 0.00 0.00 53.44 52.36 2c4m n ALA 73 Cb 0.54 -0.03 -0.08 0.00 0.00 0.00 0.00 19.45 19.87 2c4m n ALA 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2c4m h LEU 74 N 0.00 -1.30 -0.90 0.00 5.85 -1.97 0.10 115.31 117.09 2c4m h LEU 74 Ca -0.48 0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.42 2c4m h LEU 74 Cb 1.84 0.47 -0.06 0.00 0.37 0.00 0.00 40.66 43.27 2c4m h LEU 74 CO -0.04 -0.51 0.57 0.25 -0.34 0.00 0.00 178.44 178.37 2c4m h LEU 75 N -0.72 0.93 -0.43 2.25 5.85 -1.96 0.98 115.31 122.22 2c4m h LEU 75 Ca -0.02 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2c4m h LEU 75 Cb 0.68 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 2c4m h LEU 75 CO -0.18 0.61 0.24 -1.13 -0.34 0.00 0.00 178.44 177.63 2c4m h ASN 76 N 1.07 0.53 -0.54 1.25 -1.24 -1.78 0.29 115.58 115.16 2c4m h ASN 76 Ca 0.38 -0.08 -0.09 0.00 0.71 0.00 0.00 56.30 57.21 2c4m h ASN 76 Cb 0.11 -0.13 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 2c4m h ASN 76 CO -0.15 0.46 -0.02 0.78 -1.29 0.00 0.00 177.43 177.20 2c4m h ASN 77 N 0.56 0.96 -0.33 1.15 2.35 -0.16 -0.63 115.58 119.47 2c4m h ASN 77 Ca 0.15 -0.32 -0.07 0.00 -0.55 0.00 0.00 56.30 55.52 2c4m h ASN 77 Cb 0.05 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2c4m h ASN 77 CO -0.02 1.04 -0.01 -0.07 -1.65 0.00 0.00 177.43 176.72 2c4m h LEU 78 N 0.84 0.66 -0.30 1.61 3.38 -0.63 -0.91 115.31 119.96 2c4m h LEU 78 Ca 0.15 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2c4m h LEU 78 Cb 0.57 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2c4m h LEU 78 CO 0.03 0.74 -0.46 0.74 0.09 0.00 0.00 178.44 179.58 2c4m h THR 79 N 0.65 1.28 0.00 0.22 2.02 -0.66 0.26 112.91 116.67 2c4m h THR 79 Ca 0.13 -1.64 -0.05 0.00 0.77 0.00 0.00 66.41 65.61 2c4m h THR 79 Cb 0.42 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 2c4m h THR 79 CO 0.02 0.54 -0.25 0.78 0.37 0.00 0.00 175.52 176.97 2c4m h ASN 80 N 0.62 0.00 0.14 4.18 2.35 -0.92 -2.96 115.58 118.99 2c4m h ASN 80 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2c4m h ASN 80 Cb 1.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.43 2c4m h ASN 80 CO 0.11 0.25 -0.33 0.18 -1.65 0.00 0.00 177.43 175.98 2c4m n LEU 81 N -3.31 1.39 -2.50 1.61 4.77 -0.36 -4.12 117.00 114.48 2c4m n LEU 81 Ca 0.01 -0.44 -0.15 0.00 -0.03 0.00 0.00 56.01 55.40 2c4m n LEU 81 Cb 0.50 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.56 2c4m n LEU 81 CO 0.35 0.26 0.15 0.61 -1.33 0.00 0.00 177.39 177.43 2c4m n GLY 82 N 1.37 -0.02 0.04 -0.72 0.00 -0.65 -4.96 105.19 100.26 2c4m n GLY 82 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2c4m n GLY 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c4m n LEU 83 N -3.36 1.57 -0.30 0.99 4.77 0.81 -4.77 117.00 116.72 2c4m n LEU 83 Ca -0.01 -1.50 0.06 0.00 -0.03 0.00 0.00 56.01 54.52 2c4m n LEU 83 Cb 0.55 -0.01 0.21 0.00 -2.33 0.00 0.00 43.42 41.83 2c4m n LEU 83 CO 0.41 0.39 1.12 0.58 -1.33 0.00 0.00 177.39 178.57 2c4m h VAL 84 N 0.16 0.80 -0.20 4.08 2.07 -1.90 0.14 116.25 121.40 2c4m h VAL 84 Ca 0.00 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2c4m h VAL 84 Cb 0.28 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2c4m h VAL 84 CO 0.00 0.13 -0.07 0.44 0.02 0.00 0.00 177.57 178.09 2c4m h ASP 85 N 0.70 0.40 -0.46 0.57 5.19 -1.92 -1.18 116.42 119.72 2c4m h ASP 85 Ca 0.44 -0.39 -0.06 0.00 -0.62 0.00 0.00 57.03 56.41 2c4m h ASP 85 Cb 0.55 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.93 2c4m h ASP 85 CO -0.32 0.70 0.09 -0.33 -3.12 0.00 0.00 179.24 176.25 2c4m h GLU 86 N 0.10 0.82 -0.31 3.56 3.07 -1.75 -1.81 114.58 118.26 2c4m h GLU 86 Ca 0.05 -0.19 -0.04 0.00 -0.50 0.00 0.00 59.36 58.68 2c4m h GLU 86 Cb 0.53 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 2c4m h GLU 86 CO 0.02 0.77 0.02 0.00 -1.40 0.00 0.00 179.01 178.43 2c4m h ALA 87 N 1.31 0.41 -0.78 3.43 0.00 -0.68 -0.81 119.26 122.14 2c4m h ALA 87 Ca 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2c4m h ALA 87 Cb 0.35 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2c4m h ALA 87 CO 0.01 0.14 0.36 0.00 0.00 0.00 0.00 179.25 179.75 2c4m h ALA 88 N 0.86 1.16 0.01 0.00 0.00 -0.95 -0.68 119.26 119.66 2c4m h ALA 88 Ca 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2c4m h ALA 88 Cb 0.40 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2c4m h ALA 88 CO 0.01 0.63 -0.00 0.00 0.00 0.00 0.00 179.25 179.88 2c4m h ALA 89 N 1.28 -0.01 -0.94 0.00 0.00 -1.18 -1.52 119.26 116.89 2c4m h ALA 89 Ca 0.27 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2c4m h ALA 89 Cb 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2c4m h ALA 89 CO -0.03 -0.29 0.60 0.00 0.00 0.00 0.00 179.25 179.53 2c4m h ALA 90 N 0.55 1.27 -0.55 0.00 0.00 -1.03 0.73 119.26 120.24 2c4m h ALA 90 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2c4m h ALA 90 Cb 0.43 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2c4m h ALA 90 CO 0.00 0.42 0.18 1.15 0.00 0.00 0.00 179.25 180.99 2c4m h THR 91 N 1.13 1.23 -0.64 0.00 2.02 -1.07 -1.12 112.91 114.47 2c4m h THR 91 Ca 0.39 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.74 2c4m h THR 91 Cb 0.10 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2c4m h THR 91 CO -0.15 0.29 0.23 -0.09 0.37 0.00 0.00 175.52 176.18 2c4m h ARG 92 N 0.76 0.98 0.00 6.66 2.43 -0.65 0.22 114.38 124.77 2c4m h ARG 92 Ca 0.18 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 2c4m h ARG 92 Cb 0.27 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2c4m h ARG 92 CO -0.01 0.84 -0.20 1.49 -1.51 0.00 0.00 179.97 180.58 2c4m h GLU 93 N 0.91 0.00 -0.97 0.20 4.81 -0.46 -2.29 114.58 116.78 2c4m h GLU 93 Ca 0.21 0.00 -0.39 0.00 -0.13 0.00 0.00 59.36 59.05 2c4m h GLU 93 Cb 0.24 0.00 -0.23 0.00 0.63 0.00 0.00 28.75 29.39 2c4m h GLU 93 CO -0.01 0.20 0.50 1.28 -0.73 0.00 0.00 179.01 180.24 2c4m n LEU 94 N -3.89 5.99 -0.68 1.64 4.77 -0.46 -4.92 117.00 119.45 2c4m n LEU 94 Ca -0.02 -3.18 -0.09 0.00 -0.03 0.00 0.00 56.01 52.70 2c4m n LEU 94 Cb 0.29 -0.77 -0.04 0.00 -2.33 0.00 0.00 43.42 40.57 2c4m n LEU 94 CO 0.34 0.92 -0.08 0.61 -1.33 0.00 0.00 177.39 177.84 2c4m n GLY 95 N -0.74 1.02 3.56 -0.72 0.00 -0.86 -3.74 105.19 103.70 2c4m n GLY 95 Ca 0.47 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 2c4m n GLY 95 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c4m s HIS 96 N -2.18 2.00 -0.20 1.61 3.76 0.74 -5.00 115.29 116.02 2c4m s HIS 96 Ca 0.00 -0.99 0.01 0.00 -0.15 0.00 0.00 55.06 53.94 2c4m s HIS 96 Cb 0.00 -1.41 0.03 0.00 1.11 0.00 0.00 32.58 32.32 2c4m s HIS 96 CO 0.00 0.05 -0.16 -1.21 -0.85 0.00 0.00 174.74 172.57 2c4m s GLU 97 N -3.81 2.64 0.36 1.40 0.41 -1.26 -2.86 118.70 115.57 2c4m s GLU 97 Ca 0.27 -0.93 0.16 0.00 -0.41 0.00 0.00 54.97 54.06 2c4m s GLU 97 Cb 0.06 -2.59 1.10 0.00 -1.78 0.00 0.00 34.13 30.93 2c4m s GLU 97 CO 0.13 -0.32 1.68 1.25 -0.49 0.00 0.00 175.26 177.51 2c4m h LEU 98 N 7.91 0.50 -0.84 1.80 5.85 -1.90 -0.01 115.31 128.63 2c4m h LEU 98 Ca -0.37 0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.56 2c4m h LEU 98 Cb 1.11 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 2c4m h LEU 98 CO 0.57 -0.08 0.54 0.71 -0.34 0.00 0.00 178.44 179.83 2c4m h THR 99 N 0.34 1.12 -0.34 1.05 1.35 -1.99 0.77 112.91 115.20 2c4m h THR 99 Ca 0.72 -0.35 -0.11 0.00 -0.55 0.00 0.00 66.41 66.12 2c4m h THR 99 Cb 1.70 -0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 2c4m h THR 99 CO -0.53 0.19 -0.22 0.44 -0.25 0.00 0.00 175.52 175.14 2c4m h ASP 100 N 1.03 0.67 -0.50 5.36 3.32 -1.44 -2.69 116.42 122.17 2c4m h ASP 100 Ca 0.34 -0.23 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 2c4m h ASP 100 Cb 0.04 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2c4m h ASP 100 CO -0.13 0.88 -0.19 0.40 -1.72 0.00 0.00 179.24 178.48 2c4m h ILE 101 N 0.58 1.27 -0.49 0.35 1.08 -0.92 -3.07 117.51 116.31 2c4m h ILE 101 Ca 0.08 -1.36 -0.07 0.00 -0.39 0.00 0.00 64.86 63.12 2c4m h ILE 101 Cb 0.69 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 35.50 2c4m h ILE 101 CO 0.05 0.47 0.01 -0.07 -0.69 0.00 0.00 178.15 177.92 2c4m h LEU 102 N 0.88 0.78 -2.26 1.44 3.38 -0.74 -2.87 115.31 115.90 2c4m h LEU 102 Ca 0.12 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2c4m h LEU 102 Cb 0.77 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2c4m h LEU 102 CO 0.06 0.84 -0.05 -0.33 0.09 0.00 0.00 178.44 179.06 2c4m h GLU 103 N 0.76 0.00 -0.50 1.13 4.39 -1.38 -2.63 114.58 116.34 2c4m h GLU 103 Ca 0.15 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.95 2c4m h GLU 103 Cb 0.45 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 2c4m h GLU 103 CO 0.02 0.05 0.34 0.82 -1.16 0.00 0.00 179.01 179.08 2c4m h ILE 104 N 0.00 0.86 -3.34 3.13 1.08 -1.53 -3.42 117.51 114.28 2c4m h ILE 104 Ca -0.00 -0.08 -0.53 0.00 -0.39 0.00 0.00 64.86 63.86 2c4m h ILE 104 Cb 0.12 0.62 -0.00 0.00 -3.07 0.00 0.00 36.82 34.49 2c4m h ILE 104 CO 0.01 0.04 0.49 -0.70 -0.69 0.00 0.00 178.15 177.30 2c4m s GLU 105 N -5.22 4.51 0.16 2.37 2.12 -0.99 -5.04 118.70 116.60 2c4m s GLU 105 Ca -0.06 1.68 -0.08 0.00 0.36 0.00 0.00 54.97 56.86 2c4m s GLU 105 Cb 0.19 -3.35 -0.06 0.00 0.26 0.00 0.00 34.13 31.17 2c4m s GLU 105 CO 0.73 -0.12 0.46 -0.80 -0.54 0.00 0.00 175.26 174.99 2c4m s ASN 106 N 0.71 6.59 0.20 -1.70 0.02 -1.26 -4.98 114.94 114.52 2c4m s ASN 106 Ca 0.55 0.78 -0.31 0.00 -1.02 0.00 0.00 52.86 52.85 2c4m s ASN 106 Cb -0.28 -2.17 -0.11 0.00 0.02 0.00 0.00 41.25 38.72 2c4m s ASN 106 CO 0.30 0.03 1.60 -1.81 0.02 0.00 0.00 177.10 177.24 2c4m s ASP 107 N -2.25 6.52 -0.11 -1.22 1.01 -1.26 -4.63 116.67 114.72 2c4m s ASP 107 Ca 0.42 2.72 -0.30 0.00 0.71 0.00 0.00 52.55 56.10 2c4m s ASP 107 Cb -0.12 -2.60 -0.07 0.00 1.01 0.00 0.00 42.92 41.13 2c4m s ASP 107 CO 0.22 -0.86 2.10 0.00 0.21 0.00 0.00 175.17 176.84 2c4m n ALA 108 N 3.66 1.61 -1.82 5.23 0.00 -0.57 -4.83 120.51 123.80 2c4m n ALA 108 Ca 0.13 -0.02 -0.42 0.00 0.00 0.00 0.00 53.44 53.13 2c4m n ALA 108 Cb 0.38 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.04 2c4m n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4m n ALA 109 N 9.64 5.51 0.18 0.00 0.00 -1.26 -4.05 120.51 130.53 2c4m n ALA 109 Ca 0.26 -3.94 0.03 0.00 0.00 0.00 0.00 53.44 49.79 2c4m n ALA 109 Cb 0.41 -3.46 0.04 0.00 0.00 0.00 0.00 19.45 16.44 2c4m n ALA 109 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2c4m n LEU 110 N 5.81 1.81 -4.18 0.00 4.77 -1.26 -3.39 117.00 120.56 2c4m n LEU 110 Ca 0.50 -1.25 -0.14 0.00 -0.03 0.00 0.00 56.01 55.09 2c4m n LEU 110 Cb 0.39 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.36 2c4m n LEU 110 CO 0.89 0.40 -0.12 -0.83 -1.33 0.00 0.00 177.39 176.40 2c4m s GLY 111 N -0.67 1.54 0.00 -0.72 0.00 -0.98 -1.47 107.32 105.03 2c4m s GLY 111 Ca 0.09 -1.66 0.00 0.00 0.00 0.00 0.00 44.72 43.15 2c4m s GLY 111 CO 0.09 -1.28 0.00 -2.01 0.00 0.00 0.00 173.10 169.90 2c4m n ASN 112 N -0.70 0.00 0.00 1.64 2.85 -1.26 -4.60 115.26 113.19 2c4m n ASN 112 Ca 0.03 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.50 2c4m n ASN 112 Cb 0.64 -0.31 0.00 0.00 1.24 0.00 0.00 39.78 41.35 2c4m n ASN 112 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2c4m n GLY 113 N 2.17 4.69 0.32 8.20 0.00 -1.26 -4.99 105.19 114.33 2c4m n GLY 113 Ca 0.00 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.56 2c4m n GLY 113 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2c4m h GLY 114 N 0.00 0.89 0.98 -0.02 0.00 -2.01 -0.06 103.07 102.85 2c4m h GLY 114 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 2c4m h GLY 114 CO 0.00 -0.38 0.26 -2.00 0.00 0.00 0.00 176.54 174.42 2c4m h LEU 115 N 0.03 0.66 -0.66 3.11 5.85 -1.96 -0.85 115.31 121.50 2c4m h LEU 115 Ca 0.48 -0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.96 2c4m h LEU 115 Cb 0.85 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 2c4m h LEU 115 CO -0.85 0.59 -0.30 1.23 -0.34 0.00 0.00 178.44 178.78 2c4m h GLY 116 N 0.68 0.78 1.64 3.75 0.00 -1.31 -2.60 103.07 106.02 2c4m h GLY 116 Ca 0.18 -0.71 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 2c4m h GLY 116 CO -0.02 0.65 -0.27 -0.09 0.00 0.00 0.00 176.54 176.81 2c4m h ARG 117 N 0.62 0.41 -0.47 4.80 9.65 -0.78 -1.30 114.38 127.31 2c4m h ARG 117 Ca 0.07 -0.16 -0.05 0.00 -1.10 0.00 0.00 59.98 58.75 2c4m h ARG 117 Cb 0.81 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.34 2c4m h ARG 117 CO 0.07 0.65 0.11 1.25 2.80 0.00 0.00 179.97 184.85 2c4m h LEU 118 N 0.37 0.72 -1.46 3.80 5.85 -1.00 0.79 115.31 124.38 2c4m h LEU 118 Ca 0.05 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2c4m h LEU 118 Cb 0.66 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 2c4m h LEU 118 CO 0.05 0.76 0.13 0.00 -0.34 0.00 0.00 178.44 179.05 2c4m h ALA 119 N 0.98 1.58 -0.11 1.25 0.00 -1.15 0.04 119.26 121.85 2c4m h ALA 119 Ca 0.15 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2c4m h ALA 119 Cb 0.33 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2c4m h ALA 119 CO 0.00 0.33 -0.12 0.00 0.00 0.00 0.00 179.25 179.46 2c4m h ALA 120 N 1.65 0.16 -0.71 0.00 0.00 -0.58 -2.59 119.26 117.19 2c4m h ALA 120 Ca 0.12 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2c4m h ALA 120 Cb 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2c4m h ALA 120 CO -0.01 0.02 0.28 0.00 0.00 0.00 0.00 179.25 179.53 2c4m h PHE 122 N 1.02 1.22 -0.46 0.00 -1.00 -0.92 -0.77 116.94 116.03 2c4m h PHE 122 Ca 0.24 0.03 -0.10 0.00 2.81 0.00 0.00 57.97 60.94 2c4m h PHE 122 Cb 0.20 -0.41 -0.02 0.00 3.61 0.00 0.00 35.95 39.33 2c4m h PHE 122 CO 0.02 0.77 -0.13 -0.07 -1.61 0.00 0.00 178.31 177.29 2c4m h LEU 123 N 1.31 0.85 -0.49 1.54 3.38 -1.25 0.66 115.31 121.32 2c4m h LEU 123 Ca 0.35 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 2c4m h LEU 123 Cb -0.15 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.36 2c4m h LEU 123 CO -0.08 0.99 -0.13 -0.78 0.09 0.00 0.00 178.44 178.53 2c4m h ASP 124 N 0.76 0.95 0.47 -0.43 1.82 -1.21 -2.17 116.42 116.62 2c4m h ASP 124 Ca 0.12 -0.37 -0.13 0.00 -0.39 0.00 0.00 57.03 56.26 2c4m h ASP 124 Cb 0.64 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 2c4m h ASP 124 CO 0.04 1.10 -0.58 0.28 -1.61 0.00 0.00 179.24 178.47 2c4m h SER 125 N 0.80 0.13 0.45 2.28 0.02 -1.01 -2.03 113.55 114.18 2c4m h SER 125 Ca 0.12 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2c4m h SER 125 Cb 0.69 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2c4m h SER 125 CO 0.05 0.68 -0.22 0.00 -1.14 0.00 0.00 176.83 176.20 2c4m h ALA 126 N 1.32 -0.60 -0.70 3.77 0.00 -0.64 -2.91 119.26 119.49 2c4m h ALA 126 Ca -0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2c4m h ALA 126 Cb 1.05 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2c4m h ALA 126 CO 0.08 -0.75 0.27 -0.24 0.00 0.00 0.00 179.25 178.61 2c4m h VAL 127 N -0.78 1.24 -0.04 0.00 3.04 -1.40 -0.64 116.25 117.66 2c4m h VAL 127 Ca -0.06 -0.78 0.01 0.00 -1.01 0.00 0.00 66.70 64.86 2c4m h VAL 127 Cb 0.54 0.42 -0.00 0.00 -2.01 0.00 0.00 31.29 30.24 2c4m h VAL 127 CO 0.10 0.31 0.13 0.74 -1.01 0.00 0.00 177.57 177.84 2c4m h THR 128 N 1.02 0.16 -0.25 3.17 2.02 -1.35 0.10 112.91 117.78 2c4m h THR 128 Ca 0.23 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.41 2c4m h THR 128 Cb 0.22 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2c4m h THR 128 CO -0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.87 2c4m n GLN 129 N -3.27 2.81 -1.96 6.66 6.02 -0.90 -4.84 117.38 121.91 2c4m n GLN 129 Ca -0.02 -2.19 -0.19 0.00 -0.01 0.00 0.00 57.00 54.60 2c4m n GLN 129 Cb 0.21 -1.38 -0.04 0.00 1.02 0.00 0.00 30.24 30.05 2c4m n GLN 129 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2c4m n ASP 130 N 0.00 -5.31 -4.71 1.08 8.00 0.35 -4.61 116.55 111.35 2c4m n ASP 130 Ca 0.12 0.21 -0.42 0.00 0.71 0.00 0.00 54.79 55.42 2c4m n ASP 130 Cb 0.52 -4.41 -0.03 0.00 -0.02 0.00 0.00 41.12 37.19 2c4m n ASP 130 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2c4m s TYR 131 N -2.81 3.58 -0.66 1.24 2.02 -0.30 0.66 117.35 121.08 2c4m s TYR 131 Ca 0.00 1.61 -0.25 0.00 -0.37 0.00 0.00 57.07 58.06 2c4m s TYR 131 Cb 0.00 -3.18 -0.21 0.00 -0.40 0.00 0.00 41.96 38.17 2c4m s TYR 131 CO 0.00 -0.27 1.86 -0.35 -1.57 0.00 0.00 175.55 175.21 2c4m n PRO 132 N 4.17 1.08 -4.84 -1.71 -0.04 -1.26 -4.50 135.00 127.90 2c4m n PRO 132 Ca 0.07 -1.73 -0.33 0.00 -0.04 0.00 0.00 63.50 61.48 2c4m n PRO 132 Cb 0.50 -2.99 -0.13 0.00 -0.04 0.00 0.00 33.50 30.83 2c4m n PRO 132 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2c4m s VAL 133 N 7.00 3.08 -0.04 0.52 1.01 -1.26 -1.49 120.40 129.23 2c4m s VAL 133 Ca 0.63 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.95 2c4m s VAL 133 Cb 0.11 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2c4m s VAL 133 CO 0.18 0.57 -0.12 -0.89 0.00 0.00 0.00 175.10 174.84 2c4m s THR 134 N -0.34 1.05 0.15 3.92 2.01 -0.68 -4.46 115.64 117.29 2c4m s THR 134 Ca 0.03 -0.50 -0.04 0.00 0.31 0.00 0.00 61.69 61.49 2c4m s THR 134 Cb -0.13 -0.93 -0.05 0.00 0.01 0.00 0.00 72.50 71.40 2c4m s THR 134 CO 0.02 0.32 0.38 -0.83 -0.69 0.00 0.00 174.62 173.82 2c4m s GLY 135 N 0.20 2.18 -0.04 4.40 0.00 -0.78 -0.42 107.32 112.86 2c4m s GLY 135 Ca -0.05 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.08 2c4m s GLY 135 CO 0.01 -0.52 -0.01 -0.19 0.00 0.00 0.00 173.10 172.39 2c4m s TYR 136 N -1.69 0.49 0.00 1.90 1.51 0.01 -0.11 117.35 119.47 2c4m s TYR 136 Ca 0.41 -0.08 0.00 0.00 -1.01 0.00 0.00 57.07 56.39 2c4m s TYR 136 Cb -0.12 -0.55 0.00 0.00 -0.11 0.00 0.00 41.96 41.18 2c4m s TYR 136 CO 0.25 -0.18 0.00 0.41 -1.11 0.00 0.00 175.55 174.92 2c4m n GLY 137 N 4.32 2.29 3.89 0.71 0.00 -0.46 -1.91 105.19 114.03 2c4m n GLY 137 Ca -0.22 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 2c4m n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c4m s LEU 138 N 0.00 4.38 -1.24 0.99 1.43 -1.26 -0.78 118.68 122.20 2c4m s LEU 138 Ca 0.00 0.48 -0.13 0.00 -1.03 0.00 0.00 54.13 53.45 2c4m s LEU 138 Cb 0.00 -2.44 0.16 0.00 0.03 0.00 0.00 46.19 43.93 2c4m s LEU 138 CO 0.00 0.31 1.58 -0.11 0.23 0.00 0.00 176.35 178.36 2c4m n LEU 139 N 1.40 5.50 -4.73 1.79 7.94 0.56 -4.68 117.00 124.79 2c4m n LEU 139 Ca -0.14 -4.42 -0.42 0.00 -1.11 0.00 0.00 56.01 49.92 2c4m n LEU 139 Cb 0.53 -1.61 -0.03 0.00 0.53 0.00 0.00 43.42 42.85 2c4m n LEU 139 CO 0.38 0.79 1.25 -0.31 -1.11 0.00 0.00 177.39 178.39 2c4m s TYR 140 N 1.70 2.99 -0.03 1.96 2.02 -1.26 -4.84 117.35 119.89 2c4m s TYR 140 Ca 0.44 0.63 -0.09 0.00 -0.37 0.00 0.00 57.07 57.67 2c4m s TYR 140 Cb 0.01 -3.98 -0.30 0.00 -0.40 0.00 0.00 41.96 37.29 2c4m s TYR 140 CO 0.01 -3.56 0.74 -0.09 -1.57 0.00 0.00 175.55 171.09 2c4m h ARG 141 N 6.37 0.36 0.00 -0.62 2.43 -0.56 -3.40 114.38 118.97 2c4m h ARG 141 Ca -0.44 -0.62 -0.00 0.00 -0.81 0.00 0.00 59.98 58.11 2c4m h ARG 141 Cb 1.21 0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.98 2c4m h ARG 141 CO 0.89 1.26 -0.26 1.19 -1.51 0.00 0.00 179.97 181.54 2c4m n PHE 142 N -3.55 0.00 -3.86 2.20 3.72 0.02 -3.91 117.46 112.07 2c4m n PHE 142 Ca -0.22 -1.20 0.00 0.00 -0.05 0.00 0.00 57.45 55.98 2c4m n PHE 142 Cb 1.07 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 39.41 2c4m n PHE 142 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c4m n GLY 143 N -1.22 1.40 0.04 1.37 0.00 -1.22 -1.38 105.19 104.17 2c4m n GLY 143 Ca 0.17 -0.53 -0.01 0.00 0.00 0.00 0.00 46.02 45.64 2c4m n GLY 143 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c4m h LEU 144 N 0.00 0.00 0.00 0.99 5.85 -1.81 -0.29 115.31 120.05 2c4m h LEU 144 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2c4m h LEU 144 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2c4m h LEU 144 CO 0.00 0.37 0.00 2.22 -0.34 0.00 0.00 178.44 180.69 2c4m n PHE 145 N -3.68 0.00 -3.43 1.25 1.16 -1.26 -4.75 117.46 106.75 2c4m n PHE 145 Ca -0.02 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.18 2c4m n PHE 145 Cb 0.08 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.89 2c4m n PHE 145 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 2c4m s ARG 146 N -1.78 4.11 -0.18 3.97 3.52 0.17 -4.83 118.95 123.93 2c4m s ARG 146 Ca 0.00 0.40 -0.11 0.00 -0.13 0.00 0.00 55.73 55.89 2c4m s ARG 146 Cb 0.00 -3.32 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 2c4m s ARG 146 CO 0.00 0.46 0.18 -1.14 -0.81 0.00 0.00 175.30 173.99 2c4m s GLN 147 N -0.33 4.14 0.21 5.12 0.74 -1.26 -1.76 119.66 126.52 2c4m s GLN 147 Ca 0.24 -0.11 -0.00 0.00 0.05 0.00 0.00 55.36 55.54 2c4m s GLN 147 Cb -0.16 -3.40 -0.04 0.00 1.10 0.00 0.00 33.01 30.51 2c4m s GLN 147 CO 0.11 0.33 0.11 -1.54 -0.55 0.00 0.00 175.29 173.75 2c4m s SER 148 N 0.25 0.48 0.03 6.67 1.04 -0.89 -3.45 113.70 117.83 2c4m s SER 148 Ca 0.11 -1.37 0.08 0.00 0.48 0.00 0.00 55.95 55.26 2c4m s SER 148 Cb -0.12 0.31 -0.02 0.00 0.10 0.00 0.00 66.02 66.28 2c4m s SER 148 CO 0.01 -0.79 -0.24 -0.36 0.98 0.00 0.00 173.24 172.83 2c4m s PHE 149 N -4.03 2.13 -0.08 5.02 0.08 -1.26 -0.64 117.98 119.20 2c4m s PHE 149 Ca 0.37 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 57.01 2c4m s PHE 149 Cb 0.07 -1.30 0.03 0.00 -0.57 0.00 0.00 43.02 41.25 2c4m s PHE 149 CO 0.11 0.07 -0.02 1.21 -0.10 0.00 0.00 175.22 176.49 2c4m s ASN 150 N -1.01 1.71 -1.43 1.36 2.47 -0.55 -4.76 114.94 112.73 2c4m s ASN 150 Ca 0.10 -0.14 -0.01 0.00 0.42 0.00 0.00 52.86 53.23 2c4m s ASN 150 Cb -0.09 -0.54 0.01 0.00 -1.45 0.00 0.00 41.25 39.17 2c4m s ASN 150 CO 0.01 -0.17 0.10 -0.62 -3.72 0.00 0.00 177.10 172.70 2c4m n GLU 151 N 5.06 -2.39 -0.03 0.43 -0.58 -1.26 -1.88 120.64 119.98 2c4m n GLU 151 Ca -0.09 0.79 0.00 0.00 -0.42 0.00 0.00 57.16 57.44 2c4m n GLU 151 Cb 0.50 -5.46 0.00 0.00 -0.57 0.00 0.00 31.44 25.91 2c4m n GLU 151 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c4m n GLY 152 N -1.00 1.60 3.88 0.62 0.00 -1.26 -5.03 105.19 104.00 2c4m n GLY 152 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 2c4m n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c4m s PHE 153 N -2.59 3.56 0.23 1.61 0.40 -0.79 -4.06 117.98 116.35 2c4m s PHE 153 Ca 0.00 0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 56.69 2c4m s PHE 153 Cb 0.00 -2.06 -0.09 0.00 0.51 0.00 0.00 43.02 41.37 2c4m s PHE 153 CO 0.00 0.54 1.37 -1.14 0.70 0.00 0.00 175.22 176.69 2c4m s GLN 154 N -2.00 4.33 -0.02 0.44 0.74 -1.26 -1.49 119.66 120.41 2c4m s GLN 154 Ca 0.32 2.18 0.07 0.00 0.05 0.00 0.00 55.36 57.98 2c4m s GLN 154 Cb -0.13 -3.15 -0.02 0.00 1.10 0.00 0.00 33.01 30.81 2c4m s GLN 154 CO 0.19 -0.32 -0.24 0.08 -0.55 0.00 0.00 175.29 174.45 2c4m s VAL 155 N -0.03 1.89 -0.17 1.34 1.01 0.18 -4.89 120.40 119.73 2c4m s VAL 155 Ca 0.57 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2c4m s VAL 155 Cb -0.39 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 2c4m s VAL 155 CO 0.41 0.53 -0.12 -1.61 0.00 0.00 0.00 175.10 174.32 2c4m s GLU 156 N -0.56 3.29 0.26 2.72 8.01 -1.26 -2.09 118.70 129.06 2c4m s GLU 156 Ca 0.09 -0.70 0.02 0.00 0.01 0.00 0.00 54.97 54.39 2c4m s GLU 156 Cb -0.09 -2.73 -0.05 0.00 -4.31 0.00 0.00 34.13 26.95 2c4m s GLU 156 CO -0.01 -0.01 0.06 0.15 0.01 0.00 0.00 175.26 175.47 2c4m s LYS 157 N 0.91 1.42 0.72 1.61 1.02 -0.72 -4.94 119.74 119.77 2c4m s LYS 157 Ca -0.03 -1.76 -0.16 0.00 0.02 0.00 0.00 55.97 54.04 2c4m s LYS 157 Cb -0.15 -0.44 0.03 0.00 -0.52 0.00 0.00 37.83 36.74 2c4m s LYS 157 CO -0.01 -0.23 1.18 -2.30 -0.92 0.00 0.00 175.35 173.08 2c4m n PRO 158 N -0.48 0.65 -3.53 -1.68 -0.02 -1.26 0.45 135.00 129.12 2c4m n PRO 158 Ca -0.02 0.28 -0.27 0.00 -2.02 0.00 0.00 63.50 61.47 2c4m n PRO 158 Cb 0.66 -2.42 -0.09 0.00 -0.02 0.00 0.00 33.50 31.62 2c4m n PRO 158 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2c4m n ASP 159 N -2.32 3.38 -4.76 2.55 2.03 -0.48 -4.09 116.55 112.86 2c4m n ASP 159 Ca 0.14 -3.34 -0.36 0.00 0.52 0.00 0.00 54.79 51.75 2c4m n ASP 159 Cb 0.49 -0.69 0.02 0.00 -0.72 0.00 0.00 41.12 40.22 2c4m n ASP 159 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2c4m s PRO 160 N -2.15 3.23 0.00 -0.67 0.04 -1.26 -3.45 135.00 130.74 2c4m s PRO 160 Ca 0.36 1.74 0.00 0.00 0.04 0.00 0.00 61.00 63.14 2c4m s PRO 160 Cb 0.10 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2c4m s PRO 160 CO -0.06 -0.98 0.00 -2.67 0.04 0.00 0.00 177.00 173.33 2c4m n TRP 161 N -1.33 0.00 -1.91 0.56 4.27 -1.25 -4.92 117.44 112.86 2c4m n TRP 161 Ca 0.12 0.00 -0.04 0.00 -3.89 0.00 0.00 57.50 53.69 2c4m n TRP 161 Cb 0.50 0.00 0.12 0.00 -1.36 0.00 0.00 31.31 30.57 2c4m n TRP 161 CO 0.00 0.00 0.00 2.89 -2.29 0.00 0.00 177.69 178.29 2c4m n ARG 162 N 0.00 2.04 0.08 -2.67 1.85 -1.26 -4.72 116.66 111.99 2c4m n ARG 162 Ca 0.00 -3.44 -0.10 0.00 -1.00 0.00 0.00 57.85 53.31 2c4m n ARG 162 Cb 0.00 -1.64 -0.11 0.00 -1.05 0.00 0.00 32.46 29.66 2c4m n ARG 162 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2c4m h GLU 163 N 1.47 0.11 -7.07 2.89 4.39 -1.92 -3.44 114.58 111.01 2c4m h GLU 163 Ca 0.08 -0.18 -0.49 0.00 0.34 0.00 0.00 59.36 59.11 2c4m h GLU 163 Cb 1.28 0.07 0.05 0.00 -0.10 0.00 0.00 28.75 30.04 2c4m h GLU 163 CO 0.25 1.06 0.19 -1.21 -1.16 0.00 0.00 179.01 178.15 2c4m s GLU 164 N -2.76 3.38 0.06 2.33 0.41 -1.26 -5.01 118.70 115.85 2c4m s GLU 164 Ca -0.01 0.26 -0.36 0.00 -0.41 0.00 0.00 54.97 54.44 2c4m s GLU 164 Cb 0.09 -2.29 -0.15 0.00 -1.78 0.00 0.00 34.13 30.00 2c4m s GLU 164 CO 0.84 -0.42 1.50 -1.91 -0.49 0.00 0.00 175.26 174.78 2c4m n GLU 165 N -2.45 1.54 -3.89 1.61 4.07 -1.26 -4.94 120.64 115.31 2c4m n GLU 165 Ca 0.03 0.56 -0.30 0.00 -0.06 0.00 0.00 57.16 57.38 2c4m n GLU 165 Cb 0.56 -2.26 -0.14 0.00 -0.06 0.00 0.00 31.44 29.54 2c4m n GLU 