#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6i n GLN 2 N 0.00 0.00 -0.98 4.33 7.27 -1.26 -4.15 117.38 122.60 1l6i n GLN 2 Ca 0.00 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.75 1l6i n GLN 2 Cb 0.00 -0.97 0.14 0.00 2.41 0.00 0.00 30.24 31.81 1l6i n GLN 2 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1l6i s PRO 3 N 4.17 1.46 -0.17 3.69 0.02 -1.26 -4.95 135.00 137.97 1l6i s PRO 3 Ca 0.79 1.62 -0.03 0.00 0.02 0.00 0.00 61.00 63.40 1l6i s PRO 3 Cb -0.95 -1.77 -0.02 0.00 0.02 0.00 0.00 34.50 31.78 1l6i s PRO 3 CO 0.41 -2.32 -0.06 0.42 -0.33 0.00 0.00 177.00 175.13 1l6i s ILE 4 N -2.42 3.58 0.12 2.83 1.09 -1.26 -5.01 121.20 120.13 1l6i s ILE 4 Ca 0.69 -0.46 -0.28 0.00 -1.10 0.00 0.00 60.65 59.51 1l6i s ILE 4 Cb -0.25 -2.58 -0.06 0.00 -1.06 0.00 0.00 42.46 38.51 1l6i s ILE 4 CO 0.54 0.47 0.89 0.12 -0.10 0.00 0.00 174.94 176.86 1l6i s PHE 5 N 0.71 3.83 -0.07 3.97 5.36 -1.26 -5.04 117.98 125.48 1l6i s PHE 5 Ca -0.03 1.72 -0.01 0.00 -0.96 0.00 0.00 56.93 57.66 1l6i s PHE 5 Cb -0.15 -2.96 0.03 0.00 -0.34 0.00 0.00 43.02 39.60 1l6i s PHE 5 CO 0.02 0.30 -0.02 1.21 -1.46 0.00 0.00 175.22 175.27 1l6i s ASN 6 N -0.32 1.54 0.30 6.13 3.84 -1.26 -5.04 114.94 120.13 1l6i s ASN 6 Ca 0.43 -0.12 -0.01 0.00 0.21 0.00 0.00 52.86 53.37 1l6i s ASN 6 Cb -0.23 -0.49 0.46 0.00 -0.55 0.00 0.00 41.25 40.44 1l6i s ASN 6 CO 0.28 -0.16 1.92 -0.78 -2.79 0.00 0.00 177.10 175.57 1l6i h ASP 7 N 8.10 0.83 0.62 -4.21 3.58 -1.97 -1.57 116.42 121.80 1l6i h ASP 7 Ca -0.24 -0.07 -0.10 0.00 0.42 0.00 0.00 57.03 57.03 1l6i h ASP 7 Cb 1.13 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.95 1l6i h ASP 7 CO 0.32 0.69 -0.50 0.50 -2.88 0.00 0.00 179.24 177.37 1l6i h LYS 8 N 0.94 0.00 -0.34 0.28 3.64 -1.98 -1.53 116.57 117.56 1l6i h LYS 8 Ca 0.24 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.51 1l6i h LYS 8 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1l6i h LYS 8 CO -0.04 0.50 -0.21 1.96 -2.27 0.00 0.00 179.45 179.39 1l6i h GLN 9 N 0.00 0.75 -0.40 1.90 4.20 -1.74 -1.88 115.11 117.93 1l6i h GLN 9 Ca -0.00 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.35 1l6i h GLN 9 Cb 0.94 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 1l6i h GLN 9 CO 0.06 0.96 0.20 0.35 -0.67 0.00 0.00 178.83 179.74 1l6i h PHE 10 N 0.53 0.56 -0.54 2.96 3.57 -1.17 -1.74 116.94 121.12 1l6i h PHE 10 Ca 0.07 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1l6i h PHE 10 Cb 0.76 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1l6i h PHE 10 CO 0.06 0.45 0.13 1.96 -2.23 0.00 0.00 178.31 178.68 1l6i h GLN 11 N 0.51 0.86 -0.39 1.11 1.08 -1.23 0.13 115.11 117.17 1l6i h GLN 11 Ca 0.14 -0.21 -0.05 0.00 -1.45 0.00 0.00 58.65 57.08 1l6i h GLN 11 Cb 0.09 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 1l6i h GLN 11 CO -0.02 0.82 0.02 0.93 -0.95 0.00 0.00 178.83 179.63 1l6i h GLU 12 N 0.76 0.61 -0.05 1.46 5.08 -1.21 -1.99 114.58 119.25 1l6i h GLU 12 Ca 0.17 -0.14 -0.25 0.00 -1.00 0.00 0.00 59.36 58.14 1l6i h GLU 12 Cb 0.34 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.52 1l6i h GLU 12 CO 0.00 0.62 -0.95 0.00 -1.00 0.00 0.00 179.01 177.68 1l6i h ALA 13 N 1.44 0.22 -0.79 3.43 0.00 -0.74 -2.63 119.26 120.19 1l6i h ALA 13 Ca 0.12 -0.67 0.07 0.00 0.00 0.00 0.00 54.91 54.44 1l6i h ALA 13 Cb 0.34 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1l6i h ALA 13 CO 0.01 0.70 0.47 1.25 0.00 0.00 0.00 179.25 181.68 1l6i h LEU 14 N 0.42 0.71 -1.45 0.00 5.85 -0.64 -2.49 115.31 117.70 1l6i h LEU 14 Ca -0.10 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.59 1l6i h LEU 14 Cb 1.59 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 1l6i h LEU 14 CO 0.19 0.44 -0.27 0.77 -0.34 0.00 0.00 178.44 179.22 1l6i h SER 15 N 0.84 0.00 0.55 1.25 4.64 -1.05 -2.38 113.55 117.39 1l6i h SER 15 Ca 0.36 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.58 1l6i h SER 15 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1l6i h SER 15 CO -0.20 0.27 -0.45 0.03 -0.87 0.00 0.00 176.83 175.62 1l6i h ARG 16 N 0.00 0.00 0.03 4.77 3.08 -1.10 -0.92 114.38 120.24 1l6i h ARG 16 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1l6i h ARG 16 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1l6i h ARG 16 CO 0.04 0.45 -0.02 1.96 -1.07 0.00 0.00 179.97 181.33 1l6i h GLN 17 N 0.00 -0.04 0.00 0.04 1.08 -1.33 -2.00 115.11 112.86 1l6i h GLN 17 Ca -0.00 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 1l6i h GLN 17 Cb 0.84 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 1l6i h GLN 17 CO 0.06 0.56 -0.45 0.11 -0.95 0.00 0.00 178.83 178.16 1l6i h TRP 18 N -0.68 0.00 -0.45 2.96 5.08 -1.52 -0.22 115.95 121.11 1l6i h TRP 18 Ca -0.00 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.88 1l6i h TRP 18 Cb 0.62 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.76 1l6i h TRP 18 CO 0.14 0.45 -0.06 1.96 -1.28 0.00 0.00 178.44 179.64 1l6i h GLN 19 N 0.00 0.78 0.00 0.12 4.20 -1.24 -1.72 115.11 117.25 1l6i h GLN 19 Ca -0.00 -0.24 -0.03 0.00 0.06 0.00 0.00 58.65 58.44 1l6i h GLN 19 Cb 0.87 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.57 1l6i h GLN 19 CO 0.06 0.83 -0.13 -0.09 -0.67 0.00 0.00 178.83 178.83 1l6i h ARG 20 N 0.72 0.00 -0.01 1.46 2.43 -0.33 -0.16 114.38 118.49 1l6i h ARG 20 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1l6i h ARG 20 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1l6i h ARG 20 CO 0.03 0.13 -0.04 0.66 -1.51 0.00 0.00 179.97 179.23 1l6i n TYR 21 N -3.34 0.00 -2.32 2.20 4.01 -0.25 -4.93 117.16 112.52 1l6i n TYR 21 Ca -0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.68 1l6i n TYR 21 Cb 0.33 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 1l6i n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1l6i n GLY 22 N 1.16 0.26 3.93 2.72 0.00 -0.07 -5.06 105.19 108.14 1l6i n GLY 22 Ca 0.19 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 1l6i n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l6i s LEU 23 N -1.96 4.21 0.21 0.99 1.43 -0.68 -5.03 118.68 117.84 1l6i s LEU 23 Ca 0.05 0.02 0.24 0.00 -1.03 0.00 0.00 54.13 53.40 1l6i s LEU 23 Cb -0.02 -2.75 0.34 0.00 0.03 0.00 0.00 46.19 43.78 1l6i s LEU 23 CO 0.06 -0.04 1.38 0.78 0.23 0.00 0.00 176.35 178.76 1l6i h ASN 24 N 1.42 0.00 -5.03 2.29 2.35 -1.97 -3.41 115.58 111.23 1l6i h ASN 24 Ca -0.51 -0.09 0.16 0.00 -0.55 0.00 0.00 56.30 55.32 1l6i h ASN 24 Cb 1.23 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.48 1l6i h ASN 24 CO 0.62 0.04 0.53 -0.94 -1.65 0.00 0.00 177.43 176.04 1l6i s SER 25 N -4.89 -0.24 0.34 5.81 1.04 -1.26 -5.03 113.70 109.47 1l6i s SER 25 Ca 0.05 -0.20 0.03 0.00 0.48 0.00 0.00 55.95 56.32 1l6i s SER 25 Cb 0.11 0.40 0.64 0.00 0.10 0.00 0.00 66.02 67.28 1l6i s SER 25 CO 0.71 -0.71 1.97 0.00 0.98 0.00 0.00 173.24 176.19 1l6i h ALA 26 N 2.00 1.60 0.00 5.32 0.00 -1.95 -2.49 119.26 123.74 1l6i h ALA 26 Ca -0.23 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1l6i h ALA 26 Cb 1.23 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1l6i h ALA 26 CO 0.28 0.32 -0.02 0.00 0.00 0.00 0.00 179.25 179.83 1l6i h ALA 27 N 1.58 1.49 0.00 0.00 0.00 -1.95 -1.31 119.26 119.06 1l6i h ALA 27 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1l6i h ALA 27 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1l6i h ALA 27 CO -0.09 0.02 0.00 0.93 0.00 0.00 0.00 179.25 180.11 1l6i h GLU 28 N 0.00 0.00 -7.00 0.00 5.08 -1.86 -3.46 114.58 107.34 1l6i h GLU 28 Ca -0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 1l6i h GLU 28 Cb 0.05 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.46 1l6i h GLU 28 CO 0.00 0.00 0.33 -1.33 -1.00 0.00 0.00 179.01 177.01 1l6i n MET 29 N -2.70 0.94 -2.03 2.33 2.81 -0.50 -5.01 117.12 112.96 1l6i n MET 29 Ca 0.02 0.37 -0.29 0.00 -1.81 0.00 0.00 57.70 55.99 1l6i n MET 29 Cb 0.32 -2.38 0.04 0.00 -0.71 0.00 0.00 33.22 30.50 1l6i n MET 29 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1l6i s THR 30 N -1.50 3.50 0.26 2.03 -4.23 -1.26 -4.83 115.64 109.61 1l6i s THR 30 Ca 0.80 0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 61.60 1l6i s THR 30 Cb -0.38 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.27 1l6i s THR 30 CO 0.44 -0.57 1.65 -0.65 -0.54 0.00 0.00 174.62 174.95 1l6i h PRO 31 N -0.53 0.18 -0.23 3.99 0.11 -1.99 -0.21 132.00 133.33 1l6i h PRO 31 Ca -0.45 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 1l6i h PRO 31 Cb 1.26 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1l6i h PRO 31 CO 0.63 0.12 -0.46 -0.09 -0.21 0.00 0.00 178.00 177.99 1l6i h ARG 32 N 0.19 0.59 -0.65 1.05 2.43 -1.96 -2.62 114.38 113.41 1l6i h ARG 32 Ca 0.46 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1l6i h ARG 32 Cb 0.85 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.39 1l6i h ARG 32 CO -0.62 0.93 0.37 1.96 -1.51 0.00 0.00 179.97 181.10 1l6i h GLN 33 N 0.48 0.89 -0.24 0.20 4.20 -1.50 -1.77 115.11 117.36 1l6i h GLN 33 Ca 0.03 -0.09 0.06 0.00 0.06 0.00 0.00 58.65 58.70 1l6i h GLN 33 Cb 0.99 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 28.53 1l6i h GLN 33 CO 0.09 0.66 -0.12 -1.49 -0.67 0.00 0.00 178.83 177.29 1l6i h TRP 34 N 0.88 -0.30 -0.20 2.96 4.06 -0.97 1.09 115.95 123.47 1l6i h TRP 34 Ca 0.23 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.20 1l6i h TRP 34 Cb 0.01 0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 28.33 1l6i h TRP 34 CO -0.01 -0.19 0.09 2.35 -3.56 0.00 0.00 178.44 177.12 1l6i h TRP 35 N -0.10 