165 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 2c4m s TYR 166 N 1.20 2.89 -0.05 4.31 5.04 -1.26 -4.95 117.35 124.53 2c4m s TYR 166 Ca 0.85 -2.79 0.26 0.00 -2.44 0.00 0.00 57.07 52.95 2c4m s TYR 166 Cb -0.86 -2.51 1.40 0.00 0.35 0.00 0.00 41.96 40.34 2c4m s TYR 166 CO 0.46 -0.82 1.80 -1.35 -1.34 0.00 0.00 175.55 174.30 2c4m h PRO 167 N 7.03 0.00 -0.17 4.97 0.11 -1.92 -2.92 132.00 139.10 2c4m h PRO 167 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2c4m h PRO 167 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2c4m h PRO 167 CO 0.57 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.55 2c4m n PHE 168 N -2.42 0.22 -3.94 0.65 3.72 -1.26 -4.59 117.46 109.84 2c4m n PHE 168 Ca -0.01 -0.11 -0.23 0.00 -0.05 0.00 0.00 57.45 57.04 2c4m n PHE 168 Cb 0.06 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.43 2c4m n PHE 168 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2c4m s THR 169 N -1.78 0.64 -0.22 4.37 -4.23 -1.10 -4.03 115.64 109.28 2c4m s THR 169 Ca 0.17 -0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.55 2c4m s THR 169 Cb 0.09 -0.71 -0.02 0.00 1.34 0.00 0.00 72.50 73.19 2c4m s THR 169 CO 0.12 0.29 0.00 -0.63 -0.54 0.00 0.00 174.62 173.86 2c4m s ILE 170 N 1.60 3.87 0.12 2.99 1.01 0.55 -4.86 121.20 126.47 2c4m s ILE 170 Ca 0.00 -0.33 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 2c4m s ILE 170 Cb -0.13 -2.77 -0.06 0.00 0.01 0.00 0.00 42.46 39.51 2c4m s ILE 170 CO -0.04 0.40 1.04 -0.60 0.00 0.00 0.00 174.94 175.74 2c4m s ARG 171 N 1.29 4.61 -0.55 2.79 3.52 -1.26 -0.13 118.95 129.22 2c4m s ARG 171 Ca 0.04 1.59 0.06 0.00 -0.13 0.00 0.00 55.73 57.29 2c4m s ARG 171 Cb -0.15 -3.34 0.33 0.00 -1.56 0.00 0.00 34.95 30.23 2c4m s ARG 171 CO 0.01 0.08 0.90 0.54 -0.81 0.00 0.00 175.30 176.02 2c4m n ARG 172 N 2.87 2.86 0.29 5.12 5.12 0.45 -4.93 116.66 128.44 2c4m n ARG 172 Ca 0.04 -4.63 0.16 0.00 -1.93 0.00 0.00 57.85 51.48 2c4m n ARG 172 Cb 0.48 -2.16 0.88 0.00 -1.16 0.00 0.00 32.46 30.50 2c4m n ARG 172 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2c4m h ALA 173 N 3.09 1.22 0.00 7.54 0.00 -1.94 0.77 119.26 129.93 2c4m h ALA 173 Ca 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c4m h ALA 173 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2c4m h ALA 173 CO 0.77 0.07 0.00 -1.13 0.00 0.00 0.00 179.25 178.96 2c4m n SER 174 N -3.47 0.31 -1.30 0.00 3.41 -1.26 -1.92 113.62 109.38 2c4m n SER 174 Ca -0.02 0.57 0.10 0.00 -0.26 0.00 0.00 58.87 59.26 2c4m n SER 174 Cb 0.18 -0.64 0.31 0.00 -0.26 0.00 0.00 64.21 63.80 2c4m n SER 174 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2c4m n ASP 175 N -1.83 4.03 -4.70 4.04 8.00 0.26 -5.04 116.55 121.32 2c4m n ASP 175 Ca 0.03 -2.14 -0.34 0.00 0.71 0.00 0.00 54.79 53.05 2c4m n ASP 175 Cb 0.23 -0.48 0.11 0.00 -0.02 0.00 0.00 41.12 40.96 2c4m n ASP 175 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c4m n GLN 176 N 1.30 0.43 -4.72 -1.24 10.64 -0.81 -4.76 117.38 118.22 2c4m n GLN 176 Ca 0.23 0.22 -0.32 0.00 -1.83 0.00 0.00 57.00 55.30 2c4m n GLN 176 Cb 0.67 -2.45 -0.08 0.00 -0.86 0.00 0.00 30.24 27.52 2c4m n GLN 176 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2c4m s LEU 177 N -5.20 2.28 -0.09 2.61 1.43 -0.35 -4.94 118.68 114.40 2c4m s LEU 177 Ca 0.76 -1.65 0.03 0.00 -1.03 0.00 0.00 54.13 52.24 2c4m s LEU 177 Cb -0.32 -0.65 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 2c4m s LEU 177 CO 0.48 -0.85 -0.19 -0.69 0.23 0.00 0.00 176.35 175.33 2c4m s VAL 178 N -2.92 2.52 -0.30 -1.59 1.01 -1.26 -0.39 120.40 117.47 2c4m s VAL 178 Ca 0.10 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2c4m s VAL 178 Cb 0.02 -1.99 0.08 0.00 0.00 0.00 0.00 36.38 34.49 2c4m s VAL 178 CO 0.05 0.55 -0.01 -0.69 0.00 0.00 0.00 175.10 175.01 2c4m s VAL 179 N 0.08 2.04 -0.32 2.92 1.01 -0.53 -4.92 120.40 120.68 2c4m s VAL 179 Ca -0.09 -1.92 -0.12 0.00 0.00 0.00 0.00 61.98 59.85 2c4m s VAL 179 Cb -0.15 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 2c4m s VAL 179 CO 0.05 -0.38 0.23 0.00 0.00 0.00 0.00 175.10 175.00 2c4m s PHE 181 N 1.74 3.50 0.48 0.00 0.08 0.83 -4.97 117.98 119.64 2c4m s PHE 181 Ca 0.07 0.38 0.31 0.00 0.12 0.00 0.00 56.93 57.80 2c4m s PHE 181 Cb -0.17 -1.92 1.67 0.00 -0.57 0.00 0.00 43.02 42.03 2c4m s PHE 181 CO 0.11 0.10 2.16 -0.44 -0.10 0.00 0.00 175.22 177.04 2c4m h ASP 182 N 0.74 0.00 -0.11 1.36 3.32 -0.66 -2.69 116.42 118.39 2c4m h ASP 182 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2c4m h ASP 182 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2c4m h ASP 182 CO 0.61 0.07 0.00 -0.90 -1.72 0.00 0.00 179.24 177.30 2c4m n ASP 183 N -3.60 2.11 -3.54 6.45 5.75 -1.26 -5.00 116.55 117.47 2c4m n ASP 183 Ca -0.02 -1.78 -0.00 0.00 -0.01 0.00 0.00 54.79 52.98 2c4m n ASP 183 Cb 0.18 -0.07 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 2c4m n ASP 183 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 2c4m s MET 184 N -0.83 0.45 -0.25 0.11 0.00 -1.01 -5.13 119.30 112.63 2c4m s MET 184 Ca 0.09 1.11 -0.16 0.00 0.00 0.00 0.00 55.69 56.72 2c4m s MET 184 Cb 0.05 0.65 -0.03 0.00 0.00 0.00 0.00 34.83 35.49 2c4m s MET 184 CO 0.06 -0.15 0.43 0.21 0.00 0.00 0.00 175.02 175.57 2c4m s LYS 185 N 2.63 4.07 0.12 4.11 2.20 -1.26 -0.12 119.74 131.50 2c4m s LYS 185 Ca -0.05 0.18 0.08 0.00 -0.36 0.00 0.00 55.97 55.83 2c4m s LYS 185 Cb -0.09 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 2c4m s LYS 185 CO -0.18 -0.25 -0.19 0.95 -0.36 0.00 0.00 175.35 175.31 2c4m s THR 186 N 1.99 1.72 -0.12 3.43 -4.23 -0.70 -3.84 115.64 113.88 2c4m s THR 186 Ca 0.18 -1.68 -0.18 0.00 -1.18 0.00 0.00 61.69 58.83 2c4m s THR 186 Cb -0.15 -1.65 -0.04 0.00 1.34 0.00 0.00 72.50 72.00 2c4m s THR 186 CO 0.09 -0.17 0.47 -0.13 -0.54 0.00 0.00 174.62 174.34 2c4m s ARG 187 N -2.26 4.33 -0.37 3.99 0.52 0.41 -1.45 118.95 124.12 2c4m s ARG 187 Ca 0.10 0.43 -0.09 0.00 -0.52 0.00 0.00 55.73 55.64 2c4m s ARG 187 Cb -0.08 -3.44 0.05 0.00 0.52 0.00 0.00 34.95 31.99 2c4m s ARG 187 CO 0.05 0.15 0.19 0.00 0.02 0.00 0.00 175.30 175.71 2c4m s ALA 188 N 0.64 3.20 -0.28 2.13 0.00 0.47 -1.46 121.76 126.46 2c4m s ALA 188 Ca 0.25 -1.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.21 2c4m s ALA 188 Cb -0.15 -2.50 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 2c4m s ALA 188 CO 0.10 -1.45 0.38 0.42 0.00 0.00 0.00 175.76 175.22 2c4m s ILE 189 N 1.47 5.16 0.22 0.00 -1.09 0.64 -1.22 121.20 126.38 2c4m s ILE 189 Ca 0.01 0.49 -0.30 0.00 -2.23 0.00 0.00 60.65 58.62 2c4m s ILE 189 Cb -0.20 -3.74 -0.08 0.00 -1.58 0.00 0.00 42.46 36.86 2c4m s ILE 189 CO 0.04 0.10 0.98 -2.16 -1.23 0.00 0.00 174.94 172.67 2c4m s PRO 190 N 2.09 4.78 0.00 2.79 0.04 -1.26 -1.35 135.00 142.09 2c4m s PRO 190 Ca 0.15 1.55 0.07 0.00 0.04 0.00 0.00 61.00 62.81 2c4m s PRO 190 Cb -0.16 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.08 2c4m s PRO 190 CO 0.10 0.39 -0.21 0.71 0.04 0.00 0.00 177.00 178.03 2c4m s TYR 191 N -0.91 1.88 -0.14 0.56 1.51 0.05 -0.41 117.35 119.89 2c4m s TYR 191 Ca 0.43 -0.36 -0.01 0.00 -1.01 0.00 0.00 57.07 56.12 2c4m s TYR 191 Cb -0.27 -1.19 -0.02 0.00 -0.11 0.00 0.00 41.96 40.38 2c4m s TYR 191 CO 0.33 0.01 -0.12 -0.51 -1.11 0.00 0.00 175.55 174.15 2c4m s ASP 192 N -0.70 4.11 -0.16 2.29 1.01 0.82 -1.49 116.67 122.54 2c4m s ASP 192 Ca 0.08 -0.31 -0.00 0.00 0.71 0.00 0.00 52.55 53.03 2c4m s ASP 192 Cb -0.08 -1.64 -0.00 0.00 1.01 0.00 0.00 42.92 42.21 2c4m s ASP 192 CO -0.00 0.15 -0.14 -0.32 0.21 0.00 0.00 175.17 175.07 2c4m s MET 193 N 0.44 3.23 0.22 8.23 -2.45 -0.79 -0.33 119.30 127.84 2c4m s MET 193 Ca -0.09 -0.74 -0.30 0.00 -1.25 0.00 0.00 55.69 53.32 2c4m s MET 193 Cb -0.16 -2.65 -0.08 0.00 1.25 0.00 0.00 34.83 33.19 2c4m s MET 193 CO 0.05 0.01 1.06 -1.25 1.05 0.00 0.00 175.02 175.93 2c4m s PRO 194 N 0.85 4.66 -0.36 4.11 0.04 -1.26 -1.12 135.00 141.92 2c4m s PRO 194 Ca -0.04 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 2c4m s PRO 194 Cb -0.15 -3.26 0.09 0.00 0.04 0.00 0.00 34.50 31.22 2c4m s PRO 194 CO -0.00 0.21 0.10 0.42 0.04 0.00 0.00 177.00 177.76 2c4m s ILE 195 N -0.69 2.99 0.57 0.56 -1.09 0.48 -4.91 121.20 119.11 2c4m s ILE 195 Ca 0.46 -1.86 -0.09 0.00 -2.23 0.00 0.00 60.65 56.94 2c4m s ILE 195 Cb -0.29 -2.95 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 2c4m s ILE 195 CO 0.36 -0.45 0.93 0.42 -1.23 0.00 0.00 174.94 174.97 2c4m s THR 196 N 1.14 4.75 -0.03 2.92 -4.23 -1.26 -0.09 115.64 118.84 2c4m s THR 196 Ca 0.04 0.58 0.02 0.00 -1.18 0.00 0.00 61.69 61.15 2c4m s THR 196 Cb -0.21 -3.85 0.01 0.00 1.34 0.00 0.00 72.50 69.78 2c4m s THR 196 CO -0.04 -1.01 -0.08 -0.83 -0.54 0.00 0.00 174.62 172.12 2c4m s GLY 197 N -4.16 0.52 0.14 3.99 0.00 -1.26 -4.83 107.32 101.73 2c4m s GLY 197 Ca 0.52 -0.28 -0.31 0.00 0.00 0.00 0.00 44.72 44.65 2c4m s GLY 197 CO 0.50 0.01 1.53 -0.47 0.00 0.00 0.00 173.10 174.68 2c4m s TYR 198 N 0.33 3.04 0.00 1.90 6.14 -1.26 -2.92 117.35 124.58 2c4m s TYR 198 Ca -0.05 0.68 0.00 0.00 0.64 0.00 0.00 57.07 58.34 2c4m s TYR 198 Cb -0.10 -3.87 0.00 0.00 0.42 0.00 0.00 41.96 38.41 2c4m s TYR 198 CO 0.01 -3.20 0.00 0.41 0.64 0.00 0.00 175.55 173.40 2c4m n GLY 199 N 3.71 1.44 3.23 8.97 0.00 -1.26 -4.85 105.19 116.44 2c4m n GLY 199 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 2c4m n GLY 199 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2c4m s THR 200 N -3.18 0.78 -1.46 2.61 -1.32 -1.15 -5.02 115.64 106.91 2c4m s THR 200 Ca 0.00 -1.99 0.24 0.00 -1.21 0.00 0.00 61.69 58.73 2c4m s THR 200 Cb 0.00 -2.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.00 2c4m s THR 200 CO 0.00 -0.59 1.26 1.41 -2.21 0.00 0.00 174.62 174.49 2c4m n HIS 201 N -0.21 0.00 -1.99 9.09 8.25 -1.26 -4.63 115.22 124.47 2c4m n HIS 201 Ca -0.08 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 56.99 2c4m n HIS 201 Cb 0.62 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.65 2c4m n HIS 201 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2c4m s ASN 202 N -2.74 5.87 -0.16 0.41 -0.87 -1.26 -4.68 114.94 111.51 2c4m s ASN 202 Ca 0.16 2.63 -0.02 0.00 -1.57 0.00 0.00 52.86 54.06 2c4m s ASN 202 Cb 0.18 -2.63 0.05 0.00 -0.02 0.00 0.00 41.25 38.83 2c4m s ASN 202 CO 0.66 -1.15 0.01 -0.69 -2.57 0.00 0.00 177.10 173.36 2c4m s VAL 203 N -1.34 0.60 0.86 1.60 1.01 -1.26 -3.99 120.40 117.87 2c4m s VAL 203 Ca 0.64 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2c4m s VAL 203 Cb -0.37 -0.96 0.15 0.00 0.00 0.00 0.00 36.38 35.19 2c4m s VAL 203 CO 0.46 -0.03 1.20 -0.83 0.00 0.00 0.00 175.10 175.89 2c4m s GLY 204 N 1.84 1.73 -0.02 4.51 0.00 0.87 -4.78 107.32 111.48 2c4m s GLY 204 Ca 0.01 -1.15 0.05 0.00 0.00 0.00 0.00 44.72 43.63 2c4m s GLY 204 CO -0.07 -0.52 -0.17 -1.59 0.00 0.00 0.00 173.10 170.75 2c4m s THR 205 N -3.61 1.40 -0.32 0.90 2.01 -1.26 -0.38 115.64 114.37 2c4m s THR 205 Ca 0.68 -0.74 -0.04 0.00 0.31 0.00 0.00 61.69 61.90 2c4m s THR 205 Cb -0.06 -1.17 0.04 0.00 0.01 0.00 0.00 72.50 71.32 2c4m s THR 205 CO 0.50 0.40 0.05 -0.22 -0.69 0.00 0.00 174.62 174.65 2c4m s LEU 206 N -0.32 4.06 -0.23 4.42 2.96 -0.28 -1.86 118.68 127.44 2c4m s LEU 206 Ca 0.05 -1.17 -0.24 0.00 -0.22 0.00 0.00 54.13 52.55 2c4m s LEU 206 Cb -0.08 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.81 2c4m s LEU 206 CO -0.00 -0.28 0.78 -0.60 -1.32 0.00 0.00 176.35 174.93 2c4m s ARG 207 N 1.34 4.19 -0.09 1.98 6.06 0.84 -1.89 118.95 131.36 2c4m s ARG 207 Ca -0.03 0.86 0.03 0.00 -2.50 0.00 0.00 55.73 54.09 2c4m s ARG 207 Cb -0.19 -3.63 -0.01 0.00 0.06 0.00 0.00 34.95 31.17 2c4m s ARG 207 CO 0.01 -0.46 -0.20 -0.51 -2.50 0.00 0.00 175.30 171.64 2c4m s LEU 208 N 2.65 2.36 -0.10 -0.88 1.43 -0.56 -1.35 118.68 122.23 2c4m s LEU 208 Ca 0.33 -0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 52.95 2c4m s LEU 208 Cb -0.15 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 2c4m s LEU 208 CO 0.08 0.20 0.12 0.26 0.23 0.00 0.00 176.35 177.24 2c4m s TRP 209 N 0.10 3.51 -0.13 0.29 0.52 0.04 -0.77 118.94 122.50 2c4m s TRP 209 Ca -0.09 0.45 0.03 0.00 0.02 0.00 0.00 56.10 56.51 2c4m s TRP 209 Cb -0.15 -1.90 0.01 0.00 -1.15 0.00 0.00 33.47 30.27 2c4m s TRP 209 CO 0.06 0.68 -0.22 0.21 0.02 0.00 0.00 176.95 177.70 2c4m s LYS 210 N -1.09 2.95 -0.08 4.98 2.20 -0.46 -0.32 119.74 127.92 2c4m s LYS 210 Ca 0.16 -0.83 -0.22 0.00 -0.36 0.00 0.00 55.97 54.72 2c4m s LYS 210 Cb -0.12 -2.35 -0.04 0.00 -1.51 0.00 0.00 37.83 33.81 2c4m s LYS 210 CO 0.05 0.02 0.63 0.00 -0.36 0.00 0.00 175.35 175.70 2c4m s ALA 211 N 0.73 3.38 0.07 3.13 0.00 -1.26 -0.26 121.76 127.55 2c4m s ALA 211 Ca -0.10 0.04 0.04 0.00 0.00 0.00 0.00 51.96 51.95 2c4m s ALA 211 Cb -0.16 -2.86 -0.03 0.00 0.00 0.00 0.00 23.12 20.07 2c4m s ALA 211 CO 0.00 -0.06 -0.12 -1.21 0.00 0.00 0.00 175.76 174.38 2c4m s GLU 212 N 0.68 0.76 0.87 0.00 2.02 -0.53 -4.59 118.70 117.90 2c4m s GLU 212 Ca 0.34 -0.96 -0.11 0.00 0.02 0.00 0.00 54.97 54.26 2c4m s GLU 212 Cb -0.17 -0.63 0.12 0.00 0.10 0.00 0.00 34.13 33.55 2c4m s GLU 212 CO 0.16 0.13 1.09 -1.25 0.02 0.00 0.00 175.26 175.41 2c4m s PRO 213 N -1.95 1.43 0.12 0.39 0.04 -1.26 -0.45 135.00 133.32 2c4m s PRO 213 Ca -0.02 0.98 -0.12 0.00 0.04 0.00 0.00 61.00 61.88 2c4m s PRO 213 Cb -0.08 -1.82 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 2c4m s PRO 213 CO 0.01 -2.17 1.39 2.35 0.04 0.00 0.00 177.00 178.63 2c4m h TRP 214 N -1.50 1.06 -4.10 0.56 2.91 -1.94 -3.42 115.95 109.50 2c4m h TRP 214 Ca -0.48 -0.38 -0.69 0.00 1.13 0.00 0.00 58.89 58.48 2c4m h TRP 214 Cb 1.27 -0.20 -0.24 0.00 -0.51 0.00 0.00 29.16 29.48 2c4m h TRP 214 CO 0.47 1.20 -0.81 -1.21 -1.03 0.00 0.00 178.44 177.06 2c4m s GLU 215 N -4.13 2.25 0.12 2.65 0.41 -1.26 -5.05 118.70 113.69 2c4m s GLU 215 Ca -0.11 -0.86 -0.22 0.00 -0.41 0.00 0.00 54.97 53.37 2c4m s GLU 215 Cb 0.10 -2.24 -0.06 0.00 -1.78 0.00 0.00 34.13 30.15 2c4m s GLU 215 CO 0.88 0.58 1.69 0.93 -0.49 0.00 0.00 175.26 178.85 2c4m h GLU 216 N 5.02 -0.13 -3.35 1.61 4.39 -2.00 -3.46 114.58 116.65 2c4m h GLU 216 Ca -0.46 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.19 2c4m h GLU 216 Cb 1.15 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 2c4m h GLU 216 CO 0.49 -0.09 0.09 -0.59 -1.16 0.00 0.00 179.01 177.75 2c4m s PHE 217 N -6.17 0.28 -0.88 4.33 -0.71 -1.26 -4.73 117.98 108.84 2c4m s PHE 217 Ca -0.14 -0.76 -0.25 0.00 -1.04 0.00 0.00 56.93 54.74 2c4m s PHE 217 Cb 0.09 0.50 0.03 0.00 -1.21 0.00 0.00 43.02 42.43 2c4m s PHE 217 CO 0.67 -1.29 1.43 0.34 -1.34 0.00 0.00 175.22 175.03 2c4m s ASP 218 N -3.06 6.22 0.34 1.98 -1.08 0.10 -4.85 116.67 116.32 2c4m s ASP 218 Ca 0.19 -0.91 0.03 0.00 -0.52 0.00 0.00 52.55 51.34 2c4m s ASP 218 Cb -0.03 -2.56 0.60 0.00 -1.46 0.00 0.00 42.92 39.46 2c4m s ASP 218 CO 0.12 -1.76 1.92 0.22 0.52 0.00 0.00 175.17 176.19 2c4m h TYR 219 N 10.23 0.67 -0.45 -5.34 5.03 -1.99 -0.96 116.97 124.17 2c4m h TYR 219 Ca -0.03 -0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.26 2c4m h TYR 219 Cb 1.03 -0.21 -0.03 0.00 1.55 0.00 0.00 36.73 39.08 2c4m h TYR 219 CO 1.20 0.54 0.28 -0.44 -1.32 0.00 0.00 178.16 178.43 2c4m h ASP 220 N 0.66 0.47 -0.48 -2.11 3.32 -1.98 0.55 116.42 116.85 2c4m h ASP 220 Ca 0.16 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 2c4m h ASP 220 Cb 0.17 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2c4m h ASP 220 CO -0.01 0.34 -0.16 0.00 -1.72 0.00 0.00 179.24 177.69 2c4m h ALA 221 N 1.18 0.77 -0.83 3.45 0.00 -1.79 -1.72 119.26 120.33 2c4m h ALA 221 Ca 0.17 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2c4m h ALA 221 Cb -0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 2c4m h ALA 221 CO -0.06 0.67 0.50 0.35 0.00 0.00 0.00 179.25 180.70 2c4m h PHE 222 N 0.86 1.11 0.00 0.00 3.57 -0.92 -0.73 116.94 120.82 2c4m h PHE 222 Ca 0.12 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 2c4m h PHE 222 Cb 0.72 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2c4m h PHE 222 CO 0.05 0.74 -0.13 -0.97 -2.23 0.00 0.00 178.31 175.77 2c4m h ASN 223 N 1.15 0.00 -0.03 0.41 -0.73 -0.69 0.11 115.58 115.80 2c4m h ASN 223 Ca 0.30 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.47 2c4m h ASN 223 Cb -0.03 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.56 2c4m h ASN 223 CO -0.05 0.13 0.00 0.00 -0.37 0.00 0.00 177.43 177.14 2c4m n ALA 224 N -2.22 2.59 -2.08 1.57 0.00 -0.66 -4.92 120.51 114.79 2c4m n ALA 224 Ca -0.01 -0.40 -0.14 0.00 0.00 0.00 0.00 53.44 52.90 2c4m n ALA 224 Cb 0.30 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 2c4m n ALA 224 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2c4m n GLN 225 N -0.06 -1.08 -3.04 0.00 6.02 0.37 -4.93 117.38 114.66 2c4m n GLN 225 Ca 0.20 0.74 -0.44 0.00 -0.01 0.00 0.00 57.00 57.49 2c4m n GLN 225 Cb 0.30 -4.97 0.01 0.00 1.02 0.00 0.00 30.24 26.59 2c4m n GLN 225 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2c4m n ARG 226 N -2.39 4.08 -0.10 -1.09 1.74 -0.34 -4.86 116.66 113.69 2c4m n ARG 226 Ca -0.16 -4.40 0.00 0.00 -0.77 0.00 0.00 57.85 52.52 2c4m n ARG 226 Cb 0.59 -2.59 0.28 0.00 -1.02 0.00 0.00 32.46 29.73 2c4m n ARG 226 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2c4m h PHE 227 N 5.90 0.75 -0.04 -1.55 0.04 -1.87 -1.21 116.94 118.96 2c4m h PHE 227 Ca 0.22 -0.02 -0.24 0.00 2.80 0.00 0.00 57.97 60.73 2c4m h PHE 227 Cb 0.70 -0.24 0.02 0.00 2.20 0.00 0.00 35.95 38.63 2c4m h PHE 227 CO 0.96 0.55 -0.90 1.15 -0.60 0.00 0.00 178.31 179.48 2c4m h THR 228 N 0.76 1.30 -0.72 -1.55 2.02 -1.95 -3.25 112.91 109.52 2c4m h THR 228 Ca 0.19 -2.13 0.06 0.00 0.77 0.00 0.00 66.41 65.29 2c4m h THR 228 Cb 0.08 2.30 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 2c4m h THR 228 CO -0.02 0.66 0.42 0.44 0.37 0.00 0.00 175.52 177.38 2c4m h ASP 229 N 0.35 0.64 -0.29 4.18 3.32 -1.84 -2.30 116.42 120.48 2c4m h ASP 229 Ca -0.10 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.06 2c4m h ASP 229 Cb 1.55 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.99 2c4m h ASP 229 CO 0.18 0.41 0.31 0.00 -1.72 0.00 0.00 179.24 178.42 2c4m h ALA 230 N 1.36 1.96 -0.08 3.45 0.00 -1.26 -2.92 119.26 121.77 2c4m h ALA 230 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2c4m h ALA 230 Cb 0.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2c4m h ALA 230 CO -0.18 -0.46 0.00 0.44 0.00 0.00 0.00 179.25 179.05 2c4m n ILE 231 N -3.78 0.52 -0.21 0.00 -6.64 -0.89 -0.72 119.36 107.64 2c4m n ILE 231 Ca 0.04 -0.76 -0.07 0.00 -1.77 0.00 0.00 62.75 60.19 2c4m n ILE 231 Cb 0.46 0.79 0.03 0.00 -1.44 0.00 0.00 39.64 39.47 2c4m n ILE 231 CO 0.00 0.00 0.00 0.40 -1.77 0.00 0.00 176.55 175.18 2c4m h ILE 232 N 0.89 1.21 -0.25 7.28 2.04 -1.30 -0.76 117.51 126.62 2c4m h ILE 232 Ca 0.00 -0.58 -0.09 0.00 1.00 0.00 0.00 64.86 65.20 2c4m h ILE 232 Cb 0.40 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2c4m h ILE 232 CO 0.00 0.24 -0.18 -0.08 0.00 0.00 0.00 178.15 178.12 2c4m h GLU 233 N 0.80 0.56 -0.76 2.37 4.57 -1.85 -0.13 114.58 120.14 2c4m h GLU 233 Ca 0.20 -0.27 0.11 0.00 -1.18 0.00 0.00 59.36 58.22 2c4m h GLU 233 Cb 0.11 -0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.62 2c4m h GLU 233 CO -0.03 0.85 0.39 -0.09 -1.18 0.00 0.00 179.01 178.95 2c4m h ARG 234 N 0.28 0.61 0.00 1.92 2.43 -1.81 -1.00 114.38 116.82 2c4m h ARG 234 Ca 0.05 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 2c4m h ARG 234 Cb 0.71 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 2c4m h ARG 234 CO 0.05 0.41 -0.72 0.93 -1.51 0.00 0.00 179.97 179.13 2c4m h GLU 235 N 0.63 0.00 -0.54 0.20 4.39 -0.99 -1.57 114.58 116.70 2c4m h GLU 235 Ca 0.39 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.00 2c4m h GLU 235 Cb 0.44 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.07 2c4m h GLU 235 CO -0.29 0.72 -0.00 0.00 -1.16 0.00 0.00 179.01 178.27 2c4m h ARG 236 N 0.00 0.93 -0.21 2.33 3.08 -0.27 0.19 114.38 120.42 2c4m h ARG 236 Ca -0.01 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 59.69 2c4m h ARG 236 Cb 1.46 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.41 2c4m h ARG 236 CO 0.09 0.92 -0.18 0.28 -1.07 0.00 0.00 179.97 180.01 2c4m h VAL 237 N 0.86 1.32 0.00 2.04 2.07 -1.12 -2.89 116.25 118.53 2c4m h VAL 237 Ca 0.16 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 2c4m h VAL 237 Cb 0.51 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2c4m h VAL 237 CO 0.03 0.40 -0.03 0.28 0.02 0.00 0.00 177.57 178.27 2c4m h SER 238 N 0.18 0.00 0.22 0.57 0.02 -1.01 -1.42 113.55 112.11 2c4m h SER 238 Ca 0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2c4m h SER 238 Cb 0.71 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 2c4m h SER 238 CO 0.05 0.03 -0.06 0.44 -1.14 0.00 0.00 176.83 176.15 2c4m h ASP 239 N 0.00 0.00 -0.81 3.07 3.32 -0.73 -1.90 116.42 119.37 2c4m h ASP 239 Ca -0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2c4m h ASP 239 Cb 0.11 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 2c4m h ASP 239 CO 0.00 0.06 0.54 0.40 -1.72 0.00 0.00 179.24 178.52 2c4m h ILE 240 N 0.00 1.17 -0.20 0.35 2.04 -1.37 -3.01 117.51 116.50 2c4m h ILE 240 Ca -0.00 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2c4m h ILE 240 Cb 0.18 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 2c4m h ILE 240 CO 0.01 0.19 0.00 0.00 0.00 0.00 0.00 178.15 178.35 2c4m h ARG 242 N 1.18 -0.90 -4.61 0.00 2.43 -1.21 0.23 114.38 111.49 2c4m h ARG 242 Ca 0.00 0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 58.97 2c4m h ARG 242 Cb 0.75 0.21 -0.19 0.00 -0.42 0.00 0.00 29.97 30.32 2c4m h ARG 242 CO 0.03 -0.58 -0.72 0.14 -1.51 0.00 0.00 179.97 177.32 2c4m s VAL 243 N -4.90 0.61 0.25 0.20 -7.23 -1.26 -0.80 120.40 107.27 2c4m s VAL 243 Ca -0.15 -1.41 -0.13 0.00 -1.81 0.00 0.00 61.98 58.48 2c4m s VAL 243 Cb 0.02 -1.02 -0.08 0.00 0.56 0.00 0.00 36.38 35.85 2c4m s VAL 243 CO 0.47 -0.56 0.63 -1.48 -0.31 0.00 0.00 175.10 173.85 2c4m s LEU 244 N -2.14 4.16 -1.15 1.32 2.34 -0.12 -4.22 118.68 118.88 2c4m s LEU 244 Ca -0.02 1.11 -0.22 0.00 0.06 0.00 0.00 54.13 55.07 2c4m s LEU 244 Cb -0.04 -3.77 -0.00 0.00 -0.56 0.00 0.00 46.19 41.81 2c4m s LEU 244 CO -0.02 -0.09 0.78 -1.22 -1.06 0.00 0.00 176.35 174.74 2c4m n TYR 245 N -0.04 -1.85 -2.04 3.48 4.02 -1.26 -4.62 117.16 114.85 2c4m n TYR 245 Ca 0.01 0.42 -0.41 0.00 -0.01 0.00 0.00 57.90 57.90 2c4m n TYR 245 Cb 0.52 -3.38 -0.02 0.00 -0.02 0.00 0.00 39.34 36.44 2c4m n TYR 245 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2c4m s PRO 246 N -6.13 4.29 0.15 -0.72 0.04 -1.26 -4.88 135.00 126.49 2c4m s PRO 246 Ca 0.47 2.28 -0.34 0.00 0.04 0.00 0.00 61.00 63.44 2c4m s PRO 246 Cb -0.18 -3.09 -0.16 0.00 0.04 0.00 0.00 34.50 31.12 2c4m s PRO 246 CO 0.87 -0.34 1.28 -1.71 0.04 0.00 0.00 177.00 177.14 2c4m n ASN 247 N 1.69 1.73 -2.53 6.66 5.15 -1.26 -4.90 115.26 121.80 2c4m n ASN 247 Ca 0.04 1.13 -0.22 0.00 -0.60 0.00 0.00 54.58 54.93 2c4m n ASN 247 Cb 0.41 -1.25 0.01 0.00 -0.53 0.00 0.00 39.78 38.42 2c4m n ASN 247 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2c4m n ASP 248 N 2.31 3.86 0.22 1.20 5.75 -1.26 -4.60 116.55 124.03 2c4m n ASP 248 Ca 0.16 -3.46 0.12 0.00 -0.01 0.00 0.00 54.79 51.60 2c4m n ASP 248 Cb 0.24 -0.48 0.30 0.00 -1.03 0.00 0.00 41.12 40.15 2c4m n ASP 248 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2c4m h THR 249 N 2.69 0.20 -1.81 2.12 1.35 -1.92 -3.40 112.91 112.14 2c4m h THR 249 Ca 0.20 -1.09 -0.56 0.00 -0.55 0.00 0.00 66.41 64.40 2c4m h THR 249 Cb 0.99 1.93 -0.09 0.00 -1.73 0.00 0.00 68.15 69.25 2c4m h THR 249 CO 0.76 0.10 -0.55 0.42 -0.25 0.00 0.00 175.52 176.00 2c4m s THR 250 N -3.33 2.67 0.23 6.82 -4.23 -1.26 -5.02 115.64 111.52 2c4m s THR 250 Ca 0.04 -1.79 -0.06 0.00 -1.18 0.00 0.00 61.69 58.70 2c4m s THR 250 Cb 0.07 -2.92 0.18 0.00 1.34 0.00 0.00 72.50 71.17 2c4m s THR 250 CO 0.65 -0.13 1.77 0.22 -0.54 0.00 0.00 174.62 176.59 2c4m h TYR 251 N 1.60 0.63 -0.08 3.99 3.20 -2.00 -1.14 116.97 123.18 2c4m h TYR 251 Ca -0.43 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.41 2c4m h TYR 251 Cb 1.25 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 2c4m h TYR 251 CO 0.65 0.21 -0.23 0.93 -1.64 0.00 0.00 178.16 178.08 2c4m h GLU 252 N 0.59 0.13 -0.34 1.82 4.39 -1.96 0.59 114.58 119.80 2c4m h GLU 252 Ca 0.36 -0.04 -0.16 0.00 0.34 0.00 0.00 59.36 59.86 2c4m h GLU 252 Cb 0.40 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2c4m h GLU 252 CO -0.28 0.36 -0.42 0.78 -1.16 0.00 0.00 179.01 178.29 2c4m h GLY 253 N 0.85 0.97 0.96 -3.84 0.00 -1.50 -2.13 103.07 98.38 2c4m h GLY 253 Ca 0.02 -1.03 -0.07 0.00 0.00 0.00 0.00 47.33 46.25 2c4m h GLY 253 CO 0.03 0.93 -0.01 0.50 0.00 0.00 0.00 176.54 177.99 2c4m h LYS 254 N 0.68 0.73 -0.90 4.80 1.57 -0.81 -2.55 116.57 120.10 2c4m h LYS 254 Ca 0.04 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2c4m h LYS 254 Cb 1.02 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.22 2c4m h LYS 254 CO 0.10 0.82 0.60 -0.22 -0.57 0.00 0.00 179.45 180.18 2c4m h LYS 255 N 0.56 1.17 -0.22 3.15 3.64 -0.83 -1.71 116.57 122.32 2c4m h LYS 255 Ca 0.11 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2c4m h LYS 255 Cb 0.50 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2c4m h LYS 255 CO 0.02 0.77 0.13 1.25 -2.27 0.00 0.00 179.45 179.36 2c4m h LEU 256 N 1.20 0.27 -0.50 5.20 5.85 -1.11 0.91 115.31 127.12 2c4m h LEU 256 Ca 0.34 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 59.05 2c4m h LEU 256 Cb -0.11 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.81 2c4m h LEU 256 CO -0.08 0.25 0.23 0.03 -0.34 0.00 0.00 178.44 178.53 2c4m h ARG 257 N 0.27 0.44 -0.87 1.25 3.08 -1.02 