0.30 -0.24 0.49 7.01 -1.35 0.08 115.95 122.15 1l6i h TRP 35 Ca 0.13 -0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.15 1l6i h TRP 35 Cb 0.29 -0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 27.22 1l6i h TRP 35 CO -0.30 0.34 0.01 -0.07 -2.79 0.00 0.00 178.44 175.63 1l6i h LEU 36 N 0.18 -0.07 -0.38 0.65 3.38 -1.11 -1.83 115.31 116.13 1l6i h LEU 36 Ca 0.07 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1l6i h LEU 36 Cb 0.16 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1l6i h LEU 36 CO -0.01 -0.01 0.23 0.00 0.09 0.00 0.00 178.44 178.74 1l6i h ALA 37 N 1.20 0.48 -0.38 1.53 0.00 0.14 -1.36 119.26 120.87 1l6i h ALA 37 Ca 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1l6i h ALA 37 Cb 0.14 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1l6i h ALA 37 CO -0.18 -0.11 -0.06 -0.39 0.00 0.00 0.00 179.25 178.51 1l6i h VAL 38 N 0.46 1.23 -0.09 0.00 -1.51 -0.87 0.17 116.25 115.65 1l6i h VAL 38 Ca 0.15 -1.00 -0.03 0.00 -1.23 0.00 0.00 66.70 64.59 1l6i h VAL 38 Cb -0.00 1.01 -0.00 0.00 -2.13 0.00 0.00 31.29 30.17 1l6i h VAL 38 CO -0.06 0.34 -0.06 0.28 -1.23 0.00 0.00 177.57 176.84 1l6i h SER 39 N 0.60 0.20 -0.43 4.19 0.02 -1.27 -0.38 113.55 116.47 1l6i h SER 39 Ca 0.11 -0.44 -0.08 0.00 -0.84 0.00 0.00 61.79 60.54 1l6i h SER 39 Cb 0.47 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 1l6i h SER 39 CO 0.02 0.60 -0.02 -0.33 -1.14 0.00 0.00 176.83 175.97 1l6i h GLU 40 N -0.20 0.85 -0.96 3.45 5.08 -1.08 -1.35 114.58 120.38 1l6i h GLU 40 Ca 0.02 -0.24 0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1l6i h GLU 40 Cb 0.53 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 1l6i h GLU 40 CO 0.02 0.86 0.61 0.00 -1.00 0.00 0.00 179.01 179.50 1l6i h ALA 41 N 1.19 1.31 -0.13 3.43 0.00 -0.51 -1.95 119.26 122.61 1l6i h ALA 41 Ca 0.15 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1l6i h ALA 41 Cb 0.49 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1l6i h ALA 41 CO 0.02 0.41 -0.68 -0.07 0.00 0.00 0.00 179.25 178.93 1l6i h LEU 42 N 1.13 0.63 -1.42 0.00 3.38 -0.46 -2.44 115.31 116.13 1l6i h LEU 42 Ca 0.41 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1l6i h LEU 42 Cb 0.14 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1l6i h LEU 42 CO -0.16 1.14 0.23 0.00 0.09 0.00 0.00 178.44 179.73 1l6i h ALA 43 N 0.86 1.55 -0.46 1.53 0.00 -1.11 -0.96 119.26 120.68 1l6i h ALA 43 Ca -0.02 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1l6i h ALA 43 Cb 1.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1l6i h ALA 43 CO 0.13 0.37 -0.02 0.93 0.00 0.00 0.00 179.25 180.65 1l6i h GLU 44 N 0.63 0.83 -0.50 0.00 5.08 -1.06 -1.28 114.58 118.28 1l6i h GLU 44 Ca 0.16 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 1l6i h GLU 44 Cb 0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1l6i h GLU 44 CO -0.02 0.89 -0.19 0.52 -1.00 0.00 0.00 179.01 179.21 1l6i h MET 45 N 0.68 1.01 -0.64 2.33 2.86 -1.15 -1.56 114.93 118.45 1l6i h MET 45 Ca 0.13 -0.41 -0.04 0.00 -2.06 0.00 0.00 59.70 57.31 1l6i h MET 45 Cb 0.53 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 1l6i h MET 45 CO 0.03 1.10 0.24 1.25 1.06 0.00 0.00 176.91 180.58 1l6i h LEU 46 N 0.88 0.89 -0.25 1.22 5.85 -1.06 -2.71 115.31 120.13 1l6i h LEU 46 Ca 0.12 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1l6i h LEU 46 Cb 0.76 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1l6i h LEU 46 CO 0.06 0.83 0.00 0.03 -0.34 0.00 0.00 178.44 179.02 1l6i h ARG 47 N 0.90 0.00 -0.00 1.25 3.08 -1.00 -2.14 114.38 116.46 1l6i h ARG 47 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1l6i h ARG 47 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1l6i h ARG 47 CO -0.01 0.00 -0.01 0.00 -1.07 0.00 0.00 179.97 178.88 1l6i n ALA 48 N -1.93 2.66 -1.89 0.04 0.00 -0.61 -4.86 120.51 113.91 1l6i n ALA 48 Ca 0.04 -0.26 -0.35 0.00 0.00 0.00 0.00 53.44 52.88 1l6i n ALA 48 Cb 0.43 -1.43 -0.07 0.00 0.00 0.00 0.00 19.45 18.38 1l6i n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1l6i s GLN 49 N -2.05 4.31 0.49 0.00 -1.52 -0.81 -5.04 119.66 115.04 1l6i s GLN 49 Ca 0.44 1.08 -0.23 0.00 -1.95 0.00 0.00 55.36 54.70 1l6i s GLN 49 Cb 0.22 -2.50 -0.06 0.00 -0.22 0.00 0.00 33.01 30.45 1l6i s GLN 49 CO 0.37 0.15 1.29 -2.14 -0.25 0.00 0.00 175.29 174.71 1l6i s PRO 50 N -2.65 3.48 0.07 2.91 0.02 -1.26 -4.95 135.00 132.62 1l6i s PRO 50 Ca 0.55 2.08 -0.31 0.00 0.02 0.00 0.00 61.00 63.34 1l6i s PRO 50 Cb -0.13 -2.39 -0.08 0.00 0.02 0.00 0.00 34.50 31.91 1l6i s PRO 50 CO 0.18 -0.86 1.62 0.12 -0.33 0.00 0.00 177.00 177.73 1l6i s PHE 51 N -1.37 2.52 -0.24 6.54 5.36 -1.26 -4.94 117.98 124.59 1l6i s PHE 51 Ca 0.66 0.40 -0.09 0.00 -0.96 0.00 0.00 56.93 56.94 1l6i s PHE 51 Cb -0.36 -3.93 -0.04 0.00 -0.34 0.00 0.00 43.02 38.35 1l6i s PHE 51 CO 0.44 -3.69 0.11 0.00 -1.46 0.00 0.00 175.22 170.63 1l6i s ALA 52 N 2.49 3.40 0.32 11.12 0.00 -1.23 -4.91 121.76 132.95 1l6i s ALA 52 Ca 0.73 -0.98 -0.27 0.00 0.00 0.00 0.00 51.96 51.44 1l6i s ALA 52 Cb -0.39 -2.18 -0.09 0.00 0.00 0.00 0.00 23.12 20.45 1l6i s ALA 52 CO 0.32 -0.28 1.00 -1.59 0.00 0.00 0.00 175.76 175.21 1l6i s LYS 53 N 1.23 4.53 0.86 0.00 -2.85 -1.26 -4.61 119.74 117.64 1l6i s LYS 53 Ca 0.06 1.49 -0.12 0.00 -1.00 0.00 0.00 55.97 56.40 1l6i s LYS 53 Cb -0.14 -2.88 0.11 0.00 -2.06 0.00 0.00 37.83 32.85 1l6i s LYS 53 CO 0.05 0.20 1.11 -2.14 0.10 0.00 0.00 175.35 174.67 1l6i s PRO 54 N -1.91 1.53 0.23 1.78 0.02 -1.26 -4.95 135.00 130.44 1l6i s PRO 54 Ca 0.50 0.50 -0.31 0.00 0.02 0.00 0.00 61.00 61.71 1l6i s PRO 54 Cb -0.23 -1.87 -0.14 0.00 0.02 0.00 0.00 34.50 32.28 1l6i s PRO 54 CO 0.29 -1.97 1.31 0.28 -0.33 0.00 0.00 177.00 176.58 1l6i n VAL 55 N -3.65 1.05 -1.83 3.83 0.31 0.74 -4.95 118.33 113.84 1l6i n VAL 55 Ca 0.07 -0.26 -0.30 0.00 -0.01 0.00 0.00 64.34 63.83 1l6i n VAL 55 Cb 0.57 -1.28 0.06 0.00 -0.91 0.00 0.00 33.84 32.28 1l6i n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l6i s ALA 56 N -0.21 2.78 -1.41 3.52 0.00 -1.26 -4.50 121.76 120.68 1l6i s ALA 56 Ca 0.68 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.31 1l6i s ALA 56 Cb -0.70 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1l6i s ALA 56 CO 0.52 -1.26 0.39 0.09 0.00 0.00 0.00 175.76 175.50 1l6i n ASN 57 N -3.09 -0.24 -4.16 0.00 5.03 -1.26 -5.00 115.26 106.53 1l6i n ASN 57 Ca 0.07 -1.02 -0.10 0.00 0.87 0.00 0.00 54.58 54.39 1l6i n ASN 57 Cb 0.57 -2.98 -0.10 0.00 -1.02 0.00 0.00 39.78 36.26 1l6i n ASN 57 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1l6i s GLN 58 N -6.59 0.97 0.37 3.52 -2.07 -1.26 -5.14 119.66 109.46 1l6i s GLN 58 Ca 0.00 -1.46 -0.25 0.00 -1.82 0.00 0.00 55.36 51.83 1l6i s GLN 58 Cb -0.00 0.18 -0.09 0.00 -1.09 0.00 0.00 33.01 32.01 1l6i s GLN 58 CO 0.89 -0.25 1.07 1.03 -1.32 0.00 0.00 175.29 176.71 1l6i s ARG 59 N -4.04 4.26 0.23 9.60 0.52 -1.26 -4.97 118.95 123.29 1l6i s ARG 59 Ca 0.25 1.59 -0.30 0.00 -0.52 0.00 0.00 55.73 56.76 1l6i s ARG 59 Cb 0.07 -2.69 -0.09 0.00 0.52 0.00 0.00 34.95 32.77 1l6i s ARG 59 CO 0.03 -0.08 1.18 -1.58 0.02 0.00 0.00 175.30 174.87 1l6i s HIS 60 N -1.53 3.43 -0.11 -0.53 5.65 -0.57 -4.76 115.29 116.86 1l6i s HIS 60 Ca 0.55 1.50 -0.12 0.00 0.25 0.00 0.00 55.06 57.24 1l6i s HIS 60 Cb -0.25 -3.42 -0.05 0.00 -1.18 0.00 0.00 32.58 27.69 1l6i s HIS 60 CO 0.31 -1.09 0.27 0.08 -0.65 0.00 0.00 174.74 173.66 1l6i s VAL 61 N -0.49 5.30 -0.33 0.89 1.01 -0.42 -1.55 120.40 124.81 1l6i s VAL 61 Ca 0.50 0.50 0.03 0.00 0.00 0.00 0.00 61.98 63.02 1l6i s VAL 61 Cb -0.33 -3.58 0.10 0.00 0.00 0.00 0.00 36.38 32.56 1l6i s VAL 61 CO 0.40 0.50 0.04 0.20 0.00 0.00 0.00 175.10 176.24 1l6i s ASN 62 N -0.32 4.61 -0.39 3.32 0.01 -0.72 0.41 114.94 121.86 1l6i s ASN 62 Ca 0.17 -1.99 -0.15 0.00 -0.71 0.00 0.00 52.86 50.18 1l6i s ASN 62 Cb -0.13 -1.50 0.01 0.00 0.41 0.00 0.00 41.25 40.03 1l6i s ASN 62 CO 0.06 -0.37 0.34 -0.47 -1.51 0.00 0.00 177.10 175.15 1l6i s TYR 63 N 1.04 3.21 -0.26 2.20 5.04 -0.55 -1.35 117.35 126.68 1l6i s TYR 63 Ca 0.09 -0.35 -0.10 0.00 -2.44 0.00 0.00 57.07 54.27 1l6i s TYR 63 Cb -0.19 -2.66 -0.05 0.00 0.35 0.00 0.00 41.96 39.41 1l6i s TYR 63 CO -0.10 -0.54 0.16 0.42 -1.34 0.00 0.00 175.55 174.15 1l6i s ILE 64 N 1.87 5.12 -0.13 3.14 1.01 -0.73 -1.49 121.20 129.99 1l6i s ILE 64 Ca 0.08 0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.72 1l6i s ILE 64 Cb -0.18 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.91 1l6i s ILE 64 CO 0.11 0.29 0.34 -0.55 0.00 0.00 0.00 174.94 175.13 1l6i s SER 65 N 1.58 -0.35 0.52 3.58 0.15 -0.84 -3.16 113.70 115.17 1l6i s SER 65 Ca 0.07 0.68 0.29 0.00 0.70 0.00 0.00 55.95 57.69 1l6i s SER 65 Cb -0.15 0.69 1.35 0.00 -1.71 0.00 0.00 66.02 66.20 1l6i s SER 65 CO 0.08 -0.12 2.00 0.24 1.20 0.00 0.00 173.24 176.65 1l6i h MET 66 N 5.61 0.00 -5.23 5.44 2.86 -1.88 -3.37 114.93 118.36 1l6i h MET 66 Ca -0.26 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 56.92 1l6i h MET 66 Cb 1.19 0.00 -0.27 0.00 0.06 0.00 0.00 31.60 32.58 1l6i h MET 66 CO 0.30 0.12 -0.80 -1.83 1.06 0.00 0.00 176.91 175.75 1l6i s GLU 67 N -3.91 1.00 -0.31 1.72 -1.05 -1.26 -4.47 118.70 110.42 1l6i s GLU 67 Ca -0.01 -0.59 -0.01 0.00 -0.15 0.00 0.00 54.97 54.20 1l6i s GLU 67 Cb 0.11 -0.98 0.13 0.00 -0.44 0.00 0.00 34.13 32.94 1l6i s GLU 67 CO 0.58 0.26 0.23 -0.06 0.95 0.00 0.00 175.26 177.21 1l6i s PHE 68 N -0.54 0.06 -1.18 4.83 0.08 -0.69 -4.19 117.98 116.34 1l6i s PHE 68 Ca 0.03 -0.78 -0.08 0.00 0.12 0.00 0.00 56.93 