0.14 114.38 117.67 2c4m h ARG 257 Ca 0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 2c4m h ARG 257 Cb 0.03 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 2c4m h ARG 257 CO -0.01 0.29 0.45 0.28 -1.07 0.00 0.00 179.97 179.91 2c4m h VAL 258 N 0.46 1.26 -0.39 2.04 2.07 -1.03 -1.43 116.25 119.22 2c4m h VAL 258 Ca 0.23 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.08 2c4m h VAL 258 Cb 0.17 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 2c4m h VAL 258 CO -0.18 0.30 0.26 -0.09 0.02 0.00 0.00 177.57 177.88 2c4m h ARG 259 N 1.23 0.51 -0.16 1.57 2.43 0.55 -1.12 114.38 119.38 2c4m h ARG 259 Ca 0.30 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.46 2c4m h ARG 259 Cb 0.07 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2c4m h ARG 259 CO -0.04 0.34 0.04 1.96 -1.51 0.00 0.00 179.97 180.76 2c4m h GLN 260 N 0.52 0.11 -0.89 0.20 4.20 -0.22 -0.59 115.11 118.45 2c4m h GLN 260 Ca 0.15 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 2c4m h GLN 260 Cb -0.05 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 2c4m h GLN 260 CO -0.04 0.08 0.48 1.96 -0.67 0.00 0.00 178.83 180.64 2c4m h GLN 261 N 0.12 1.25 -0.19 1.46 4.20 -1.01 -2.63 115.11 118.30 2c4m h GLN 261 Ca 0.07 -0.15 -0.21 0.00 0.06 0.00 0.00 58.65 58.42 2c4m h GLN 261 Cb 0.05 -0.24 0.01 0.00 0.30 0.00 0.00 27.48 27.60 2c4m h GLN 261 CO -0.08 0.92 -0.71 -0.92 -0.67 0.00 0.00 178.83 177.37 2c4m h TYR 262 N 1.25 1.04 0.08 2.96 3.20 -1.07 -2.89 116.97 121.54 2c4m h TYR 262 Ca 0.31 -0.43 0.02 0.00 3.14 0.00 0.00 58.73 61.77 2c4m h TYR 262 Cb 0.04 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2c4m h TYR 262 CO 0.01 1.26 -0.31 0.35 -1.64 0.00 0.00 178.16 177.83 2c4m h PHE 263 N 0.56 -0.85 0.00 -3.82 3.57 -0.80 -0.37 116.94 115.24 2c4m h PHE 263 Ca -0.03 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.36 2c4m h PHE 263 Cb 1.33 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 40.41 2c4m h PHE 263 CO 0.08 -0.41 -0.61 0.27 -2.23 0.00 0.00 178.31 175.41 2c4m h PHE 264 N -0.51 0.00 -0.11 0.41 -0.00 -1.58 -2.34 116.94 112.82 2c4m h PHE 264 Ca 0.04 0.00 -0.22 0.00 -0.00 0.00 0.00 57.97 57.80 2c4m h PHE 264 Cb 0.56 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 36.51 2c4m h PHE 264 CO -0.30 0.61 -0.80 1.79 -0.00 0.00 0.00 178.31 179.61 2c4m h THR 265 N 0.00 1.32 -0.24 0.88 1.35 -1.39 -1.97 112.91 112.85 2c4m h THR 265 Ca -0.01 -2.08 -0.04 0.00 -0.55 0.00 0.00 66.41 63.73 2c4m h THR 265 Cb 1.27 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 69.77 2c4m h THR 265 CO 0.08 0.65 -0.00 -1.28 -0.25 0.00 0.00 175.52 174.71 2c4m h SER 266 N 0.43 0.42 -0.22 5.36 0.87 -1.07 -1.11 113.55 118.22 2c4m h SER 266 Ca -0.06 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.19 2c4m h SER 266 Cb 1.42 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.25 2c4m h SER 266 CO 0.15 0.63 0.11 0.00 -0.53 0.00 0.00 176.83 177.20 2c4m h ALA 267 N 0.80 0.29 0.03 6.23 0.00 -1.47 -1.13 119.26 124.01 2c4m h ALA 267 Ca 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2c4m h ALA 267 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2c4m h ALA 267 CO 0.01 -0.16 -0.07 0.77 0.00 0.00 0.00 179.25 179.80 2c4m h SER 268 N 0.24 -0.18 -0.92 0.00 0.02 -1.31 -1.13 113.55 110.27 2c4m h SER 268 Ca 0.08 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2c4m h SER 268 Cb 0.10 0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.66 2c4m h SER 268 CO -0.01 -0.10 0.61 -0.07 -1.14 0.00 0.00 176.83 176.12 2c4m h LEU 269 N -0.13 1.04 -0.54 5.07 3.38 -1.10 -0.20 115.31 122.83 2c4m h LEU 269 Ca 0.02 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2c4m h LEU 269 Cb 0.15 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2c4m h LEU 269 CO -0.05 0.75 0.17 1.56 0.09 0.00 0.00 178.44 180.96 2c4m h GLN 270 N 1.23 0.84 -0.61 1.13 4.20 -0.86 -1.27 115.11 119.77 2c4m h GLN 270 Ca 0.34 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.78 2c4m h GLN 270 Cb -0.12 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.52 2c4m h GLN 270 CO -0.08 0.77 0.04 0.00 -0.67 0.00 0.00 178.83 178.89 2c4m h ALA 271 N 1.03 0.82 -0.31 3.87 0.00 -0.61 -1.22 119.26 122.85 2c4m h ALA 271 Ca 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2c4m h ALA 271 Cb 0.28 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2c4m h ALA 271 CO -0.01 0.63 0.13 0.52 0.00 0.00 0.00 179.25 180.53 2c4m h MET 272 N 0.96 0.45 -0.58 0.00 2.86 -0.86 -0.79 114.93 116.97 2c4m h MET 272 Ca 0.18 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 2c4m h MET 272 Cb 0.52 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 2c4m h MET 272 CO 0.02 0.46 0.23 0.82 1.06 0.00 0.00 176.91 179.50 2c4m h ILE 273 N 0.35 1.23 -0.11 -1.22 2.04 -1.15 1.00 117.51 119.64 2c4m h ILE 273 Ca 0.10 -0.70 0.03 0.00 1.00 0.00 0.00 64.86 65.29 2c4m h ILE 273 Cb 0.17 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 2c4m h ILE 273 CO -0.01 0.27 -0.08 1.56 0.00 0.00 0.00 178.15 179.89 2c4m h GLN 274 N 0.80 -0.08 -0.16 2.37 4.20 -0.99 -1.47 115.11 119.77 2c4m h GLN 274 Ca 0.19 0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.82 2c4m h GLN 274 Cb 0.20 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2c4m h GLN 274 CO -0.02 -0.06 -0.29 0.22 -0.67 0.00 0.00 178.83 178.02 2c4m h ASP 275 N -0.09 0.31 -0.65 1.46 3.58 -0.89 -2.81 116.42 117.32 2c4m h ASP 275 Ca 0.07 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 2c4m h ASP 275 Cb 0.19 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 2c4m h ASP 275 CO -0.16 0.59 0.34 -0.74 -2.88 0.00 0.00 179.24 176.39 2c4m h HIS 276 N 0.27 0.91 0.00 0.28 2.76 -0.21 -1.97 115.15 117.19 2c4m h HIS 276 Ca 0.04 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2c4m h HIS 276 Cb 0.65 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.32 2c4m h HIS 276 CO 0.01 0.66 0.00 1.28 -1.30 0.00 0.00 177.93 178.58 2c4m n LEU 277 N -4.52 0.21 -0.92 0.26 4.77 -0.61 -0.91 117.00 115.28 2c4m n LEU 277 Ca 0.05 0.55 0.12 0.00 -0.03 0.00 0.00 56.01 56.70 2c4m n LEU 277 Cb 0.10 -0.52 0.18 0.00 -2.33 0.00 0.00 43.42 40.85 2c4m n LEU 277 CO 0.38 -0.35 0.68 0.00 -1.33 0.00 0.00 177.39 176.76 2c4m n ALA 278 N -1.58 2.47 0.00 -1.18 0.00 -0.75 -4.19 120.51 115.28 2c4m n ALA 278 Ca 0.03 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2c4m n ALA 278 Cb 0.18 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2c4m n ALA 278 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2c4m n HIS 279 N 1.19 0.00 -4.19 0.00 8.25 -0.87 -5.09 115.22 114.52 2c4m n HIS 279 Ca 0.16 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.50 2c4m n HIS 279 Cb 0.56 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.57 2c4m n HIS 279 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2c4m s HIS 280 N -1.54 0.98 0.05 4.41 3.76 -0.09 -5.09 115.29 117.78 2c4m s HIS 280 Ca 0.00 -1.08 -0.35 0.00 -0.15 0.00 0.00 55.06 53.48 2c4m s HIS 280 Cb 0.00 -0.57 -0.19 0.00 1.11 0.00 0.00 32.58 32.93 2c4m s HIS 280 CO 0.00 -0.32 1.47 -0.22 -0.85 0.00 0.00 174.74 174.83 2c4m h LYS 281 N 2.84 -1.21 0.00 1.40 3.64 -1.86 -3.40 116.57 117.97 2c4m h LYS 281 Ca -0.36 0.08 -0.24 0.00 -1.27 0.00 0.00 60.65 58.87 2c4m h LYS 281 Cb 1.19 0.28 -0.06 0.00 -0.41 0.00 0.00 32.23 33.22 2c4m h LYS 281 CO 0.62 -0.81 -0.23 -0.40 -2.27 0.00 0.00 179.45 176.37 2c4m n ASP 282 N -5.51 -0.21 -0.42 4.20 5.68 -1.26 -4.97 116.55 114.07 2c4m n ASP 282 Ca -0.16 -2.06 0.12 0.00 -0.50 0.00 0.00 54.79 52.19 2c4m n ASP 282 Cb 0.50 0.78 0.49 0.00 -1.14 0.00 0.00 41.12 41.75 2c4m n ASP 282 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2c4m n LEU 283 N 0.00 1.28 -0.36 -2.12 4.77 -1.26 -4.23 117.00 115.09 2c4m n LEU 283 Ca 0.03 -0.50 0.08 0.00 -0.03 0.00 0.00 56.01 55.60 2c4m n LEU 283 Cb 0.29 -0.05 0.25 0.00 -2.33 0.00 0.00 43.42 41.59 2c4m n LEU 283 CO 0.15 0.25 1.22 0.77 -1.33 0.00 0.00 177.39 178.45 2c4m h SER 284 N 1.82 0.88 -0.96 -1.43 4.64 -2.01 -1.37 113.55 115.13 2c4m h SER 284 Ca 0.00 0.06 -0.58 0.00 -0.47 0.00 0.00 61.79 60.80 2c4m h SER 284 Cb 0.39 -0.11 -0.29 0.00 -0.31 0.00 0.00 62.40 62.08 2c4m h SER 284 CO 0.00 0.43 0.68 -0.46 -0.87 0.00 0.00 176.83 176.62 2c4m n ASN 285 N -4.66 5.50 0.06 4.97 6.94 -1.26 -4.68 115.26 122.12 2c4m n ASN 285 Ca 0.20 -3.70 -0.12 0.00 -0.02 0.00 0.00 54.58 50.93 2c4m n ASN 285 Cb 0.40 -0.88 -0.07 0.00 -2.36 0.00 0.00 39.78 36.87 2c4m n ASN 285 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 2c4m h PHE 286 N 1.48 -0.05 0.00 -2.53 3.57 -1.52 -2.58 116.94 115.31 2c4m h PHE 286 Ca 0.60 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 62.08 2c4m h PHE 286 Cb 1.86 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 40.61 2c4m h PHE 286 CO 1.48 -0.03 -0.10 0.00 -2.23 0.00 0.00 178.31 177.43 2c4m h ALA 287 N 0.92 1.32 -0.18 2.41 0.00 -1.83 -1.54 119.26 120.35 2c4m h ALA 287 Ca -0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2c4m h ALA 287 Cb 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2c4m h ALA 287 CO 0.00 0.13 -0.18 1.49 0.00 0.00 0.00 179.25 180.69 2c4m h GLU 288 N 0.00 0.31 -0.09 0.00 4.81 -1.81 -3.22 114.58 114.58 2c4m h GLU 288 Ca -0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2c4m h GLU 288 Cb 0.28 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2c4m h GLU 288 CO 0.01 0.49 0.00 1.19 -0.73 0.00 0.00 179.01 179.97 2c4m n PHE 289 N -4.21 0.12 -3.78 0.92 3.72 -0.95 -4.88 117.46 108.41 2c4m n PHE 289 Ca -0.00 -0.24 -0.13 0.00 -0.05 0.00 0.00 57.45 57.03 2c4m n PHE 289 Cb 0.32 -0.02 -0.13 0.00 -0.94 0.00 0.00 39.48 38.71 2c4m n PHE 289 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2c4m s HIS 290 N -0.74 -0.18 0.16 1.38 3.76 -0.62 -1.10 115.29 117.95 2c4m s HIS 290 Ca 0.10 0.46 0.09 0.00 -0.15 0.00 0.00 55.06 55.57 2c4m s HIS 290 Cb 0.06 -0.01 -0.04 0.00 1.11 0.00 0.00 32.58 33.70 2c4m s HIS 290 CO 0.08 -0.13 -0.21 -1.54 -0.85 0.00 0.00 174.74 172.09 2c4m s SER 291 N 0.66 2.92 -0.10 1.40 1.04 0.21 -4.52 113.70 115.31 2c4m s SER 291 Ca -0.05 -0.83 0.01 0.00 0.48 0.00 0.00 55.95 55.56 2c4m s SER 291 Cb -0.06 -0.19 0.02 0.00 0.10 0.00 0.00 66.02 65.89 2c4m s SER 291 CO -0.03 0.04 -0.11 -0.69 0.98 0.00 0.00 173.24 173.43 2c4m s VAL 292 N -1.74 1.18 -0.12 5.02 1.01 0.19 0.14 120.40 126.09 2c4m s VAL 292 Ca 0.16 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.55 2c4m s VAL 292 Cb -0.07 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 2c4m s VAL 292 CO 0.07 0.38 0.35 -1.58 0.00 0.00 0.00 175.10 174.32 2c4m s GLN 293 N 1.18 4.17 -0.52 2.72 2.00 -1.00 -0.76 119.66 127.45 2c4m s GLN 293 Ca -0.04 0.23 -0.16 0.00 -2.00 0.00 0.00 55.36 53.39 2c4m s GLN 293 Cb -0.14 -3.38 0.11 0.00 0.80 0.00 0.00 33.01 30.40 2c4m s GLN 293 CO -0.03 0.33 0.48 -0.51 -0.50 0.00 0.00 175.29 175.06 2c4m s LEU 294 N 0.15 5.99 -0.84 3.68 1.02 1.00 -1.85 118.68 127.82 2c4m s LEU 294 Ca 0.20 -1.64 -0.25 0.00 0.02 0.00 0.00 54.13 52.46 2c4m s LEU 294 Cb -0.14 -2.21 0.04 0.00 0.02 0.00 0.00 46.19 43.90 2c4m s LEU 294 CO 0.07 -0.81 1.34 0.21 0.02 0.00 0.00 176.35 177.18 2c4m s ASN 295 N 3.32 6.29 0.20 2.29 2.47 -1.06 -1.61 114.94 126.83 2c4m s ASN 295 Ca 0.04 -0.82 0.00 0.00 0.42 0.00 0.00 52.86 52.50 2c4m s ASN 295 Cb -0.28 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 36.96 2c4m s ASN 295 CO 0.04 -1.72 0.00 -0.67 -3.72 0.00 0.00 177.10 171.04 2c4m n ASP 296 N 9.18 -1.31 -0.45 -4.21 -0.08 -1.07 -4.37 116.55 114.26 2c4m n ASP 296 Ca 0.14 0.02 0.13 0.00 -1.51 0.00 0.00 54.79 53.58 2c4m n ASP 296 Cb 0.50 -0.07 0.41 0.00 2.34 0.00 0.00 41.12 44.30 2c4m n ASP 296 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2c4m n THR 297 N -0.51 0.00 -0.29 5.18 -2.24 -1.26 -4.36 114.28 110.80 2c4m n THR 297 Ca 0.00 -0.23 0.02 0.00 -2.27 0.00 0.00 64.05 61.57 2c4m n THR 297 Cb 0.01 0.59 0.15 0.00 -2.10 0.00 0.00 70.33 68.98 2c4m n THR 297 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2c4m h HIS 298 N 2.19 0.85 -0.41 4.78 3.86 -1.95 -2.10 115.15 122.36 2c4m h HIS 298 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2c4m h HIS 298 Cb 0.56 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.76 2c4m h HIS 298 CO 0.00 0.38 0.00 -0.35 0.86 0.00 0.00 177.93 178.82 2c4m n PRO 299 N -4.72 3.01 0.30 2.45 -0.05 -1.26 -4.42 135.00 130.31 2c4m n PRO 299 Ca 0.12 -1.92 0.18 0.00 -0.05 0.00 0.00 63.50 61.83 2c4m n PRO 299 Cb 0.24 -1.77 0.96 0.00 -0.05 0.00 0.00 33.50 32.88 2c4m n PRO 299 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 175.50 175.73 2c4m h VAL 300 N 2.66 0.25 0.00 0.52 2.07 -1.65 -1.28 116.25 118.82 2c4m h VAL 300 Ca 0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2c4m h VAL 300 Cb 1.16 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2c4m h VAL 300 CO 0.20 0.03 0.00 -0.07 0.02 0.00 0.00 177.57 177.75 2c4m h LEU 301 N 0.00 0.00 -1.71 2.57 3.38 -1.83 -1.24 115.31 116.49 2c4m h LEU 301 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2c4m h LEU 301 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2c4m h LEU 301 CO 0.00 0.00 0.07 0.00 0.09 0.00 0.00 178.44 178.60 2c4m h ALA 302 N 2.02 1.77 0.69 1.53 0.00 -1.56 -1.83 119.26 121.88 2c4m h ALA 302 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2c4m h ALA 302 Cb 0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.75 2c4m h ALA 302 CO 0.00 0.19 -0.33 0.82 0.00 0.00 0.00 179.25 179.93 2c4m h ILE 303 N 0.26 0.19 -0.21 0.00 2.04 -1.43 0.17 117.51 118.53 2c4m h ILE 303 Ca 0.07 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2c4m h ILE 303 Cb 0.07 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2c4m h ILE 303 CO -0.01 0.02 -0.08 1.55 0.00 0.00 0.00 178.15 179.64 2c4m h PRO 304 N -1.11 0.33 -0.59 2.37 0.13 -1.71 -2.79 132.00 128.63 2c4m h PRO 304 Ca -0.09 -0.07 -0.10 0.00 -0.87 0.00 0.00 66.00 64.86 2c4m h PRO 304 Cb 0.74 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 2c4m h PRO 304 CO 0.16 0.42 -0.03 1.49 -0.23 0.00 0.00 178.00 179.81 2c4m h GLU 305 N 0.32 1.06 -0.67 0.86 4.57 -1.23 -1.23 114.58 118.26 2c4m h GLU 305 Ca 0.07 -0.35 -0.06 0.00 -1.18 0.00 0.00 59.36 57.84 2c4m h GLU 305 Cb 0.34 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.81 2c4m h GLU 305 CO 0.02 1.05 0.18 1.25 -1.18 0.00 0.00 179.01 180.33 2c4m h LEU 306 N 0.96 0.98 -0.70 1.64 5.85 -0.78 -0.67 115.31 122.59 2c4m h LEU 306 Ca 0.16 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.70 2c4m h LEU 306 Cb 0.59 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2c4m h LEU 306 CO 0.04 0.93 0.46 0.24 -0.34 0.00 0.00 178.44 179.77 2c4m h MET 307 N 1.00 0.92 -0.21 1.25 2.86 -1.20 -0.43 114.93 119.11 2c4m h MET 307 Ca 0.22 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.78 2c4m h MET 307 Cb 0.32 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2c4m h MET 307 CO -0.00 0.61 0.07 -0.09 1.06 0.00 0.00 176.91 178.55 2c4m h ARG 308 N 0.94 0.33 -0.31 1.72 2.43 -0.60 -1.93 114.38 116.97 2c4m h ARG 308 Ca 0.25 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.37 2c4m h ARG 308 Cb -0.11 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 2c4m h ARG 308 CO -0.06 0.42 0.16 -0.07 -1.51 0.00 0.00 179.97 178.92 2c4m h LEU 309 N 0.17 0.25 -0.57 3.80 3.38 -0.80 0.18 115.31 121.73 2c4m h LEU 309 Ca 0.07 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2c4m h LEU 309 Cb 0.23 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2c4m h LEU 309 CO -0.00 0.19 0.21 -0.07 0.09 0.00 0.00 178.44 178.86 2c4m h LEU 310 N 0.34 0.80 0.03 1.67 3.38 -1.02 -1.75 115.31 118.76 2c4m h LEU 310 Ca 0.13 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2c4m h LEU 310 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2c4m h LEU 310 CO -0.08 0.77 -0.64 0.24 0.09 0.00 0.00 178.44 178.82 2c4m h MET 311 N 0.79 0.07 0.00 1.13 2.86 -1.24 -1.81 114.93 116.72 2c4m h MET 311 Ca 0.19 -0.12 -0.16 0.00 -2.06 0.00 0.00 59.70 57.56 2c4m h MET 311 Cb 0.23 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 2c4m h MET 311 CO -0.01 1.06 -0.75 -0.44 1.06 0.00 0.00 176.91 177.82 2c4m h ASP 312 N -0.83 0.00 -0.00 1.22 5.19 -0.76 -3.00 116.42 118.24 2c4m h ASP 312 Ca -0.16 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.25 2c4m h ASP 312 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 2c4m h ASP 312 CO -0.03 0.75 -0.34 -0.62 -3.12 0.00 0.00 179.24 175.88 2c4m n GLU 313 N -3.56 3.08 -0.82 3.56 -0.58 -0.67 -4.69 120.64 116.96 2c4m n GLU 313 Ca -0.00 -0.27 0.03 0.00 -0.42 0.00 0.00 57.16 56.50 2c4m n GLU 313 Cb 0.75 -1.01 0.04 0.00 -0.57 0.00 0.00 31.44 30.66 2c4m n GLU 313 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2c4m n HIS 314 N -0.79 0.00 -2.68 -0.32 8.25 -1.05 -5.00 115.22 113.64 2c4m n HIS 314 Ca 0.03 -0.45 -0.13 0.00 -0.26 0.00 0.00 57.72 56.91 2c4m n HIS 314 Cb 0.17 -0.12 -0.00 0.00 1.12 0.00 0.00 29.99 31.16 2c4m n HIS 314 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2c4m n ASP 315 N -0.10 -3.34 -4.84 0.41 8.00 -1.13 -4.84 116.55 110.70 2c4m n ASP 315 Ca 0.06 0.10 -0.35 0.00 0.71 0.00 0.00 54.79 55.31 2c4m n ASP 315 Cb 0.85 -2.85 -0.06 0.00 -0.02 0.00 0.00 41.12 39.05 2c4m n ASP 315 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2c4m s MET 316 N -5.27 3.98 0.73 -1.24 -1.94 -0.71 -4.98 119.30 109.88 2c4m s MET 316 Ca 0.10 0.49 -0.12 0.00 -1.71 0.00 0.00 55.69 54.46 2c4m s MET 316 Cb -0.05 -2.91 0.03 0.00 2.01 0.00 0.00 34.83 33.92 2c4m s MET 316 CO 0.12 0.46 1.12 0.20 -0.01 0.00 0.00 175.02 176.91 2c4m s GLY 317 N -1.76 1.62 0.23 -0.03 0.00 -1.26 -4.23 107.32 101.89 2c4m s GLY 317 Ca 0.39 -0.41 -0.07 0.00 0.00 0.00 0.00 44.72 44.62 2c4m s GLY 317 CO 0.19 -0.01 1.86 -0.25 0.00 0.00 0.00 173.10 174.89 2c4m h TRP 318 N -0.77 1.22 -0.14 1.90 2.91 -1.98 -2.04 115.95 117.06 2c4m h TRP 318 Ca -0.45 -0.02 -0.00 0.00 1.13 0.00 0.00 58.89 59.54 2c4m h TRP 318 Cb 1.27 -0.39 -0.01 0.00 -0.51 0.00 0.00 29.16 29.52 2c4m h TRP 318 CO 0.45 0.83 0.08 0.93 -1.03 0.00 0.00 178.44 179.71 2c4m h GLU 319 N 1.25 0.19 -0.24 2.65 3.07 -1.99 0.53 114.58 120.06 2c4m h GLU 319 Ca 0.32 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 59.04 2c4m h GLU 319 Cb 0.00 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 2c4m h GLU 319 CO -0.05 0.20 -0.34 1.49 -1.40 0.00 0.00 179.01 178.91 2c4m h GLU 320 N 0.13 0.50 -0.21 2.33 4.81 -1.94 -0.87 114.58 119.34 2c4m h GLU 320 Ca 0.05 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.00 2c4m h GLU 320 Cb 0.06 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2c4m h GLU 320 CO -0.01 0.78 -0.07 0.77 -0.73 0.00 0.00 179.01 179.75 2c4m h SER 321 N 0.43 0.42 0.32 1.04 0.02 -1.16 -2.19 113.55 112.43 2c4m h SER 321 Ca 0.05 -0.38 -0.10 0.00 -0.84 0.00 0.00 61.79 60.52 2c4m h SER 321 Cb 0.79 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 2c4m h SER 321 CO 0.06 0.71 -0.40 -0.25 -1.14 0.00 0.00 176.83 175.81 2c4m h TRP 322 N 0.13 0.14 -0.41 3.45 2.91 -0.84 -1.05 115.95 120.28 2c4m h TRP 322 Ca 0.05 -0.04 -0.05 0.00 1.13 0.00 0.00 58.89 59.99 2c4m h TRP 322 Cb 0.53 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.13 2c4m h TRP 322 CO 0.06 0.51 0.04 0.00 -1.03 0.00 0.00 178.44 178.02 2c4m h ALA 323 N 1.49 1.32 -0.02 2.65 0.00 -1.01 0.11 119.26 123.80 2c4m h ALA 323 Ca 0.01 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 2c4m h ALA 323 Cb 0.76 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.39 2c4m h ALA 323 CO 0.06 0.47 -0.33 0.82 0.00 0.00 0.00 179.25 180.26 2c4m h ILE 324 N 0.60 1.49 -0.64 0.00 2.04 -0.76 -3.19 117.51 117.06 2c4m h ILE 324 Ca 0.13 -1.92 0.01 0.00 1.00 0.00 0.00 64.86 64.09 2c4m h ILE 324 Cb 0.32 2.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 2c4m h ILE 324 CO 0.01 0.54 0.42 0.58 0.00 0.00 0.00 178.15 179.69 2c4m h VAL 325 N -0.34 1.15 0.00 1.67 2.07 -0.96 -0.63 116.25 119.20 2c4m h VAL 325 Ca -0.04 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2c4m h VAL 325 Cb 1.06 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2c4m h VAL 325 CO 0.07 0.16 0.00 -1.54 0.02 0.00 0.00 177.57 176.27 2c4m n SER 326 N -4.65 0.00 -0.04 0.57 3.41 0.37 -2.11 113.62 111.17 2c4m n SER 326 Ca 0.05 0.35 0.04 0.00 -0.26 0.00 0.00 58.87 59.05 2c4m n SER 326 Cb 0.03 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 63.51 2c4m n SER 326 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2c4m n LYS 327 N -1.42 3.74 -0.11 4.33 5.02 -0.77 -3.86 118.16 125.09 2c4m n LYS 327 Ca 0.05 -0.11 -0.24 0.00 -2.02 0.00 0.00 58.31 55.98 2c4m n LYS 327 Cb 0.15 -0.94 -0.11 0.00 -0.02 0.00 0.00 35.03 34.11 2c4m n LYS 327 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2c4m n THR 328 N -1.02 1.56 -3.09 -0.18 -1.04 -0.32 -4.93 114.28 105.27 2c4m n THR 328 Ca 0.02 -0.34 -0.39 0.00 -2.04 0.00 0.00 64.05 61.30 2c4m n THR 328 Cb 0.15 -1.84 -0.06 0.00 -1.82 0.00 0.00 70.33 66.76 2c4m n THR 328 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2c4m s PHE 329 N -2.47 3.85 0.03 -1.42 0.08 -1.03 -0.63 117.98 116.38 2c4m s PHE 329 Ca -0.33 1.50 0.06 0.00 0.12 0.00 0.00 56.93 58.27 2c4m s PHE 329 Cb 0.10 -2.67 -0.02 0.00 -0.57 0.00 0.00 43.02 39.86 2c4m s PHE 329 CO 0.58 0.53 -0.16 0.00 -0.10 0.00 0.00 175.22 176.06 2c4m s ALA 330 N -1.17 1.37 -0.02 5.36 0.00 0.06 -1.41 121.76 125.96 2c4m s ALA 330 Ca 0.34 -0.86 0.07 0.00 0.00 0.00 0.00 51.96 51.51 2c4m s ALA 330 Cb -0.21 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 2c4m s ALA 330 CO 0.23 0.29 -0.23 -0.47 0.00 0.00 0.00 175.76 175.59 2c4m s TYR 331 N -0.73 2.04 -0.17 0.00 5.04 0.89 -0.00 117.35 124.42 2c4m s TYR 331 Ca 0.04 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.29 2c4m s TYR 331 Cb -0.08 -1.31 0.00 0.00 0.35 0.00 0.00 41.96 40.92 2c4m s TYR 331 CO 0.01 -0.03 -0.15 0.99 -1.34 0.00 0.00 175.55 175.02 2c4m s THR 332 N -0.53 2.62 -0.02 4.34 2.01 -0.63 -1.61 115.64 121.81 2c4m s THR 332 Ca 0.09 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 2c4m s THR 332 Cb -0.09 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 2c4m s THR 332 CO -0.01 0.51 0.15 0.21 -0.69 0.00 0.00 174.62 174.79 2c4m s ASN 333 N 0.96 6.14 -0.00 3.53 3.84 0.06 -2.58 114.94 126.89 2c4m s ASN 333 Ca -0.02 0.29 0.03 0.00 0.21 0.00 0.00 52.86 53.36 2c4m s ASN 333 Cb -0.15 -1.88 -0.04 0.00 -0.55 0.00 0.00 41.25 38.63 2c4m s ASN 333 CO -0.03 0.28 0.09 1.41 -2.79 0.00 0.00 177.10 176.06 2c4m n HIS 334 N 1.09 0.00 -4.14 0.43 8.25 -1.26 -3.93 115.22 115.67 2c4m n HIS 334 Ca -0.12 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.22 2c4m n HIS 334 Cb 0.53 -0.04 -0.11 0.00 1.12 0.00 0.00 29.99 31.49 2c4m n HIS 334 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2c4m s THR 335 N -1.80 0.70 0.04 1.59 -1.32 -1.26 -4.76 115.64 108.84 2c4m s THR 335 Ca -0.00 -1.60 -0.16 0.00 -1.21 0.00 0.00 61.69 58.72 2c4m s THR 335 Cb 0.02 -1.27 -0.26 0.00 -1.51 0.00 0.00 72.50 69.48 2c4m s THR 335 CO 0.12 -0.64 1.11 0.58 -2.21 0.00 0.00 174.62 173.58 2c4m h VAL 336 N 3.59 1.32 -3.67 5.08 2.07 -1.94 -3.46 116.25 119.24 2c4m h VAL 336 Ca -0.36 -2.32 -0.46 0.00 0.82 0.00 0.00 66.70 64.38 2c4m h VAL 336 Cb 1.18 2.61 0.13 0.00 -1.52 0.00 0.00 31.29 33.69 2c4m h VAL 336 CO 0.54 0.70 0.33 -0.76 0.02 0.00 0.00 177.57 178.40 2c4m s LEU 337 N -8.04 2.76 -0.30 2.57 1.43 -1.26 -4.47 118.68 111.37 2c4m s LEU 337 Ca -0.11 0.23 0.09 0.00 -1.03 0.00 0.00 54.13 53.31 2c4m s LEU 337 Cb 0.05 -2.49 0.53 0.00 0.03 0.00 0.00 46.19 44.31 2c4m s LEU 337 CO 0.90 -2.27 1.51 0.35 0.23 0.00 0.00 176.35 177.07 2c4m n THR 338 N -3.38 2.60 -0.02 5.49 -2.24 -1.26 -4.66 114.28 110.80 2c4m n THR 338 Ca 0.13 -2.60 0.01 0.00 -2.27 0.00 0.00 64.05 59.32 2c4m n THR 338 Cb 0.60 -0.33 -0.14 0.00 -2.10 0.00 0.00 70.33 68.36 2c4m n THR 338 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2c4m n GLU 339 N -1.07 0.66 0.00 -0.78 0.28 -1.26 -3.49 120.64 114.97 2c4m n GLU 339 Ca 0.35 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.34 2c4m n GLU 339 Cb 1.09 -1.61 0.00 0.00 1.43 0.00 0.00 31.44 32.35 2c4m n GLU 339 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2c4m n ALA 340 N -2.46 2.19 -3.67 -1.84 0.00 -1.26 -4.64 120.51 108.84 2c4m n ALA 340 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.91 2c4m n ALA 340 Cb 0.84 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.19 2c4m n ALA 340 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2c4m s LEU 341 N -0.57 5.46 0.26 0.00 1.43 -1.23 -4.77 118.68 119.27 2c4m s LEU 341 Ca 0.00 -2.20 -0.31 0.00 -1.03 0.00 0.00 54.13 50.59 2c4m s LEU 341 Cb 0.00 -1.91 -0.13 0.00 0.03 0.00 0.00 46.19 44.18 2c4m s LEU 341 CO 0.00 -0.56 1.50 -0.62 0.23 0.00 0.00 176.35 176.90 2c4m n GLU 342 N 4.42 2.34 -4.47 1.70 1.02 -1.26 -4.86 120.64 119.53 2c4m n GLU 342 Ca -0.01 0.83 -0.23 0.00 -0.02 0.00 0.00 57.16 57.74 2c4m n GLU 342 Cb 0.41 -2.55 -0.16 0.00 -0.02 0.00 0.00 31.44 29.11 2c4m n GLU 342 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2c4m s GLN 343 N -0.40 1.31 0.03 3.49 -0.21 -1.26 -1.11 119.66 121.51 2c4m s GLN 343 Ca 0.67 -0.34 0.05 0.00 0.02 0.00 0.00 55.36 55.75 2c4m s GLN 343 Cb -0.58 -1.15 -0.02 0.00 1.00 0.00 0.00 33.01 32.26 2c4m s GLN 343 CO 0.49 0.06 -0.15 -1.58 -2.12 0.00 0.00 175.29 171.98 2c4m s TRP 344 N 0.49 1.30 0.09 0.91 0.52 -0.33 -4.92 118.94 117.01 2c4m s TRP 344 Ca -0.09 -0.33 -0.31 0.00 0.02 0.00 0.00 56.10 55.39 2c4m s TRP 344 Cb -0.13 -0.79 -0.09 0.00 -1.15 0.00 0.00 33.47 31.31 2c4m s TRP 344 CO 0.02 0.03 1.66 0.34 0.02 0.00 0.00 176.95 179.01 2c4m s ASP 345 N -0.94 6.58 0.61 2.95 -1.08 -1.26 0.52 116.67 124.05 2c4m s ASP 345 Ca 0.03 2.54 0.31 0.00 -0.52 0.00 0.00 52.55 54.92 2c4m s ASP 345 Cb -0.07 -2.57 1.75 0.00 -1.46 0.00 0.00 42.92 40.57 2c4m s ASP 345 CO 0.01 -0.89 2.11 1.05 0.52 0.00 0.00 175.17 177.97 2c4m h GLU 346 N 8.05 0.00 0.00 4.34 4.11 -1.41 -1.33 114.58 128.34 2c4m h GLU 346 Ca -0.43 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 58.96 2c4m h GLU 346 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2c4m h GLU 346 CO 0.93 0.00 -0.20 0.37 0.07 0.00 0.00 179.01 180.18 2c4m h GLN 347 N 0.00 0.00 -0.78 1.06 4.15 -1.89 -1.08 115.11 116.58 2c4m h GLN 347 Ca 0.07 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 2c4m h GLN 347 Cb 0.46 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.12 2c4m h GLN 347 CO -0.00 0.20 0.46 0.82 -1.93 0.00 0.00 178.83 178.38 2c4m h ILE 348 N 0.00 1.22 -0.22 2.39 2.04 -1.61 -1.35 117.51 119.98 2c4m h ILE 348 Ca -0.00 -0.51 -0.15 0.00 1.00 0.00 0.00 64.86 65.20 2c4m h ILE 348 Cb 0.35 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2c4m h ILE 348 CO 0.03 0.24 -0.47 -0.26 0.00 0.00 0.00 178.15 177.68 2c4m h PHE 349 N 1.07 0.71 -0.09 1.37 0.04 -1.43 -1.59 116.94 117.01 2c4m h PHE 349 Ca 0.28 -0.23 -0.07 0.00 2.80 0.00 0.00 57.97 60.75 2c4m h PHE 349 Cb -0.02 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 2c4m h PHE 349 CO -0.00 0.94 -0.25 1.96 -0.60 0.00 0.00 178.31 180.36 2c4m h GLN 350 N 0.46 0.16 0.12 1.51 4.20 -0.74 -1.36 115.11 119.47 2c4m h GLN 350 Ca 0.03 -0.05 -0.33 0.00 0.06 0.00 0.00 58.65 58.36 2c4m h GLN 350 Cb 1.00 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 2c4m h GLN 350 CO 0.09 0.41 -1.69 1.96 -0.67 0.00 0.00 178.83 178.92 2c4m h GLN 351 N 0.15 0.25 0.14 1.46 4.20 -1.15 -3.33 115.11 116.83 2c4m h GLN 351 Ca 0.02 -0.43 -0.30 0.00 0.06 0.00 0.00 58.65 58.00 2c4m h GLN 351 Cb 0.53 0.16 0.03 0.00 0.30 0.00 0.00 27.48 28.50 2c4m h GLN 351 CO 0.04 1.10 -1.27 -0.07 -0.67 0.00 0.00 178.83 177.96 2c4m h LEU 352 N 0.07 0.81 -5.98 1.46 3.38 -1.25 -3.40 115.31 110.40 2c4m h LEU 352 Ca -0.31 -0.77 -0.06 0.00 0.09 0.00 0.00 57.88 56.83 2c4m h LEU 352 Cb 2.04 -0.26 -0.19 0.00 0.09 0.00 0.00 40.66 42.34 2c4m h LEU 352 CO 0.14 1.58 -0.44 0.72 0.09 0.00 0.00 178.44 180.53 2c4m s PHE 353 N -2.90 -1.71 0.21 1.13 -0.12 -0.52 -0.04 117.98 114.03 2c4m s PHE 353 Ca -0.09 0.25 -0.10 0.00 -0.05 0.00 0.00 56.93 56.95 2c4m s PHE 353 Cb 0.06 0.31 0.26 0.00 -0.63 0.00 0.00 43.02 43.02 2c4m s PHE 353 CO 0.93 -1.16 1.77 2.35 -0.05 0.00 0.00 175.22 179.05 2c4m h TRP 354 N 6.95 0.49 -0.69 3.49 2.91 -1.67 -1.51 115.95 125.94 2c4m h TRP 354 Ca 0.05 0.03 0.04 0.00 1.13 0.00 0.00 58.89 60.13 2c4m h TRP 354 Cb 1.18 -0.13 -0.05 0.00 -0.51 0.00 0.00 29.16 29.65 2c4m h TRP 354 CO 0.14 0.18 0.42 -0.09 -1.03 0.00 0.00 178.44 178.06 2c4m h ARG 355 N 0.50 0.78 -0.04 2.65 9.65 -1.93 -0.04 114.38 125.95 2c4m h ARG 355 Ca 0.30 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 59.06 2c4m h ARG 355 Cb 0.30 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 2c4m h ARG 355 CO -0.25 0.51 -0.29 0.28 2.80 0.00 0.00 179.97 183.03 2c4m h VAL 356 N 0.80 1.22 -0.37 0.20 2.07 -1.78 -2.69 116.25 115.70 2c4m h VAL 356 Ca 0.29 -1.06 -0.10 0.00 0.82 0.00 0.00 66.70 66.65 2c4m h VAL 356 Cb 0.07 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2c4m h VAL 356 CO -0.13 0.31 -0.14 -0.25 0.02 0.00 0.00 177.57 177.38 2c4m h TRP 357 N 0.07 0.86 -0.50 1.57 2.91 -0.06 -1.69 115.95 119.11 2c4m h TRP 357 Ca 0.01 -0.20 0.02 0.00 1.13 0.00 0.00 58.89 59.85 2c4m h TRP 357 Cb 0.55 -0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 2c4m h TRP 357 CO 0.00 0.92 0.30 0.93 -1.03 0.00 0.00 178.44 179.56 2c4m h GLU 358 N 0.55 0.58 -0.45 2.65 5.08 -0.84 0.55 114.58 122.71 2c4m h GLU 358 Ca 0.09 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2c4m h GLU 358 Cb 0.67 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 2c4m h GLU 358 CO 0.05 0.39 0.12 0.82 -1.00 0.00 0.00 179.01 179.38 2c4m h ILE 359 N 0.60 1.19 -0.41 3.13 2.04 -1.37 0.32 117.51 123.01 2c4m h ILE 359 Ca 0.20 -0.67 -0.15 0.00 1.00 0.00 0.00 64.86 65.24 2c4m h ILE 359 Cb 0.01 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2c4m h ILE 359 CO -0.09 0.25 -0.34 0.40 0.00 0.00 0.00 178.15 178.37 2c4m h ILE 360 N 0.65 1.27 -0.47 -0.67 2.04 -0.41 -0.95 117.51 118.97 2c4m h ILE 360 Ca 0.15 -1.51 -0.04 0.00 1.00 0.00 0.00 64.86 64.46 2c4m h ILE 360 Cb 0.22 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2c4m h ILE 360 CO -0.01 0.51 0.15 0.00 0.00 0.00 0.00 178.15 178.81 2c4m h ALA 361 N 0.82 0.61 -0.75 1.87 0.00 -0.38 -1.53 119.26 119.89 2c4m h ALA 361 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2c4m h ALA 361 Cb 0.93 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 2c4m h ALA 361 CO 0.09 0.25 0.42 1.49 0.00 0.00 0.00 179.25 181.51 2c4m h GLU 362 N 0.62 1.04 -0.74 0.00 4.57 -0.78 0.50 114.58 119.79 2c4m h GLU 362 Ca 0.15 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 2c4m h GLU 362 Cb 0.25 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.60 2c4m h GLU 362 CO -0.01 0.75 0.38 0.82 -1.18 0.00 0.00 179.01 179.78 2c4m h ILE 363 N 1.05 1.23 -0.28 2.32 2.04 -0.73 0.11 117.51 123.25 2c4m h ILE 363 Ca 0.27 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 2c4m h ILE 363 Cb 0.00 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 2c4m h ILE 363 CO -0.05 0.26 -0.03 -0.78 0.00 0.00 0.00 178.15 177.55 2c4m h ASP 364 N 1.04 0.52 -0.22 1.72 3.58 -0.07 -1.41 116.42 121.59 2c4m h ASP 364 Ca 0.26 -0.34 -0.04 0.00 0.42 0.00 0.00 57.03 57.34 2c4m h ASP 364 Cb 0.06 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 2c4m h ASP 364 CO -0.04 0.73 -0.01 -0.09 -2.88 0.00 0.00 179.24 176.96 2c4m h ARG 365 N 0.30 0.39 -0.49 0.28 2.43 -0.59 -1.91 114.38 114.78 2c4m h ARG 365 Ca 0.08 -0.13 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2c4m h ARG 365 Cb 0.48 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.95 2c4m h ARG 365 CO 0.02 0.58 0.22 0.00 -1.51 0.00 0.00 179.97 179.29 2c4m h ARG 366 N 0.14 0.43 -0.59 0.20 2.47 -0.78 -1.21 114.38 115.04 2c4m h ARG 366 Ca 0.06 -0.03 0.01 0.00 -1.26 0.00 0.00 59.98 58.76 2c4m h ARG 366 Cb 0.41 -0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.61 2c4m h ARG 366 CO 0.01 0.28 0.39 0.35 0.56 0.00 0.00 179.97 181.56 2c4m h PHE 367 N 0.44 0.73 -0.08 3.04 3.57 -1.13 -0.67 116.94 122.83 2c4m h PHE 367 Ca 0.23 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 2c4m h PHE 367 Cb 0.17 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2c4m h PHE 367 CO -0.12 0.45 -0.16 0.00 -2.23 0.00 0.00 178.31 176.25 2c4m h ARG 368 N 0.79 0.13 0.07 1.11 3.08 -0.74 -1.83 114.38 116.99 2c4m h ARG 368 Ca 0.22 -0.03 -0.28 0.00 0.07 0.00 0.00 59.98 59.96 2c4m h ARG 368 Cb -0.07 -0.02 0.02 0.00 0.08 0.00 0.00 29.97 29.99 2c4m h ARG 368 CO -0.06 0.30 -1.15 -0.07 -1.07 0.00 0.00 179.97 177.91 2c4m h LEU 369 N 0.13 0.88 -0.83 3.04 4.07 -0.64 -2.72 115.31 119.23 2c4m h LEU 369 Ca 0.03 -0.76 -0.07 0.00 0.08 0.00 0.00 57.88 57.16 2c4m h LEU 369 Cb 0.36 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.80 2c4m h LEU 369 CO 0.02 1.56 0.14 -0.33 -1.08 0.00 0.00 178.44 178.76 2c4m h GLU 370 N 0.32 1.02 -0.02 1.13 5.08 -0.83 -1.10 114.58 120.18 2c4m h GLU 370 Ca -0.16 -0.24 -0.16 0.00 -1.00 0.00 0.00 59.36 57.80 2c4m h GLU 370 Cb 1.82 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.92 2c4m h GLU 370 CO 0.22 0.91 -0.71 0.00 -1.00 0.00 0.00 179.01 178.43 2c4m h ARG 371 N 0.97 0.15 -0.54 2.33 2.47 -1.43 -1.73 114.38 116.60 2c4m h ARG 371 Ca 0.20 -0.13 -0.03 0.00 -1.26 0.00 0.00 59.98 58.77 2c4m h ARG 371 Cb 0.36 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.69 2c4m h ARG 371 CO 0.00 0.80 0.21 0.00 0.56 0.00 0.00 179.97 181.55 2c4m h ALA 372 N 1.16 0.70 0.00 0.04 0.00 -1.11 -1.41 119.26 118.65 2c4m h ALA 372 Ca -0.02 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 2c4m h ALA 372 Cb 1.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2c4m h ALA 372 CO 0.10 0.31 -0.43 0.00 0.00 0.00 0.00 179.25 179.23 2c4m h ALA 373 N 1.06 1.27 0.00 0.00 0.00 -1.11 -1.61 119.26 118.87 2c4m h ALA 373 Ca 0.18 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2c4m h ALA 373 Cb 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2c4m h ALA 373 CO -0.01 0.54 0.00 -0.25 0.00 0.00 0.00 179.25 179.53 2c4m n ASP 374 N -4.00 0.57 0.00 0.00 9.92 -0.66 -4.86 116.55 117.52 2c4m n ASP 374 Ca -0.02 0.64 0.00 0.00 -0.53 0.00 0.00 54.79 54.88 2c4m n ASP 374 Cb 0.46 -0.76 0.00 0.00 -0.64 0.00 0.00 41.12 40.18 2c4m n ASP 374 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2c4m n GLY 375 N 0.04 0.60 3.75 0.44 0.00 -0.60 -5.02 105.19 104.39 2c4m n GLY 375 Ca 0.02 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2c4m n GLY 375 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2c4m s LEU 376 N 0.00 4.47 0.39 0.99 2.96 -0.59 -4.98 118.68 121.92 2c4m s LEU 376 Ca 0.00 2.35 -0.26 0.00 -0.22 0.00 0.00 54.13 56.00 2c4m s LEU 376 Cb 0.00 -3.62 -0.09 0.00 0.50 0.00 0.00 46.19 42.98 2c4m s LEU 376 CO 0.00 -0.36 1.19 1.51 -1.32 0.00 0.00 176.35 177.37 2c4m s ASP 377 N -0.24 6.55 0.40 3.68 1.47 -1.26 -4.62 116.67 122.65 2c4m s ASP 377 Ca 0.50 2.39 0.23 0.00 1.18 0.00 0.00 52.55 56.85 2c4m s ASP 377 Cb -0.34 -2.62 1.25 0.00 -0.34 0.00 0.00 42.92 40.87 2c4m s ASP 377 CO 0.41 -0.66 1.68 -0.33 0.68 0.00 0.00 175.17 176.95 2c4m h GLU 378 N 2.74 0.23 -0.70 2.11 5.08 -1.97 -0.12 114.58 121.95 2c4m h GLU 378 Ca -0.49 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 57.79 2c4m h GLU 378 Cb 1.23 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 2c4m h GLU 378 CO 0.63 0.15 0.17 1.49 -1.00 0.00 0.00 179.01 180.45 2c4m h GLU 379 N 0.23 1.12 -0.19 2.33 4.81 -2.00 -1.71 114.58 119.17 2c4m h GLU 379 Ca 0.73 -0.27 -0.21 0.00 -0.13 0.00 0.00 59.36 59.48 2c4m h GLU 379 Cb 2.03 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 31.27 2c4m h GLU 379 CO -0.42 0.99 -0.72 1.15 -0.73 0.00 0.00 179.01 179.28 2c4m h THR 380 N 1.05 1.28 -0.41 0.32 2.02 -1.40 -3.10 112.91 112.66 2c4m h THR 380 Ca 0.22 -1.91 0.00 0.00 0.77 0.00 0.00 66.41 65.50 2c4m h THR 380 Cb 0.37 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 2c4m h THR 380 CO 0.00 0.61 0.27 0.40 0.37 0.00 0.00 175.52 177.17 2c4m h ILE 381 N 0.58 1.12 -0.45 3.11 2.04 -1.31 -2.02 117.51 120.57 2c4m h ILE 381 Ca -0.03 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 2c4m h ILE 381 Cb 1.34 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2c4m h ILE 381 CO 0.15 0.12 0.19 0.78 0.00 0.00 0.00 178.15 179.39 2c4m h ASN 382 N 0.56 0.58 0.77 1.72 2.35 -1.35 0.66 115.58 120.86 2c4m h ASN 382 Ca 0.15 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2c4m h ASN 382 Cb -0.04 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.18 2c4m h ASN 382 CO -0.03 0.52 -0.29 -2.11 -1.65 0.00 0.00 177.43 173.87 2c4m n ARG 383 N -4.37 0.03 -0.01 0.81 1.85 -1.07 -3.45 116.66 110.45 2c4m n ARG 383 Ca 0.03 0.01 0.10 0.00 -1.00 0.00 0.00 57.85 57.00 2c4m n ARG 383 Cb 0.14 -1.52 -0.14 0.00 -1.05 0.00 0.00 32.46 29.89 2c4m n ARG 383 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 2c4m n MET 384 N -1.57 0.59 -1.71 2.89 2.81 -0.78 -5.00 117.12 114.34 2c4m n MET 384 Ca 0.06 -0.12 -0.42 0.00 -1.81 0.00 0.00 57.70 55.42 2c4m n MET 384 Cb 0.35 -1.46 -0.00 0.00 -0.71 0.00 0.00 33.22 31.40 2c4m n MET 384 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c4m n ALA 385 N -1.93 1.45 -0.09 3.04 0.00 0.17 -4.87 120.51 118.28 2c4m n ALA 385 Ca -0.01 0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.75 2c4m n ALA 385 Cb 0.44 -2.28 0.25 0.00 0.00 0.00 0.00 19.45 17.86 2c4m n ALA 385 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2c4m h PRO 386 N 2.48 0.73 -5.21 0.00 0.13 -1.89 -3.41 132.00 124.83 2c4m h PRO 386 Ca -0.47 -0.13 -0.66 0.00 -0.87 0.00 0.00 66.00 63.87 2c4m h PRO 386 Cb 1.28 -0.12 -0.28 0.00 0.13 0.00 0.00 31.00 32.01 2c4m h PRO 386 CO 0.62 0.64 -0.77 0.42 -0.23 0.00 0.00 178.00 178.68 2c4m s ILE 387 N -5.24 3.01 -0.08 -3.56 1.01 -1.26 0.68 121.20 115.75 2c4m s ILE 387 Ca -0.09 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 2c4m s ILE 387 Cb 0.16 -2.29 0.04 0.00 0.01 0.00 0.00 42.46 40.38 2c4m s ILE 387 CO 0.78 0.50 0.17 -1.10 0.00 0.00 0.00 174.94 175.29 2c4m s GLN 388 N 0.75 0.09 -1.49 2.79 -0.21 -0.69 -4.91 119.66 115.99 2c4m s GLN 388 Ca -0.05 0.48 -0.06 0.00 0.02 0.00 0.00 55.36 55.74 2c4m s GLN 388 Cb -0.15 -0.19 0.05 0.00 1.00 0.00 0.00 33.01 33.72 2c4m s GLN 388 CO 0.01 -0.22 0.58 0.72 -2.12 0.00 0.00 175.29 174.27 2c4m n HIS 389 N 4.63 -1.75 -0.95 0.91 8.25 -1.26 -1.26 115.22 123.79 2c4m n HIS 389 Ca -0.18 0.78 0.00 0.00 -0.26 0.00 0.00 57.72 58.06 2c4m n HIS 389 Cb 0.51 -3.59 0.00 0.00 1.12 0.00 0.00 29.99 28.03 2c4m n HIS 389 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c4m n GLY 390 N -1.78 0.55 3.17 -1.41 0.00 -1.26 -5.01 105.19 99.44 2c4m n GLY 390 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2c4m n GLY 390 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c4m s THR 391 N -2.44 1.56 -0.20 2.61 -4.23 -0.39 -0.99 115.64 111.56 2c4m s THR 391 Ca 0.00 -0.80 -0.20 0.00 -1.18 0.00 0.00 61.69 59.51 2c4m s THR 391 Cb 0.00 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.48 2c4m s THR 391 CO 0.00 0.45 0.59 -0.69 -0.54 0.00 0.00 174.62 174.43 2c4m s VAL 392 N -0.05 5.05 -0.54 2.29 1.01 0.18 -1.70 120.40 126.64 2c4m s VAL 392 Ca -0.03 1.11 -0.23 0.00 0.00 0.00 0.00 61.98 62.83 2c4m s VAL 392 Cb -0.12 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2c4m s VAL 392 CO 0.02 0.13 0.89 -1.00 0.00 0.00 0.00 175.10 175.14 2c4m s HIS 393 N 1.82 2.84 0.30 5.22 4.02 0.21 -1.19 115.29 128.52 2c4m s HIS 393 Ca 0.27 -0.11 0.03 0.00 1.02 0.00 0.00 55.06 56.27 2c4m s HIS 393 Cb -0.16 -3.98 0.49 0.00 -1.02 0.00 0.00 32.58 27.91 2c4m s HIS 393 CO 0.10 -1.30 1.79 0.52 1.02 0.00 0.00 174.74 176.88 2c4m h MET 394 N 9.26 0.52 -0.06 1.40 2.86 -1.41 -2.72 114.93 124.78 2c4m h MET 394 Ca -0.26 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.19 2c4m h MET 394 Cb 1.08 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 2c4m h MET 394 CO 1.07 0.64 -0.10 0.00 1.06 0.00 0.00 176.91 179.58 2c4m h ALA 395 N 1.39 1.72 -0.01 6.32 0.00 -1.90 -1.80 119.26 124.97 2c4m h ALA 395 Ca 0.09 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 2c4m h ALA 395 Cb 0.50 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2c4m h ALA 395 CO 0.03 0.21 -0.88 -1.49 0.00 0.00 0.00 179.25 177.12 2c4m h TRP 396 N 0.09 0.51 -0.42 0.00 -0.00 -1.82 -1.65 115.95 112.65 2c4m h TRP 396 Ca 0.02 -0.27 -0.11 0.00 -0.00 0.00 0.00 58.89 58.54 2c4m h TRP 396 Cb 0.24 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.16 29.32 2c4m h TRP 396 CO 0.00 1.07 -0.17 0.82 -0.00 0.00 0.00 178.44 180.16 2c4m h ILE 397 N 0.21 1.27 0.12 1.49 2.04 -1.31 -1.81 117.51 119.51 2c4m h ILE 397 Ca -0.06 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 2c4m h ILE 397 Cb 1.50 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 2c4m h ILE 397 CO 0.15 0.43 -0.06 0.00 0.00 0.00 0.00 178.15 178.67 2c4m h ALA 398 N 1.10 -0.16 -0.48 1.87 0.00 -1.24 -2.02 119.26 118.33 2c4m h ALA 398 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2c4m h ALA 398 Cb 0.67 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2c4m h ALA 398 CO 0.05 -0.49 0.16 0.00 0.00 0.00 0.00 179.25 178.97 2c4m h TYR 400 N 0.68 0.53 0.18 0.00 3.20 -1.25 -3.34 116.97 116.97 2c4m h TYR 400 Ca 0.16 -0.10 -0.33 0.00 3.14 0.00 0.00 58.73 61.60 2c4m h TYR 400 Cb 0.19 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.33 2c4m h TYR 400 CO 0.01 0.66 -1.62 0.00 -1.64 0.00 0.00 178.16 175.57 2c4m h ALA 401 N 0.80 0.12 -2.64 1.82 0.00 -1.14 -3.48 119.26 114.75 2c4m h ALA 401 Ca 0.07 -1.07 -0.55 0.00 0.00 0.00 0.00 54.91 53.36 2c4m h ALA 401 Cb 0.47 0.34 0.09 0.00 0.00 0.00 0.00 17.79 18.68 2c4m h ALA 401 CO 0.02 0.99 0.76 0.00 0.00 0.00 0.00 179.25 181.02 2c4m n ALA 402 N -2.77 2.01 1.23 0.00 0.00 0.63 -4.18 120.51 117.44 2c4m n ALA 402 Ca -0.20 0.38 0.13 0.00 0.00 0.00 0.00 53.44 53.75 2c4m n ALA 402 Cb 1.07 -2.39 0.41 0.00 0.00 0.00 0.00 19.45 18.54 2c4m n ALA 402 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2c4m n TYR 403 N 1.77 0.00 -3.72 0.00 0.18 -0.50 -4.81 117.16 110.08 2c4m n TYR 403 Ca 0.08 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.75 2c4m n TYR 403 Cb 0.35 -0.16 -0.11 0.00 -0.38 0.00 0.00 39.34 39.04 2c4m n TYR 403 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2c4m s SER 404 N -2.58 -0.41 -0.10 9.48 0.15 -1.26 -4.64 113.70 114.35 2c4m s SER 404 Ca 0.23 0.74 -0.00 0.00 0.70 0.00 0.00 55.95 57.62 2c4m s SER 404 Cb 0.19 0.67 0.02 0.00 -1.71 0.00 0.00 66.02 65.20 2c4m s SER 404 CO 0.54 -0.16 -0.07 -0.63 1.20 0.00 0.00 173.24 174.12 2c4m s ILE 405 N 0.92 0.92 0.12 6.45 1.01 -0.21 -0.08 121.20 130.33 2c4m s ILE 405 Ca -0.06 -0.24 0.06 0.00 0.00 0.00 0.00 60.65 60.41 2c4m s ILE 405 Cb -0.07 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 2c4m s ILE 405 CO -0.07 0.34 -0.14 0.54 0.00 0.00 0.00 174.94 175.62 2c4m s ASN 406 N 1.59 1.94 0.53 3.58 4.22 -0.63 -1.95 114.94 124.23 2c4m s ASN 406 Ca 0.02 -0.81 0.09 0.00 -2.14 0.00 0.00 52.86 50.01 2c4m s ASN 406 Cb -0.13 -0.06 0.06 0.00 1.28 0.00 0.00 41.25 42.40 2c4m s ASN 406 CO -0.06 -0.16 0.69 -0.83 -2.04 0.00 0.00 177.10 174.70 2c4m s GLY 407 N -2.46 1.86 0.00 0.45 0.00 -1.09 -0.76 107.32 105.31 2c4m s GLY 407 Ca 0.09 -1.95 0.11 0.00 0.00 0.00 0.00 44.72 42.97 2c4m s GLY 407 CO 0.03 -1.68 1.08 3.33 0.00 0.00 0.00 173.10 175.86 2c4m n VAL 408 N -2.08 0.57 -3.50 1.40 0.24 -1.25 -2.03 118.33 111.68 2c4m n VAL 408 Ca 0.12 -0.79 -0.16 0.00 -2.04 0.00 0.00 64.34 61.47 2c4m n VAL 408 Cb 0.61 0.81 -0.05 0.00 -1.47 0.00 0.00 33.84 33.75 2c4m n VAL 408 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c4m s ALA 409 N -0.97 -1.74 0.14 2.33 0.00 -1.26 -1.31 121.76 118.96 2c4m s ALA 409 Ca 0.19 1.13 -0.27 0.00 0.00 0.00 0.00 51.96 53.01 2c4m s ALA 409 Cb 0.11 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 2c4m s ALA 409 CO 0.15 -0.47 1.59 0.00 0.00 0.00 0.00 175.76 177.03 2c4m h ALA 410 N 2.71 -0.44 -0.58 0.00 0.00 -1.94 0.59 119.26 119.60 2c4m h ALA 410 Ca -0.28 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2c4m h ALA 410 Cb 1.18 0.72 -0.03 0.00 0.00 0.00 0.00 17.79 19.67 2c4m h ALA 410 CO 0.38 -0.85 0.23 -0.07 0.00 0.00 0.00 179.25 178.95 2c4m h LEU 411 N -0.41 0.77 -0.25 0.00 3.38 -1.97 -2.33 115.31 114.50 2c4m h LEU 411 Ca 0.10 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2c4m h LEU 411 Cb 0.58 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2c4m h LEU 411 CO -0.42 0.70 0.06 -0.74 0.09 0.00 0.00 178.44 178.13 2c4m h HIS 412 N 0.84 0.43 -0.66 1.13 2.76 -1.67 -2.52 115.15 115.45 2c4m h HIS 412 Ca 0.20 -0.05 -0.04 0.00 -2.20 0.00 0.00 60.37 58.28 2c4m h HIS 412 Cb 0.17 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 2c4m h HIS 412 CO 0.01 0.49 0.25 1.15 -1.30 0.00 0.00 177.93 178.54 2c4m h THR 413 N 0.24 1.23 -0.51 6.26 2.02 -0.67 -2.05 112.91 119.43 2c4m h THR 413 Ca 0.08 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.48 2c4m h THR 413 Cb 0.28 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2c4m h THR 413 CO 0.00 0.29 0.16 -0.33 0.37 0.00 0.00 175.52 176.01 2c4m h GLU 414 N 0.95 0.80 -0.52 6.66 4.39 -1.35 -2.60 114.58 122.93 2c4m h GLU 414 Ca 0.22 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 2c4m h GLU 414 Cb 0.20 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 2c4m h GLU 414 CO -0.02 0.75 0.21 0.82 -1.16 0.00 0.00 179.01 179.60 2c4m h ILE 415 N 0.70 1.22 0.00 3.13 2.04 -1.09 -1.54 117.51 121.97 2c4m h ILE 415 Ca 0.17 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.30 2c4m h ILE 415 Cb 0.28 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2c4m h ILE 415 CO -0.00 0.25 -0.28 0.16 0.00 0.00 0.00 178.15 178.28 2c4m h ILE 416 N 0.69 0.85 -0.29 -0.67 3.07 -1.32 0.87 117.51 120.71 2c4m h ILE 416 Ca 0.17 -1.12 -0.13 0.00 1.55 0.00 0.00 64.86 65.33 2c4m h ILE 416 Cb 0.20 1.67 -0.00 0.00 -0.27 0.00 0.00 36.82 38.42 2c4m h ILE 416 CO -0.01 0.28 -0.33 0.11 -1.05 0.00 0.00 178.15 177.14 2c4m h LYS 417 N 0.00 0.74 0.00 0.16 1.57 -1.05 0.33 116.57 118.32 2c4m h LYS 417 Ca -0.00 -0.41 -0.08 0.00 -1.87 0.00 0.00 60.65 58.29 2c4m h LYS 417 Cb 0.65 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 2c4m h LYS 417 CO 0.04 1.03 -0.99 0.00 -0.57 0.00 0.00 179.45 178.96 2c4m h ALA 418 N 0.70 0.64 -3.00 3.86 0.00 -0.87 -3.30 119.26 117.28 2c4m h ALA 418 Ca 0.04 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2c4m h ALA 418 Cb 0.91 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2c4m h ALA 418 CO 0.08 0.47 0.00 0.39 0.00 0.00 0.00 179.25 180.19 2c4m n GLU 419 N -2.89 0.00 -0.31 0.00 1.02 0.30 -4.66 120.64 114.10 2c4m n GLU 419 Ca -0.03 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.12 2c4m n GLU 419 Cb 0.69 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 32.17 2c4m n GLU 419 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2c4m n THR 420 N -0.62 -0.41 -1.58 2.62 -1.04 -1.21 -1.64 114.28 110.40 2c4m n THR 420 Ca 0.00 1.91 0.06 0.00 -2.04 0.00 0.00 64.05 63.99 2c4m n THR 420 Cb 0.00 -2.56 0.19 0.00 -1.82 0.00 0.00 70.33 66.14 2c4m n THR 420 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2c4m n LEU 421 N -5.24 2.57 -0.30 -4.42 4.77 0.11 -4.87 117.00 109.62 2c4m n LEU 421 Ca 0.10 -3.71 0.04 0.00 -0.03 0.00 0.00 56.01 52.41 2c4m n LEU 421 Cb 0.35 -0.49 0.12 0.00 -2.33 0.00 0.00 43.42 41.07 2c4m n LEU 421 CO -0.11 1.28 0.70 0.00 -1.33 0.00 0.00 177.39 177.94 2c4m h ALA 422 N 0.87 0.61 0.00 -1.18 0.00 -1.13 0.22 119.26 118.66 2c4m h ALA 422 Ca -0.01 0.33 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2c4m h ALA 422 Cb 1.04 0.63 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 2c4m h ALA 422 CO 0.00 -0.41 -0.10 -0.44 0.00 0.00 0.00 179.25 178.30 2c4m h ASP 423 N 0.01 0.00 0.36 0.00 3.32 -1.87 -0.14 116.42 118.10 2c4m h ASP 423 Ca 0.42 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 57.15 2c4m h ASP 423 Cb 0.67 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.24 2c4m h ASP 423 CO -0.87 0.10 -1.45 -0.50 -1.72 0.00 0.00 179.24 174.80 2c4m h TRP 424 N 0.00 0.82 -0.27 4.55 4.06 -0.99 -2.93 115.95 121.18 2c4m h TRP 424 Ca -0.00 -0.60 -0.11 0.00 2.06 0.00 0.00 58.89 60.24 2c4m h TRP 424 Cb 0.25 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.36 2c4m h TRP 424 CO 0.00 1.50 -0.29 -0.92 -3.56 0.00 0.00 178.44 175.17 2c4m h TYR 425 N 0.12 0.64 0.00 0.49 3.20 -0.85 0.24 116.97 120.81 2c4m h TYR 425 Ca -0.23 -0.15 -0.03 0.00 3.14 0.00 0.00 58.73 61.46 2c4m h TYR 425 Cb 2.11 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 40.23 2c4m h TYR 425 CO 0.11 0.79 -0.12 0.00 -1.64 0.00 0.00 178.16 177.30 2c4m h ALA 426 N 1.20 1.03 0.02 1.82 0.00 -1.09 -2.50 119.26 119.75 2c4m h ALA 426 Ca 0.06 -0.11 -0.39 0.00 0.00 0.00 0.00 54.91 54.47 2c4m h ALA 426 Cb 0.75 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 2c4m h ALA 426 CO 0.06 0.15 -2.28 -0.11 0.00 0.00 0.00 179.25 177.08 2c4m n LEU 427 N -3.28 2.49 -3.40 0.00 7.94 -0.94 -4.78 117.00 115.01 2c4m n LEU 427 Ca 0.00 0.13 -0.26 0.00 -1.11 0.00 0.00 56.01 54.77 2c4m n LEU 427 Cb 0.36 -0.93 -0.09 0.00 0.53 0.00 0.00 43.42 43.30 2c4m n LEU 427 CO 0.31 0.74 -0.16 0.79 -1.11 0.00 0.00 177.39 177.96 2c4m n TRP 428 N -3.73 1.16 0.28 1.96 8.01 0.79 -4.96 117.44 120.95 2c4m n TRP 428 Ca -0.45 -3.78 0.16 0.00 -1.31 0.00 0.00 57.50 52.12 2c4m n TRP 428 Cb 0.93 -0.32 0.90 0.00 -2.01 0.00 0.00 31.31 30.82 2c4m n TRP 428 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2c4m h PRO 429 N 4.60 0.00 0.00 -0.99 0.13 -1.63 -2.55 132.00 131.56 2c4m h PRO 429 Ca 0.16 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.23 2c4m h PRO 429 Cb 0.81 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2c4m h PRO 429 CO 0.58 0.00 -0.29 1.05 -0.23 0.00 0.00 178.00 179.11 2c4m h GLU 430 N 0.00 0.00 -0.22 0.86 9.09 -1.93 -3.13 114.58 119.25 2c4m h GLU 430 Ca 0.02 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.32 2c4m h GLU 430 Cb 0.12 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.21 2c4m h GLU 430 CO -0.00 0.29 -0.33 0.87 0.05 0.00 0.00 179.01 179.90 2c4m h LYS 431 N 0.00 0.46 -6.42 1.06 1.57 -1.72 -3.45 116.57 108.08 2c4m h LYS 431 Ca -0.00 -0.20 -0.54 0.00 -1.87 0.00 0.00 60.65 58.04 2c4m h LYS 431 Cb 0.65 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 2c4m h LYS 431 CO 0.04 0.73 0.58 -0.06 -0.57 0.00 0.00 179.45 180.18 2c4m s PHE 432 N -4.35 3.38 0.34 -1.35 0.40 -1.19 -1.05 117.98 114.16 2c4m s PHE 432 Ca -0.07 1.32 -0.04 0.00 -0.60 0.00 0.00 56.93 57.54 2c4m s PHE 432 Cb 0.13 -3.39 0.01 0.00 0.51 0.00 0.00 43.02 40.28 2c4m s PHE 432 CO 0.80 -1.14 0.51 0.54 0.70 0.00 0.00 175.22 176.62 2c4m s ASN 433 N 1.20 0.75 -0.00 1.36 2.20 -0.82 -4.97 114.94 114.65 2c4m s ASN 433 Ca 0.57 -1.41 0.05 0.00 -0.94 0.00 0.00 52.86 51.12 2c4m s ASN 433 Cb -0.27 0.68 -0.01 0.00 -2.00 0.00 0.00 41.25 39.64 2c4m s ASN 433 CO 0.27 -1.33 -0.15 0.21 -2.94 0.00 0.00 177.10 173.16 2c4m s ASN 434 N -3.21 1.79 -0.30 3.54 2.47 -1.26 -2.69 114.94 115.29 2c4m s ASN 434 Ca 0.28 -0.31 -0.03 0.00 0.42 0.00 0.00 52.86 53.22 2c4m s ASN 434 Cb -0.01 -0.18 0.10 0.00 -1.45 0.00 0.00 41.25 39.71 2c4m s ASN 434 CO 0.19 0.16 0.12 -0.54 -3.72 0.00 0.00 