56.23 1l6i s PHE 68 Cb -0.06 -0.70 0.23 0.00 -0.57 0.00 0.00 43.02 41.92 1l6i s PHE 68 CO 0.00 -0.88 1.63 -0.11 -0.10 0.00 0.00 175.22 175.76 1l6i n LEU 69 N 4.93 6.36 0.21 -0.37 7.94 -0.43 -3.89 117.00 131.75 1l6i n LEU 69 Ca 0.01 -4.88 0.09 0.00 -1.11 0.00 0.00 56.01 50.11 1l6i n LEU 69 Cb 0.43 -1.41 0.38 0.00 0.53 0.00 0.00 43.42 43.34 1l6i n LEU 69 CO 0.05 1.44 0.75 0.16 -1.11 0.00 0.00 177.39 178.68 1l6i h ILE 70 N 3.69 0.60 -0.76 1.96 3.07 -1.86 -3.41 117.51 120.80 1l6i h ILE 70 Ca 0.29 -1.30 0.04 0.00 1.55 0.00 0.00 64.86 65.44 1l6i h ILE 70 Cb 0.66 1.88 -0.01 0.00 -0.27 0.00 0.00 36.82 39.08 1l6i h ILE 70 CO 1.43 0.26 -0.05 0.61 -1.05 0.00 0.00 178.15 179.35 1l6i n GLY 71 N 0.34 -1.86 3.76 0.16 0.00 -1.26 -4.77 105.19 101.57 1l6i n GLY 71 Ca 0.00 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 1l6i n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l6i s ARG 72 N -0.42 3.57 -0.10 1.61 0.52 -1.26 -4.49 118.95 118.39 1l6i s ARG 72 Ca 0.00 2.17 0.07 0.00 -0.52 0.00 0.00 55.73 57.45 1l6i s ARG 72 Cb 0.00 -2.49 -0.11 0.00 0.52 0.00 0.00 34.95 32.87 1l6i s ARG 72 CO 0.00 -0.83 0.01 1.28 0.02 0.00 0.00 175.30 175.79 1l6i n LEU 73 N -0.47 0.37 -0.12 2.53 4.32 -1.26 -4.58 117.00 117.79 1l6i n LEU 73 Ca 0.07 -0.01 -0.05 0.00 -0.02 0.00 0.00 56.01 56.00 1l6i n LEU 73 Cb 0.45 0.15 0.03 0.00 -1.62 0.00 0.00 43.42 42.42 1l6i n LEU 73 CO 0.54 0.29 0.88 0.74 -1.22 0.00 0.00 177.39 178.62 1l6i h THR 74 N 0.00 0.76 -0.28 -5.08 2.02 -1.96 0.17 112.91 108.54 1l6i h THR 74 Ca -0.26 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 1l6i h THR 74 Cb 1.56 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 1l6i h THR 74 CO 0.01 0.03 -0.24 1.23 0.37 0.00 0.00 175.52 176.92 1l6i h GLY 75 N 0.16 0.72 0.55 2.16 0.00 -1.95 -2.72 103.07 101.99 1l6i h GLY 75 Ca 0.19 -0.71 0.10 0.00 0.00 0.00 0.00 47.33 46.91 1l6i h GLY 75 CO -0.28 0.65 0.64 -0.57 0.00 0.00 0.00 176.54 176.98 1l6i h ASN 76 N 0.40 0.97 -0.08 0.19 -1.24 -1.70 -1.64 115.58 112.47 1l6i h ASN 76 Ca 0.05 0.04 -0.09 0.00 0.71 0.00 0.00 56.30 57.01 1l6i h ASN 76 Cb 0.80 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.69 1l6i h ASN 76 CO 0.06 0.54 -0.29 0.78 -1.29 0.00 0.00 177.43 177.24 1l6i h ASN 77 N 1.05 0.40 -0.31 1.15 2.35 -0.88 -2.09 115.58 117.24 1l6i h ASN 77 Ca 0.48 -0.62 0.07 0.00 -0.55 0.00 0.00 56.30 55.68 1l6i h ASN 77 Cb 0.40 -0.12 -0.08 0.00 0.05 0.00 0.00 38.32 38.57 1l6i h ASN 77 CO -0.24 0.95 -0.34 -0.07 -1.65 0.00 0.00 177.43 176.08 1l6i h LEU 78 N -0.13 -1.10 -0.79 1.61 3.38 -1.36 -0.48 115.31 116.45 1l6i h LEU 78 Ca -0.01 0.18 0.11 0.00 0.09 0.00 0.00 57.88 58.25 1l6i h LEU 78 Cb 0.92 0.49 -0.08 0.00 0.09 0.00 0.00 40.66 42.08 1l6i h LEU 78 CO 0.06 -0.34 0.42 0.25 0.09 0.00 0.00 178.44 178.92 1l6i h LEU 79 N -0.31 0.55 -0.68 1.67 6.46 -1.27 0.13 115.31 121.87 1l6i h LEU 79 Ca 0.14 0.07 -0.11 0.00 -0.12 0.00 0.00 57.88 57.85 1l6i h LEU 79 Cb 0.55 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.43 1l6i h LEU 79 CO -0.48 0.29 -0.21 0.78 -0.62 0.00 0.00 178.44 178.20 1l6i h ASN 80 N 0.67 0.81 1.17 1.25 4.21 -0.74 -1.89 115.58 121.07 1l6i h ASN 80 Ca 0.40 -0.29 0.00 0.00 1.21 0.00 0.00 56.30 57.62 1l6i h ASN 80 Cb 0.45 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.43 1l6i h ASN 80 CO -0.29 1.00 0.00 -0.07 -1.29 0.00 0.00 177.43 176.78 1l6i h LEU 81 N 0.70 0.00 0.25 1.61 3.38 -0.79 0.33 115.31 120.79 1l6i h LEU 81 Ca 0.10 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1l6i h LEU 81 Cb 0.73 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.50 1l6i h LEU 81 CO 0.06 0.00 -0.22 0.61 0.09 0.00 0.00 178.44 178.97 1l6i n GLY 82 N 0.35 0.19 0.21 0.83 0.00 -0.14 -4.76 105.19 101.87 1l6i n GLY 82 Ca 0.02 -0.46 0.05 0.00 0.00 0.00 0.00 46.02 45.63 1l6i n GLY 82 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1l6i n TRP 83 N -3.77 0.00 -0.03 1.61 7.02 0.28 -4.82 117.44 117.74 1l6i n TRP 83 Ca -0.05 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.29 1l6i n TRP 83 Cb 0.55 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.35 1l6i n TRP 83 CO 0.00 0.00 0.00 -0.92 -2.02 0.00 0.00 177.69 174.75 1l6i h TYR 84 N 1.02 -1.52 -0.53 -5.99 5.03 -1.89 -1.22 116.97 111.88 1l6i h TYR 84 Ca 0.00 0.06 -0.04 0.00 2.58 0.00 0.00 58.73 61.33 1l6i h TYR 84 Cb 0.35 0.69 -0.03 0.00 1.55 0.00 0.00 36.73 39.29 1l6i h TYR 84 CO 0.00 -0.52 0.16 0.37 -1.32 0.00 0.00 178.16 176.85 1l6i h GLN 85 N -0.53 0.79 -0.19 1.82 5.75 -1.93 0.62 115.11 121.44 1l6i h GLN 85 Ca 0.05 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 1l6i h GLN 85 Cb 0.66 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1l6i h GLN 85 CO -0.46 0.69 0.05 -0.44 -2.65 0.00 0.00 178.83 176.01 1l6i h ASP 86 N 0.77 0.29 -0.67 -0.69 3.32 -1.84 0.15 116.42 117.75 1l6i h ASP 86 Ca 0.18 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 1l6i h ASP 86 Cb 0.23 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1l6i h ASP 86 CO -0.01 0.45 0.10 0.58 -1.72 0.00 0.00 179.24 178.64 1l6i h VAL 87 N 0.12 1.26 -0.89 -1.35 2.07 -1.13 0.69 116.25 117.03 1l6i h VAL 87 Ca 0.06 -1.05 0.06 0.00 0.82 0.00 0.00 66.70 66.59 1l6i h VAL 87 Cb 0.27 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 1l6i h VAL 87 CO 0.00 0.39 0.56 -0.61 0.02 0.00 0.00 177.57 177.94 1l6i h GLN 88 N 1.04 1.01 -0.14 1.57 4.15 -0.49 -1.81 115.11 120.43 1l6i h GLN 88 Ca 0.20 -0.06 -0.17 0.00 0.77 0.00 0.00 58.65 59.39 1l6i h GLN 88 Cb 0.45 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1l6i h GLN 88 CO 0.01 0.67 -0.62 -0.44 -1.93 0.00 0.00 178.83 176.52 1l6i h ASP 89 N 1.04 0.55 0.68 -0.69 3.32 0.00 -3.04 116.42 118.27 1l6i h ASP 89 Ca 0.38 -0.32 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1l6i h ASP 89 Cb 0.14 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1l6i h ASP 89 CO -0.16 1.03 -0.25 0.28 -1.72 0.00 0.00 179.24 178.42 1l6i h SER 90 N 0.35 0.00 1.34 6.45 0.02 -0.27 -2.97 113.55 118.47 1l6i h SER 90 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1l6i h SER 90 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1l6i h SER 90 CO 0.11 0.25 -0.31 -0.07 -1.14 0.00 0.00 176.83 175.66 1l6i h LEU 91 N 0.00 0.00 -1.39 5.07 3.38 -1.24 -3.29 115.31 117.84 1l6i h LEU 91 Ca -0.00 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1l6i h LEU 91 Cb 0.66 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1l6i h LEU 91 CO 0.03 0.03 0.45 0.11 0.09 0.00 0.00 178.44 179.15 1l6i h LYS 92 N 0.00 0.76 0.00 1.13 1.57 -1.48 0.39 116.57 118.94 1l6i h LYS 92 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1l6i h LYS 92 Cb 0.83 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1l6i h LYS 92 CO 0.00 0.50 0.00 0.00 -0.57 0.00 0.00 179.45 179.38 1l6i n ALA 93 N -2.45 2.09 0.12 3.86 0.00 -1.24 -1.18 120.51 121.71 1l6i n ALA 93 Ca 0.09 -0.10 0.01 0.00 0.00 0.00 0.00 53.44 53.44 1l6i n ALA 93 Cb 0.16 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1l6i n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1l6i n TYR 94 N -1.05 0.00 -2.52 0.00 4.01 0.13 -4.96 117.16 112.77 1l6i n TYR 94 Ca 0.12 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.81 1l6i n TYR 94 Cb 0.07 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.11 1l6i n TYR 94 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1l6i n ASP 95 N -0.32 -2.59 -4.33 7.72 8.00 -0.32 -4.97 116.55 119.73 1l6i n ASP 95 Ca 0.01 -0.07 -0.34 0.00 0.71 0.00 0.00 54.79 55.10 1l6i n ASP 95 Cb 0.06 -1.39 -0.14 0.00 -0.02 0.00 0.00 41.12 39.63 1l6i n ASP 95 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1l6i s ILE 96 N -2.80 3.19 -0.41 0.53 -1.09 -0.84 -5.02 121.20 114.76 1l6i s ILE 96 Ca 0.08 -0.58 -0.24 0.00 -2.23 0.00 0.00 60.65 57.68 1l6i s ILE 96 Cb -0.04 -2.40 0.02 0.00 -1.58 0.00 0.00 42.46 38.46 1l6i s ILE 96 CO 0.10 0.48 0.83 0.21 -1.23 0.00 0.00 174.94 175.33 1l6i s ASN 97 N 0.93 6.52 0.21 3.58 2.47 -1.26 -4.21 114.94 123.17 1l6i s ASN 97 Ca -0.02 0.20 -0.15 0.00 0.42 0.00 0.00 52.86 53.32 1l6i s ASN 97 Cb -0.15 -2.41 0.23 0.00 -1.45 0.00 0.00 41.25 37.47 1l6i s ASN 97 CO -0.00 -0.86 1.62 0.25 -3.72 0.00 0.00 177.10 174.38 1l6i h LEU 98 N 10.06 -0.70 -0.72 3.21 5.85 -1.94 -1.51 115.31 129.56 1l6i h LEU 98 Ca -0.24 0.20 0.13 0.00 0.84 0.00 0.00 57.88 58.80 1l6i h LEU 98 Cb 1.09 0.43 -0.09 0.00 0.37 0.00 0.00 40.66 42.46 1l6i h LEU 98 CO 0.96 -0.23 0.28 0.74 -0.34 0.00 0.00 178.44 179.84 1l6i h THR 99 N -0.03 0.69 -0.37 1.05 2.02 -2.00 -0.97 112.91 113.29 1l6i h THR 99 Ca 0.30 -0.15 -0.14 0.00 0.77 0.00 0.00 66.41 67.19 1l6i h THR 99 Cb 0.49 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1l6i h THR 99 CO -0.67 0.08 -0.30 0.44 0.37 0.00 0.00 175.52 175.44 1l6i h ASP 100 N 0.44 0.90 -1.00 4.18 5.19 -1.86 -3.17 116.42 121.09 1l6i h ASP 100 Ca 0.39 -0.45 0.05 0.00 -0.62 0.00 0.00 57.03 56.40 1l6i h ASP 100 Cb 0.56 -0.25 -0.06 0.00 0.18 0.00 0.00 39.33 39.75 1l6i h ASP 100 CO -0.38 1.16 0.65 0.25 -3.12 0.00 0.00 179.24 177.80 1l6i h LEU 101 N 0.65 1.06 -1.63 1.55 5.85 -0.48 -2.31 115.31 120.01 1l6i h LEU 101 Ca 0.07 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1l6i h LEU 101 Cb 0.88 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1l6i h LEU 101 CO 0.08 0.70 -0.21 -0.07 -0.34 0.00 0.00 178.44 178.60 1l6i h LEU 102 N 1.22 0.00 0.00 2.25 3.38 -1.18 -1.99 115.31 118.98 1l6i h LEU 102 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1l6i h LEU 102 