177.10 173.31 2c4m s LYS 435 N -0.51 0.35 0.08 0.43 -0.14 -0.86 -4.93 119.74 114.16 2c4m s LYS 435 Ca 0.05 -0.70 -0.31 0.00 -1.36 0.00 0.00 55.97 53.65 2c4m s LYS 435 Cb -0.06 -1.41 -0.07 0.00 -1.68 0.00 0.00 37.83 34.61 2c4m s LYS 435 CO -0.00 -1.01 1.44 0.99 -0.76 0.00 0.00 175.35 176.00 2c4m s THR 436 N 1.94 3.34 0.93 2.17 2.01 -1.25 -4.05 115.64 120.72 2c4m s THR 436 Ca 0.09 0.89 -0.12 0.00 0.31 0.00 0.00 61.69 62.86 2c4m s THR 436 Cb -0.16 -3.57 0.07 0.00 0.01 0.00 0.00 72.50 68.84 2c4m s THR 436 CO -0.33 0.04 0.64 0.59 -0.69 0.00 0.00 174.62 174.87 2c4m n ASN 437 N 4.57 -1.29 -3.19 3.53 3.02 -0.42 -4.65 115.26 116.83 2c4m n ASN 437 Ca 0.13 0.37 -0.09 0.00 -0.03 0.00 0.00 54.58 54.96 2c4m n ASN 437 Cb 0.42 -1.29 0.01 0.00 -0.61 0.00 0.00 39.78 38.31 2c4m n ASN 437 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2c4m s GLY 438 N -2.19 0.34 0.20 7.41 0.00 -1.26 -4.87 107.32 106.94 2c4m s GLY 438 Ca 0.60 -0.70 0.03 0.00 0.00 0.00 0.00 44.72 44.65 2c4m s GLY 438 CO 0.64 -0.31 -0.03 -1.34 0.00 0.00 0.00 173.10 172.06 2c4m s VAL 439 N -2.78 0.99 -0.12 1.40 -7.23 0.03 -4.51 120.40 108.18 2c4m s VAL 439 Ca 0.16 -2.03 -0.24 0.00 -1.81 0.00 0.00 61.98 58.05 2c4m s VAL 439 Cb -0.05 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.70 2c4m s VAL 439 CO 0.11 -0.47 0.77 0.28 -0.31 0.00 0.00 175.10 175.48 2c4m s THR 440 N -3.45 4.96 -1.33 5.32 -1.32 -1.26 -0.13 115.64 118.42 2c4m s THR 440 Ca 0.24 1.55 0.19 0.00 -1.21 0.00 0.00 61.69 62.47 2c4m s THR 440 Cb 0.05 -4.10 0.30 0.00 -1.51 0.00 0.00 72.50 67.24 2c4m s THR 440 CO 0.05 0.13 1.61 -0.81 -2.21 0.00 0.00 174.62 173.40 2c4m n PRO 441 N 4.53 0.22 0.00 7.08 -0.04 -1.26 -2.24 135.00 143.28 2c4m n PRO 441 Ca 0.02 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2c4m n PRO 441 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2c4m n PRO 441 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2c4m n ARG 442 N -1.33 0.00 -0.26 0.54 3.00 -1.26 -0.62 116.66 116.72 2c4m n ARG 442 Ca 0.08 0.26 -0.01 0.00 -0.01 0.00 0.00 57.85 58.17 2c4m n ARG 442 Cb 0.17 -0.94 0.11 0.00 0.00 0.00 0.00 32.46 31.80 2c4m n ARG 442 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2c4m h ARG 443 N 0.00 0.81 -0.07 5.56 2.43 -1.96 0.38 114.38 121.53 2c4m h ARG 443 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2c4m h ARG 443 Cb 0.00 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2c4m h ARG 443 CO 0.00 0.54 0.00 0.91 -1.51 0.00 0.00 179.97 179.91 2c4m n TRP 444 N -4.69 0.08 0.08 2.20 7.02 -0.95 -3.44 117.44 117.73 2c4m n TRP 444 Ca 0.10 -0.04 0.00 0.00 -1.02 0.00 0.00 57.50 56.54 2c4m n TRP 444 Cb 0.15 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.04 2c4m n TRP 444 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2c4m n LEU 445 N -0.13 -0.70 0.02 -0.99 7.94 -1.06 -4.78 117.00 117.30 2c4m n LEU 445 Ca 0.18 0.28 -0.11 0.00 -1.11 0.00 0.00 56.01 55.25 2c4m n LEU 445 Cb 0.25 0.82 -0.05 0.00 0.53 0.00 0.00 43.42 44.97 2c4m n LEU 445 CO 0.14 -0.46 0.84 -0.09 -1.11 0.00 0.00 177.39 176.71 2c4m h ARG 446 N 0.00 -0.04 -0.21 1.96 9.65 -0.34 0.60 114.38 126.01 2c4m h ARG 446 Ca 0.00 0.00 -0.07 0.00 -1.10 0.00 0.00 59.98 58.82 2c4m h ARG 446 Cb 0.00 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.58 2c4m h ARG 446 CO 0.00 -0.02 -0.13 1.98 2.80 0.00 0.00 179.97 184.59 2c4m h MET 447 N -0.04 0.46 0.00 0.20 4.05 -0.45 -3.36 114.93 115.79 2c4m h MET 447 Ca 0.04 -0.21 0.00 0.00 -0.28 0.00 0.00 59.70 59.24 2c4m h MET 447 Cb 0.09 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.89 2c4m h MET 447 CO -0.08 0.76 -0.93 0.44 0.23 0.00 0.00 176.91 177.33 2c4m n ILE 448 N -4.51 0.46 -3.40 1.77 -5.35 -1.22 -4.51 119.36 102.61 2c4m n ILE 448 Ca -0.05 -0.42 -0.26 0.00 -0.27 0.00 0.00 62.75 61.74 2c4m n ILE 448 Cb 0.35 -0.19 -0.08 0.00 -1.74 0.00 0.00 39.64 37.99 2c4m n ILE 448 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2c4m n ASN 449 N -2.40 2.98 0.17 7.28 2.85 0.20 -4.86 115.26 121.49 2c4m n ASN 449 Ca 0.01 -3.28 0.06 0.00 -0.11 0.00 0.00 54.58 51.26 2c4m n ASN 449 Cb 0.50 -0.67 0.52 0.00 1.24 0.00 0.00 39.78 41.38 2c4m n ASN 449 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2c4m h PRO 450 N 4.21 0.16 0.40 1.20 0.13 -1.76 -0.41 132.00 135.93 2c4m h PRO 450 Ca 0.17 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.27 2c4m h PRO 450 Cb 0.71 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2c4m h PRO 450 CO 0.75 0.18 -0.19 0.78 -0.23 0.00 0.00 178.00 179.29 2c4m h GLY 451 N 0.35 -0.55 1.15 1.56 0.00 -1.93 -1.38 103.07 102.26 2c4m h GLY 451 Ca 0.04 0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.52 2c4m h GLY 451 CO 0.00 -0.20 0.20 -2.00 0.00 0.00 0.00 176.54 174.54 2c4m h LEU 452 N -0.65 1.00 -1.31 3.11 5.85 -1.87 -2.59 115.31 118.85 2c4m h LEU 452 Ca -0.05 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.51 2c4m h LEU 452 Cb 0.47 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 2c4m h LEU 452 CO 0.09 0.94 0.48 0.28 -0.34 0.00 0.00 178.44 179.89 2c4m h SER 453 N 1.02 0.77 0.17 1.25 0.02 -0.95 -1.51 113.55 114.32 2c4m h SER 453 Ca 0.22 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 61.05 2c4m h SER 453 Cb 0.31 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2c4m h SER 453 CO -0.01 0.53 -0.41 0.44 -1.14 0.00 0.00 176.83 176.25 2c4m h ASP 454 N 0.90 0.33 -0.20 3.07 3.32 -0.85 -0.87 116.42 122.11 2c4m h ASP 454 Ca 0.29 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.09 2c4m h ASP 454 Cb 0.05 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2c4m h ASP 454 CO -0.08 0.70 -0.30 0.25 -1.72 0.00 0.00 179.24 178.09 2c4m h LEU 455 N 0.26 0.61 -0.75 1.55 5.85 -1.17 -1.56 115.31 120.10 2c4m h LEU 455 Ca 0.02 -0.52 -0.03 0.00 0.84 0.00 0.00 57.88 58.19 2c4m h LEU 455 Cb 0.84 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2c4m h LEU 455 CO 0.07 1.01 0.34 -0.07 -0.34 0.00 0.00 178.44 179.45 2c4m h LEU 456 N 0.23 0.99 -0.77 2.25 3.38 -1.20 -1.01 115.31 119.17 2c4m h LEU 456 Ca 0.02 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 2c4m h LEU 456 Cb 0.88 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2c4m h LEU 456 CO 0.07 0.86 -0.53 0.74 0.09 0.00 0.00 178.44 179.67 2c4m h THR 457 N 1.06 1.36 -0.08 0.22 2.02 -1.15 -1.87 112.91 114.47 2c4m h THR 457 Ca 0.25 -1.80 -0.09 0.00 0.77 0.00 0.00 66.41 65.55 2c4m h THR 457 Cb 0.14 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 2c4m h THR 457 CO -0.03 0.53 -0.29 -0.09 0.37 0.00 0.00 175.52 176.02 2c4m h ARG 458 N 0.18 0.33 0.00 6.66 2.43 -0.90 -1.59 114.38 121.50 2c4m h ARG 458 Ca 0.00 -0.25 -0.10 0.00 -0.81 0.00 0.00 59.98 58.82 2c4m h ARG 458 Cb 0.99 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2c4m h ARG 458 CO 0.08 0.88 -0.48 -0.07 -1.51 0.00 0.00 179.97 178.88 2c4m h LEU 459 N -0.14 0.00 0.00 3.80 3.38 -1.23 -3.13 115.31 117.99 2c4m h LEU 459 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2c4m h LEU 459 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2c4m h LEU 459 CO 0.06 0.48 -0.85 -1.54 0.09 0.00 0.00 178.44 176.68 2c4m n SER 460 N -3.59 0.71 0.00 -0.43 3.41 -0.71 -4.97 113.62 108.04 2c4m n SER 460 Ca -0.00 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2c4m n SER 460 Cb 0.57 0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.95 2c4m n SER 460 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c4m n GLY 461 N 1.30 2.37 3.24 5.00 0.00 -0.63 -4.98 105.19 111.50 2c4m n GLY 461 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 2c4m n GLY 461 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c4m n SER 462 N 0.00 -1.97 -1.88 1.61 3.41 -1.04 -4.97 113.62 108.78 2c4m n SER 462 Ca 0.00 -2.35 -0.21 0.00 -0.26 0.00 0.00 58.87 56.04 2c4m n SER 462 Cb 0.00 3.28 0.12 0.00 -0.26 0.00 0.00 64.21 67.34 2c4m n SER 462 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2c4m n ASP 463 N -1.45 4.83 0.18 4.04 5.75 -1.26 -4.34 116.55 124.29 2c4m n ASP 463 Ca -0.07 -3.76 0.02 0.00 -0.01 0.00 0.00 54.79 50.96 2c4m n ASP 463 Cb 0.51 -0.70 0.33 0.00 -1.03 0.00 0.00 41.12 40.23 2c4m n ASP 463 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2c4m h ASP 464 N 1.58 0.01 0.04 -1.12 5.19 -1.96 -2.80 116.42 117.36 2c4m h ASP 464 Ca 0.44 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.84 2c4m h ASP 464 Cb 1.55 -0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.06 2c4m h ASP 464 CO 0.95 0.41 -0.03 4.11 -3.12 0.00 0.00 179.24 181.56 2c4m h TRP 465 N 0.01 0.00 -0.53 4.55 5.08 -1.81 -2.42 115.95 120.82 2c4m h TRP 465 Ca -0.00 0.00 0.14 0.00 1.08 0.00 0.00 58.89 60.10 2c4m h TRP 465 Cb 0.72 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.85 2c4m h TRP 465 CO 0.00 0.03 0.37 0.28 -1.28 0.00 0.00 178.44 177.85 2c4m h VAL 466 N 0.00 0.78 -0.13 0.12 2.07 -1.86 -1.16 116.25 116.07 2c4m h VAL 466 Ca -0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2c4m h VAL 466 Cb 0.06 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2c4m h VAL 466 CO 0.00 0.02 0.00 0.35 0.02 0.00 0.00 177.57 177.96 2c4m n THR 467 N -4.41 1.59 -2.74 2.57 -2.24 -0.94 -4.56 114.28 103.55 2c4m n THR 467 Ca 0.09 -1.61 -0.08 0.00 -2.27 0.00 0.00 64.05 60.18 2c4m n THR 467 Cb 0.53 0.08 0.06 0.00 -2.10 0.00 0.00 70.33 68.91 2c4m n THR 467 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2c4m n ASP 468 N -0.61 -2.70 0.06 3.42 -0.08 -0.53 -5.03 116.55 111.09 2c4m n ASP 468 Ca 0.12 -3.29 0.21 0.00 -1.51 0.00 0.00 54.79 50.32 2c4m n ASP 468 Cb 0.56 1.79 0.69 0.00 2.34 0.00 0.00 41.12 46.51 2c4m n ASP 468 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2c4m h LEU 469 N 3.74 0.00 -2.36 -2.67 5.85 -1.61 -0.44 115.31 117.82 2c4m h LEU 469 Ca -0.15 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.58 2c4m h LEU 469 Cb 1.06 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 2c4m h LEU 469 CO 0.26 0.00 0.04 0.44 -0.34 0.00 0.00 178.44 178.84 2c4m h ASP 470 N 0.00 0.00 0.00 1.25 3.32 -1.86 -1.41 116.42 117.72 2c4m h ASP 470 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2c4m h ASP 470 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.91 2c4m h ASP 470 CO -0.00 0.00 0.28 -0.33 -1.72 0.00 0.00 179.24 177.46 2c4m h GLU 471 N 0.00 0.00 0.00 3.56 4.39 -1.40 -0.03 114.58 121.10 2c4m h GLU 471 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2c4m h GLU 471 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2c4m h GLU 471 CO -0.00 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.13 2c4m n LEU 472 N -2.61 0.66 -0.20 1.33 4.77 -0.53 -3.02 117.00 117.39 2c4m n LEU 472 Ca -0.02 0.61 -0.02 0.00 -0.03 0.00 0.00 56.01 56.55 2c4m n LEU 472 Cb 0.32 -0.45 0.18 0.00 -2.33 0.00 0.00 43.42 41.13 2c4m n LEU 472 CO 0.11 -0.34 1.10 0.11 -1.33 0.00 0.00 177.39 177.04 2c4m h LYS 473 N 0.00 0.98 0.00 3.23 1.57 -0.93 -1.50 116.57 119.92 2c4m h LYS 473 Ca 0.00 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2c4m h LYS 473 Cb 0.53 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2c4m h LYS 473 CO 0.00 0.76 0.14 0.87 -0.57 0.00 0.00 179.45 180.65 2c4m h LYS 474 N 0.97 0.00 -0.00 3.15 1.57 -1.75 0.16 116.57 120.67 2c4m h LYS 474 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2c4m h LYS 474 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2c4m h LYS 474 CO -0.03 0.00 -0.63 1.28 -0.57 0.00 0.00 179.45 179.50 2c4m n LEU 475 N -2.35 0.88 0.28 2.94 4.77 -0.57 -4.04 117.00 118.92 2c4m n LEU 475 Ca -0.01 -0.27 0.18 0.00 -0.03 0.00 0.00 56.01 55.87 2c4m n LEU 475 Cb 0.17 -0.13 0.97 0.00 -2.33 0.00 0.00 43.42 42.10 2c4m n LEU 475 CO 0.10 0.20 1.15 -0.09 -1.33 0.00 0.00 177.39 177.42 2c4m h ARG 476 N 0.40 0.00 0.00 3.23 2.43 -0.70 -1.04 114.38 118.70 2c4m h ARG 476 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2c4m h ARG 476 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2c4m h ARG 476 CO 0.00 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.33 2c4m n SER 477 N -3.51 0.49 -0.76 -3.80 3.41 -1.26 -1.25 113.62 106.94 2c4m n SER 477 Ca -0.01 0.65 0.08 0.00 -0.26 0.00 0.00 58.87 59.32 2c4m n SER 477 Cb 0.19 -0.74 0.23 0.00 -0.26 0.00 0.00 64.21 63.63 2c4m n SER 477 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2c4m n TYR 478 N -2.07 0.49 0.26 7.33 4.01 -0.39 -4.37 117.16 122.42 2c4m n TYR 478 Ca 0.01 -0.25 0.18 0.00 -0.16 0.00 0.00 57.90 57.69 2c4m n TYR 478 Cb 0.16 0.00 0.89 0.00 -0.31 0.00 0.00 39.34 40.08 2c4m n TYR 478 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2c4m h ALA 479 N 3.88 1.55 -0.02 -0.72 0.00 -1.34 -1.70 119.26 120.92 2c4m h ALA 479 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c4m h ALA 479 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2c4m h ALA 479 CO 0.00 -0.29 -0.15 -0.25 0.00 0.00 0.00 179.25 178.56 2c4m n ASP 480 N -3.39 1.98 -4.59 0.00 8.00 -1.26 -4.76 116.55 112.52 2c4m n ASP 480 Ca 0.00 -1.49 -0.43 0.00 0.71 0.00 0.00 54.79 53.59 2c4m n ASP 480 Cb 0.33 0.22 -0.02 0.00 -0.02 0.00 0.00 41.12 41.62 2c4m n ASP 480 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2c4m s ASP 481 N -1.55 6.43 0.36 -2.24 2.15 -0.64 -4.87 116.67 116.29 2c4m s ASP 481 Ca 0.16 0.44 0.10 0.00 0.43 0.00 0.00 52.55 53.68 2c4m s ASP 481 Cb 0.13 -2.55 0.85 0.00 -0.30 0.00 0.00 42.92 41.05 2c4m s ASP 481 CO 0.28 -1.43 1.85 0.50 -0.17 0.00 0.00 175.17 176.20 2c4m h LYS 482 N 9.99 0.64 -0.43 4.34 3.64 -1.91 -0.71 116.57 132.13 2c4m h LYS 482 Ca -0.25 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2c4m h LYS 482 Cb 1.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 2c4m h LYS 482 CO 1.14 0.42 0.28 1.03 -2.27 0.00 0.00 179.45 180.05 2c4m h SER 483 N 0.66 0.50 -0.31 4.20 0.87 -1.96 0.30 113.55 117.80 2c4m h SER 483 Ca 0.48 -0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.92 2c4m h SER 483 Cb 0.85 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2c4m h SER 483 CO -0.23 0.37 -0.18 0.58 -0.53 0.00 0.00 176.83 176.83 2c4m h VAL 484 N 0.57 1.29 -0.74 2.23 2.07 -1.53 -2.04 116.25 118.10 2c4m h VAL 484 Ca 0.16 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.37 2c4m h VAL 484 Cb -0.05 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2c4m h VAL 484 CO -0.03 0.42 0.49 -0.07 0.02 0.00 0.00 177.57 178.40 2c4m h LEU 485 N 0.43 0.85 -1.59 2.57 3.38 -0.97 -0.76 115.31 119.22 2c4m h LEU 485 Ca 0.06 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2c4m h LEU 485 Cb 0.72 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2c4m h LEU 485 CO 0.05 0.62 -0.21 -0.08 0.09 0.00 0.00 178.44 178.91 2c4m h GLU 486 N 1.01 0.00 -0.19 1.13 4.57 -0.85 -1.32 114.58 118.93 2c4m h GLU 486 Ca 0.27 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.25 2c4m h GLU 486 Cb -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 2c4m h GLU 486 CO -0.06 0.21 -0.66 0.93 -1.18 0.00 0.00 179.01 178.25 2c4m h GLU 487 N 0.00 0.72 -0.55 1.92 5.08 -0.46 -2.24 114.58 119.05 2c4m h GLU 487 Ca -0.00 -0.53 -0.09 0.00 -1.00 0.00 0.00 59.36 57.75 2c4m h GLU 487 Cb 0.48 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2c4m h GLU 487 CO 0.03 1.15 -0.00 1.25 -1.00 0.00 0.00 179.01 180.43 2c4m h LEU 488 N 0.52 0.92 -0.58 1.33 5.85 -0.41 -1.28 115.31 121.67 2c4m h LEU 488 Ca -0.02 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 2c4m h LEU 488 Cb 1.27 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2c4m h LEU 488 CO 0.13 0.98 0.21 0.03 -0.34 0.00 0.00 178.44 179.45 2c4m h ARG 489 N 0.87 0.88 -0.20 1.25 3.08 -1.17 -1.27 114.38 117.82 2c4m h ARG 489 Ca 0.16 -0.18 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 2c4m h ARG 489 Cb 0.51 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2c4m h ARG 489 CO 0.03 0.78 -0.28 0.00 -1.07 0.00 0.00 179.97 179.42 2c4m h ALA 490 N 1.06 1.15 -0.24 0.04 0.00 -1.08 -0.73 119.26 119.46 2c4m h ALA 490 Ca 0.19 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2c4m h ALA 490 Cb 0.25 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2c4m h ALA 490 CO -0.01 0.54 0.01 0.82 0.00 0.00 0.00 179.25 180.62 2c4m h ILE 491 N 0.34 1.25 -0.56 0.00 2.04 -0.83 -1.65 117.51 118.10 2c4m h ILE 491 Ca 0.05 -0.85 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2c4m h ILE 491 Cb 0.68 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 2c4m h ILE 491 CO 0.05 0.27 0.16 0.50 0.00 0.00 0.00 178.15 179.13 2c4m h LYS 492 N 0.19 0.88 -0.37 2.37 1.63 -1.05 -1.40 116.57 118.81 2c4m h LYS 492 Ca 0.07 -0.20 0.01 0.00 -0.85 0.00 0.00 60.65 59.68 2c4m h LYS 492 Cb 0.38 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 2c4m h LYS 492 CO 0.01 0.81 0.24 0.00 -3.45 0.00 0.00 179.45 177.06 2c4m h ALA 493 N 1.03 0.47 -0.66 5.00 0.00 -1.06 0.16 119.26 124.19 2c4m h ALA 493 Ca 0.18 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2c4m h ALA 493 Cb 0.31 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2c4m h ALA 493 CO -0.00 -0.07 0.16 0.00 0.00 0.00 0.00 179.25 179.33 2c4m h ALA 494 N 1.14 1.03 -0.65 0.00 0.00 -1.15 0.18 119.26 119.81 2c4m h ALA 494 Ca 0.14 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2c4m h ALA 494 Cb -0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 2c4m h ALA 494 CO -0.03 0.64 0.28 -0.91 0.00 0.00 0.00 179.25 179.22 2c4m h ASN 495 N 1.00 0.88 0.37 0.00 2.35 -0.66 -0.96 115.58 118.55 2c4m h ASN 495 Ca 0.21 -0.16 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 2c4m h ASN 495 Cb 0.35 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2c4m h ASN 495 CO 0.00 0.79 -0.44 0.11 -1.65 0.00 0.00 177.43 176.24 2c4m h LYS 496 N 0.91 0.10 -0.49 0.81 1.57 -0.32 -1.51 116.57 117.64 2c4m h LYS 496 Ca 0.22 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 2c4m h LYS 496 Cb 0.17 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2c4m h LYS 496 CO -0.02 0.53 -0.14 0.37 -0.57 0.00 0.00 179.45 179.61 2c4m h GLN 497 N 0.08 0.94 -0.42 3.15 5.75 -0.47 -1.23 115.11 122.92 2c4m h GLN 497 Ca 0.00 -0.36 -0.05 0.00 -0.15 0.00 0.00 58.65 58.10 2c4m h GLN 497 Cb 0.82 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.29 2c4m h GLN 497 CO 0.06 1.02 0.07 -0.44 -2.65 0.00 0.00 178.83 176.89 2c4m h ASP 498 N 0.83 0.66 -0.53 -0.69 5.19 -0.77 -2.67 116.42 118.44 2c4m h ASP 498 Ca 0.13 -0.26 -0.03 0.00 -0.62 0.00 0.00 57.03 56.24 2c4m h ASP 498 Cb 0.69 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.00 2c4m h ASP 498 CO 0.05 0.75 0.22 0.15 -3.12 0.00 0.00 179.24 177.29 2c4m h PHE 499 N 0.55 0.84 -0.88 4.55 3.57 -1.05 -0.41 116.94 124.11 2c4m h PHE 499 Ca 0.13 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2c4m h PHE 499 Cb 0.37 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 2c4m h PHE 499 CO 0.03 0.66 0.46 0.00 -2.23 0.00 0.00 178.31 177.22 2c4m h ALA 500 N 1.42 1.14 -0.26 2.41 0.00 -0.98 0.81 119.26 123.80 2c4m h ALA 500 Ca 0.20 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2c4m h ALA 500 Cb 0.18 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2c4m h ALA 500 CO -0.02 0.67 -0.47 0.93 0.00 0.00 0.00 179.25 180.37 2c4m h GLU 501 N 1.25 0.77 -0.04 0.00 5.08 -1.09 -2.23 114.58 118.32 2c4m h GLU 501 Ca 0.31 -0.49 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 2c4m h GLU 501 Cb 0.07 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2c4m h GLU 501 CO -0.04 1.11 -0.01 2.35 -1.00 0.00 0.00 179.01 181.42 2c4m h TRP 502 N 0.52 -0.02 -0.12 4.33 7.01 -0.54 -1.54 115.95 125.59 2c4m h TRP 502 Ca 0.02 0.00 -0.12 0.00 2.11 0.00 0.00 58.89 60.90 2c4m h TRP 502 Cb 1.07 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 28.13 2c4m h TRP 502 CO 0.08 -0.01 -0.45 0.97 -2.79 0.00 0.00 178.44 176.23 2c4m h ILE 503 N 0.00 1.32 -0.41 2.65 6.09 -0.92 -0.38 117.51 125.87 2c4m h ILE 503 Ca 0.02 -1.63 -0.01 0.00 -1.37 0.00 0.00 64.86 61.87 2c4m h ILE 503 Cb 0.03 1.73 -0.02 0.00 0.47 0.00 0.00 36.82 39.03 2c4m h ILE 503 CO -0.04 0.49 0.21 0.25 -3.07 0.00 0.00 178.15 176.00 2c4m h LEU 504 N 0.24 0.53 -0.20 2.19 5.85 -1.13 0.16 115.31 122.95 2c4m h LEU 504 Ca 0.02 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 2c4m h LEU 504 Cb 0.89 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 2c4m h LEU 504 CO 0.07 0.49 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.13 2c4m h GLU 505 N 0.53 0.49 -0.57 1.25 5.08 -1.15 0.44 114.58 120.65 2c4m h GLU 505 Ca 0.14 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 2c4m h GLU 505 Cb 0.08 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2c4m h GLU 505 CO -0.02 0.83 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.68 2c4m h ARG 506 N 0.17 1.03 0.00 2.33 2.43 -0.92 -3.38 114.38 116.04 2c4m h ARG 506 Ca 0.03 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2c4m h ARG 506 Cb 0.74 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2c4m h ARG 506 CO 0.05 1.04 0.00 1.04 -1.51 0.00 0.00 179.97 180.59 2c4m n GLN 507 N -4.16 0.68 -1.95 0.20 6.02 0.03 -5.03 117.38 113.17 2c4m n GLN 507 Ca 0.02 -0.71 -0.18 0.00 -0.01 0.00 0.00 57.00 56.12 2c4m n GLN 507 Cb 0.37 -0.62 -0.04 0.00 1.02 0.00 0.00 30.24 30.97 2c4m n GLN 507 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2c4m n GLY 508 N -0.12 0.62 3.70 1.08 0.00 0.15 -4.99 105.19 105.65 2c4m n GLY 508 Ca 0.00 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 2c4m n GLY 508 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2c4m s ILE 509 N -2.78 5.00 -0.22 -0.61 2.07 -1.25 -4.98 121.20 118.43 2c4m s ILE 509 Ca 0.00 0.03 -0.14 0.00 -1.41 0.00 0.00 60.65 59.14 2c4m s ILE 509 Cb 0.00 -3.23 -0.04 0.00 0.13 0.00 0.00 42.46 39.32 2c4m s ILE 509 CO 0.00 0.50 0.31 -0.70 -1.91 0.00 0.00 174.94 173.14 2c4m s GLU 510 N -0.01 4.12 0.31 3.50 2.12 -1.26 -3.65 118.70 123.84 2c4m s GLU 510 Ca 0.07 0.02 0.07 0.00 0.36 0.00 0.00 54.97 55.49 2c4m s GLU 510 Cb -0.12 -3.55 -0.06 0.00 0.26 0.00 0.00 34.13 30.66 2c4m s GLU 510 CO 0.01 -0.02 -0.06 0.96 -0.54 0.00 0.00 175.26 175.60 2c4m s ILE 511 N 1.28 1.83 -0.41 -3.70 -4.36 -1.26 -5.11 121.20 109.47 2c4m s ILE 511 Ca 0.14 -2.14 -0.21 0.00 -0.26 0.00 0.00 60.65 58.18 2c4m s ILE 511 Cb -0.14 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 41.02 2c4m s ILE 511 CO 0.07 -0.23 0.69 -0.62 0.24 0.00 0.00 174.94 175.08 2c4m s ASP 512 N -3.51 6.39 0.42 4.36 -1.08 -1.26 -4.93 116.67 117.06 2c4m s ASP 512 Ca 0.31 -0.07 0.26 0.00 -0.52 0.00 0.00 52.55 52.53 2c4m s ASP 512 Cb 0.04 -2.34 1.44 0.00 -1.46 0.00 0.00 42.92 40.59 2c4m s ASP 512 CO 0.14 -0.75 1.80 -0.65 0.52 0.00 0.00 175.17 176.23 2c4m h PRO 513 N 8.74 0.00 0.00 4.34 0.11 -1.97 -1.94 132.00 141.28 2c4m h PRO 513 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2c4m h PRO 513 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2c4m h PRO 513 CO 0.89 0.00 -1.46 0.39 -0.21 0.00 0.00 178.00 177.61 2c4m n GLU 514 N -2.46 0.51 -0.97 1.05 1.02 -1.26 -4.67 120.64 113.87 2c4m n GLU 514 Ca -0.02 -0.06 -0.29 0.00 -0.02 0.00 0.00 57.16 56.78 2c4m n GLU 514 Cb 0.09 -1.61 0.20 0.00 -0.02 0.00 0.00 31.44 30.10 2c4m n GLU 514 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2c4m s SER 515 N -4.48 2.07 -0.03 1.62 1.04 -0.73 -4.94 113.70 108.25 2c4m s SER 515 Ca -0.02 1.29 -0.30 0.00 0.48 0.00 0.00 55.95 57.40 2c4m s SER 515 Cb 0.13 -1.99 -0.03 0.00 0.10 0.00 0.00 66.02 64.22 2c4m s SER 515 CO 0.85 -3.49 1.11 -0.63 0.98 0.00 0.00 173.24 172.06 2c4m s ILE 516 N -2.81 4.46 -0.65 -1.02 1.01 -0.19 -4.83 121.20 117.17 2c4m s ILE 516 Ca 0.66 1.76 -0.20 0.00 0.00 0.00 0.00 60.65 62.87 2c4m s ILE 516 Cb -0.21 -4.13 0.10 0.00 0.01 0.00 0.00 42.46 38.23 2c4m s ILE 516 CO 0.60 0.06 0.83 -0.36 0.00 0.00 0.00 174.94 176.07 2c4m s PHE 517 N 1.63 2.91 -0.44 3.97 0.40 -1.26 -0.68 117.98 124.50 2c4m s PHE 517 Ca 0.54 -0.87 -0.21 0.00 -0.60 0.00 0.00 56.93 55.79 2c4m s PHE 517 Cb -0.24 -4.13 0.03 0.00 0.51 0.00 0.00 43.02 39.19 2c4m s PHE 517 CO 0.24 -1.43 0.66 0.34 0.70 0.00 0.00 175.22 175.73 2c4m s ASP 518 N 3.62 6.33 -0.10 1.36 -1.08 -0.69 -1.45 116.67 124.66 2c4m s ASP 518 Ca 0.17 -0.34 0.03 0.00 -0.52 0.00 0.00 52.55 51.90 2c4m s ASP 518 Cb -0.20 -2.33 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 2c4m s ASP 518 CO 0.06 -0.80 -0.21 -0.69 0.52 0.00 0.00 175.17 174.05 2c4m s VAL 519 N 2.87 1.82 -0.23 1.11 1.01 -0.02 0.21 120.40 127.18 2c4m s VAL 519 Ca 0.23 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2c4m s VAL 519 Cb -0.14 -1.60 0.05 0.00 0.00 0.00 0.00 36.38 34.70 2c4m s VAL 519 CO 0.19 0.51 -0.09 -1.58 0.00 0.00 0.00 175.10 174.13 2c4m s GLN 520 N 0.49 1.98 -0.41 2.72 0.74 -0.39 -0.43 119.66 124.36 2c4m s GLN 520 Ca -0.16 -1.02 0.02 0.00 0.05 0.00 0.00 55.36 54.25 2c4m s GLN 520 Cb -0.17 -2.60 0.12 0.00 1.10 0.00 0.00 33.01 31.47 2c4m s GLN 520 CO 0.06 -0.51 0.19 0.96 -0.55 0.00 0.00 175.29 175.44 2c4m s ILE 521 N 1.32 1.57 0.12 -2.34 -4.36 -1.26 -1.66 121.20 114.58 2c4m s ILE 521 Ca -0.05 -2.40 -0.08 0.00 -0.26 0.00 0.00 60.65 57.87 2c4m s ILE 521 Cb -0.18 -2.12 -0.01 0.00 1.25 0.00 0.00 42.46 41.41 2c4m s ILE 521 CO -0.07 -0.80 0.21 -0.54 0.24 0.00 0.00 174.94 173.98 2c4m s LYS 522 N 0.59 0.96 0.68 0.37 1.02 -1.05 -4.98 119.74 117.33 2c4m s LYS 522 Ca 0.15 -1.07 -0.17 0.00 0.02 0.00 0.00 55.97 54.90 2c4m s LYS 522 Cb -0.23 0.35 0.01 0.00 -0.52 0.00 0.00 37.83 37.44 2c4m s LYS 522 CO -0.06 -0.32 1.25 0.50 -0.92 0.00 0.00 175.35 175.80 2c4m s ARG 523 N -3.91 2.41 -0.36 1.68 6.06 -1.26 -4.24 118.95 119.32 2c4m s ARG 523 Ca 0.11 1.91 -0.24 0.00 -2.50 0.00 0.00 55.73 55.01 2c4m s ARG 523 Cb 0.04 -1.85 0.01 0.00 0.06 0.00 0.00 34.95 33.22 2c4m s ARG 523 CO -0.06 -1.67 0.83 -1.17 -2.50 0.00 