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1l6i h LEU 102 CO -0.15 0.21 0.00 -0.62 0.09 0.00 0.00 178.44 177.96 1l6i n GLU 103 N -4.06 0.29 0.25 1.13 -0.58 -0.87 -2.97 120.64 113.83 1l6i n GLU 103 Ca -0.02 0.09 0.17 0.00 -0.42 0.00 0.00 57.16 56.98 1l6i n GLU 103 Cb 0.28 -1.50 0.72 0.00 -0.57 0.00 0.00 31.44 30.37 1l6i n GLU 103 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1l6i h GLU 104 N 0.00 0.00 -6.23 3.49 4.39 -1.47 -3.45 114.58 111.31 1l6i h GLU 104 Ca 0.00 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.14 1l6i h GLU 104 Cb 0.19 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 1l6i h GLU 104 CO 0.00 0.00 0.82 -2.00 -1.16 0.00 0.00 179.01 176.67 1l6i s GLU 105 N -3.65 4.28 -0.07 2.33 2.12 -1.16 -5.02 118.70 117.53 1l6i s GLU 105 Ca 0.01 1.70 -0.30 0.00 0.36 0.00 0.00 54.97 56.74 1l6i s GLU 105 Cb 0.09 -3.68 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 1l6i s GLU 105 CO 0.47 -0.60 0.99 0.42 -0.54 0.00 0.00 175.26 176.00 1l6i s ILE 106 N 2.93 4.82 0.42 -3.70 1.01 -1.26 -4.98 121.20 120.44 1l6i s ILE 106 Ca 0.56 2.05 -0.26 0.00 0.00 0.00 0.00 60.65 63.00 1l6i s ILE 106 Cb -0.24 -4.31 -0.09 0.00 0.01 0.00 0.00 42.46 37.82 1l6i s ILE 106 CO 0.19 0.06 1.36 0.47 0.00 0.00 0.00 174.94 177.01 1l6i n ASP 107 N 4.61 2.99 -4.69 3.58 9.92 -1.26 -4.84 116.55 126.85 1l6i n ASP 107 Ca 0.08 1.13 -0.44 0.00 -0.53 0.00 0.00 54.79 55.03 1l6i n ASP 107 Cb 0.50 -1.55 -0.02 0.00 -0.64 0.00 0.00 41.12 39.40 1l6i n ASP 107 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1l6i n PRO 108 N 0.02 2.24 -3.00 -0.24 -0.02 -1.26 -4.81 135.00 127.93 1l6i n PRO 108 Ca 0.05 0.80 -0.44 0.00 -2.02 0.00 0.00 63.50 61.89 1l6i n PRO 108 Cb 0.40 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1l6i n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l6i n ALA 109 N 1.84 4.55 0.01 3.55 0.00 -1.26 -4.58 120.51 124.62 1l6i n ALA 109 Ca 0.10 -4.54 0.00 0.00 0.00 0.00 0.00 53.44 49.01 1l6i n ALA 109 Cb 0.33 -2.67 0.01 0.00 0.00 0.00 0.00 19.45 17.12 1l6i n ALA 109 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1l6i n LEU 110 N 3.32 1.56 0.00 0.00 4.77 -1.26 -3.22 117.00 122.17 1l6i n LEU 110 Ca 0.30 -1.48 -0.10 0.00 -0.03 0.00 0.00 56.01 54.70 1l6i n LEU 110 Cb 0.38 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1l6i n LEU 110 CO 0.63 0.39 0.12 0.61 -1.33 0.00 0.00 177.39 177.80 1l6i n GLY 111 N -0.17 2.41 2.00 -0.72 0.00 -1.25 -1.71 105.19 105.75 1l6i n GLY 111 Ca 0.01 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1l6i n GLY 111 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l6i n ASN 112 N -1.78 -0.05 0.00 1.61 2.85 -1.26 -4.52 115.26 112.12 1l6i n ASN 112 Ca 0.00 0.13 0.00 0.00 -0.11 0.00 0.00 54.58 54.61 1l6i n ASN 112 Cb 0.41 0.11 0.00 0.00 1.24 0.00 0.00 39.78 41.54 1l6i n ASN 112 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1l6i n GLY 113 N 1.50 4.53 0.37 8.20 0.00 -1.26 -4.94 105.19 113.59 1l6i n GLY 113 Ca 0.00 -0.86 0.14 0.00 0.00 0.00 0.00 46.02 45.30 1l6i n GLY 113 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1l6i h GLY 114 N 0.00 0.81 0.86 -0.02 0.00 -2.02 0.48 103.07 103.19 1l6i h GLY 114 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1l6i h GLY 114 CO 0.00 0.08 0.02 -2.00 0.00 0.00 0.00 176.54 174.64 1l6i h LEU 115 N 0.50 0.44 -0.89 3.11 5.85 -1.96 0.18 115.31 122.54 1l6i h LEU 115 Ca 0.37 -0.29 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 1l6i h LEU 115 Cb 0.74 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1l6i h LEU 115 CO -0.13 0.62 -0.37 1.23 -0.34 0.00 0.00 178.44 179.45 1l6i h GLY 116 N 0.25 0.39 1.83 3.75 0.00 -1.29 -2.25 103.07 105.75 1l6i h GLY 116 Ca 0.08 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 46.93 1l6i h GLY 116 CO 0.01 0.33 -0.49 -0.09 0.00 0.00 0.00 176.54 176.30 1l6i h ARG 117 N 0.31 0.19 -0.04 4.80 9.65 0.13 -1.06 114.38 128.35 1l6i h ARG 117 Ca 0.03 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 1l6i h ARG 117 Cb 0.79 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.38 1l6i h ARG 117 CO 0.06 0.64 -0.01 1.25 2.80 0.00 0.00 179.97 184.71 1l6i h LEU 118 N 0.15 0.09 -0.85 3.80 5.85 -0.53 0.03 115.31 123.85 1l6i h LEU 118 Ca 0.01 -0.39 0.15 0.00 0.84 0.00 0.00 57.88 58.49 1l6i h LEU 118 Cb 0.92 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.83 1l6i h LEU 118 CO 0.07 0.46 0.43 0.00 -0.34 0.00 0.00 178.44 179.06 1l6i h ALA 119 N 0.63 1.28 -0.13 1.25 0.00 -1.43 0.61 119.26 121.48 1l6i h ALA 119 Ca 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1l6i h ALA 119 Cb 0.42 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1l6i h ALA 119 CO 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 179.25 179.13 1l6i h ALA 120 N 1.57 0.18 -0.49 0.00 0.00 -1.33 0.27 119.26 119.46 1l6i h ALA 120 Ca 0.47 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.22 1l6i h ALA 120 Cb 0.68 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 1l6i h ALA 120 CO -0.37 -0.10 0.22 0.00 0.00 0.00 0.00 179.25 179.00 1l6i h PHE 122 N 0.43 1.10 -0.43 0.00 -1.00 0.19 -0.03 116.94 117.22 1l6i h PHE 122 Ca 0.22 -0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.96 1l6i h PHE 122 Cb 0.17 -0.35 -0.02 0.00 3.61 0.00 0.00 35.95 39.36 1l6i h PHE 122 CO -0.12 0.78 0.21 -0.07 -1.61 0.00 0.00 178.31 177.50 1l6i h LEU 123 N 1.11 0.55 -0.69 1.54 3.38 -0.75 -0.51 115.31 119.94 1l6i h LEU 123 Ca 0.28 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1l6i h LEU 123 Cb 0.05 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1l6i h LEU 123 CO -0.04 0.51 0.46 -0.78 0.09 0.00 0.00 178.44 178.68 1l6i h ASP 124 N 0.55 0.79 -0.04 -0.43 1.82 -0.76 -1.98 116.42 116.37 1l6i h ASP 124 Ca 0.15 -0.02 -0.00 0.00 -0.39 0.00 0.00 57.03 56.77 1l6i h ASP 124 Cb 0.10 -0.20 -0.00 0.00 0.68 0.00 0.00 39.33 39.91 1l6i h ASP 124 CO -0.02 0.57 0.02 0.28 -1.61 0.00 0.00 179.24 178.48 1l6i h SER 125 N 0.93 0.05 -0.81 2.28 0.02 -0.90 -1.16 113.55 113.95 1l6i h SER 125 Ca 0.25 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.23 1l6i h SER 125 Cb -0.10 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 1l6i h SER 125 CO -0.06 0.08 0.48 0.24 -1.14 0.00 0.00 176.83 176.43 1l6i h MET 126 N 0.01 0.83 -0.57 3.45 2.86 -0.97 0.59 114.93 121.13 1l6i h MET 126 Ca 0.01 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1l6i h MET 126 Cb 0.04 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.49 1l6i h MET 126 CO -0.00 0.55 0.09 0.00 1.06 0.00 0.00 176.91 178.61 1l6i h ALA 127 N 1.41 1.09 -0.30 6.32 0.00 -1.22 0.02 119.26 126.58 1l6i h ALA 127 Ca 0.37 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1l6i h ALA 127 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1l6i h ALA 127 CO -0.20 0.59 -0.42 1.15 0.00 0.00 0.00 179.25 180.37 1l6i h THR 128 N 0.87 1.29 -0.38 0.00 2.02 0.20 -2.80 112.91 114.11 1l6i h THR 128 Ca 0.18 -1.61 0.00 0.00 0.77 0.00 0.00 66.41 65.75 1l6i h THR 128 Cb 0.38 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1l6i h THR 128 CO 0.01 0.52 0.00 1.33 0.37 0.00 0.00 175.52 177.75 1l6i n VAL 129 N -4.03 1.38 -2.12 3.16 0.24 0.19 -4.77 118.33 112.38 1l6i n VAL 129 Ca -0.02 -0.78 -0.19 0.00 -2.04 0.00 0.00 64.34 61.31 1l6i n VAL 129 Cb 0.55 -0.18 -0.03 0.00 -1.47 0.00 0.00 33.84 32.71 1l6i n VAL 129 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1l6i n GLY 130 N 0.62 0.25 3.56 7.63 0.00 -0.95 -4.79 105.19 111.50 1l6i n GLY 130 Ca 0.16 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1l6i n GLY 130 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1l6i s GLN 131 N -4.55 3.47 0.12 1.61 2.00 -0.05 -0.18 119.66 122.08 1l6i s GLN 131 Ca 0.00 0.09 -0.35 0.00 -2.00 0.00 0.00 55.36 53.10 1l6i s GLN 131 Cb 0.00 -4.01 -0.14 0.00 0.80 0.00 0.00 33.01 29.66 1l6i s GLN 131 CO 0.00 -1.53 1.56 0.45 -0.50 0.00 0.00 175.29 175.27 1l6i n SER 132 N 7.89 2.84 -3.47 6.67 2.88 -1.26 -4.50 113.62 124.66 1l6i n SER 132 Ca 0.06 1.08 -0.14 0.00 -1.33 0.00 0.00 58.87 58.54 1l6i n SER 132 Cb 0.48 -1.37 -0.04 0.00 -0.75 0.00 0.00 64.21 62.54 1l6i n SER 132 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1l6i s ALA 133 N 1.15 -1.70 -0.04 -1.46 0.00 -1.26 -1.30 121.76 117.15 1l6i s ALA 133 Ca 0.81 0.90 0.01 0.00 0.00 0.00 0.00 51.96 53.69 1l6i s ALA 133 Cb -0.74 0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.83 1l6i s ALA 133 CO 0.41 -0.59 -0.05 0.99 0.00 0.00 0.00 175.76 176.52 1l6i s THR 134 N -2.59 0.58 0.11 0.00 2.01 0.17 -4.56 115.64 111.36 1l6i s THR 134 Ca -0.03 -0.17 -0.22 0.00 0.31 0.00 0.00 61.69 61.57 1l6i s THR 134 Cb -0.01 -0.58 -0.07 0.00 0.01 0.00 0.00 72.50 71.85 1l6i s THR 134 CO -0.03 0.22 0.66 -0.83 -0.69 0.00 0.00 174.62 173.95 1l6i s GLY 135 N 0.73 2.78 -0.24 4.40 0.00 -1.12 -1.48 107.32 112.39 1l6i s GLY 135 Ca -0.10 0.18 0.01 0.00 0.00 0.00 0.00 44.72 44.81 1l6i s GLY 135 CO 0.00 0.65 -0.07 -0.19 0.00 0.00 0.00 173.10 173.49 1l6i s TYR 136 N -1.11 2.58 0.00 1.90 2.02 -0.56 -0.30 117.35 121.88 1l6i s TYR 136 Ca 0.32 -1.87 0.00 0.00 -0.37 0.00 0.00 57.07 55.15 1l6i s TYR 136 Cb -0.21 -1.65 0.00 0.00 -0.40 0.00 0.00 41.96 39.70 1l6i s TYR 136 CO 0.22 -0.80 0.00 0.41 -1.57 0.00 0.00 175.55 173.82 1l6i n GLY 137 N 4.62 5.32 3.52 0.71 0.00 -0.89 -1.98 105.19 116.49 1l6i n GLY 137 Ca -0.13 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 1l6i n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l6i s LEU 138 N 0.00 2.99 -1.32 0.99 1.43 -1.26 -0.57 118.68 120.94 1l6i s LEU 138 Ca 0.00 -0.11 -0.12 0.00 -1.03 0.00 0.00 54.13 52.87 1l6i s LEU 138 Cb 0.00 -1.65 0.12 0.00 0.03 0.00 0.00 46.19 44.70 1l6i s LEU 138 CO 0.00 0.32 1.91 -3.20 0.23 0.00 0.00 176.35 175.61 1l6i n ASN 139 N 2.48 4.75 -4.70 2.29 4.05 0.14 -4.67 115.26 119.61 1l6i n ASN 139 Ca -0.18 -3.00 -0.42 0.00 0.45 0.00 0.00 54.58 51.43 1l6i n ASN 139 Cb 0.53 -1.56 -0.03 0.00 1.23 0.00 0.00 39.78 39.94 1l6i n ASN 139 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1l6i s TYR 140 N 1.65 2.44 0.18 1.20 2.02 -1.26 -4.84 117.35 118.75 1l6i s TYR 140 Ca 0.43 0.19 -0.10 0.00 -0.37 0.00 0.00 57.07 57.23 1l6i s TYR 140 Cb 0.09 -4.09 0.09 0.00 -0.40 0.00 0.00 41.96 37.65 1l6i s TYR 140 CO -0.02 -4.37 1.71 0.37 -1.57 0.00 0.00 175.55 171.68 1l6i h GLN 141 N 8.03 1.02 0.00 -0.62 4.15 -1.05 -3.35 115.11 123.28 1l6i h GLN 141 Ca -0.44 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 58.76 1l6i h GLN 141 Cb 1.21 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1l6i h GLN 141 CO 0.94 0.89 -0.09 0.66 -1.93 0.00 0.00 178.83 179.31 1l6i n TYR 142 N -4.34 0.00 -4.98 3.99 4.01 0.46 -4.08 117.16 112.21 1l6i n TYR 142 Ca 0.04 -0.50 0.00 0.00 -0.16 0.00 0.00 57.90 57.29 1l6i n TYR 142 Cb 0.22 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1l6i n TYR 142 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1l6i n GLY 143 N -0.64 1.61 0.04 2.72 0.00 -1.20 -2.65 105.19 105.07 1l6i n GLY 143 Ca 0.05 -0.54 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 1l6i n GLY 143 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1l6i h LEU 144 N 0.00 0.00 0.00 0.99 5.85 -1.79 -0.85 115.31 119.50 1l6i h LEU 144 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1l6i h LEU 144 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1l6i h LEU 144 CO 0.00 0.44 0.00 2.22 -0.34 0.00 0.00 178.44 180.76 1l6i n PHE 145 N -4.12 0.00 -2.97 1.25 -1.74 -1.26 -4.76 117.46 103.86 1l6i n PHE 145 Ca -0.02 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.46 1l6i n PHE 145 Cb 0.06 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.01 1l6i n PHE 145 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 1l6i s ARG 146 N -2.00 4.22 -0.01 3.97 3.52 0.04 -4.76 118.95 123.94 1l6i s ARG 146 Ca 0.00 0.84 -0.16 0.00 -0.13 0.00 0.00 55.73 56.28 1l6i s ARG 146 Cb 0.00 -3.60 -0.06 0.00 -1.56 0.00 0.00 34.95 29.73 1l6i s ARG 146 CO 0.00 -0.37 0.45 -1.14 -0.81 0.00 0.00 175.30 173.43 1l6i s GLN 147 N 2.31 4.04 0.15 5.12 0.74 -1.26 -1.90 119.66 128.86 1l6i s GLN 147 Ca 0.33 0.48 -0.05 0.00 0.05 0.00 0.00 55.36 56.17 1l6i s GLN 147 Cb -0.16 -3.26 -0.02 0.00 1.10 0.00 0.00 33.01 30.67 1l6i s GLN 147 CO 0.10 0.59 0.17 -1.54 -0.55 0.00 0.00 175.29 174.06 1l6i s SER 148 N -0.80 0.18 -0.06 6.67 1.04 -1.10 -3.90 113.70 115.73 1l6i s SER 148 Ca 0.25 -1.03 0.06 0.00 0.48 0.00 0.00 55.95 55.70 1l6i s SER 148 Cb -0.17 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.31 1l6i s SER 148 CO 0.14 -0.81 -0.24 -0.36 0.98 0.00 0.00 173.24 172.95 1l6i s PHE 149 N -4.00 2.36 -0.10 5.02 0.08 -1.26 -0.17 117.98 119.92 1l6i s PHE 149 Ca 0.20 -0.73 -0.01 0.00 0.12 0.00 0.00 56.93 56.51 1l6i s PHE 149 Cb 0.05 -1.56 0.03 0.00 -0.57 0.00 0.00 43.02 40.98 1l6i s PHE 149 CO 0.01 -0.24 -0.03 0.08 -0.10 0.00 0.00 175.22 174.94 1l6i s VAL 150 N -0.08 0.69 -1.63 -0.44 1.01 -0.20 -4.71 120.40 115.04 1l6i s VAL 150 Ca -0.05 -0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1l6i s VAL 150 Cb -0.14 -0.80 0.13 0.00 0.00 0.00 0.00 36.38 35.56 1l6i s VAL 150 CO 0.04 0.28 0.86 0.47 0.00 0.00 0.00 175.10 176.75 1l6i n ASP 151 N 5.05 -3.82 0.00 3.32 8.00 -1.26 -1.75 116.55 126.09 1l6i n ASP 151 Ca -0.10 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1l6i n ASP 151 Cb 0.50 -3.21 0.00 0.00 -0.02 0.00 0.00 41.12 38.39 1l6i n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l6i n GLY 152 N -1.53 1.05 3.67 0.44 0.00 -1.26 -5.02 105.19 102.54 1l6i n GLY 152 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1l6i n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l6i s LYS 153 N -0.09 2.50 0.19 1.61 1.02 -0.72 -3.91 119.74 120.33 1l6i s LYS 153 Ca 0.00 -0.85 -0.31 0.00 0.02 0.00 0.00 55.97 54.83 1l6i s LYS 153 Cb 0.00 -2.51 -0.09 0.00 -0.52 0.00 0.00 37.83 34.71 1l6i s LYS 153 CO 0.00 0.54 1.44 -1.14 -0.92 0.00 0.00 175.35 175.27 1l6i s GLN 154 N -2.21 4.29 -0.03 1.68 0.74 -1.26 -1.03 119.66 121.84 1l6i s GLN 154 Ca 0.24 2.22 0.07 0.00 0.05 0.00 0.00 55.36 57.94 1l6i s GLN 154 Cb -0.12 -3.17 -0.02 0.00 1.10 0.00 0.00 33.01 30.80 1l6i s GLN 154 CO 0.17 -0.44 -0.25 0.08 -0.55 0.00 0.00 175.29 174.30 1l6i s VAL 155 N 0.58 2.16 -0.19 1.34 1.01 0.77 -4.89 120.40 121.17 1l6i s VAL 155 Ca 0.63 -1.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 1l6i s VAL 155 Cb -0.40 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1l6i s VAL 155 CO 0.36 0.58 0.08 -1.61 0.00 0.00 0.00 175.10 174.51 1l6i s GLU 156 N -0.57 3.96 0.29 2.72 8.01 -1.26 -2.71 118.70 129.14 1l6i s GLU 156 Ca 0.09 -0.34 0.02 0.00 0.01 0.00 0.00 54.97 54.74 1l6i s GLU 156 Cb -0.11 -3.27 -0.06 0.00 -4.31 0.00 0.00 34.13 26.39 1l6i s GLU 156 CO -0.00 0.21 0.08 0.00 0.01 0.00 0.00 175.26 175.56 1l6i s ALA 157 N 0.55 1.99 0.25 5.21 0.00 -0.80 -4.95 121.76 124.01 1l6i s ALA 157 Ca 0.04 -1.94 -0.30 0.00 0.00 0.00 0.00 51.96 49.76 1l6i s ALA 157 Cb -0.13 0.90 -0.09 0.00 0.00 0.00 0.00 23.12 23.80 1l6i s ALA 157 CO 0.01 -0.40 1.32 -2.14 0.00 0.00 0.00 175.76 174.54 1l6i s PRO 158 N -3.97 4.38 -1.18 0.00 0.02 -1.26 -0.78 135.00 132.20 1l6i s PRO 158 Ca 0.37 2.12 -0.08 0.00 0.02 0.00 0.00 61.00 63.42 1l6i s PRO 158 Cb 0.08 -3.15 0.23 0.00 0.02 0.00 0.00 34.50 31.68 1l6i s PRO 158 CO 0.14 -0.23 1.56 -3.47 -0.33 0.00 0.00 177.00 174.67 1l6i n ASP 159 N 2.03 5.60 -4.67 2.53 2.03 -1.08 -4.37 116.55 118.62 1l6i n ASP 159 Ca 0.04 -3.17 -0.43 0.00 0.52 0.00 0.00 54.79 51.76 1l6i n ASP 159 Cb 0.42 -1.42 -0.02 0.00 -0.72 0.00 0.00 41.12 39.38 1l6i n ASP 159 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1l6i s ASP 160 N 0.47 6.86 -0.15 1.67 -1.08 -1.26 -4.23 116.67 118.95 1l6i s ASP 160 Ca 0.36 1.90 0.17 0.00 -0.52 0.00 0.00 52.55 54.46 1l6i s ASP 160 Cb 0.03 -2.54 0.33 0.00 -1.46 0.00 0.00 42.92 39.27 1l6i s ASP 160 CO 0.02 -0.79 1.17 -2.67 0.52 0.00 0.00 175.17 173.42 1l6i n TRP 161 N 6.51 0.00 -3.38 -5.34 4.27 -1.26 -4.97 117.44 113.28 1l6i n TRP 161 Ca 0.15 -1.14 -0.17 0.00 -3.89 0.00 0.00 57.50 52.45 1l6i n TRP 161 Cb 0.44 -0.18 0.08 0.00 -1.36 0.00 0.00 31.31 30.29 1l6i n TRP 161 CO 0.00 0.00 0.00 0.72 -2.29 0.00 0.00 177.69 176.12 1l6i n HIS 162 N -1.35 -2.28 -0.24 -2.67 8.25 -1.26 -4.86 115.22 110.81 1l6i n HIS 162 Ca 0.17 0.90 -0.03 0.00 -0.26 0.00 0.00 57.72 58.50 1l6i n HIS 162 Cb 0.65 -4.71 0.08 0.00 1.12 0.00 0.00 29.99 27.13 1l6i n HIS 162 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1l6i h ARG 163 N -1.61 0.78 0.00 -0.41 2.43 -1.93 -2.13 114.38 111.51 1l6i h ARG 163 Ca -0.60 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.52 1l6i h ARG 163 Cb 1.33 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1l6i h ARG 163 CO 0.48 0.52 -0.04 0.66 -1.51 0.00 0.00 179.97 180.07 1l6i h SER 164 N 0.80 0.00 -0.52 -3.80 4.64 -1.97 -1.38 113.55 111.32 1l6i h SER 164 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1l6i h SER 164 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1l6i h SER 164 CO -0.12 0.04 0.00 0.59 -0.87 0.00 0.00 176.83 176.47 1l6i n ASN 165 N -3.26 3.49 -4.66 4.97 3.02 -0.82 -4.99 115.26 113.01 1l6i n ASN 165 Ca -0.01 -1.97 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 1l6i n ASN 165 Cb 0.22 -0.34 -0.03 0.00 -0.61 0.00 0.00 39.78 39.02 1l6i n ASN 165 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1l6i s TYR 166 N -1.12 1.74 -0.28 3.10 5.04 -0.52 -4.86 117.35 120.46 1l6i s TYR 166 Ca 0.38 -0.04 0.28 0.00 -2.44 0.00 0.00 57.07 55.25 1l6i s TYR 166 Cb 0.21 -4.04 1.09 0.00 0.35 0.00 0.00 41.96 39.57 1l6i s TYR 166 CO 0.28 -4.48 1.82 -1.00 -1.34 0.00 0.00 175.55 170.83 1l6i h PRO 167 N 9.86 0.00 0.00 4.97 0.13 -1.92 -2.47 132.00 142.58 1l6i h PRO 167 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1l6i h PRO 167 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1l6i h PRO 167 CO 0.95 0.00 -0.15 0.91 -0.23 0.00 0.00 178.00 179.48 1l6i n TRP 168 N -2.60 0.30 -1.08 1.56 7.02 -1.26 -4.40 117.44 116.98 1l6i n TRP 168 Ca 0.02 0.09 -0.31 0.00 -1.02 0.00 0.00 57.50 56.27 1l6i n TRP 168 Cb 0.29 -0.59 0.12 0.00 -2.42 0.00 0.00 31.31 28.71 1l6i n TRP 168 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1l6i s PHE 169 N -3.04 2.27 -0.08 -5.99 0.08 -0.93 -4.49 117.98 105.79 1l6i s PHE 169 Ca 0.12 1.62 -0.06 0.00 0.12 0.00 0.00 56.93 58.72 1l6i s PHE 169 Cb 0.16 -3.14 0.03 0.00 -0.57 0.00 0.00 43.02 39.50 1l6i s PHE 169 CO 0.60 -2.14 0.21 -0.98 -0.10 0.00 0.00 175.22 172.80 1l6i s ARG 170 N -4.82 0.22 -0.15 0.44 1.70 0.36 -4.97 118.95 111.73 1l6i s ARG 170 Ca 0.63 0.33 0.00 0.00 -0.47 0.00 0.00 55.73 56.22 1l6i s ARG 170 Cb -0.19 0.06 0.03 0.00 -0.57 0.00 0.00 34.95 34.27 1l6i s ARG 170 CO 0.57 -0.06 -0.13 -1.58 -1.08 0.00 0.00 175.30 173.02 1l6i s HIS 171 N 0.36 2.15 -0.40 5.89 5.65 -1.26 -1.06 115.29 126.61 1l6i s HIS 171 Ca -0.02 -1.24 -0.05 0.00 0.25 0.00 0.00 55.06 54.00 1l6i s HIS 171 Cb -0.04 -1.57 0.09 0.00 -1.18 0.00 0.00 32.58 29.89 1l6i s HIS 171 CO -0.02 -0.67 0.21 1.21 -0.65 0.00 0.00 