0.00 175.30 170.73 2c4m s LEU 524 N -4.68 4.08 0.02 -0.88 0.20 -0.26 -4.91 118.68 112.26 2c4m s LEU 524 Ca 0.79 0.47 0.01 0.00 0.69 0.00 0.00 54.13 56.09 2c4m s LEU 524 Cb -0.33 -3.11 -0.02 0.00 -0.43 0.00 0.00 46.19 42.30 2c4m s LEU 524 CO 0.41 -0.76 -0.04 -1.00 -0.29 0.00 0.00 176.35 174.67 2c4m s HIS 525 N 3.20 0.38 0.39 5.38 3.76 -1.26 -4.65 115.29 122.50 2c4m s HIS 525 Ca 0.34 -0.45 0.08 0.00 -0.15 0.00 0.00 55.06 54.88 2c4m s HIS 525 Cb -0.13 -0.25 0.79 0.00 1.11 0.00 0.00 32.58 34.10 2c4m s HIS 525 CO 0.17 -0.13 1.95 0.93 -0.85 0.00 0.00 174.74 176.81 2c4m h GLU 526 N 4.82 0.34 0.00 1.40 5.08 -1.97 -1.93 114.58 122.32 2c4m h GLU 526 Ca -0.32 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2c4m h GLU 526 Cb 1.21 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2c4m h GLU 526 CO 0.42 0.39 0.00 2.48 -1.00 0.00 0.00 179.01 181.30 2c4m n TYR 527 N -4.33 0.05 0.21 4.33 0.18 -1.26 -1.65 117.16 114.68 2c4m n TYR 527 Ca 0.00 0.02 0.12 0.00 1.88 0.00 0.00 57.90 59.92 2c4m n TYR 527 Cb 0.21 -0.53 0.10 0.00 -0.38 0.00 0.00 39.34 38.75 2c4m n TYR 527 CO 0.00 0.00 0.00 -0.22 -2.08 0.00 0.00 176.86 174.56 2c4m h LYS 528 N 0.00 0.00 -4.80 -3.48 1.63 -1.70 -2.30 116.57 105.92 2c4m h LYS 528 Ca 0.00 0.00 -0.29 0.00 -0.85 0.00 0.00 60.65 59.51 2c4m h LYS 528 Cb 0.41 0.00 0.12 0.00 -0.60 0.00 0.00 32.23 32.16 2c4m h LYS 528 CO 0.00 0.00 -0.55 0.54 -3.45 0.00 0.00 179.45 175.99 2c4m n ARG 529 N -2.82 -5.90 0.28 1.90 1.74 -0.66 -3.91 116.66 107.29 2c4m n ARG 529 Ca 0.02 0.65 0.14 0.00 -0.77 0.00 0.00 57.85 57.90 2c4m n ARG 529 Cb 0.53 -5.14 0.83 0.00 -1.02 0.00 0.00 32.46 27.66 2c4m n ARG 529 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2c4m h GLN 530 N -1.91 0.00 -0.65 5.56 7.50 -1.83 -1.88 115.11 121.89 2c4m h GLN 530 Ca -0.45 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 58.63 2c4m h GLN 530 Cb 1.28 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.78 2c4m h GLN 530 CO 0.42 0.06 0.13 1.25 -1.50 0.00 0.00 178.83 179.20 2c4m h LEU 531 N 0.00 1.01 -0.66 1.46 5.85 -1.90 -0.91 115.31 120.16 2c4m h LEU 531 Ca -0.00 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 2c4m h LEU 531 Cb 0.18 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2c4m h LEU 531 CO 0.01 1.00 0.18 -0.03 -0.34 0.00 0.00 178.44 179.25 2c4m h MET 532 N 0.98 1.05 -0.42 1.25 4.05 -1.72 0.28 114.93 120.40 2c4m h MET 532 Ca 0.20 -0.24 0.01 0.00 -0.28 0.00 0.00 59.70 59.39 2c4m h MET 532 Cb 0.40 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 2c4m h MET 532 CO 0.01 0.93 0.26 -0.97 0.23 0.00 0.00 176.91 177.37 2c4m h ASN 533 N 0.98 0.45 -0.50 1.39 -0.73 -1.32 -1.73 115.58 114.11 2c4m h ASN 533 Ca 0.21 -0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.31 2c4m h ASN 533 Cb 0.34 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.80 2c4m h ASN 533 CO -0.00 0.32 0.11 0.00 -0.37 0.00 0.00 177.43 177.49 2c4m h ALA 534 N 1.17 1.14 -0.56 1.57 0.00 -0.63 -1.98 119.26 119.98 2c4m h ALA 534 Ca 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2c4m h ALA 534 Cb -0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2c4m h ALA 534 CO -0.05 0.57 0.28 -0.07 0.00 0.00 0.00 179.25 179.98 2c4m h LEU 535 N 0.83 0.72 -0.62 0.00 3.38 -0.51 0.48 115.31 119.59 2c4m h LEU 535 Ca 0.18 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.06 2c4m h LEU 535 Cb 0.34 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2c4m h LEU 535 CO 0.00 0.64 0.36 0.22 0.09 0.00 0.00 178.44 179.76 2c4m h TYR 536 N 0.75 0.67 -0.41 1.13 5.03 -0.88 0.20 116.97 123.47 2c4m h TYR 536 Ca 0.19 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.50 2c4m h TYR 536 Cb 0.10 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.15 2c4m h TYR 536 CO -0.01 0.36 0.16 0.28 -1.32 0.00 0.00 178.16 177.64 2c4m h VAL 537 N 0.70 1.20 -0.28 1.81 2.07 -0.91 0.12 116.25 120.96 2c4m h VAL 537 Ca 0.26 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 2c4m h VAL 537 Cb 0.08 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2c4m h VAL 537 CO -0.13 0.22 0.17 0.25 0.02 0.00 0.00 177.57 178.10 2c4m h LEU 538 N 0.52 0.33 0.06 2.57 5.85 -0.35 0.09 115.31 124.38 2c4m h LEU 538 Ca 0.14 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 2c4m h LEU 538 Cb 0.20 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2c4m h LEU 538 CO -0.01 0.29 -0.03 -0.78 -0.34 0.00 0.00 178.44 177.57 2c4m h ASP 539 N 0.35 -0.07 -0.66 1.25 3.58 -0.40 -1.79 116.42 118.68 2c4m h ASP 539 Ca 0.10 0.00 0.12 0.00 0.42 0.00 0.00 57.03 57.67 2c4m h ASP 539 Cb 0.01 0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.04 2c4m h ASP 539 CO -0.02 -0.05 0.44 0.25 -2.88 0.00 0.00 179.24 176.98 2c4m h LEU 540 N -0.08 0.38 -0.89 2.28 5.85 -0.54 0.21 115.31 122.51 2c4m h LEU 540 Ca -0.01 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2c4m h LEU 540 Cb 0.06 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2c4m h LEU 540 CO 0.01 0.22 0.49 0.22 -0.34 0.00 0.00 178.44 179.04 2c4m h TYR 541 N 0.41 1.22 -0.07 1.25 3.20 -0.11 -2.01 116.97 120.86 2c4m h TYR 541 Ca 0.31 -0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.91 2c4m h TYR 541 Cb 0.66 -0.39 0.01 0.00 1.54 0.00 0.00 36.73 38.55 2c4m h TYR 541 CO -0.00 0.85 -0.91 0.74 -1.64 0.00 0.00 178.16 177.19 2c4m h PHE 542 N 1.25 1.04 -0.35 -3.82 0.04 -0.25 0.57 116.94 115.41 2c4m h PHE 542 Ca 0.31 -0.51 0.04 0.00 2.80 0.00 0.00 57.97 60.61 2c4m h PHE 542 Cb 0.03 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.00 2c4m h PHE 542 CO 0.01 1.35 0.14 0.00 -0.60 0.00 0.00 178.31 179.20 2c4m h ARG 543 N 0.46 0.29 -0.37 1.51 3.08 -0.95 0.60 114.38 118.99 2c4m h ARG 543 Ca -0.09 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.77 2c4m h ARG 543 Cb 1.55 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.54 2c4m h ARG 543 CO 0.18 0.19 -0.42 0.82 -1.07 0.00 0.00 179.97 179.67 2c4m h ILE 544 N 0.29 1.27 -0.17 2.04 2.04 -1.41 0.20 117.51 121.78 2c4m h ILE 544 Ca 0.15 -1.60 -0.20 0.00 1.00 0.00 0.00 64.86 64.21 2c4m h ILE 544 Cb 0.11 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 2c4m h ILE 544 CO -0.14 0.53 -0.70 0.50 0.00 0.00 0.00 178.15 178.34 2c4m h LYS 545 N 0.75 0.71 0.00 2.37 3.11 -0.24 -3.36 116.57 119.91 2c4m h LYS 545 Ca 0.05 -0.54 0.00 0.00 -2.81 0.00 0.00 60.65 57.35 2c4m h LYS 545 Cb 1.02 0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.35 2c4m h LYS 545 CO 0.10 1.16 -0.86 0.39 -2.81 0.00 0.00 179.45 177.43 2c4m n GLU 546 N -3.93 1.92 0.00 1.90 1.02 0.20 -4.73 120.64 117.02 2c4m n GLU 546 Ca -0.06 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.23 2c4m n GLU 546 Cb 0.70 -0.93 0.63 0.00 -0.02 0.00 0.00 31.44 31.82 2c4m n GLU 546 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2c4m n ASP 547 N -2.04 0.96 -0.53 1.62 9.92 0.43 -4.93 116.55 121.98 2c4m n ASP 547 Ca 0.00 -1.21 -0.07 0.00 -0.53 0.00 0.00 54.79 52.98 2c4m n ASP 547 Cb 0.43 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.88 2c4m n ASP 547 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2c4m n GLY 548 N 1.16 0.91 3.65 0.44 0.00 0.35 -4.91 105.19 106.79 2c4m n GLY 548 Ca 0.19 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 2c4m n GLY 548 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2c4m s LEU 549 N -1.56 4.19 0.00 0.99 2.96 -0.53 -4.80 118.68 119.94 2c4m s LEU 549 Ca 0.00 2.32 0.00 0.00 -0.22 0.00 0.00 54.13 56.23 2c4m s LEU 549 Cb 0.00 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.16 2c4m s LEU 549 CO 0.00 -1.18 0.00 0.35 -1.32 0.00 0.00 176.35 174.20 2c4m n THR 550 N 5.97 0.00 -2.21 3.68 -2.24 -1.26 -4.48 114.28 113.74 2c4m n THR 550 Ca 0.21 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.56 2c4m n THR 550 Cb 0.43 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 2c4m n THR 550 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2c4m n ASP 551 N -2.21 4.48 -3.70 3.42 2.03 -1.26 -4.82 116.55 114.49 2c4m n ASP 551 Ca 0.00 -2.89 -0.12 0.00 0.52 0.00 0.00 54.79 52.30 2c4m n ASP 551 Cb 0.36 -1.70 -0.07 0.00 -0.72 0.00 0.00 41.12 38.99 2c4m n ASP 551 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2c4m s ILE 552 N 3.67 0.07 0.58 5.18 -4.36 -1.26 -5.02 121.20 120.06 2c4m s ILE 552 Ca 0.50 -0.55 -0.16 0.00 -0.26 0.00 0.00 60.65 60.19 2c4m s ILE 552 Cb 0.08 -0.94 -0.04 0.00 1.25 0.00 0.00 42.46 42.82 2c4m s ILE 552 CO 0.00 -0.30 1.04 -2.16 0.24 0.00 0.00 174.94 173.77 2c4m s PRO 553 N -2.47 3.42 0.45 0.37 0.04 -1.26 -5.01 135.00 130.54 2c4m s PRO 553 Ca -0.05 1.14 -0.22 0.00 0.04 0.00 0.00 61.00 61.91 2c4m s PRO 553 Cb -0.01 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 2c4m s PRO 553 CO -0.03 -0.72 1.06 0.00 0.04 0.00 0.00 177.00 177.35 2c4m s ALA 554 N -2.52 2.97 0.03 8.56 0.00 -1.26 -4.92 121.76 124.62 2c4m s ALA 554 Ca 0.62 0.70 -0.03 0.00 0.00 0.00 0.00 51.96 53.25 2c4m s ALA 554 Cb -0.15 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 2c4m s ALA 554 CO 0.37 -0.33 0.04 -0.98 0.00 0.00 0.00 175.76 174.87 2c4m s ARG 555 N -2.84 0.48 -0.22 0.00 1.70 -0.33 -1.02 118.95 116.71 2c4m s ARG 555 Ca 0.63 -0.71 0.02 0.00 -0.47 0.00 0.00 55.73 55.20 2c4m s ARG 555 Cb -0.21 0.18 0.05 0.00 -0.57 0.00 0.00 34.95 34.40 2c4m s ARG 555 CO 0.25 -0.10 -0.11 0.99 -1.08 0.00 0.00 175.30 175.25 2c4m s THR 556 N -2.18 1.87 -0.19 4.99 2.01 0.14 -2.30 115.64 119.97 2c4m s THR 556 Ca -0.09 -1.26 -0.21 0.00 0.31 0.00 0.00 61.69 60.44 2c4m s THR 556 Cb -0.04 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.50 2c4m s THR 556 CO -0.03 0.11 0.64 -0.69 -0.69 0.00 0.00 174.62 173.96 2c4m s VAL 557 N 1.28 5.01 -0.18 3.82 1.01 -0.08 -1.70 120.40 129.56 2c4m s VAL 557 Ca -0.04 1.22 -0.02 0.00 0.00 0.00 0.00 61.98 63.14 2c4m s VAL 557 Cb -0.18 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 2c4m s VAL 557 CO -0.07 0.11 -0.09 -0.63 0.00 0.00 0.00 175.10 174.42 2c4m s ILE 558 N 1.91 3.16 -0.09 2.22 1.01 0.13 -0.28 121.20 129.27 2c4m s ILE 558 Ca 0.29 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 2c4m s ILE 558 Cb -0.16 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 2c4m s ILE 558 CO 0.11 0.47 0.06 -0.36 0.00 0.00 0.00 174.94 175.21 2c4m s PHE 559 N 1.03 3.33 -0.05 3.97 0.08 0.48 -1.26 117.98 125.56 2c4m s PHE 559 Ca -0.00 0.31 -0.02 0.00 0.12 0.00 0.00 56.93 57.34 2c4m s PHE 559 Cb -0.15 -1.84 0.04 0.00 -0.57 0.00 0.00 43.02 40.50 2c4m s PHE 559 CO -0.01 0.57 0.10 0.20 -0.10 0.00 0.00 175.22 175.98 2c4m s GLY 560 N -1.02 0.09 -0.30 4.36 0.00 -0.67 -0.05 107.32 109.74 2c4m s GLY 560 Ca 0.15 0.41 -0.19 0.00 0.00 0.00 0.00 44.72 45.09 2c4m s GLY 560 CO 0.04 1.20 1.26 0.00 0.00 0.00 0.00 173.10 175.61 2c4m s ALA 561 N 1.71 -2.47 0.18 3.20 0.00 -1.26 -2.51 121.76 120.61 2c4m s ALA 561 Ca -0.02 1.92 0.00 0.00 0.00 0.00 0.00 51.96 53.86 2c4m s ALA 561 Cb -0.12 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 2c4m s ALA 561 CO -0.04 -0.26 0.35 0.15 0.00 0.00 0.00 175.76 175.96 2c4m s LYS 562 N 0.76 3.49 -0.03 0.00 1.02 -1.26 -4.82 119.74 118.90 2c4m s LYS 562 Ca -0.03 -0.43 0.07 0.00 0.02 0.00 0.00 55.97 55.60 2c4m s LYS 562 Cb -0.03 -2.89 -0.02 0.00 -0.52 0.00 0.00 37.83 34.37 2c4m s LYS 562 CO -0.12 0.45 -0.25 0.00 -0.92 0.00 0.00 175.35 174.51 2c4m s ALA 563 N -1.81 2.10 0.26 5.17 0.00 -1.26 -1.10 121.76 125.12 2c4m s ALA 563 Ca 0.37 -1.07 -0.31 0.00 0.00 0.00 0.00 51.96 50.95 2c4m s ALA 563 Cb -0.11 -0.56 -0.13 0.00 0.00 0.00 0.00 23.12 22.32 2c4m s ALA 563 CO 0.29 0.49 1.42 0.00 0.00 0.00 0.00 175.76 177.95 2c4m n ALA 564 N 2.57 1.35 -0.33 0.00 0.00 -1.26 -4.85 120.51 117.99 2c4m n ALA 564 Ca -0.16 0.40 0.16 0.00 0.00 0.00 0.00 53.44 53.84 2c4m n ALA 564 Cb 0.51 -2.30 0.33 0.00 0.00 0.00 0.00 19.45 18.00 2c4m n ALA 564 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2c4m h PRO 565 N 4.04 0.06 -0.17 0.00 0.11 -2.02 -1.49 132.00 132.52 2c4m h PRO 565 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2c4m h PRO 565 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2c4m h PRO 565 CO 0.74 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.98 2c4m n GLY 566 N -1.43 0.97 3.56 -0.55 0.00 -1.26 -4.79 105.19 101.68 2c4m n GLY 566 Ca 0.25 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 2c4m n GLY 566 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2c4m s TYR 567 N -1.79 2.34 0.14 1.61 6.14 -0.56 -4.88 117.35 120.35 2c4m s TYR 567 Ca 0.34 -0.46 -0.25 0.00 0.64 0.00 0.00 57.07 57.34 2c4m s TYR 567 Cb 0.21 -4.52 -0.00 0.00 0.42 0.00 0.00 41.96 38.07 2c4m s TYR 567 CO 0.30 -1.87 1.61 0.28 0.64 0.00 0.00 175.55 176.52 2c4m h VAL 568 N 6.86 0.30 -0.78 3.14 2.07 -1.86 -1.91 116.25 124.07 2c4m h VAL 568 Ca 0.18 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 2c4m h VAL 568 Cb 1.00 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 2c4m h VAL 568 CO 1.37 0.00 0.38 0.03 0.02 0.00 0.00 177.57 179.37 2c4m h ARG 569 N -0.35 1.11 -0.52 1.57 3.08 -1.99 -1.22 114.38 116.08 2c4m h ARG 569 Ca 0.11 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2c4m h ARG 569 Cb 0.52 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2c4m h ARG 569 CO -0.38 0.85 0.29 0.00 -1.07 0.00 0.00 179.97 179.66 2c4m h ALA 570 N 1.31 0.66 0.00 0.04 0.00 -1.83 0.63 119.26 120.07 2c4m h ALA 570 Ca 0.27 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2c4m h ALA 570 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2c4m h ALA 570 CO -0.04 0.17 -0.33 0.87 0.00 0.00 0.00 179.25 179.92 2c4m h LYS 571 N 0.69 0.00 -0.16 0.00 1.57 -1.02 -1.69 116.57 115.95 2c4m h LYS 571 Ca 0.18 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 2c4m h LYS 571 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2c4m h LYS 571 CO -0.03 0.33 -0.59 0.00 -0.57 0.00 0.00 179.45 178.59 2c4m h ALA 572 N 1.67 0.66 -0.39 3.86 0.00 -0.54 -1.79 119.26 122.74 2c4m h ALA 572 Ca -0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 2c4m h ALA 572 Cb 0.77 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2c4m h ALA 572 CO 0.04 0.70 -0.21 0.82 0.00 0.00 0.00 179.25 180.60 2c4m h ILE 573 N 0.40 1.27 -0.42 0.00 2.04 -0.28 0.14 117.51 120.67 2c4m h ILE 573 Ca -0.00 -1.31 -0.06 0.00 1.00 0.00 0.00 64.86 64.48 2c4m h ILE 573 Cb 1.14 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 2c4m h ILE 573 CO 0.11 0.44 0.01 0.40 0.00 0.00 0.00 178.15 179.11 2c4m h ILE 574 N 0.66 1.26 -0.73 -0.67 2.04 -1.20 0.10 117.51 118.97 2c4m h ILE 574 Ca 0.09 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 2c4m h ILE 574 Cb 0.71 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2c4m h ILE 574 CO 0.05 0.34 0.37 0.50 0.00 0.00 0.00 178.15 179.41 2c4m h LYS 575 N 0.57 1.04 -0.09 2.37 1.63 -1.04 -1.43 116.57 119.62 2c4m h LYS 575 Ca 0.12 -0.13 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 2c4m h LYS 575 Cb 0.47 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.90 2c4m h LYS 575 CO 0.02 0.79 0.01 1.25 -3.45 0.00 0.00 179.45 178.07 2c4m h LEU 576 N 1.04 0.14 -0.71 5.20 5.85 -0.46 -0.08 115.31 126.29 2c4m h LEU 576 Ca 0.26 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 58.79 2c4m h LEU 576 Cb 0.08 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.01 2c4m h LEU 576 CO -0.04 0.38 0.37 0.40 -0.34 0.00 0.00 178.44 179.21 2c4m h ILE 577 N -0.11 0.88 -0.35 4.05 2.04 -0.51 0.15 117.51 123.67 2c4m h ILE 577 Ca 0.03 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 2c4m h ILE 577 Cb 0.30 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2c4m h ILE 577 CO 0.00 0.12 -0.08 0.78 0.00 0.00 0.00 178.15 178.97 2c4m h ASN 578 N 0.64 0.55 -0.25 1.72 2.35 -1.05 -0.51 115.58 119.03 2c4m h ASN 578 Ca 0.34 -0.14 -0.15 0.00 -0.55 0.00 0.00 56.30 55.81 2c4m h ASN 578 Cb 0.33 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2c4m h ASN 578 CO -0.25 0.68 -0.41 0.28 -1.65 0.00 0.00 177.43 176.08 2c4m h SER 579 N 0.54 0.80 -0.65 5.81 0.02 0.63 -2.08 113.55 118.62 2c4m h SER 579 Ca 0.10 -0.52 -0.05 0.00 -0.84 0.00 0.00 61.79 60.48 2c4m h SER 579 Cb 0.46 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2c4m h SER 579 CO 0.02 1.17 0.21 0.40 -1.14 0.00 0.00 176.83 177.49 2c4m h ILE 580 N 0.45 1.25 -0.38 3.27 2.04 -0.63 -1.49 117.51 122.01 2c4m h ILE 580 Ca 0.02 -0.84 0.04 0.00 1.00 0.00 0.00 64.86 65.08 2c4m h ILE 580 Cb 1.01 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 2c4m h ILE 580 CO 0.09 0.32 0.16 0.00 0.00 0.00 0.00 178.15 178.73 2c4m h ALA 581 N 1.08 0.46 -0.18 1.87 0.00 -0.99 0.27 119.26 121.78 2c4m h ALA 581 Ca 0.21 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2c4m h ALA 581 Cb 0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2c4m h ALA 581 CO -0.01 -0.22 0.11 -0.44 0.00 0.00 0.00 179.25 178.69 2c4m h ASP 582 N 0.34 0.21 -0.30 0.00 5.19 -1.15 0.27 116.42 120.97 2c4m h ASP 582 Ca 0.17 -0.03 0.03 0.00 -0.62 0.00 0.00 57.03 56.58 2c4m h ASP 582 Cb 0.12 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.55 2c4m h ASP 582 CO -0.15 0.17 0.12 0.25 -3.12 0.00 0.00 179.24 176.52 2c4m h LEU 583 N 0.22 0.16 -0.02 1.55 7.12 -0.69 -2.34 115.31 121.31 2c4m h LEU 583 Ca 0.06 0.02 -0.03 0.00 0.13 0.00 0.00 57.88 58.07 2c4m h LEU 583 Cb -0.00 -0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 2c4m h LEU 583 CO -0.01 0.13 -0.09 0.58 -0.13 0.00 0.00 178.44 178.92 2c4m h VAL 584 N 0.27 1.49 -0.21 1.05 2.07 -0.33 -3.24 116.25 117.34 2c4m h VAL 584 Ca 0.13 -1.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.05 2c4m h VAL 584 Cb 0.08 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 2c4m h VAL 584 CO -0.11 0.42 0.02 0.78 0.02 0.00 0.00 177.57 178.69 2c4m h ASN 585 N -0.51 0.28 -0.02 0.57 2.35 -0.47 -2.88 115.58 114.90 2c4m h ASN 585 Ca -0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2c4m h ASN 585 Cb 0.73 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2c4m h ASN 585 CO 0.02 0.32 -0.00 0.59 -1.65 0.00 0.00 177.43 176.71 2c4m n ASN 586 N -4.38 1.84 -4.46 5.81 3.02 -0.88 -4.72 115.26 111.48 2c4m n ASN 586 Ca 0.00 -1.61 -0.44 0.00 -0.03 0.00 0.00 54.58 52.51 2c4m n ASN 586 Cb 0.18 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.28 2c4m n ASN 586 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2c4m s ASP 587 N -2.00 6.24 0.62 6.41 -1.08 -1.09 -4.92 116.67 120.85 2c4m s ASP 587 Ca 0.36 -0.79 0.28 0.00 -0.52 0.00 0.00 52.55 51.88 2c4m s ASP 587 Cb 0.21 -2.30 1.47 0.00 -1.46 0.00 0.00 42.92 40.84 2c4m s ASP 587 CO 0.33 -0.87 1.87 -0.65 0.52 0.00 0.00 175.17 176.36 2c4m h PRO 588 N 8.97 0.00 -0.01 4.34 0.11 -1.87 0.20 132.00 143.74 2c4m h PRO 588 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2c4m h PRO 588 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2c4m h PRO 588 CO 0.95 0.00 -0.17 0.39 -0.21 0.00 0.00 178.00 178.96 2c4m n GLU 589 N -3.40 0.84 0.00 1.05 1.02 -1.26 -4.43 120.64 114.47 2c4m n GLU 589 Ca 0.05 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.78 2c4m n GLU 589 Cb 0.60 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 2c4m n GLU 589 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2c4m n VAL 590 N -0.72 0.00 -0.29 2.62 0.31 0.45 -4.74 118.33 115.95 2c4m n VAL 590 Ca 0.14 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.57 2c4m n VAL 590 Cb 0.31 -0.33 0.24 0.00 -0.91 0.00 0.00 33.84 33.15 2c4m n VAL 590 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2c4m h SER 591 N 0.00 -0.26 0.00 4.52 4.64 -0.96 0.12 113.55 121.61 2c4m h SER 591 Ca 0.00 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2c4m h SER 591 Cb 0.58 0.36 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2c4m h SER 591 CO 0.00 -0.22 0.05 1.55 -0.87 0.00 0.00 176.83 177.34 2c4m h PRO 592 N 0.11 0.00 0.00 4.77 0.13 -1.83 -2.59 132.00 132.60 2c4m h PRO 592 Ca 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.64 2c4m h PRO 592 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2c4m h PRO 592 CO -0.73 0.00 -0.81 1.28 -0.23 0.00 0.00 178.00 177.51 2c4m n LEU 593 N -2.57 0.06 -3.68 1.56 4.77 0.22 -4.79 117.00 112.57 2c4m n LEU 593 Ca -0.02 -0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 2c4m n LEU 593 Cb 0.10 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.09 2c4m n LEU 593 CO 0.13 0.02 0.13 -0.22 -1.33 0.00 0.00 177.39 176.12 2c4m s LEU 594 N -2.87 -0.29 0.01 2.23 2.96 -0.06 -1.19 118.68 119.47 2c4m s LEU 594 Ca -0.00 1.05 -0.04 0.00 -0.22 0.00 0.00 54.13 54.92 2c4m s LEU 594 Cb 0.03 1.62 -0.01 0.00 0.50 0.00 0.00 46.19 48.32 2c4m s LEU 594 CO 0.16 -0.20 0.06 -0.54 -1.32 0.00 0.00 176.35 174.50 2c4m s LYS 595 N 1.40 0.39 -0.03 1.98 1.02 -0.97 -3.73 119.74 119.80 2c4m s LYS 595 Ca -0.09 -0.48 0.06 0.00 0.02 0.00 0.00 55.97 55.48 2c4m s LYS 595 Cb -0.07 0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.37 2c4m s LYS 595 CO -0.14 -0.08 -0.22 0.08 -0.92 0.00 0.00 175.35 174.07 2c4m s VAL 596 N -1.38 2.42 -0.12 3.17 1.01 -1.26 -0.90 120.40 123.34 2c4m s VAL 596 Ca -0.15 -0.97 -0.00 0.00 0.00 0.00 0.00 61.98 60.86 2c4m s VAL 596 Cb -0.09 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.44 2c4m s VAL 596 CO 0.00 0.58 -0.09 -0.69 0.00 0.00 0.00 175.10 174.90 2c4m s VAL 597 N -0.62 1.14 -0.40 2.92 1.01 0.62 -4.94 120.40 120.13 2c4m s VAL 597 Ca 0.10 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 2c4m s VAL 597 Cb -0.10 -1.13 0.07 0.00 0.00 0.00 0.00 36.38 35.22 2c4m s VAL 597 CO -0.00 0.38 0.23 0.12 0.00 0.00 0.00 175.10 175.83 2c4m s PHE 598 N 1.57 3.32 -0.22 5.22 2.19 -1.26 -0.39 117.98 128.41 2c4m s PHE 598 Ca 0.03 -1.47 -0.29 0.00 0.33 0.00 0.00 56.93 55.54 2c4m s PHE 598 Cb -0.13 -2.80 -0.02 0.00 -1.31 0.00 0.00 43.02 38.77 2c4m s PHE 598 CO -0.08 -0.81 1.41 0.08 1.83 0.00 0.00 175.22 177.65 2c4m s VAL 599 N 1.43 4.01 0.46 3.12 1.01 0.93 -4.96 120.40 126.39 2c4m s VAL 599 Ca 0.02 1.17 -0.23 0.00 0.00 0.00 0.00 61.98 62.94 2c4m s VAL 599 Cb -0.22 -3.93 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 2c4m s VAL 599 CO 0.03 -0.30 1.16 -0.70 0.00 0.00 0.00 175.10 175.29 2c4m s GLU 600 N 4.11 3.78 -1.19 2.72 2.12 -1.26 -3.99 118.70 124.99 2c4m s GLU 600 Ca 0.61 1.75 -0.32 0.00 0.36 0.00 0.00 54.97 57.38 2c4m s GLU 600 Cb -0.22 -2.41 0.03 0.00 0.26 0.00 0.00 34.13 31.80 2c4m s GLU 600 CO 0.23 -0.52 0.71 -1.71 -0.54 0.00 0.00 175.26 173.42 2c4m n ASN 601 N -0.47 -4.42 -4.72 -1.70 5.15 -1.22 -4.83 115.26 103.05 2c4m n ASN 601 Ca 0.07 -1.24 -0.42 0.00 -0.60 0.00 0.00 54.58 52.39 2c4m n ASN 601 Cb 0.48 -2.02 -0.03 0.00 -0.53 0.00 0.00 39.78 37.68 2c4m n ASN 601 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2c4m n TYR 602 N -4.83 2.74 -3.05 1.20 9.36 -1.26 -4.92 117.16 116.40 2c4m n TYR 602 Ca -0.11 0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.20 2c4m n TYR 602 Cb 0.57 -2.65 0.00 0.00 -0.63 0.00 0.00 39.34 36.62 2c4m n TYR 602 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2c4m n ASN 603 N 3.66 0.00 -0.04 2.98 2.85 -1.26 -4.86 115.26 118.59 2c4m n ASN 603 Ca 0.15 -0.89 -0.08 0.00 -0.11 0.00 0.00 54.58 53.64 2c4m n ASN 603 Cb 0.35 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.34 2c4m n ASN 603 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 2c4m h VAL 604 N 0.89 0.77 -0.49 3.44 2.07 -1.96 -0.73 116.25 120.24 2c4m h VAL 604 Ca 0.00 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.40 2c4m h VAL 604 Cb 0.00 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2c4m h VAL 604 CO 0.00 0.00 -0.17 -1.28 0.02 0.00 0.00 177.57 176.14 2c4m h SER 605 N -0.02 1.01 -0.84 0.57 0.87 -1.97 -0.18 113.55 112.99 2c4m h SER 605 Ca 0.10 -0.38 0.06 0.00 -1.23 0.00 0.00 61.79 60.34 2c4m h SER 605 Cb 0.17 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 61.80 2c4m h SER 605 CO -0.22 1.16 0.52 -0.65 -0.53 0.00 0.00 176.83 177.11 2c4m h PRO 606 N 0.85 0.93 -0.88 2.24 0.11 -1.89 -1.72 132.00 131.64 2c4m h PRO 606 Ca 0.12 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.21 2c4m h PRO 606 Cb 0.75 -0.21 -0.05 0.00 0.11 0.00 0.00 31.00 31.60 2c4m h PRO 606 CO 0.06 0.62 0.58 0.00 -0.21 0.00 0.00 178.00 179.05 2c4m h ALA 607 N 1.39 1.47 0.00 -0.75 0.00 -0.45 -0.61 119.26 120.31 2c4m h ALA 607 Ca 0.36 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 2c4m h ALA 607 Cb 0.15 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2c4m h ALA 607 CO -0.17 0.44 -0.16 0.93 0.00 0.00 0.00 179.25 180.29 2c4m h GLU 608 N 1.08 0.00 0.00 0.00 5.08 -0.14 -0.88 114.58 119.71 2c4m h GLU 608 Ca 0.36 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.59 2c4m h GLU 608 Cb 0.