174.74 174.82 1l6i s ASN 172 N 1.49 5.37 0.62 9.88 2.47 -1.26 -4.96 114.94 128.55 1l6i s ASN 172 Ca 0.04 -1.76 0.31 0.00 0.42 0.00 0.00 52.86 51.87 1l6i s ASN 172 Cb -0.13 -1.88 1.72 0.00 -1.45 0.00 0.00 41.25 39.51 1l6i s ASN 172 CO -0.10 -0.52 2.05 1.05 -3.72 0.00 0.00 177.10 175.86 1l6i h GLU 173 N 8.19 0.00 0.00 0.43 4.11 -1.98 0.73 114.58 126.06 1l6i h GLU 173 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 1l6i h GLU 173 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1l6i h GLU 173 CO 0.71 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.79 1l6i n ALA 174 N -2.18 1.68 0.62 1.06 0.00 -1.26 -1.92 120.51 118.51 1l6i n ALA 174 Ca 0.01 0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.61 1l6i n ALA 174 Cb 0.36 -1.38 0.25 0.00 0.00 0.00 0.00 19.45 18.68 1l6i n ALA 174 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1l6i n LEU 175 N -2.20 2.46 -4.71 0.00 4.77 0.25 -4.94 117.00 112.64 1l6i n LEU 175 Ca 0.02 -1.18 -0.33 0.00 -0.03 0.00 0.00 56.01 54.49 1l6i n LEU 175 Cb 0.23 -0.27 0.12 0.00 -2.33 0.00 0.00 43.42 41.17 1l6i n LEU 175 CO 0.20 0.59 0.76 -1.81 -1.33 0.00 0.00 177.39 175.80 1l6i s ASP 176 N -1.17 3.76 0.01 -1.43 1.01 -0.81 -4.58 116.67 113.46 1l6i s ASP 176 Ca 0.33 2.30 0.01 0.00 0.71 0.00 0.00 52.55 55.90 1l6i s ASP 176 Cb 0.17 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.52 1l6i s ASP 176 CO 0.24 -2.55 -0.04 0.68 0.21 0.00 0.00 175.17 173.70 1l6i s VAL 177 N -2.22 0.33 -0.09 -1.27 -7.23 -0.97 -4.97 120.40 103.98 1l6i s VAL 177 Ca 0.72 -0.37 -0.17 0.00 -1.81 0.00 0.00 61.98 60.35 1l6i s VAL 177 Cb -0.27 -0.32 -0.05 0.00 0.56 0.00 0.00 36.38 36.31 1l6i s VAL 177 CO 0.50 -0.03 0.46 -1.10 -0.31 0.00 0.00 175.10 174.62 1l6i s GLN 178 N -0.43 4.26 -0.12 4.82 -1.52 -1.26 -0.94 119.66 124.46 1l6i s GLN 178 Ca -0.02 0.45 0.01 0.00 -1.95 0.00 0.00 55.36 53.85 1l6i s GLN 178 Cb -0.03 -3.39 0.02 0.00 -0.22 0.00 0.00 33.01 29.39 1l6i s GLN 178 CO -0.00 0.28 -0.13 0.08 -0.25 0.00 0.00 175.29 175.27 1l6i s VAL 179 N 0.21 1.39 0.35 1.09 1.01 0.22 -4.96 120.40 119.71 1l6i s VAL 179 Ca 0.25 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.56 1l6i s VAL 179 Cb -0.16 -1.31 -0.08 0.00 0.00 0.00 0.00 36.38 34.84 1l6i s VAL 179 CO 0.11 0.42 0.73 -0.83 0.00 0.00 0.00 175.10 175.54 1l6i s GLY 180 N 1.27 2.13 -0.00 4.51 0.00 -1.26 -0.68 107.32 113.28 1l6i s GLY 180 Ca -0.01 -0.11 -0.06 0.00 0.00 0.00 0.00 44.72 44.54 1l6i s GLY 180 CO -0.05 0.08 0.11 -1.50 0.00 0.00 0.00 173.10 171.74 1l6i s ILE 181 N -2.16 0.08 0.00 0.90 2.07 0.15 -4.95 121.20 117.29 1l6i s ILE 181 Ca 0.52 -0.63 0.00 0.00 -1.41 0.00 0.00 60.65 59.13 1l6i s ILE 181 Cb -0.10 -0.37 0.00 0.00 0.13 0.00 0.00 42.46 42.12 1l6i s ILE 181 CO 0.25 -0.35 0.00 0.61 -1.91 0.00 0.00 174.94 173.54 1l6i n GLY 182 N 1.69 0.18 7.00 1.50 0.00 0.13 -1.82 105.19 113.87 1l6i n GLY 182 Ca -0.21 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1l6i n GLY 182 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l6i n GLY 183 N 0.00 -0.18 3.32 -0.02 0.00 -1.26 -3.78 105.19 103.27 1l6i n GLY 183 Ca 0.00 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 1l6i n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l6i s LYS 184 N 0.00 1.12 -0.10 1.61 -2.85 -0.77 -4.84 119.74 113.90 1l6i s LYS 184 Ca 0.00 -1.15 -0.10 0.00 -1.00 0.00 0.00 55.97 53.72 1l6i s LYS 184 Cb 0.00 0.37 -0.05 0.00 -2.06 0.00 0.00 37.83 36.10 1l6i s LYS 184 CO 0.00 -0.40 0.22 0.08 0.10 0.00 0.00 175.35 175.35 1l6i s VAL 185 N -3.96 5.36 0.89 1.79 1.01 -1.26 -0.22 120.40 124.02 1l6i s VAL 185 Ca 0.16 0.39 -0.11 0.00 0.00 0.00 0.00 61.98 62.42 1l6i s VAL 185 Cb 0.04 -3.51 0.18 0.00 0.00 0.00 0.00 36.38 33.08 1l6i s VAL 185 CO -0.01 0.57 1.22 0.42 0.00 0.00 0.00 175.10 177.29 1l6i s THR 186 N -0.73 2.04 0.31 3.92 -4.23 0.86 -4.86 115.64 112.95 1l6i s THR 186 Ca 0.16 -0.18 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1l6i s THR 186 Cb -0.13 -2.86 0.19 0.00 1.34 0.00 0.00 72.50 71.04 1l6i s THR 186 CO 0.06 0.00 1.89 0.11 -0.54 0.00 0.00 174.62 176.14 1l6i h LYS 187 N -1.30 0.77 -0.16 3.99 1.79 -1.99 0.06 116.57 119.73 1l6i h LYS 187 Ca -0.42 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 57.93 1l6i h LYS 187 Cb 1.25 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1l6i h LYS 187 CO 0.39 0.65 0.00 -0.40 -1.08 0.00 0.00 179.45 179.01 1l6i n ASP 188 N -4.32 1.58 0.00 0.86 5.68 -1.26 -4.95 116.55 114.13 1l6i n ASP 188 Ca 0.04 -1.70 0.00 0.00 -0.50 0.00 0.00 54.79 52.64 1l6i n ASP 188 Cb 0.17 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1l6i n ASP 188 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1l6i n GLY 189 N 1.11 1.02 3.76 6.12 0.00 0.01 -5.10 105.19 112.12 1l6i n GLY 189 Ca 0.16 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1l6i n GLY 189 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l6i s ARG 190 N -0.18 3.61 -0.21 1.61 0.52 -1.26 -4.77 118.95 118.27 1l6i s ARG 190 Ca 0.00 -0.24 -0.18 0.00 -0.52 0.00 0.00 55.73 54.79 1l6i s ARG 190 Cb 0.00 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 1l6i s ARG 190 CO 0.00 0.57 0.50 -0.46 0.02 0.00 0.00 175.30 175.93 1l6i s TRP 191 N -0.45 3.35 -0.42 -0.53 -0.00 -1.26 -0.10 118.94 119.53 1l6i s TRP 191 Ca 0.11 0.72 -0.01 0.00 -0.00 0.00 0.00 56.10 56.92 1l6i s TRP 191 Cb -0.12 -2.66 0.11 0.00 -0.00 0.00 0.00 33.47 30.81 1l6i s TRP 191 CO 0.02 -0.13 0.19 -1.21 -0.00 0.00 0.00 176.95 175.82 1l6i s GLU 192 N 1.74 1.91 0.61 5.86 2.02 0.69 -4.97 118.70 126.56 1l6i s GLU 192 Ca 0.23 -1.96 -0.17 0.00 0.02 0.00 0.00 54.97 53.09 1l6i s GLU 192 Cb -0.15 -3.48 -0.02 0.00 0.10 0.00 0.00 34.13 30.57 1l6i s GLU 192 CO 0.09 -1.05 1.13 -2.14 0.02 0.00 0.00 175.26 173.31 1l6i s PRO 193 N 0.87 3.00 0.03 0.39 0.02 -1.26 -1.85 135.00 136.20 1l6i s PRO 193 Ca 0.10 1.53 0.21 0.00 0.02 0.00 0.00 61.00 62.86 1l6i s PRO 193 Cb -0.22 -1.97 -0.20 0.00 0.02 0.00 0.00 34.50 32.14 1l6i s PRO 193 CO -0.05 -1.11 0.65 -0.85 -0.33 0.00 0.00 177.00 175.31 1l6i n GLU 194 N -1.93 0.64 -4.37 5.54 0.28 -0.76 -4.79 120.64 115.26 1l6i n GLU 194 Ca 0.11 -0.02 -0.19 0.00 -0.16 0.00 0.00 57.16 56.91 1l6i n GLU 194 Cb 0.51 -1.66 -0.14 0.00 1.43 0.00 0.00 31.44 31.58 1l6i n GLU 194 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1l6i s PHE 195 N -3.26 0.89 -0.16 -1.84 5.36 -0.95 -4.98 117.98 113.04 1l6i s PHE 195 Ca -0.05 -0.21 0.01 0.00 -0.96 0.00 0.00 56.93 55.72 1l6i s PHE 195 Cb 0.11 -0.56 0.02 0.00 -0.34 0.00 0.00 43.02 42.24 1l6i s PHE 195 CO 0.85 -0.01 -0.19 0.99 -1.46 0.00 0.00 175.22 175.39 1l6i s THR 196 N -0.39 1.96 -0.05 0.12 2.01 -1.26 -0.67 115.64 117.36 1l6i s THR 196 Ca 0.02 -0.89 -0.04 0.00 0.31 0.00 0.00 61.69 61.09 1l6i s THR 196 Cb -0.05 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.65 1l6i s THR 196 CO -0.00 0.53 0.15 -0.63 -0.69 0.00 0.00 174.62 173.98 1l6i s ILE 197 N 1.18 5.34 -0.28 1.82 1.01 0.14 -4.76 121.20 125.64 1l6i s ILE 197 Ca 0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 60.65 60.52 1l6i s ILE 197 Cb -0.14 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 1l6i s ILE 197 CO -0.09 0.44 0.10 -0.89 0.00 0.00 0.00 174.94 174.49 1l6i s THR 198 N -1.20 4.28 -0.08 2.92 2.01 -0.20 -0.61 115.64 122.76 1l6i s THR 198 Ca 0.22 -0.43 -0.15 0.00 0.31 0.00 0.00 61.69 61.64 1l6i s THR 198 Cb -0.12 -3.13 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 1l6i s THR 198 CO 0.13 0.17 0.39 -0.83 -0.69 0.00 0.00 174.62 173.79 1l6i s GLY 199 N 1.58 2.38 0.00 4.40 0.00 -0.12 -1.42 107.32 114.13 1l6i s GLY 199 Ca 0.05 -0.28 0.02 0.00 0.00 0.00 0.00 44.72 44.51 1l6i s GLY 199 CO 0.04 0.41 -0.02 1.20 0.00 0.00 0.00 173.10 174.73 1l6i s GLN 200 N -0.12 2.69 -0.34 2.90 -0.21 0.14 -2.29 119.66 122.43 1l6i s GLN 200 Ca 0.22 -0.66 -0.19 0.00 0.02 0.00 0.00 55.36 54.75 1l6i s GLN 200 Cb -0.15 -2.60 -0.01 0.00 1.00 0.00 0.00 33.01 31.25 1l6i s GLN 200 CO 0.10 0.61 0.57 0.00 -2.12 0.00 0.00 175.29 174.45 1l6i s ALA 201 N -1.06 3.49 -0.39 6.09 0.00 -1.26 -0.99 121.76 127.64 1l6i s ALA 201 Ca 0.19 -0.86 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 1l6i s ALA 201 Cb -0.11 -3.07 0.07 0.00 0.00 0.00 0.00 23.12 20.01 1l6i s ALA 201 CO 0.09 -1.18 0.19 -1.58 0.00 0.00 0.00 175.76 173.28 1l6i s TRP 202 N 2.52 3.37 -0.07 0.00 0.52 -0.78 -4.04 118.94 120.46 1l6i s TRP 202 Ca 0.22 -1.75 -0.15 0.00 0.02 0.00 0.00 56.10 54.43 1l6i s TRP 202 Cb -0.15 -2.79 -0.05 0.00 -1.15 0.00 0.00 33.47 29.33 1l6i s TRP 202 CO 0.13 -0.85 0.40 -0.51 0.02 0.00 0.00 176.95 176.14 1l6i s ASP 203 N 1.82 6.70 0.04 2.95 1.01 -0.22 -0.82 116.67 128.13 1l6i s ASP 203 Ca 0.02 0.83 0.08 0.00 0.71 0.00 0.00 52.55 54.19 1l6i s ASP 203 Cb -0.22 -2.25 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 1l6i s ASP 203 CO 0.00 0.19 -0.23 -0.76 0.21 0.00 0.00 175.17 174.58 1l6i s LEU 204 N -0.29 2.15 0.05 1.23 1.43 -0.80 -0.48 118.68 121.97 1l6i s LEU 204 Ca 0.23 -0.54 -0.21 0.00 -1.03 0.00 0.00 54.13 52.58 1l6i s LEU 204 Cb -0.15 -1.13 -0.06 0.00 0.03 0.00 0.00 46.19 44.87 1l6i s LEU 204 CO 0.11 0.22 0.63 -2.16 0.23 0.00 0.00 176.35 175.37 1l6i s PRO 205 N -1.12 4.33 -0.42 1.29 0.05 -1.26 -0.69 135.00 137.17 1l6i s PRO 205 Ca 0.09 0.82 -0.16 0.00 0.05 0.00 0.00 61.00 61.81 1l6i s PRO 205 Cb -0.09 -3.30 0.03 0.00 0.05 0.00 0.00 34.50 31.19 1l6i s PRO 205 CO 0.02 0.47 0.34 0.08 0.05 0.00 0.00 177.00 177.96 1l6i s VAL 206 N -0.59 5.22 -0.32 -0.36 1.01 0.90 -4.87 120.40 