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2c4m h GLU 608 CO -0.11 0.16 -1.22 0.45 -1.00 0.00 0.00 179.01 177.28 2c4m h HIS 609 N 0.00 0.00 0.00 4.33 3.86 -0.88 -3.40 115.15 119.06 2c4m h HIS 609 Ca -0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.14 2c4m h HIS 609 Cb 0.35 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 2c4m h HIS 609 CO 0.00 0.45 -0.38 0.82 0.86 0.00 0.00 177.93 179.68 2c4m h ILE 610 N 0.00 1.23 -0.57 2.45 2.04 -0.75 -3.40 117.51 118.51 2c4m h ILE 610 Ca -0.11 -2.06 0.10 0.00 1.00 0.00 0.00 64.86 63.79 2c4m h ILE 610 Cb 1.44 2.46 -0.11 0.00 -0.74 0.00 0.00 36.82 39.87 2c4m h ILE 610 CO 0.04 0.42 -0.32 -0.07 0.00 0.00 0.00 178.15 178.21 2c4m h LEU 611 N -1.00 -1.11 -2.72 1.44 3.38 -1.38 -1.56 115.31 112.35 2c4m h LEU 611 Ca -0.10 0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c4m h LEU 611 Cb 0.93 0.55 -0.00 0.00 0.09 0.00 0.00 40.66 42.24 2c4m h LEU 611 CO -0.06 -0.30 -0.01 -0.65 0.09 0.00 0.00 178.44 177.51 2c4m h PRO 612 N -0.16 0.00 -0.30 1.13 0.11 -1.79 -2.24 132.00 128.74 2c4m h PRO 612 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2c4m h PRO 612 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2c4m h PRO 612 CO -0.66 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 177.14 2c4m n ALA 613 N -2.14 2.40 -1.98 -0.75 0.00 -0.62 -4.73 120.51 112.69 2c4m n ALA 613 Ca -0.03 -0.94 -0.40 0.00 0.00 0.00 0.00 53.44 52.08 2c4m n ALA 613 Cb 0.10 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 18.75 2c4m n ALA 613 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2c4m s SER 614 N -1.38 7.42 -0.24 0.00 1.04 -0.84 -4.66 113.70 115.04 2c4m s SER 614 Ca 0.32 1.68 0.00 0.00 0.48 0.00 0.00 55.95 58.43 2c4m s SER 614 Cb 0.19 -2.51 -0.15 0.00 0.10 0.00 0.00 66.02 63.65 2c4m s SER 614 CO 0.27 0.19 -0.22 0.47 0.98 0.00 0.00 173.24 174.93 2c4m n ASP 615 N 1.65 2.14 -4.20 7.02 8.00 -0.53 -4.06 116.55 126.58 2c4m n ASP 615 Ca -0.05 -0.08 -0.32 0.00 0.71 0.00 0.00 54.79 55.05 2c4m n ASP 615 Cb 0.49 -0.41 -0.16 0.00 -0.02 0.00 0.00 41.12 41.01 2c4m n ASP 615 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2c4m s VAL 616 N -2.47 2.14 -0.40 2.53 1.01 -0.61 -0.62 120.40 121.99 2c4m s VAL 616 Ca -0.32 -0.97 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 2c4m s VAL 616 Cb 0.09 -1.85 0.03 0.00 0.00 0.00 0.00 36.38 34.65 2c4m s VAL 616 CO 0.53 0.55 0.25 -0.55 0.00 0.00 0.00 175.10 175.88 2c4m s SER 617 N 0.64 5.87 -0.43 3.32 0.15 -0.03 -0.84 113.70 122.39 2c4m s SER 617 Ca -0.11 -1.03 -0.24 0.00 0.70 0.00 0.00 55.95 55.27 2c4m s SER 617 Cb -0.16 -2.07 0.02 0.00 -1.71 0.00 0.00 66.02 62.09 2c4m s SER 617 CO 0.02 -0.43 0.86 -1.61 1.20 0.00 0.00 173.24 173.28 2c4m s GLU 618 N 1.59 3.58 -0.54 5.44 0.41 0.42 -0.47 118.70 129.13 2c4m s GLU 618 Ca 0.03 0.17 0.06 0.00 -0.41 0.00 0.00 54.97 54.82 2c4m s GLU 618 Cb -0.20 -3.89 0.22 0.00 -1.78 0.00 0.00 34.13 28.48 2c4m s GLU 618 CO 0.07 -1.09 0.55 1.04 -0.49 0.00 0.00 175.26 175.35 2c4m n GLN 619 N 6.85 1.44 -0.80 1.61 1.13 -0.45 -4.68 117.38 122.47 2c4m n GLN 619 Ca 0.05 -3.95 -0.01 0.00 -1.94 0.00 0.00 57.00 51.14 2c4m n GLN 619 Cb 0.48 -1.86 0.27 0.00 0.11 0.00 0.00 30.24 29.24 2c4m n GLN 619 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2c4m n ILE 620 N 1.61 2.67 -1.52 5.09 -5.35 -1.26 -2.23 119.36 118.37 2c4m n ILE 620 Ca 0.25 -1.96 -0.37 0.00 -0.27 0.00 0.00 62.75 60.41 2c4m n ILE 620 Cb 0.44 -0.32 0.07 0.00 -1.74 0.00 0.00 39.64 38.09 2c4m n ILE 620 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2c4m n SER 621 N -0.49 0.83 -4.69 7.28 7.64 -1.25 -4.73 113.62 118.20 2c4m n SER 621 Ca 0.34 0.74 -0.44 0.00 1.01 0.00 0.00 58.87 60.51 2c4m n SER 621 Cb 1.17 -1.42 -0.04 0.00 -1.01 0.00 0.00 64.21 62.91 2c4m n SER 621 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2c4m n THR 622 N -2.15 0.05 -1.64 0.44 -1.04 -0.86 -4.66 114.28 104.42 2c4m n THR 622 Ca 0.14 -0.01 -0.48 0.00 -2.04 0.00 0.00 64.05 61.66 2c4m n THR 622 Cb 0.49 -1.71 -0.04 0.00 -1.82 0.00 0.00 70.33 67.24 2c4m n THR 622 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2c4m n ALA 623 N 3.55 0.43 -0.13 2.41 0.00 -1.26 -1.68 120.51 123.83 2c4m n ALA 623 Ca 0.16 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.06 2c4m n ALA 623 Cb 0.31 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2c4m n ALA 623 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c4m n GLY 624 N 2.73 0.59 0.04 0.00 0.00 -1.26 -4.63 105.19 102.67 2c4m n GLY 624 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2c4m n GLY 624 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c4m n LYS 625 N -2.00 0.64 -4.01 1.61 4.76 -0.67 -4.90 118.16 113.58 2c4m n LYS 625 Ca 0.00 -0.09 -0.35 0.00 -2.87 0.00 0.00 58.31 54.99 2c4m n LYS 625 Cb 0.00 -1.62 -0.13 0.00 -1.84 0.00 0.00 35.03 31.44 2c4m n LYS 625 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2c4m s GLU 626 N -3.47 3.60 0.05 1.97 0.41 -1.26 -4.97 118.70 115.03 2c4m s GLU 626 Ca -0.06 -0.52 0.08 0.00 -0.41 0.00 0.00 54.97 54.07 2c4m s GLU 626 Cb 0.13 -3.11 -0.22 0.00 -1.78 0.00 0.00 34.13 29.15 2c4m s GLU 626 CO 0.87 -0.03 1.02 0.00 -0.49 0.00 0.00 175.26 176.63 2c4m h ALA 627 N 7.65 0.51 -3.00 5.21 0.00 -1.91 -2.42 119.26 125.29 2c4m h ALA 627 Ca -0.37 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.41 2c4m h ALA 627 Cb 1.18 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2c4m h ALA 627 CO 0.61 1.37 0.00 0.45 0.00 0.00 0.00 179.25 181.68 2c4m n SER 628 N -3.24 0.00 0.00 0.00 2.88 -1.26 -4.57 113.62 107.43 2c4m n SER 628 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2c4m n SER 628 Cb 0.99 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.45 2c4m n SER 628 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2c4m n GLY 629 N 0.67 -0.20 0.17 0.46 0.00 -1.26 -1.87 105.19 103.16 2c4m n GLY 629 Ca 0.00 0.04 0.02 0.00 0.00 0.00 0.00 46.02 46.08 2c4m n GLY 629 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2c4m h THR 630 N 0.00 1.18 -0.26 2.61 1.35 -1.97 -2.50 112.91 113.31 2c4m h THR 630 Ca 0.00 -1.71 -0.04 0.00 -0.55 0.00 0.00 66.41 64.11 2c4m h THR 630 Cb 0.00 1.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2c4m h THR 630 CO 0.00 0.46 0.00 0.77 -0.25 0.00 0.00 175.52 176.51 2c4m h SER 631 N 0.00 0.36 -0.58 5.36 4.64 -1.97 -1.92 113.55 119.44 2c4m h SER 631 Ca -0.00 -0.06 0.12 0.00 -0.47 0.00 0.00 61.79 61.38 2c4m h SER 631 Cb 0.93 -0.09 -0.11 0.00 -0.31 0.00 0.00 62.40 62.82 2c4m h SER 631 CO 0.06 0.42 -0.10 0.78 -0.87 0.00 0.00 176.83 177.13 2c4m h ASN 632 N 0.38 -0.45 -0.57 4.97 4.21 -1.85 -1.69 115.58 120.59 2c4m h ASN 632 Ca 0.09 0.17 -0.07 0.00 1.21 0.00 0.00 56.30 57.69 2c4m h ASN 632 Cb 0.25 0.33 -0.03 0.00 -1.12 0.00 0.00 38.32 37.76 2c4m h ASN 632 CO 0.01 -0.17 0.10 0.24 -1.29 0.00 0.00 177.43 176.32 2c4m h MET 633 N 0.03 0.97 -0.79 0.81 2.86 -1.34 -2.58 114.93 114.90 2c4m h MET 633 Ca 0.29 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 2c4m h MET 633 Cb 0.45 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 2c4m h MET 633 CO -0.57 0.90 0.32 0.87 1.06 0.00 0.00 176.91 179.48 2c4m h LYS 634 N 0.92 1.17 -0.58 1.72 1.57 -0.81 -2.28 116.57 118.28 2c4m h LYS 634 Ca 0.19 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 2c4m h LYS 634 Cb 0.40 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2c4m h LYS 634 CO 0.01 0.95 0.05 0.74 -0.57 0.00 0.00 179.45 180.63 2c4m h PHE 635 N 1.14 1.04 -0.43 -1.35 0.04 -1.13 -3.01 116.94 113.23 2c4m h PHE 635 Ca 0.26 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 2c4m h PHE 635 Cb 0.21 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 2c4m h PHE 635 CO 0.02 0.90 0.24 1.98 -0.60 0.00 0.00 178.31 180.85 2c4m h MET 636 N 0.91 0.60 0.00 1.51 4.05 -1.06 -2.08 114.93 118.86 2c4m h MET 636 Ca 0.18 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 2c4m h MET 636 Cb 0.45 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 2c4m h MET 636 CO 0.02 0.48 0.00 0.52 0.23 0.00 0.00 176.91 178.16 2c4m h MET 637 N 0.56 0.00 -0.44 0.39 2.86 -1.30 -2.94 114.93 114.07 2c4m h MET 637 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2c4m h MET 637 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2c4m h MET 637 CO -0.02 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.04 2c4m n ASN 638 N -3.03 3.69 0.00 1.22 3.02 -0.99 -4.85 115.26 114.31 2c4m n ASN 638 Ca -0.02 -2.33 0.00 0.00 -0.03 0.00 0.00 54.58 52.20 2c4m n ASN 638 Cb 0.14 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.90 2c4m n ASN 638 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c4m n GLY 639 N 0.54 0.43 3.75 7.41 0.00 -1.11 -4.82 105.19 111.39 2c4m n GLY 639 Ca 0.18 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 2c4m n GLY 639 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4m s ALA 640 N -2.00 3.54 -0.04 4.61 0.00 -0.82 -4.78 121.76 122.27 2c4m s ALA 640 Ca 0.00 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.03 2c4m s ALA 640 Cb 0.00 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.33 2c4m s ALA 640 CO 0.00 0.54 0.58 -0.51 0.00 0.00 0.00 175.76 176.37 2c4m s LEU 641 N -0.75 4.36 -0.12 0.00 1.43 0.20 -4.33 118.68 119.48 2c4m s LEU 641 Ca 0.12 1.08 -0.30 0.00 -1.03 0.00 0.00 54.13 54.01 2c4m s LEU 641 Cb -0.12 -2.89 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 2c4m s LEU 641 CO 0.03 0.04 1.18 -0.89 0.23 0.00 0.00 176.35 176.94 2c4m s THR 642 N 0.18 4.38 -0.36 5.49 2.01 -1.26 -0.85 115.64 125.23 2c4m s THR 642 Ca 0.31 1.68 -0.03 0.00 0.31 0.00 0.00 61.69 63.96 2c4m s THR 642 Cb -0.17 -4.08 0.08 0.00 0.01 0.00 0.00 72.50 68.33 2c4m s THR 642 CO 0.16 -0.07 0.11 -0.22 -0.69 0.00 0.00 174.62 173.91 2c4m s LEU 643 N 2.76 4.62 0.00 4.42 2.96 0.38 -1.36 118.68 132.46 2c4m s LEU 643 Ca 0.53 -1.64 -0.09 0.00 -0.22 0.00 0.00 54.13 52.71 2c4m s LEU 643 Cb -0.22 -1.79 0.03 0.00 0.50 0.00 0.00 46.19 44.72 2c4m s LEU 643 CO 0.17 -0.41 0.46 0.61 -1.32 0.00 0.00 176.35 175.86 2c4m n GLY 644 N 4.63 1.18 3.96 7.98 0.00 -0.81 -1.34 105.19 120.78 2c4m n GLY 644 Ca -0.07 -1.07 -0.23 0.00 0.00 0.00 0.00 46.02 44.64 2c4m n GLY 644 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c4m s THR 645 N -2.42 2.41 -1.33 2.61 -4.23 -0.95 -1.07 115.64 110.67 2c4m s THR 645 Ca 0.10 -0.51 -0.13 0.00 -1.18 0.00 0.00 61.69 59.97 2c4m s THR 645 Cb -0.02 -2.90 0.12 0.00 1.34 0.00 0.00 72.50 71.04 2c4m s THR 645 CO 0.04 0.00 1.90 0.23 -0.54 0.00 0.00 174.62 176.25 2c4m n MET 646 N -2.67 3.29 -3.61 3.99 2.81 -1.26 -4.72 117.12 114.95 2c4m n MET 646 Ca 0.10 -3.25 -0.13 0.00 -1.81 0.00 0.00 57.70 52.61 2c4m n MET 646 Cb 0.60 -3.13 -0.07 0.00 -0.71 0.00 0.00 33.22 29.91 2c4m n MET 646 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2c4m s ASP 647 N 2.33 -0.61 0.94 7.83 2.15 -1.26 -4.62 116.67 123.44 2c4m s ASP 647 Ca 0.44 1.08 0.00 0.00 0.43 0.00 0.00 52.55 54.50 2c4m s ASP 647 Cb 0.08 1.06 0.00 0.00 -0.30 0.00 0.00 42.92 43.77 2c4m s ASP 647 CO -0.02 -0.27 0.00 0.61 -0.17 0.00 0.00 175.17 175.32 2c4m n GLY 648 N 2.15 2.24 0.33 2.66 0.00 -0.91 -2.64 105.19 109.02 2c4m n GLY 648 Ca -0.14 -0.47 0.19 0.00 0.00 0.00 0.00 46.02 45.60 2c4m n GLY 648 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4m h ALA 649 N -0.94 1.31 -0.21 4.61 0.00 -1.62 -1.08 119.26 121.33 2c4m h ALA 649 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2c4m h ALA 649 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2c4m h ALA 649 CO 0.00 -0.14 0.00 -0.91 0.00 0.00 0.00 179.25 178.20 2c4m h ASN 650 N 0.00 0.28 -0.13 0.00 4.21 -1.80 -0.31 115.58 117.83 2c4m h ASN 650 Ca 0.02 -0.04 -0.00 0.00 1.21 0.00 0.00 56.30 57.49 2c4m h ASN 650 Cb 0.26 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.38 2c4m h ASN 650 CO -0.00 0.33 0.08 0.58 -1.29 0.00 0.00 177.43 177.13 2c4m h VAL 651 N 0.30 1.06 0.00 2.81 2.07 -1.34 -1.12 116.25 120.04 2c4m h VAL 651 Ca 0.07 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.38 2c4m h VAL 651 Cb 0.20 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 2c4m h VAL 651 CO 0.00 0.05 -0.32 -0.33 0.02 0.00 0.00 177.57 177.00 2c4m h GLU 652 N 0.15 0.00 -0.08 1.57 5.08 -1.57 -0.68 114.58 119.04 2c4m h GLU 652 Ca 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2c4m h GLU 652 Cb 0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2c4m h GLU 652 CO -0.01 0.32 -0.03 0.82 -1.00 0.00 0.00 179.01 179.11 2c4m h ILE 653 N 0.00 1.30 -0.70 3.13 2.04 -0.59 -2.54 117.51 120.15 2c4m h ILE 653 Ca -0.00 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2c4m h ILE 653 Cb 0.81 1.79 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 2c4m h ILE 653 CO 0.04 0.27 0.46 -0.37 0.00 0.00 0.00 178.15 178.55 2c4m h VAL 654 N -0.19 1.18 -0.33 1.67 -1.51 -1.12 0.89 116.25 116.84 2c4m h VAL 654 Ca 0.02 -0.35 0.10 0.00 -1.23 0.00 0.00 66.70 65.24 2c4m h VAL 654 Cb 0.44 0.16 -0.01 0.00 -2.13 0.00 0.00 31.29 29.75 2c4m h VAL 654 CO 0.01 0.18 0.40 -0.78 -1.23 0.00 0.00 177.57 176.15 2c4m h ASP 655 N 0.95 0.00 0.04 4.19 3.58 -1.05 0.37 116.42 124.49 2c4m h ASP 655 Ca 0.26 0.00 -0.38 0.00 0.42 0.00 0.00 57.03 57.33 2c4m h ASP 655 Cb -0.10 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 40.89 2c4m h ASP 655 CO -0.05 0.00 -2.37 -1.20 -2.88 0.00 0.00 179.24 172.74 2c4m n SER 656 N -3.62 1.33 -0.41 2.28 7.64 -0.65 -4.54 113.62 115.66 2c4m n SER 656 Ca 0.05 -0.04 0.07 0.00 1.01 0.00 0.00 58.87 59.97 2c4m n SER 656 Cb 0.56 -0.01 0.02 0.00 -1.01 0.00 0.00 64.21 63.77 2c4m n SER 656 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2c4m n VAL 657 N -3.11 0.00 0.00 0.44 0.24 0.22 -4.96 118.33 111.15 2c4m n VAL 657 Ca -0.39 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.52 2c4m n VAL 657 Cb 1.05 1.21 0.00 0.00 -1.47 0.00 0.00 33.84 34.63 2c4m n VAL 657 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c4m n GLY 658 N 1.03 -2.50 0.25 7.63 0.00 0.13 -4.01 105.19 107.71 2c4m n GLY 658 Ca 0.07 -1.31 0.17 0.00 0.00 0.00 0.00 46.02 44.94 2c4m n GLY 658 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2c4m h GLU 659 N 0.00 0.00 -0.00 1.61 4.57 -1.91 -1.31 114.58 117.53 2c4m h GLU 659 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2c4m h GLU 659 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2c4m h GLU 659 CO 0.00 0.00 -0.27 -0.85 -1.18 0.00 0.00 179.01 176.71 2c4m n GLU 660 N -2.67 0.41 -0.54 1.92 0.00 -1.26 -3.81 120.64 114.69 2c4m n GLU 660 Ca -0.02 -0.20 0.03 0.00 0.00 0.00 0.00 57.16 56.98 2c4m n GLU 660 Cb 0.05 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.20 2c4m n GLU 660 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2c4m n ASN 661 N -1.12 2.50 -3.76 -1.84 3.02 -0.49 -4.99 115.26 108.57 2c4m n ASN 661 Ca 0.10 -3.54 -0.09 0.00 -0.03 0.00 0.00 54.58 51.02 2c4m n ASN 661 Cb 0.32 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 38.91 2c4m n ASN 661 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c4m s ALA 662 N -3.10 -1.10 -0.53 5.41 0.00 -1.25 -4.77 121.76 116.43 2c4m s ALA 662 Ca 0.40 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.19 2c4m s ALA 662 Cb 0.36 0.88 0.14 0.00 0.00 0.00 0.00 23.12 24.50 2c4m s ALA 662 CO 0.00 -0.90 0.31 0.71 0.00 0.00 0.00 175.76 175.87 2c4m s TYR 663 N -3.89 2.85 -0.06 0.00 1.51 -0.47 -4.91 117.35 112.38 2c4m s TYR 663 Ca 0.10 -2.97 -0.19 0.00 -1.01 0.00 0.00 57.07 52.99 2c4m s TYR 663 Cb -0.03 -2.46 -0.05 0.00 -0.11 0.00 0.00 41.96 39.31 2c4m s TYR 663 CO 0.01 -0.71 0.54 0.42 -1.11 0.00 0.00 175.55 174.70 2c4m s ILE 664 N -0.35 5.06 0.30 2.71 -1.09 -1.26 -1.93 121.20 124.63 2c4m s ILE 664 Ca 0.19 1.11 0.04 0.00 -2.23 0.00 0.00 60.65 59.77 2c4m s ILE 664 Cb -0.20 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.77 2c4m s ILE 664 CO -0.04 0.37 0.20 0.72 -1.23 0.00 0.00 174.94 174.96 2c4m s PHE 665 N 0.21 1.58 0.00 3.97 -0.71 -0.24 -4.98 117.98 117.82 2c4m s PHE 665 Ca 0.29 -1.49 0.00 0.00 -1.04 0.00 0.00 56.93 54.69 2c4m s PHE 665 Cb -0.17 -0.75 0.00 0.00 -1.21 0.00 0.00 43.02 40.89 2c4m s PHE 665 CO 0.14 -0.68 0.00 0.41 -1.34 0.00 0.00 175.22 173.75 2c4m n GLY 666 N -0.55 -0.13 3.76 1.99 0.00 -1.26 -4.22 105.19 104.78 2c4m n GLY 666 Ca 0.03 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 2c4m n GLY 666 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4m s ALA 667 N -2.13 2.77 0.46 4.61 0.00 -1.26 -4.91 121.76 121.29 2c4m s ALA 667 Ca 0.00 0.97 -0.03 0.00 0.00 0.00 0.00 51.96 52.89 2c4m s ALA 667 Cb 0.00 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 2c4m s ALA 667 CO 0.00 -0.89 0.72 1.03 0.00 0.00 0.00 175.76 176.62 2c4m s ARG 668 N -3.05 3.41 0.61 0.00 1.81 -1.26 -4.58 118.95 115.89 2c4m s ARG 668 Ca 0.71 -0.04 0.31 0.00 -1.72 0.00 0.00 55.73 54.99 2c4m s ARG 668 Cb -0.29 -2.46 1.71 0.00 -0.45 0.00 0.00 34.95 33.47 2c4m s ARG 668 CO 0.33 -0.18 2.07 -0.24 -0.68 0.00 0.00 175.30 176.61 2c4m h VAL 669 N 0.34 0.32 -0.00 3.52 3.04 -1.83 0.37 116.25 122.00 2c4m h VAL 669 Ca -0.47 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 2c4m h VAL 669 Cb 1.22 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 31.30 2c4m h VAL 669 CO 0.61 0.00 -0.52 -1.84 -1.01 0.00 0.00 177.57 174.81 2c4m n GLU 670 N -3.55 0.16 -0.02 4.17 0.00 -1.26 -4.03 120.64 116.12 2c4m n GLU 670 Ca 0.01 -0.10 -0.11 0.00 0.00 0.00 0.00 57.16 56.96 2c4m n GLU 670 Cb 0.35 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.15 2c4m n GLU 670 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2c4m n GLU 671 N -1.33 0.65 -0.21 3.44 1.02 0.09 -4.42 120.64 119.88 2c4m n GLU 671 Ca 0.07 0.30 -0.00 0.00 -0.02 0.00 0.00 57.16 57.50 2c4m n GLU 671 Cb 0.34 -1.78 0.11 0.00 -0.02 0.00 0.00 31.44 30.08 2c4m n GLU 671 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2c4m h LEU 672 N 0.01 0.33 -2.29 -4.62 3.38 -1.62 -0.72 115.31 109.79 2c4m h LEU 672 Ca -0.31 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2c4m h LEU 672 Cb 2.02 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.78 2c4m h LEU 672 CO 0.08 0.20 0.00 1.55 0.09 0.00 0.00 178.44 180.37 2c4m h PRO 673 N 0.49 0.00 0.21 1.13 0.13 -1.78 0.40 132.00 132.59 2c4m h PRO 673 Ca 0.31 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 65.12 2c4m h PRO 673 Cb 0.33 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.48 2c4m h PRO 673 CO -0.27 0.00 -1.44 0.00 -0.23 0.00 0.00 178.00 176.06 2c4m h ALA 674 N 2.00 -0.05 -0.17 -0.56 0.00 -1.64 -3.25 119.26 115.59 2c4m h ALA 674 Ca 0.00 -0.92 -0.08 0.00 0.00 0.00 0.00 54.91 53.91 2c4m h ALA 674 Cb 0.01 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2c4m h ALA 674 CO -0.00 0.73 -0.26 -0.07 0.00 0.00 0.00 179.25 179.66 2c4m h LEU 675 N 0.02 0.31 -0.58 0.00 3.38 -0.22 -3.03 115.31 115.19 2c4m h LEU 675 Ca -0.27 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.46 2c4m h LEU 675 Cb 2.04 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.70 2c4m h LEU 675 CO 0.22 0.57 -0.52 0.03 0.09 0.00 0.00 178.44 178.83 2c4m h ARG 676 N 0.28 0.51 -0.94 1.13 3.08 -0.35 -2.76 114.38 115.34 2c4m h ARG 676 Ca 0.04 -0.31 0.16 0.00 0.07 0.00 0.00 59.98 59.95 2c4m h ARG 676 Cb 0.61 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.59 2c4m h ARG 676 CO 0.04 0.91 0.53 1.49 -1.07 0.00 0.00 179.97 181.87 2c4m h GLU 677 N 0.40 0.70 -0.10 0.04 4.57 -1.56 -2.46 114.58 116.17 2c4m h GLU 677 Ca 0.01 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.11 2c4m h GLU 677 Cb 1.04 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 2c4m h GLU 677 CO 0.10 0.46 -0.21 -1.13 -1.18 0.00 0.00 179.01 177.05 2c4m n SER 678 N -4.80 2.30 -4.67 1.04 3.41 -1.23 -4.16 113.62 105.52 2c4m n SER 678 Ca 0.20 -3.54 -0.42 0.00 -0.26 0.00 0.00 58.87 54.85 2c4m n SER 678 Cb 0.49 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 2c4m n SER 678 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2c4m s TYR 679 N -3.09 1.79 -0.63 7.33 5.04 -0.95 -4.80 117.35 122.04 2c4m s TYR 679 Ca 0.38 -0.13 0.06 0.00 -2.44 0.00 0.00 57.07 54.94 2c4m s TYR 679 Cb 0.35 -4.13 0.26 0.00 0.35 0.00 0.00 41.96 38.78 2c4m s TYR 679 CO -0.01 -4.87 0.76 1.63 -1.34 0.00 0.00 175.55 171.72 2c4m n LYS 680 N 6.70 2.53 -0.24 4.97 5.02 -1.26 -1.31 118.16 134.57 2c4m n LYS 680 Ca 0.18 -4.64 0.16 0.00 -2.02 0.00 0.00 58.31 51.99 2c4m n LYS 680 Cb 0.40 -2.22 0.46 0.00 -0.02 0.00 0.00 35.03 33.65 2c4m n LYS 680 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2c4m h PRO 681 N 4.07 0.50 -0.05 1.97 0.13 -1.88 0.13 132.00 136.88 2c4m h PRO 681 Ca 0.19 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.22 2c4m h PRO 681 Cb 0.66 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 2c4m h PRO 681 CO 0.82 0.33 -0.30 -0.92 -0.23 0.00 0.00 178.00 177.70 2c4m h TYR 682 N 0.51 0.09 0.02 1.56 3.20 -1.79 -1.27 116.97 119.30 2c4m h TYR 682 Ca 0.44 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.29 2c4m h TYR 682 Cb 0.93 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.18 2c4m h TYR 682 CO -0.00 0.38 -0.01 1.49 -1.64 0.00 0.00 178.16 178.38 2c4m h GLU 683 N 0.08 -0.03 -0.86 1.82 4.57 -1.12 -2.64 114.58 116.38 2c4m h GLU 683 Ca 0.01 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.30 2c4m h GLU 683 Cb 0.58 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.11 2c4m h GLU 683 CO 0.04 0.24 0.56 -0.07 -1.18 0.00 0.00 179.01 178.60 2c4m h LEU 684 N -0.30 0.73 -1.02 1.64 3.38 -1.00 0.17 115.31 118.91 2c4m h LEU 684 Ca -0.00 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2c4m h LEU 684 Cb 0.28 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2c4m h LEU 684 CO 0.01 0.42 0.27 0.22 0.09 0.00 0.00 178.44 179.44 2c4m h TYR 685 N 0.80 0.98 0.00 1.13 3.20 -0.96 -0.15 116.97 121.96 2c4m h TYR 685 Ca 0.41 -0.06 -0.20 0.00 3.14 0.00 0.00 58.73 62.02 2c4m h TYR 685 Cb 0.49 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 2c4m h TYR 685 CO -0.00 0.75 -1.59 0.39 -1.64 0.00 0.00 178.16 176.06 2c4m n GLU 686 N -4.31 0.63 -0.13 1.82 1.02 -0.68 -2.03 120.64 116.97 2c4m n GLU 686 Ca 0.06 0.19 -0.26 0.00 -0.02 0.00 0.00 57.16 57.13 2c4m n GLU 686 Cb 0.17 -1.76 -0.11 0.00 -0.02 0.00 0.00 31.44 29.72 2c4m n GLU 686 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2c4m n THR 687 N -2.87 1.52 -1.66 2.62 -2.24 0.52 -4.88 114.28 107.29 2c4m n THR 687 Ca -0.13 -0.44 -0.49 0.00 -2.27 0.00 0.00 64.05 60.72 2c4m n THR 687 Cb 0.89 -1.73 -0.05 0.00 -2.10 0.00 0.00 70.33 67.35 2c4m n THR 687 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2c4m n VAL 688 N -3.91 0.53 -1.51 2.28 0.31 -0.08 -4.75 118.33 111.20 2c4m n VAL 688 Ca -0.51 -0.13 -0.55 0.00 -0.01 0.00 0.00 64.34 63.14 2c4m n VAL 688 Cb 0.92 -1.86 -0.08 0.00 -0.91 0.00 0.00 33.84 31.91 2c4m n VAL 688 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2c4m n PRO 689 N 6.84 0.93 0.00 5.55 -0.02 -1.26 -0.95 135.00 146.08 2c4m n PRO 689 Ca 0.25 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2c4m n PRO 689 Cb 0.29 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2c4m n PRO 689 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c4m n GLY 690 N 5.86 3.30 0.19 -1.23 0.00 -1.26 -4.92 105.19 107.14 2c4m n GLY 690 Ca 0.38 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.29 2c4m n GLY 690 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c4m h LEU 691 N 0.00 -0.41 -1.23 0.99 5.85 -1.33 -1.72 115.31 117.46 2c4m h LEU 691 Ca 0.00 0.06 0.19 0.00 0.84 0.00 0.00 57.88 58.97 2c4m h LEU 691 Cb 0.00 0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.12 2c4m h LEU 691 CO 0.00 -0.20 0.61 0.50 -0.34 0.00 0.00 178.44 179.01 2c4m h LYS 692 N -0.23 0.61 -0.41 1.25 3.64 -1.59 0.13 116.57 119.96 2c4m h LYS 692 Ca 0.05 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 2c4m h LYS 692 Cb 0.30 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2c4m h LYS 692 CO -0.14 0.40 0.11 -0.09 -2.27 0.00 0.00 179.45 177.46 2c4m h ARG 693 N 0.63 0.65 0.17 1.90 2.43 -1.65 -1.58 114.38 116.92 2c4m h ARG 693 Ca 0.52 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.53 2c4m h ARG 693 Cb 0.99 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2c4m h ARG 693 CO -0.28 0.67 -0.08 0.00 -1.51 0.00 0.00 179.97 178.77 2c4m h ALA 694 N 0.96 -0.22 0.00 2.80 0.00 0.00 -2.82 119.26 119.98 2c4m h ALA 694 Ca 0.13 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2c4m h ALA 694 Cb 0.30 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2c4m h ALA 694 CO 0.00 -0.47 -0.22 -0.07 0.00 0.00 0.00 179.25 178.49 2c4m h LEU 695 N -0.54 0.00 -0.36 0.00 3.38 -1.08 -2.67 115.31 114.04 2c4m h LEU 695 Ca -0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 2c4m h LEU 695 Cb 0.41 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2c4m h LEU 695 CO 0.04 0.22 -0.59 0.44 0.09 0.00 0.00 178.44 178.64 2c4m h ASP 696 N 0.00 0.00 -0.04 -0.43 3.32 -1.28 -2.97 116.42 115.03 2c4m h ASP 696 Ca -0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 2c4m h ASP 696 Cb 0.48 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 2c4m h ASP 696 CO 0.03 0.59 0.05 0.00 -1.72 0.00 0.00 179.24 178.19 2c4m h ALA 697 N 1.41 1.55 -0.43 3.45 0.00 -1.20 -0.70 119.26 123.33 2c4m h ALA 697 Ca -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2c4m h ALA 697 Cb 1.30 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2c4m h ALA 697 CO 0.08 -0.07 0.22 -0.07 0.00 0.00 0.00 179.25 179.41 2c4m h LEU 698 N 0.00 0.55 -3.02 0.00 4.07 -1.61 -3.03 115.31 112.28 2c4m h LEU 698 Ca 0.02 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.87 2c4m h LEU 698 Cb 0.11 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.71 2c4m h LEU 698 CO -0.00 0.51 0.00 -0.90 -1.08 0.00 0.00 178.44 176.97 2c4m n ASP 699 N -4.69 2.40 -0.89 -0.43 5.75 -0.74 -4.53 116.55 113.42 2c4m n ASP 699 Ca 0.01 -2.74 0.08 0.00 -0.01 0.00 0.00 54.79 52.13 2c4m n ASP 699 Cb 0.10 -0.31 0.20 0.00 -1.03 0.00 0.00 41.12 40.07 2c4m n ASP 699 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2c4m n ASN 700 N -1.03 3.19 0.00 -1.12 0.23 -0.34 -4.96 115.26 111.22 2c4m n ASN 700 Ca 0.12 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.22 2c4m n ASN 700 Cb 0.54 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 2c4m n ASN 700 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2c4m n GLY 701 N 0.97 0.31 0.21 4.83 0.00 -1.26 -4.96 105.19 105.28 2c4m n GLY 701 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2c4m n GLY 701 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c4m h THR 702 N 0.00 1.31 -3.49 2.61 2.02 -1.89 -3.43 112.91 110.03 2c4m h THR 702 Ca 0.00 -1.54 -0.68 0.00 0.77 0.00 0.00 66.41 64.96 2c4m h THR 702 Cb 0.00 1.68 -0.18 0.00 -1.74 0.00 0.00 68.15 67.91 2c4m h THR 702 CO 0.00 0.49 -0.66 -0.76 0.37 0.00 0.00 175.52 174.96 2c4m s LEU 703 N -8.89 3.35 -0.35 2.58 1.43 -1.15 -5.02 118.68 110.64 2c4m s LEU 703 Ca -0.12 0.04 -0.13 0.00 -1.03 0.00 0.00 54.13 52.89 2c4m s LEU 703 Cb 0.08 -1.75 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 2c4m s LEU 703 CO 0.84 0.35 0.24 0.21 0.23 0.00 0.00 176.35 178.22 2c4m s ASN 704 N -0.73 6.03 -0.21 2.29 3.84 -1.26 -4.89 114.94 120.01 2c4m s ASN 704 Ca 0.11 -0.49 0.15 0.00 0.21 0.00 0.00 52.86 52.84 2c4m s ASN 704 Cb -0.11 -2.13 0.63 0.00 -0.55 0.00 0.00 41.25 39.09 2c4m s ASN 704 CO 0.02 -0.26 1.55 -0.90 -2.79 0.00 0.00 177.10 174.72 2c4m n ASP 705 N 5.10 4.42 -3.27 -4.21 5.75 -1.26 -4.90 116.55 118.18 2c4m n ASP 705 Ca -0.12 -3.05 -0.20 0.00 -0.01 0.00 0.00 54.79 51.40 2c4m n ASP 705 Cb 0.49 -0.61 0.08 0.00 -1.03 0.00 0.00 41.12 40.05 2c4m n ASP 705 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2c4m n ASN 706 N -0.20 -4.78 -4.01 -1.12 4.05 -1.26 -2.50 115.26 105.44 2c4m n ASN 706 Ca 0.25 -0.51 -0.33 0.00 0.45 0.00 0.00 54.58 54.44 2c4m n ASN 706 Cb 1.03 -4.64 -0.02 0.00 1.23 0.00 0.00 39.78 37.39 2c4m n ASN 706 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2c4m n ASN 707 N -2.70 -3.54 0.02 1.20 4.05 -1.26 -4.83 115.26 108.21 2c4m n ASN 707 Ca -0.07 -0.85 0.09 0.00 0.45 0.00 0.00 54.58 54.19 2c4m n ASN 707 Cb 0.58 -2.90 -0.11 0.00 1.23 0.00 0.00 39.78 38.59 2c4m n ASN 707 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2c4m n SER 708 N -2.58 0.33 0.00 1.20 3.41 -1.04 -4.97 113.62 109.96 2c4m n SER 708 Ca 0.06 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2c4m n SER 708 Cb 0.50 1.30 0.00 0.00 -0.26 0.00 0.00 64.21 65.75 2c4m n SER 708 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c4m n GLY 709 N 1.29 0.54 0.20 5.00 0.00 -1.26 -4.93 105.19 106.02 2c4m n GLY 709 Ca -0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 2c4m n GLY 709 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2c4m h LEU 710 N 0.00 0.68 -0.67 0.99 3.38 -1.93 -2.25 115.31 115.50 2c4m h LEU 710 Ca 0.00 -0.49 -0.10 0.00 0.09 0.00 0.00 57.88 57.38 2c4m h LEU 710 Cb 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2c4m h LEU 710 CO 0.00 1.03 -0.09 -0.26 0.09 0.00 0.00 178.44 179.21 2c4m h PHE 711 N 0.34 1.04 -0.86 1.13 0.04 -1.92 -0.95 116.94 115.76 2c4m h PHE 711 Ca 0.03 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.59 2c4m h PHE 711 Cb 0.85 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 38.70 2c4m h PHE 711 CO 0.08 0.97 0.49 -0.92 -0.60 0.00 0.00 178.31 178.33 2c4m h TYR 712 N 0.85 1.17 -0.42 -0.55 5.03 -1.79 0.93 116.97 122.19 2c4m h TYR 712 Ca 0.14 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 2c4m h TYR 712 Cb 0.62 -0.38 -0.02 0.00 1.55 0.00 0.00 36.73 38.51 2c4m h TYR 712 CO 0.04 0.80 0.16 0.22 -1.32 0.00 0.00 178.16 178.06 2c4m h ASP 713 N 1.20 0.57 -0.19 -2.11 3.58 -0.90 -1.91 116.42 116.66 2c4m h ASP 713 Ca 0.31 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 2c4m h ASP 713 Cb 0.00 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.89 2c4m h ASP 713 CO -0.05 0.59 0.07 -0.07 -2.88 0.00 0.00 179.24 176.89 2c4m h LEU 714 N 0.53 0.28 -0.52 2.28 3.38 -0.74 -1.13 115.31 119.39 2c4m h LEU 714 Ca 0.14 -0.18 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2c4m h LEU 714 Cb 0.19 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.78 2c4m h LEU 714 CO -0.01 0.38 -0.02 0.50 0.09 0.00 0.00 178.44 179.38 2c4m h LYS 715 N 0.15 0.09 0.00 1.13 3.64 -0.65 -1.06 116.57 119.88 2c4m h LYS 715 Ca 0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2c4m h LYS 715 Cb 0.20 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2c4m h LYS 715 CO -0.00 0.06 0.00 0.45 -2.27 0.00 0.00 179.45 177.69 2c4m h HIS 716 N 0.10 0.00 0.00 1.91 3.86 -1.18 -2.24 115.15 117.59 2c4m h HIS 716 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2c4m h HIS 716 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2c4m h HIS 716 CO -0.34 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 177.32 2c4m n SER 717 N -2.83 0.00 -0.06 2.45 3.41 -0.41 -1.80 113.62 114.38 2c4m n SER 717 Ca 0.03 0.32 -0.10 0.00 -0.26 0.00 0.00 58.87 58.87 2c4m n SER 717 Cb 0.41 -0.42 -0.05 0.00 -0.26 0.00 0.00 64.21 63.89 2c4m n SER 717 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2c4m n LEU 718 N -1.42 2.08 -0.20 1.04 4.77 -1.03 -1.95 117.00 120.28 2c4m n LEU 718 Ca 0.06 0.03 0.13 0.00 -0.03 0.00 0.00 56.01 56.20 2c4m n LEU 718 Cb 0.19 -0.37 0.39 0.00 -2.33 0.00 0.00 43.42 41.30 2c4m n LEU 718 CO 0.16 0.50 0.66 2.30 -1.33 0.00 0.00 177.39 179.68 2c4m n ILE 719 N -3.12 0.00 -3.18 -0.08 -5.35 -0.87 -4.18 119.36 102.57 2c4m n ILE 719 Ca -0.21 -0.11 -0.38 0.00 -0.27 0.00 0.00 62.75 61.78 2c4m n ILE 719 Cb 0.69 0.32 -0.06 0.00 -1.74 0.00 0.00 39.64 38.85 2c4m n ILE 719 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 2c4m s HIS 720 N -2.55 3.76 0.00 4.28 2.46 -0.74 -3.88 115.29 118.62 2c4m s HIS 720 Ca 0.23 1.35 0.00 0.00 0.47 0.00 0.00 55.06 57.11 2c4m s HIS 720 Cb 0.19 -2.57 0.00 0.00 -0.13 0.00 0.00 32.58 30.07 2c4m s HIS 720 CO 0.53 0.48 0.00 0.41 -2.47 0.00 0.00 174.74 173.70 2c4m n GLY 721 N 1.30 -1.90 3.65 1.59 0.00 -1.26 -1.48 105.19 107.08 2c4m n GLY 721 Ca -0.07 -1.63 -0.02 0.00 0.00 0.00 0.00 46.02 44.30 2c4m n GLY 721 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2c4m s TYR 722 N 0.00 -0.12 0.00 1.61 -0.85 -1.26 -4.51 117.35 112.22 2c4m s TYR 722 Ca 0.00 -0.05 0.00 0.00 -0.52 0.00 0.00 57.07 56.50 2c4m s TYR 722 Cb 0.00 0.57 0.00 0.00 0.38 0.00 0.00 41.96 42.91 2c4m s TYR 722 CO 0.00 -0.48 0.00 0.41 -1.52 0.00 0.00 175.55 173.96 2c4m n GLY 723 N -0.40 -0.90 0.06 5.49 0.00 -0.43 -2.54 105.19 106.47 2c4m n GLY 723 Ca -0.06 -1.11 0.04 0.00 0.00 0.00 0.00 46.02 44.88 2c4m n GLY 723 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2c4m n LYS 724 N -0.77 0.05 -0.25 1.61 4.81 -1.09 -1.88 118.16 120.65 2c4m n LYS 724 Ca 0.00 0.55 0.09 0.00 -0.87 0.00 0.00 58.31 58.08 2c4m n LYS 724 Cb 0.00 -1.68 0.16 0.00 0.02 0.00 0.00 35.03 33.53 2c4m n LYS 724 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2c4m n ASP 725 N -1.79 2.15 -4.73 3.14 8.00 -1.23 -5.03 116.55 117.06 2c4m n ASP 725 Ca -0.01 -3.36 -0.35 0.00 0.71 0.00 0.00 54.79 51.78 2c4m n ASP 725 Cb 0.02 -0.46 0.07 0.00 -0.02 0.00 0.00 41.12 40.73 2c4m n ASP 725 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c4m s ALA 726 N -3.00 2.29 0.42 2.24 0.00 -0.79 -4.66 121.76 118.26 2c4m s ALA 726 Ca 0.34 1.02 0.11 0.00 0.00 0.00 0.00 51.96 53.43 2c4m s ALA 726 Cb 0.31 -3.50 0.92 0.00 0.00 0.00 0.00 23.12 20.85 2c4m s ALA 726 CO -0.00 -1.65 2.00 0.77 0.00 0.00 0.00 175.76 176.88 2c4m h SER 727 N 0.22 0.22 0.00 0.00 0.02 -1.50 -3.31 113.55 109.19 2c4m h SER 727 Ca -0.49 -0.03 -0.64 0.00 -0.84 0.00 0.00 61.79 59.79 2c4m h SER 727 Cb 1.31 -0.06 0.02 0.00 0.14 0.00 0.00 62.40 63.82 2c4m h SER 727 CO 0.52 0.28 2.61 -0.67 -1.14 0.00 0.00 176.83 178.43 2c4m n ASP 728 N -4.38 3.37 -0.34 3.07 2.03 -0.82 -4.72 116.55 114.76 2c4m n ASP 728 Ca -0.00 -2.68 0.18 0.00 0.52 0.00 0.00 54.79 52.81 2c4m n ASP 728 Cb 0.18 -1.27 0.40 0.00 -0.72 0.00 0.00 41.12 39.72 2c4m n ASP 728 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2c4m h THR 729 N 4.18 0.56 -0.59 5.18 2.02 -1.81 -2.66 112.91 119.79 2c4m h THR 729 Ca 0.49 -0.20 -0.22 0.00 0.77 0.00 0.00 66.41 67.25 2c4m h THR 729 Cb 0.59 -0.06 -0.13 0.00 -1.74 0.00 0.00 68.15 66.81 2c4m h THR 729 CO 1.88 0.10 0.19 -1.22 0.37 0.00 0.00 175.52 176.85 2c4m n TYR 730 N -4.81 1.91 -3.83 3.16 4.01 -1.26 -4.95 117.16 111.39 2c4m n TYR 730 Ca 0.26 -1.37 -0.27 0.00 -0.16 0.00 0.00 57.90 56.37 2c4m n TYR 730 Cb 0.75 -0.61 0.03 0.00 -0.31 0.00 0.00 39.34 39.19 2c4m n TYR 730 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 2c4m n TYR 731 N -0.66 -2.16 -0.05 -0.72 9.36 -1.00 -4.71 117.16 117.21 2c4m n TYR 731 Ca 0.39 0.88 -0.12 0.00 3.32 0.00 0.00 57.90 62.36 2c4m n TYR 731 Cb 1.25 -4.14 -0.07 0.00 -0.63 0.00 0.00 39.34 35.75 2c4m n TYR 731 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2c4m h VAL 732 N -2.02 1.30 0.00 2.97 2.07 -1.93 -2.34 116.25 116.30 2c4m h VAL 732 Ca -0.59 -1.05 -0.14 0.00 0.82 0.00 0.00 66.70 65.74 2c4m h VAL 732 Cb 1.37 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 2c4m h VAL 732 CO 0.63 0.31 -0.66 -0.07 0.02 0.00 0.00 177.57 177.80 2c4m h LEU 733 N -0.02 0.00 -0.32 2.57 -0.00 -1.91 -2.34 115.31 113.29 2c4m h LEU 733 Ca 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.88 2c4m h LEU 733 Cb 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.15 2c4m h LEU 733 CO 0.02 0.66 0.08 1.23 -0.00 0.00 0.00 178.44 180.42 2c4m h GLY 734 N 2.00 0.55 1.32 0.83 0.00 -1.92 -3.14 103.07 102.70 2c4m h GLY 734 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2c4m h GLY 734 CO 0.09 0.32 -0.45 1.22 0.00 0.00 0.00 176.54 177.72 2c4m n ASP 735 N -4.65 0.59 -0.34 0.19 8.00 -0.89 -4.35 116.55 115.11 2c4m n ASP 735 Ca -0.02 0.13 0.13 0.00 0.71 0.00 0.00 54.79 55.74 2c4m n ASP 735 Cb 0.19 -0.01 0.32 0.00 -0.02 0.00 0.00 41.12 41.60 2c4m n ASP 735 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 2c4m h PHE 736 N 0.00 1.02 -0.19 1.24 3.57 -1.36 0.19 116.94 121.40 2c4m h PHE 736 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2c4m h PHE 736 Cb 0.66 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2c4m h PHE 736 CO 0.00 0.19 0.02 0.00 -2.23 0.00 0.00 178.31 176.29 2c4m h ALA 737 N 1.65 0.25 -0.02 2.41 0.00 -1.76 -0.88 119.26 120.92 2c4m h ALA 737 Ca 0.58 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.18 2c4m h ALA 737 Cb 0.94 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2c4m h ALA 737 CO -0.40 -0.05 -0.55 0.22 0.00 0.00 0.00 179.25 178.46 2c4m h ASP 738 N 0.10 0.06 0.01 0.00 3.58 -1.71 -2.16 116.42 116.30 2c4m h ASP 738 Ca 0.06 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 2c4m h ASP 738 Cb 0.35 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.38 2c4m h ASP 738 CO 0.01 0.60 -0.00 0.22 -2.88 0.00 0.00 179.24 177.18 2c4m h TYR 739 N 0.04 -0.01 -0.26 0.28 3.20 -0.47 -1.69 116.97 118.07 2c4m h TYR 739 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2c4m h TYR 739 Cb 0.99 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 2c4m h TYR 739 CO 0.00 0.32 0.13 -0.09 -1.64 0.00 0.00 178.16 176.88 2c4m h ARG 740 N -0.34 0.36 -0.00 1.82 2.43 -1.14 -0.09 114.38 117.42 2c4m h ARG 740 Ca -0.00 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2c4m h ARG 740 Cb 0.33 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 2c4m h ARG 740 CO 0.00 0.34 -0.53 1.49 -1.51 0.00 0.00 179.97 179.76 2c4m h GLU 741 N 0.29 -0.64 -0.55 0.20 4.22 -1.37 0.12 114.58 116.86 2c4m h GLU 741 Ca 0.09 0.04 0.03 0.00 0.08 0.00 0.00 59.36 59.61 2c4m h GLU 741 Cb 0.08 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2c4m h GLU 741 CO -0.01 -0.43 0.31 1.15 -2.18 0.00 0.00 179.01 177.85 2c4m h THR 742 N -0.67 1.02 -0.70 0.32 2.02 -1.19 -2.07 112.91 111.64 2c4m h THR 742 Ca 0.02 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2c4m h THR 742 Cb 0.72 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.45 2c4m h THR 742 CO -0.36 0.11 0.34 -0.09 0.37 0.00 0.00 175.52 175.90 2c4m h ARG 743 N 0.61 1.00 -0.72 6.66 2.43 -0.60 -1.49 114.38 122.28 2c4m h ARG 743 Ca 0.23 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2c4m h ARG 743 Cb 0.07 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 2c4m h ARG 743 CO -0.12 0.79 0.42 -0.44 -1.51 0.00 0.00 179.97 179.11 2c4m h ASP 744 N 0.97 0.87 0.76 -3.80 3.32 -0.37 -2.11 116.42 116.06 2c4m h ASP 744 Ca 0.24 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2c4m h ASP 744 Cb 0.11 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.44 2c4m h ASP 744 CO -0.03 0.69 -0.36 0.03 -1.72 0.00 0.00 179.24 177.84 2c4m h ARG 745 N 0.98 -0.98 -0.99 3.56 3.08 -1.09 -0.56 114.38 118.38 2c4m h ARG 745 Ca 0.26 0.07 0.36 0.00 0.07 0.00 0.00 59.98 60.73 2c4m h ARG 745 Cb -0.02 0.22 -0.17 0.00 0.08 0.00 0.00 29.97 30.09 2c4m h ARG 745 CO -0.05 -0.65 0.49 1.98 -1.07 0.00 0.00 179.97 180.68 2c4m h MET 746 N -1.04 0.13 0.14 0.04 4.05 -1.11 0.55 114.93 117.70 2c4m h MET 746 Ca -0.10 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.30 2c4m h MET 746 Cb 0.78 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 2c4m h MET 746 CO 0.17 0.09 -0.07 0.00 0.23 0.00 0.00 176.91 177.33 2c4m h ALA 747 N 1.93 -0.19 -0.68 0.39 0.00 -1.04 -2.34 119.26 117.32 2c4m h ALA 747 Ca 0.77 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.57 2c4m h ALA 747 Cb 1.89 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 19.66 2c4m h ALA 747 CO -0.71 -0.30 0.21 0.00 0.00 0.00 0.00 179.25 178.44 2c4m h ALA 748 N -0.17 0.89 -0.06 0.00 0.00 0.10 -0.61 119.26 119.42 2c4m h ALA 748 Ca -0.02 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2c4m h ALA 748 Cb 0.54 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2c4m h ALA 748 CO 0.03 -0.27 -0.08 -0.44 0.00 0.00 0.00 179.25 178.49 2c4m h ASP 749 N 0.34 -0.24 -0.89 0.00 5.19 -0.14 -0.41 116.42 120.28 2c4m h ASP 749 Ca 0.37 0.04 0.23 0.00 -0.62 0.00 0.00 57.03 57.06 2c4m h ASP 749 Cb 0.57 0.11 -0.16 0.00 0.18 0.00 0.00 39.33 40.04 2c4m h ASP 749 CO -0.42 -0.11 0.09 0.22 -3.12 0.00 0.00 179.24 175.90 2c4m h TYR 750 N -0.11 0.08 0.00 4.55 3.20 -0.54 0.33 116.97 124.47 2c4m h TYR 750 Ca 0.05 0.06 -0.20 0.00 3.14 0.00 0.00 58.73 61.78 2c4m h TYR 750 Cb 0.18 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.53 2c4m h TYR 750 CO -0.17 -0.31 -1.22 0.00 -1.64 0.00 0.00 178.16 174.82 2c4m h ALA 751 N 1.84 0.61 0.00 1.82 0.00 -1.17 -3.31 119.26 119.06 2c4m h ALA 751 Ca 0.53 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2c4m h ALA 751 Cb 1.06 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2c4m h ALA 751 CO -0.77 1.14 -0.90 0.66 0.00 0.00 0.00 179.25 179.38 2c4m h SER 752 N 0.00 0.00 -2.01 0.00 4.64 -0.12 -3.41 113.55 112.66 2c4m h SER 752 Ca -0.13 -0.06 -0.53 0.00 -0.47 0.00 0.00 61.79 60.60 2c4m h SER 752 Cb 1.72 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 63.41 2c4m h SER 752 CO 0.08 0.03 -1.13 -0.67 -0.87 0.00 0.00 176.83 174.27 2c4m n ASP 753 N -2.55 0.49 -0.23 4.97 2.03 0.11 -4.98 116.55 116.38 2c4m n ASP 753 Ca 0.01 -2.82 0.04 0.00 0.52 0.00 0.00 54.79 52.54 2c4m n ASP 753 Cb 0.52 -0.63 0.16 0.00 -0.72 0.00 0.00 41.12 40.45 2c4m n ASP 753 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2c4m h PRO 754 N 3.65 0.24 -0.11 -0.67 0.11 -1.76 0.34 132.00 133.80 2c4m h PRO 754 Ca 0.08 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.03 2c4m h PRO 754 Cb 0.91 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 2c4m h PRO 754 CO 0.48 0.16 -0.57 -0.07 -0.21 0.00 0.00 178.00 177.79 2c4m h LEU 755 N 0.25 0.39 -0.54 2.35 -0.00 -1.93 -1.04 115.31 114.79 2c4m h LEU 755 Ca 0.38 -0.22 -0.11 0.00 -0.00 0.00 0.00 57.88 57.93 2c4m h LEU 755 Cb 0.64 -0.11 -0.02 0.00 -0.00 0.00 0.00 40.66 41.16 2c4m h LEU 755 CO -0.49 0.88 -0.11 1.23 -0.00 0.00 0.00 178.44 179.95 2c4m h GLY 756 N 1.30 1.12 0.90 0.83 0.00 -1.51 -0.36 103.07 105.36 2c4m h GLY 756 Ca -0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 47.33 46.41 2c4m h GLY 756 CO 0.10 0.83 -0.14 -0.25 0.00 0.00 0.00 176.54 177.08 2c4m h TRP 757 N 0.91 -0.35 -0.96 5.60 2.91 -0.21 -1.99 115.95 121.85 2c4m h TRP 757 Ca 0.14 -0.01 0.18 0.00 1.13 0.00 0.00 58.89 60.34 2c4m h TRP 757 Cb 0.68 0.12 -0.11 0.00 -0.51 0.00 0.00 29.16 29.34 2c4m h TRP 757 CO 0.05 -0.15 0.55 0.00 -1.03 0.00 0.00 178.44 177.86 2c4m h ALA 758 N 0.21 1.56 -0.31 2.65 0.00 -1.04 -0.20 119.26 122.13 2c4m h ALA 758 Ca -0.04 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c4m h ALA 758 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2c4m h ALA 758 CO 0.06 -0.09 0.18 -0.09 0.00 0.00 0.00 179.25 179.31 2c4m h ARG 759 N 0.70 0.42 -0.62 0.00 2.43 -0.63 -0.08 114.38 116.60 2c4m h ARG 759 Ca 0.55 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.70 2c4m h ARG 759 Cb 0.86 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.29 2c4m h ARG 759 CO -0.39 0.34 0.40 0.52 -1.51 0.00 0.00 179.97 179.32 2c4m h MET 760 N 0.39 0.77 -0.57 0.20 2.86 -0.36 -1.56 114.93 116.66 2c4m h MET 760 Ca 0.11 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2c4m h MET 760 Cb 0.03 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 2c4m h MET 760 CO -0.02 0.51 0.36 0.00 1.06 0.00 0.00 176.91 178.82 2c4m h ALA 761 N 1.25 0.73 -0.67 6.32 0.00 -0.83 -1.76 119.26 124.30 2c4m h ALA 761 Ca 0.24 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2c4m h ALA 761 Cb -0.03 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 2c4m h ALA 761 CO -0.08 0.12 0.39 2.35 0.00 0.00 0.00 179.25 182.04 2c4m h TRP 762 N 0.73 0.73 -0.66 0.00 2.91 -0.36 -1.03 115.95 118.29 2c4m h TRP 762 Ca 0.22 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.24 2c4m h TRP 762 Cb -0.04 -0.23 -0.03 0.00 -0.51 0.00 0.00 29.16 28.35 2c4m h TRP 762 CO -0.05 0.39 0.31 0.82 -1.03 0.00 0.00 178.44 178.88 2c4m h ILE 763 N 0.75 1.22 -0.38 2.65 2.04 -0.84 -0.61 117.51 122.34 2c4m h ILE 763 Ca 0.28 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2c4m h ILE 763 Cb 0.10 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2c4m h ILE 763 CO -0.14 0.26 0.21 0.78 0.00 0.00 0.00 178.15 179.26 2c4m h ASN 764 N 0.91 0.47 -0.13 1.72 2.35 -0.70 -1.35 115.58 118.85 2c4m h ASN 764 Ca 0.22 -0.08 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2c4m h ASN 764 Cb 0.12 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2c4m h ASN 764 CO -0.03 0.42 0.04 0.40 -1.65 0.00 0.00 177.43 176.61 2c4m h ILE 765 N 0.48 0.96 0.00 2.81 2.04 -0.88 -1.59 117.51 121.33 2c4m h ILE 765 Ca 0.13 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 2c4m h ILE 765 Cb 0.05 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2c4m h ILE 765 CO -0.02 0.02 -0.21 0.00 0.00 0.00 0.00 178.15 177.93 2c4m n GLU 767 N -4.28 1.55 0.18 0.00 -0.58 -0.52 -3.11 120.64 113.88 2c4m n GLU 767 Ca -0.02 -1.08 0.14 0.00 -0.42 0.00 0.00 57.16 55.78 2c4m n GLU 767 Cb 0.27 -1.48 0.59 0.00 -0.57 0.00 0.00 31.44 30.25 2c4m n GLU 767 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2c4m h SER 768 N 2.63 0.00 -0.43 1.62 4.64 -0.84 -3.15 113.55 118.01 2c4m h SER 768 Ca 0.00 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.44 2c4m h SER 768 Cb 0.65 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.73 2c4m h SER 768 CO 0.00 0.00 0.48 1.23 -0.87 0.00 0.00 176.83 177.67 2c4m h GLY 769 N 1.90 0.00 2.00 -0.77 0.00 -1.75 0.17 103.07 104.62 2c4m h GLY 769 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2c4m h GLY 769 CO 0.00 0.00 -0.08 -0.09 0.00 0.00 0.00 176.54 176.37 2c4m h ARG 770 N 0.00 0.00 -0.67 4.80 2.43 -1.88 -2.79 114.38 116.27 2c4m h ARG 770 Ca 0.20 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2c4m h ARG 770 Cb 1.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2c4m h ARG 770 CO -0.00 0.08 0.00 1.19 -1.51 0.00 0.00 179.97 179.73 2c4m n PHE 771 N -3.60 1.43 -2.51 2.20 3.72 0.60 -4.96 117.46 114.35 2c4m n PHE 771 Ca -0.02 -0.58 -0.41 0.00 -0.05 0.00 0.00 57.45 56.39 2c4m n PHE 771 Cb 0.19 -0.21 -0.04 0.00 -0.94 0.00 0.00 39.48 38.48 2c4m n PHE 771 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2c4m s SER 772 N -0.90 7.25 0.00 4.37 0.15 -1.05 -0.79 113.70 122.72 2c4m s SER 772 Ca 0.51 2.09 0.15 0.00 0.70 0.00 0.00 55.95 59.39 2c4m s SER 772 Cb 0.32 -2.60 0.67 0.00 -1.71 0.00 0.00 66.02 62.70 2c4m s SER 772 CO 0.26 -0.24 1.47 -1.54 1.20 0.00 0.00 173.24 174.38 2c4m n SER 773 N 2.48 0.00 -0.18 5.45 3.41 0.82 -2.38 113.62 123.22 2c4m n SER 773 Ca 0.03 0.39 -0.06 0.00 -0.26 0.00 0.00 58.87 58.97 2c4m n SER 773 Cb 0.46 -0.45 0.09 0.00 -0.26 0.00 0.00 64.21 64.06 2c4m n SER 773 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2c4m h ASP 774 N 0.00 0.93 -0.24 4.04 3.32 -1.91 -0.69 116.42 121.87 2c4m h ASP 774 Ca 0.00 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.76 2c4m h ASP 774 Cb 0.23 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2c4m h ASP 774 CO 0.00 0.96 -0.07 -0.09 -1.72 0.00 0.00 179.24 178.32 2c4m h ARG 775 N 0.90 0.47 -0.24 3.56 2.43 -1.84 -1.60 114.38 118.06 2c4m h ARG 775 Ca 0.17 -0.19 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2c4m h ARG 775 Cb 0.46 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 2c4m h ARG 775 CO 0.02 0.71 0.01 1.15 -1.51 0.00 0.00 179.97 180.35 2c4m h THR 776 N 0.20 0.84 -0.24 0.20 2.02 -1.56 -1.33 112.91 113.05 2c4m h THR 776 Ca 0.06 -0.03 -0.09 0.00 0.77 0.00 0.00 66.41 67.12 2c4m h THR 776 Cb 0.55 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2c4m h THR 776 CO 0.03 0.02 -0.24 0.40 0.37 0.00 0.00 175.52 176.09 2c4m h ILE 777 N 0.09 1.26 -0.69 3.11 1.08 -1.11 -0.57 117.51 120.68 2c4m h ILE 777 Ca 0.11 -1.22 -0.02 0.00 -0.39 0.00 0.00 64.86 63.34 2c4m h ILE 777 Cb 0.14 1.34 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 2c4m h ILE 777 CO -0.18 0.39 0.35 -0.09 -0.69 0.00 0.00 178.15 177.92 2c4m h ARG 778 N 0.39 0.99 0.39 2.37 2.43 -0.86 0.13 114.38 120.23 2c4m h ARG 778 Ca 0.06 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 2c4m h ARG 778 Cb 0.64 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2c4m h ARG 778 CO 0.05 0.77 -0.19 -0.44 -1.51 0.00 0.00 179.97 178.65 2c4m h ASP 779 N 0.96 -0.45 -0.76 -3.80 5.19 -0.86 0.40 116.42 117.11 2c4m h ASP 779 Ca 0.24 -0.12 0.07 0.00 -0.62 0.00 0.00 57.03 56.60 2c4m h ASP 779 Cb 0.10 0.12 -0.10 0.00 0.18 0.00 0.00 39.33 39.62 2c4m h ASP 779 CO -0.03 -0.09 -0.49 1.88 -3.12 0.00 0.00 179.24 177.38 2c4m h TYR 780 N -0.84 -1.57 -0.35 4.55 0.05 -1.07 0.29 116.97 118.03 2c4m h TYR 780 Ca -0.05 0.10 -0.02 0.00 0.05 0.00 0.00 58.73 58.81 2c4m h TYR 780 Cb 0.54 0.79 -0.02 0.00 1.01 0.00 0.00 36.73 39.05 2c4m h TYR 780 CO 0.01 -0.33 0.11 0.00 -1.05 0.00 0.00 178.16 176.91 2c4m h ALA 781 N 0.18 1.56 0.00 3.88 0.00 -0.57 0.22 119.26 124.53 2c4m h ALA 781 Ca 0.12 -0.12 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 2c4m h ALA 781 Cb 0.37 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2c4m h ALA 781 CO -0.75 0.34 -1.62 1.79 0.00 0.00 0.00 179.25 179.02 2c4m h THR 782 N 0.49 0.93 0.01 0.00 1.35 -0.84 0.40 112.91 115.25 2c4m h THR 782 Ca 0.12 -2.76 -0.38 0.00 -0.55 0.00 0.00 66.41 62.84 2c4m h THR 782 Cb 0.14 2.45 -0.06 0.00 -1.73 0.00 0.00 68.15 68.95 2c4m h THR 782 CO -0.01 0.53 -2.38 -0.62 -0.25 0.00 0.00 175.52 172.79 2c4m n GLU 783 N -3.07 0.67 -0.09 4.72 1.02 0.08 -4.42 120.64 119.55 2c4m n GLU 783 Ca -0.15 0.13 -0.17 0.00 -0.02 0.00 0.00 57.16 56.95 2c4m n GLU 783 Cb 1.03 -1.55 -0.06 0.00 -0.02 0.00 0.00 31.44 30.85 2c4m n GLU 783 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2c4m n ILE 784 N -3.15 1.23 0.14 -3.67 5.41 0.58 -4.71 119.36 115.20 2c4m n ILE 784 Ca -0.40 -0.12 0.02 0.00 1.00 0.00 0.00 62.75 63.24 2c4m n ILE 784 Cb 1.04 -1.90 0.09 0.00 -0.71 0.00 0.00 39.64 38.16 2c4m n ILE 784 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2c4m h TRP 785 N -0.74 0.00 -5.61 1.39 6.55 -1.18 -3.48 115.95 112.88 2c4m h TRP 785 Ca -0.35 0.00 -0.30 0.00 0.95 0.00 0.00 58.89 59.20 2c4m h TRP 785 Cb 1.22 0.00 0.17 0.00 -0.86 0.00 0.00 29.16 29.69 2c4m h TRP 785 CO -0.15 0.56 -0.85 1.63 -1.05 0.00 0.00 178.44 178.58 2c4m n LYS 786 N -3.36 -3.28 -3.49 0.49 4.76 0.68 -4.88 118.16 109.08 2c4m n LYS 786 Ca 0.01 0.81 -0.20 0.00 -2.87 0.00 0.00 58.31 56.06 2c4m n LYS 786 Cb 0.70 -5.64 -0.03 0.00 -1.84 0.00 0.00 35.03 28.23 2c4m n LYS 786 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2c4m s LEU 787 N -5.79 3.43 -0.02 -0.35 1.43 0.11 -5.00 118.68 112.49 2c4m s LEU 787 Ca 0.33 -0.70 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 2c4m s LEU 787 Cb -0.05 -2.14 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 2c4m s LEU 787 CO 0.75 -0.66 -0.15 -1.61 0.23 0.00 0.00 176.35 174.91 2c4m s GLU 788 N -4.16 1.30 0.18 1.70 0.41 -1.26 -4.70 118.70 112.17 2c4m s GLU 788 Ca 0.49 -0.53 -0.32 0.00 -0.41 0.00 0.00 54.97 54.20 2c4m s GLU 788 Cb -0.04 -1.23 -0.12 0.00 -1.78 0.00 0.00 34.13 30.96 2c4m s GLU 788 CO 0.29 0.29 1.73 -0.35 -0.49 0.00 0.00 175.26 176.73 2c4m n PRO 789 N 2.84 2.68 -3.89 0.39 -0.04 -1.26 -4.50 135.00 131.23 2c4m n PRO 789 Ca -0.15 0.97 -0.30 0.00 -0.04 0.00 0.00 63.50 63.98 2c4m n PRO 789 Cb 0.54 -2.82 -0.14 0.00 -0.04 0.00 0.00 33.50 31.05 2c4m n PRO 789 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2c4m s THR 790 N 1.55 2.19 0.57 0.52 2.01 0.21 -4.97 115.64 117.71 2c4m s THR 790 Ca 0.78 -2.95 -0.19 0.00 0.31 0.00 0.00 61.69 59.63 2c4m s THR 790 Cb -0.53 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 2c4m s THR 790 CO 0.34 -0.80 1.15 -2.16 -0.69 0.00 0.00 174.62 172.47 2c4m s PRO 791 N 0.07 3.19 0.62 4.92 0.04 -1.26 -4.81 135.00 137.77 2c4m s PRO 791 Ca 0.16 1.67 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 2c4m s PRO 791 Cb -0.25 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 2c4m s PRO 791 CO -0.02 -1.00 1.06 0.00 0.04 0.00 0.00 177.00 177.09 2c4m s ALA 792 N -1.75 2.70 0.00 8.56 0.00 -1.26 -4.94 121.76 125.08 2c4m s ALA 792 Ca 0.74 0.34 0.00 0.00 0.00 0.00 0.00 51.96 53.04 2c4m s ALA 792 Cb -0.26 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2c4m s ALA 792 CO 0.30 -0.93 0.00 1.55 0.00 0.00 0.00 175.76 176.68