121.40 1l6i s VAL 206 Ca 0.32 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 1l6i s VAL 206 Cb -0.19 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1l6i s VAL 206 CO 0.19 -0.38 0.55 -0.69 0.00 0.00 0.00 175.10 174.77 1l6i s VAL 207 N 1.77 5.00 0.57 2.92 1.01 -1.26 -2.81 120.40 127.60 1l6i s VAL 207 Ca 0.06 0.61 -0.15 0.00 0.00 0.00 0.00 61.98 62.50 1l6i s VAL 207 Cb -0.20 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1l6i s VAL 207 CO 0.10 -0.13 1.02 -0.83 0.00 0.00 0.00 175.10 175.27 1l6i s GLY 208 N 1.69 2.01 -0.48 4.51 0.00 -0.60 -4.86 107.32 109.59 1l6i s GLY 208 Ca 0.21 0.23 -0.28 0.00 0.00 0.00 0.00 44.72 44.88 1l6i s GLY 208 CO 0.12 0.52 1.42 -0.47 0.00 0.00 0.00 173.10 174.69 1l6i s TYR 209 N -2.65 2.34 -1.54 1.90 5.04 -1.26 -4.08 117.35 117.09 1l6i s TYR 209 Ca 0.60 0.59 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 1l6i s TYR 209 Cb -0.13 -4.34 0.00 0.00 0.35 0.00 0.00 41.96 37.84 1l6i s TYR 209 CO 0.38 -1.97 0.00 0.54 -1.34 0.00 0.00 175.55 173.16 1l6i n ARG 210 N 8.35 -1.78 0.00 4.97 5.12 0.10 -4.81 116.66 128.60 1l6i n ARG 210 Ca 0.15 0.87 0.00 0.00 -1.93 0.00 0.00 57.85 56.94 1l6i n ARG 210 Cb 0.49 -5.42 0.00 0.00 -1.16 0.00 0.00 32.46 26.37 1l6i n ARG 210 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1l6i n ASN 211 N -1.65 0.55 -0.01 0.55 0.23 -1.26 -4.09 115.26 109.57 1l6i n ASN 211 Ca -0.19 -0.90 -0.00 0.00 -0.53 0.00 0.00 54.58 52.96 1l6i n ASN 211 Cb 0.63 0.10 -0.00 0.00 -2.08 0.00 0.00 39.78 38.43 1l6i n ASN 211 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1l6i n GLY 212 N 0.10 0.35 3.80 4.83 0.00 -1.26 -3.82 105.19 109.19 1l6i n GLY 212 Ca 0.00 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1l6i n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l6i s VAL 213 N -1.69 4.55 -0.21 1.61 1.01 -1.26 -3.57 120.40 120.84 1l6i s VAL 213 Ca 0.00 1.45 -0.05 0.00 0.00 0.00 0.00 61.98 63.37 1l6i s VAL 213 Cb 0.00 -4.01 0.10 0.00 0.00 0.00 0.00 36.38 32.48 1l6i s VAL 213 CO 0.00 0.51 0.40 0.00 0.00 0.00 0.00 175.10 176.01 1l6i s ALA 214 N -1.16 -1.11 0.04 5.51 0.00 -1.26 -1.56 121.76 122.22 1l6i s ALA 214 Ca 0.33 1.29 -0.05 0.00 0.00 0.00 0.00 51.96 53.53 1l6i s ALA 214 Cb -0.21 -1.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1l6i s ALA 214 CO 0.23 -0.91 0.09 1.14 0.00 0.00 0.00 175.76 176.30 1l6i s GLN 215 N 2.58 0.59 0.40 0.00 -2.07 -1.12 -4.92 119.66 115.13 1l6i s GLN 215 Ca 0.03 -0.80 -0.16 0.00 -1.82 0.00 0.00 55.36 52.61 1l6i s GLN 215 Cb -0.13 0.23 -0.09 0.00 -1.09 0.00 0.00 33.01 31.93 1l6i s GLN 215 CO -0.13 -0.15 0.85 -1.25 -1.32 0.00 0.00 175.29 173.29 1l6i s PRO 216 N -2.74 4.03 -0.38 9.60 0.05 -1.26 -0.07 135.00 144.23 1l6i s PRO 216 Ca -0.04 0.83 -0.09 0.00 0.05 0.00 0.00 61.00 61.75 1l6i s PRO 216 Cb -0.00 -2.30 0.05 0.00 0.05 0.00 0.00 34.50 32.30 1l6i s PRO 216 CO -0.05 -0.00 0.20 -1.17 0.05 0.00 0.00 177.00 176.02 1l6i s LEU 217 N -3.36 4.78 -0.51 -3.56 2.96 0.13 -2.80 118.68 116.32 1l6i s LEU 217 Ca 0.57 -1.24 -0.20 0.00 -0.22 0.00 0.00 54.13 53.04 1l6i s LEU 217 Cb -0.10 -1.97 0.05 0.00 0.50 0.00 0.00 46.19 44.68 1l6i s LEU 217 CO 0.20 -0.43 0.71 -0.60 -1.32 0.00 0.00 176.35 174.91 1l6i s ARG 218 N 1.46 3.19 -0.29 1.98 3.52 0.59 -1.90 118.95 127.50 1l6i s ARG 218 Ca 0.01 -0.70 -0.11 0.00 -0.13 0.00 0.00 55.73 54.81 1l6i s ARG 218 Cb -0.21 -4.08 -0.04 0.00 -1.56 0.00 0.00 34.95 29.06 1l6i s ARG 218 CO 0.04 -1.27 0.19 -0.51 -0.81 0.00 0.00 175.30 172.94 1l6i s LEU 219 N 2.97 4.07 0.15 -0.88 1.43 -0.00 -2.08 118.68 124.34 1l6i s LEU 219 Ca 0.19 -0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.90 1l6i s LEU 219 Cb -0.17 -2.11 -0.07 0.00 0.03 0.00 0.00 46.19 43.87 1l6i s LEU 219 CO 0.14 -0.08 1.03 0.26 0.23 0.00 0.00 176.35 177.93 1l6i s TRP 220 N 1.75 3.71 -0.08 0.29 0.52 0.26 -1.87 118.94 123.52 1l6i s TRP 220 Ca 0.07 1.70 0.04 0.00 0.02 0.00 0.00 56.10 57.93 1l6i s TRP 220 Cb -0.16 -3.16 -0.01 0.00 -1.15 0.00 0.00 33.47 28.98 1l6i s TRP 220 CO 0.11 -0.20 -0.22 -1.14 0.02 0.00 0.00 176.95 175.51 1l6i s GLN 221 N -0.26 2.81 -0.02 4.98 0.74 -0.16 0.29 119.66 128.04 1l6i s GLN 221 Ca 0.48 -0.85 -0.20 0.00 0.05 0.00 0.00 55.36 54.83 1l6i s GLN 221 Cb -0.27 -2.29 -0.05 0.00 1.10 0.00 0.00 33.01 31.51 1l6i s GLN 221 CO 0.32 0.32 0.59 0.00 -0.55 0.00 0.00 175.29 175.97 1l6i s ALA 222 N 0.01 3.47 0.19 1.58 0.00 -1.26 -0.69 121.76 125.06 1l6i s ALA 222 Ca -0.08 0.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.86 1l6i s ALA 222 Cb -0.15 -2.75 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1l6i s ALA 222 CO 0.05 0.13 0.19 0.95 0.00 0.00 0.00 175.76 177.08 1l6i s THR 223 N -0.04 0.03 -0.04 0.00 -4.23 -0.51 -4.33 115.64 106.52 1l6i s THR 223 Ca 0.31 -1.80 0.04 0.00 -1.18 0.00 0.00 61.69 59.06 1l6i s THR 223 Cb -0.18 -2.25 -0.00 0.00 1.34 0.00 0.00 72.50 71.40 1l6i s THR 223 CO 0.17 -0.15 -0.17 -2.28 -0.54 0.00 0.00 174.62 171.64 1l6i s HIS 224 N -4.08 1.73 0.56 3.99 2.46 -1.26 -1.04 115.29 117.65 1l6i s HIS 224 Ca 0.30 -0.48 0.25 0.00 0.47 0.00 0.00 55.06 55.60 1l6i s HIS 224 Cb 0.05 -1.16 1.64 0.00 -0.13 0.00 0.00 32.58 32.99 1l6i s HIS 224 CO 0.07 -0.15 2.22 0.00 -2.47 0.00 0.00 174.74 174.41 1l6i h ALA 225 N 6.18 1.67 -2.43 1.58 0.00 -1.94 -3.30 119.26 121.02 1l6i h ALA 225 Ca -0.33 -0.00 -0.59 0.00 0.00 0.00 0.00 54.91 53.98 1l6i h ALA 225 Cb 1.17 -0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.56 1l6i h ALA 225 CO 0.48 0.01 -0.83 0.72 0.00 0.00 0.00 179.25 179.62 1l6i n HIS 226 N -4.06 1.14 0.24 0.00 8.25 -1.26 -4.97 115.22 114.56 1l6i n HIS 226 Ca -0.03 -3.79 0.12 0.00 -0.26 0.00 0.00 57.72 53.76 1l6i n HIS 226 Cb 0.09 -0.26 0.51 0.00 1.12 0.00 0.00 29.99 31.45 1l6i n HIS 226 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1l6i h PRO 227 N 4.92 0.00 -5.09 -0.41 0.13 -1.90 -3.42 132.00 126.23 1l6i h PRO 227 Ca 0.18 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.81 1l6i h PRO 227 Cb 0.82 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.64 1l6i h PRO 227 CO 0.57 0.16 -0.82 0.12 -0.23 0.00 0.00 178.00 177.80 1l6i s PHE 228 N -3.65 1.37 -0.34 1.56 5.36 -1.26 -1.51 117.98 119.51 1l6i s PHE 228 Ca 0.01 -0.35 -0.04 0.00 -0.96 0.00 0.00 56.93 55.59 1l6i s PHE 228 Cb 0.10 -0.93 0.06 0.00 -0.34 0.00 0.00 43.02 41.91 1l6i s PHE 228 CO 0.61 -0.11 0.09 0.34 -1.46 0.00 0.00 175.22 174.69 1l6i s ASP 229 N -0.01 5.14 0.42 6.13 -1.08 -0.38 -4.99 116.67 121.90 1l6i s ASP 229 Ca -0.01 -1.40 0.19 0.00 -0.52 0.00 0.00 52.55 50.81 1l6i s ASP 229 Cb -0.09 -1.80 0.93 0.00 -1.46 0.00 0.00 42.92 40.50 1l6i s ASP 229 CO 0.01 -0.35 1.87 0.25 0.52 0.00 0.00 175.17 177.47 1l6i h LEU 230 N 8.10 0.00 0.26 -1.34 5.85 -1.99 -2.89 115.31 123.30 1l6i h LEU 230 Ca -0.20 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1l6i h LEU 230 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1l6i h LEU 230 CO 0.60 0.29 -0.13 0.74 -0.34 0.00 0.00 178.44 179.60 1l6i h THR 231 N 0.00 0.74 -0.57 1.05 2.02 -1.98 -0.54 112.91 113.63 1l6i h THR 231 Ca -0.00 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1l6i h THR 231 Cb 0.63 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 1l6i h THR 231 CO 0.04 0.01 0.35 0.11 0.37 0.00 0.00 175.52 176.39 1l6i h LYS 232 N -0.37 0.77 -0.59 6.66 1.57 -1.91 -1.66 116.57 121.04 1l6i h LYS 232 Ca -0.04 -0.07 0.10 0.00 -1.87 0.00 0.00 60.65 58.78 1l6i h LYS 232 Cb 0.28 -0.16 -0.08 0.00 0.08 0.00 0.00 32.23 32.35 1l6i h LYS 232 CO 0.06 0.55 0.16 0.35 -0.57 0.00 0.00 179.45 180.00 1l6i h PHE 233 N 0.76 0.26 0.00 -1.35 3.04 -1.41 -0.00 116.94 118.24 1l6i h PHE 233 Ca 0.20 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.19 1l6i h PHE 233 Cb -0.03 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 38.46 1l6i h PHE 233 CO -0.02 0.02 0.00 0.09 -2.02 0.00 0.00 178.31 176.37 1l6i n ASN 234 N -5.08 0.64 -0.59 0.41 3.02 -0.22 -0.74 115.26 112.70 1l6i n ASN 234 Ca 0.08 0.62 0.08 0.00 -0.03 0.00 0.00 54.58 55.33 1l6i n ASN 234 Cb 0.29 -0.77 0.26 0.00 -0.61 0.00 0.00 39.78 38.95 1l6i n ASN 234 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1l6i n ASP 235 N -2.17 1.74 0.00 6.41 8.00 -0.65 -4.91 116.55 124.98 1l6i n ASP 235 Ca 0.03 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.68 1l6i n ASP 235 Cb 0.29 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1l6i n ASP 235 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l6i n GLY 236 N 1.08 0.63 2.87 0.44 0.00 0.08 -4.95 105.19 105.35 1l6i n GLY 236 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1l6i n GLY 236 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l6i n ASP 237 N 0.00 5.52 -0.28 1.61 8.00 -0.06 -4.84 116.55 126.51 1l6i n ASP 237 Ca 0.00 -3.19 0.01 0.00 0.71 0.00 0.00 54.79 52.33 1l6i n ASP 237 Cb 0.00 -1.42 0.14 0.00 -0.02 0.00 0.00 41.12 39.82 1l6i n ASP 237 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1l6i h PHE 238 N 5.60 0.83 -0.06 1.24 0.04 -1.83 -1.39 116.94 121.38 1l6i h PHE 238 Ca 0.37 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 61.14 1l6i h PHE 238 Cb 0.61 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 1l6i h PHE 238 CO 1.22 0.37 -0.07 1.25 -0.60 0.00 0.00 178.31 180.47 1l6i h LEU 239 N 0.80 0.17 -1.88 1.54 5.85 -1.96 -3.27 115.31 116.55 1l6i h LEU 239 Ca 0.37 -0.51 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1l6i h LEU 239 Cb 0.28 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 1l6i h LEU 239 CO -0.22 0.65 -0.13 0.03 -0.34 0.00 0.00 178.44 178.43 1l6i h ARG 240 N -0.31 0.00 0.00 1.25 3.08 -1.92 -0.46 114.38 116.03 1l6i h ARG 240 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1l6i h ARG 240 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1l6i h ARG 240 CO 0.02 0.13 0.23 0.00 -1.07 0.00 0.00 179.97 179.28 1l6i h ALA 241 N 1.87 1.22 -0.02 0.04 0.00 -1.30 -1.97 119.26 119.10 1l6i h ALA 241 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1l6i h ALA 241 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1l6i h ALA 241 CO 0.02 -0.22 -0.06 0.39 0.00 0.00 0.00 179.25 179.37 1l6i n GLU 242 N -2.82 1.88 -0.29 0.00 -0.58 -0.18 -1.25 120.64 117.40 1l6i n GLU 242 Ca -0.02 -1.65 0.01 0.00 -0.42 0.00 0.00 57.16 55.08 1l6i n GLU 242 Cb 0.28 -1.41 0.08 0.00 -0.57 0.00 0.00 31.44 29.82 1l6i n GLU 242 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1l6i h GLN 243 N 3.91 -0.03 -0.63 3.49 5.75 -1.43 0.20 115.11 126.38 1l6i h GLN 243 Ca 0.00 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 1l6i h GLN 243 Cb 0.86 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.38 1l6i h GLN 243 CO 0.00 -0.02 0.41 0.37 -2.65 0.00 0.00 178.83 176.94 1l6i h GLN 244 N -0.03 0.82 0.34 1.69 4.15 -1.82 0.15 115.11 120.41 1l6i h GLN 244 Ca 0.36 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.72 1l6i h GLN 244 Cb 0.60 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 1l6i h GLN 244 CO -0.85 0.54 -0.19 0.78 -1.93 0.00 0.00 178.83 177.18 1l6i h GLY 245 N 0.84 -0.52 1.06 2.39 0.00 0.41 -2.64 103.07 104.61 1l6i h GLY 245 Ca 0.23 0.21 0.09 0.00 0.00 0.00 0.00 47.33 47.86 1l6i h GLY 245 CO -0.06 -0.20 0.41 -2.22 0.00 0.00 0.00 176.54 174.48 1l6i h ILE 246 N -0.50 0.93 0.00 2.60 2.04 -0.70 -1.33 117.51 120.55 1l6i h ILE 246 Ca -0.04 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1l6i h ILE 246 Cb 0.41 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1l6i h ILE 246 CO 0.05 0.09 -0.21 0.78 0.00 0.00 0.00 178.15 178.86 1l6i h ASN 247 N 0.48 0.00 0.14 1.72 2.35 -0.33 -2.37 115.58 117.57 1l6i h ASN 247 Ca 0.28 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.74 1l6i h ASN 247 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1l6i h ASN 247 CO -0.08 0.21 -1.48 0.00 -1.65 0.00 0.00 177.43 174.43 1l6i h ALA 248 N 1.79 0.15 0.00 -0.83 0.00 -1.29 -3.38 119.26 115.71 1l6i h ALA 248 Ca -0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1l6i h ALA 248 Cb 0.40 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1l6i h ALA 248 CO 0.03 0.86 0.00 0.39 0.00 0.00 0.00 179.25 180.52 1l6i n GLU 249 N -3.84 0.04 0.16 0.00 1.02 -0.57 -2.57 120.64 114.89 1l6i n GLU 249 Ca -0.24 0.12 0.13 0.00 -0.02 0.00 0.00 57.16 57.15 1l6i n GLU 249 Cb 0.95 -1.56 0.43 0.00 -0.02 0.00 0.00 31.44 31.25 1l6i n GLU 249 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1l6i h LYS 250 N 0.00 0.00 0.00 3.49 2.10 -1.62 -2.67 116.57 117.88 1l6i h LYS 250 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.59 1l6i h LYS 250 Cb 0.45 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.77 1l6i h LYS 250 CO 0.00 0.00 -0.31 -0.07 -2.00 0.00 0.00 179.45 177.07 1l6i h LEU 251 N 0.00 0.00 -3.51 7.07 3.38 -1.76 -3.21 115.31 117.28 1l6i h LEU 251 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1l6i h LEU 251 Cb 0.64 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.13 1l6i h LEU 251 CO 0.00 0.31 -0.51 0.35 0.09 0.00 0.00 178.44 178.68 1l6i n THR 252 N -4.08 2.53 -0.07 0.22 -2.24 -1.01 -4.70 114.28 104.94 1l6i n THR 252 Ca -0.02 -3.66 -0.21 0.00 -2.27 0.00 0.00 64.05 57.89 1l6i n THR 252 Cb 0.36 -0.79 -0.12 0.00 -2.10 0.00 0.00 70.33 67.68 1l6i n THR 252 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1l6i h LYS 253 N 1.69 0.08 -4.70 -0.78 1.79 -1.59 -1.09 116.57 111.97 1l6i h LYS 253 Ca 0.27 -0.15 -0.43 0.00 -2.18 0.00 0.00 60.65 58.16 1l6i h LYS 253 Cb 1.36 0.05 -0.30 0.00 -1.58 0.00 0.00 32.23 31.76 1l6i h LYS 253 CO 0.57 1.07 -0.79 0.08 -1.08 0.00 0.00 179.45 179.30 1l6i s VAL 254 N -2.41 0.82 -0.00 0.50 1.01 -1.26 -0.40 120.40 118.66 1l6i s VAL 254 Ca -0.26 -0.40 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1l6i s VAL 254 Cb 0.05 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 1l6i s VAL 254 CO 0.66 0.25 0.71 -0.22 0.00 0.00 0.00 175.10 176.49 1l6i s LEU 255 N 0.07 4.40 -1.33 3.92 0.20 -0.33 -4.17 118.68 121.44 1l6i s LEU 255 Ca -0.01 1.30 -0.06 0.00 0.69 0.00 0.00 54.13 56.04 1l6i s LEU 255 Cb -0.07 -3.11 -0.00 0.00 -0.43 0.00 0.00 46.19 42.57 1l6i s LEU 255 CO 0.00 -0.01 0.52 -1.22 -0.29 0.00 0.00 176.35 175.36 1l6i n TYR 256 N 3.13 -1.71 -1.39 5.38 4.01 -1.26 -4.53 117.16 120.79 1l6i n TYR 256 Ca -0.03 0.65 -0.35 0.00 -0.16 0.00 0.00 57.90 58.01 1l6i n TYR 256 Cb 0.51 -3.66 0.10 0.00 -0.31 0.00 0.00 39.34 35.98 1l6i n TYR 256 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1l6i n PRO 257 N -4.37 0.61 -1.72 -0.72 -0.04 -1.26 -4.78 135.00 122.72 1l6i n PRO 257 Ca -0.25 0.28 -0.60 0.00 -0.04 0.00 0.00 63.50 62.88 1l6i n PRO 257 Cb 0.66 -2.47 -0.08 0.00 -0.04 0.00 0.00 33.50 31.57 1l6i n PRO 257 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1l6i n ASN 258 N -2.59 2.05 -1.16 3.54 2.85 -1.26 -4.83 115.26 113.86 1l6i n ASN 258 Ca 0.15 1.11 -0.03 0.00 -0.11 0.00 0.00 54.58 55.69 1l6i n ASN 258 Cb 0.49 -1.07 0.21 0.00 1.24 0.00 0.00 39.78 40.65 1l6i n ASN 258 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1l6i n ASP 259 N 4.94 2.70 0.23 1.20 5.75 -1.26 -4.27 116.55 125.84 1l6i n ASP 259 Ca 0.27 -3.67 0.12 0.00 -0.01 0.00 0.00 54.79 51.50 1l6i n ASP 259 Cb 0.08 -0.63 0.50 0.00 -1.03 0.00 0.00 41.12 40.04 1l6i n ASP 259 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 1l6i h ASN 260 N 1.09 0.00 -2.10 -1.12 -0.26 -1.93 -3.40 115.58 107.86 1l6i h ASN 260 Ca 0.21 0.00 -0.57 0.00 -0.56 0.00 0.00 56.30 55.38 1l6i h ASN 260 Cb 1.67 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 38.83 1l6i h ASN 260 CO 0.39 0.17 -0.64 0.00 -1.06 0.00 0.00 177.43 176.28 1l6i s ALA 261 N -3.65 3.14 0.18 -0.83 0.00 -1.26 -5.04 121.76 114.31 1l6i s ALA 261 Ca 0.01 -1.78 -0.12 0.00 0.00 0.00 0.00 51.96 50.06 1l6i s ALA 261 Cb 0.10 -0.59 0.16 0.00 0.00 0.00 0.00 23.12 22.79 1l6i s ALA 261 CO 0.62 0.20 1.78 0.35 0.00 0.00 0.00 175.76 178.70 1l6i h PHE 262 N 1.89 0.47 0.00 0.00 3.57 -1.94 -1.46 116.94 119.46 1l6i h PHE 262 Ca -0.43 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.07 1l6i h PHE 262 Cb 1.25 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.85 1l6i h PHE 262 CO 0.70 0.22 -0.12 0.93 -2.23 0.00 0.00 178.31 177.81 1l6i h GLU 263 N 0.50 0.00 0.09 1.11 5.08 -1.95 -1.09 114.58 118.31 1l6i h GLU 263 Ca 0.24 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.34 1l6i h GLU 263 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1l6i h GLU 263 CO -0.18 0.12 -1.17 0.78 -1.00 0.00 0.00 179.01 177.56 1l6i h GLY 264 N 0.77 0.23 0.86 -3.84 0.00 -1.46 -1.53 103.07 98.11 1l6i h GLY 264 Ca -0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 1l6i h GLY 264 CO 0.02 0.51 -0.01 0.50 0.00 0.00 0.00 176.54 177.56 1l6i h LYS 265 N 0.06 0.49 -0.93 4.80 1.57 -0.84 -2.04 116.57 119.68 1l6i h LYS 265 Ca -0.10 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1l6i h LYS 265 Cb 1.90 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 34.13 1l6i h LYS 265 CO 0.18 0.66 0.57 -0.22 -0.57 0.00 0.00 179.45 180.07 1l6i h LYS 266 N 0.27 1.25 -0.29 3.15 3.64 -1.31 -2.39 116.57 120.88 1l6i h LYS 266 Ca 0.08 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1l6i h LYS 266 Cb 0.44 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1l6i h LYS 266 CO 0.02 0.86 0.12 1.25 -2.27 0.00 0.00 179.45 179.43 1l6i h LEU 267 N 1.27 0.40 -0.90 5.20 5.85 -1.13 -0.69 115.31 125.31 1l6i h LEU 267 Ca 0.33 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1l6i h LEU 267 Cb -0.07 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 1l6i h LEU 267 CO -0.06 0.45 0.58 0.03 -0.34 0.00 0.00 178.44 179.10 1l6i h ARG 268 N 0.32 1.11 -0.65 1.25 2.47 -1.21 0.95 114.38 118.62 1l6i h ARG 268 Ca 0.10 -0.07 -0.07 0.00 -1.26 0.00 0.00 59.98 58.68 1l6i h ARG 268 Cb 0.17 -0.25 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 1l6i h ARG 268 CO -0.01 0.73 0.13 1.25 0.56 0.00 0.00 179.97 182.64 1l6i h LEU 269 N 1.14 1.01 -1.25 3.04 5.85 -1.07 -2.47 115.31 121.56 1l6i h LEU 269 Ca 0.36 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1l6i h LEU 269 Cb -0.01 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 1l6i h LEU 269 CO -0.11 1.00 0.16 0.24 -0.34 0.00 0.00 178.44 179.38 1l6i h MET 270 N 0.98 0.67 -0.18 1.25 2.86 -0.62 -2.78 114.93 117.13 1l6i h MET 270 Ca 0.20 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1l6i h MET 270 Cb 0.40 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1l6i h MET 270 CO 0.01 0.58 0.09 1.96 1.06 0.00 0.00 176.91 180.61 1l6i h GLN 271 N 0.67 0.26 -0.28 1.72 4.20 -0.38 -1.15 115.11 120.14 1l6i h GLN 271 Ca 0.16 -0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.89 1l6i h GLN 271 Cb 0.18 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.86 1l6i h GLN 271 CO -0.01 0.28 -0.06 1.96 -0.67 0.00 0.00 178.83 180.34 1l6i h GLN 272 N 0.16 0.01 0.14 1.46 4.20 -1.31 0.11 115.11 119.89 1l6i h GLN 272 Ca 0.06 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1l6i h GLN 272 Cb 0.11 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1l6i h GLN 272 CO -0.01 0.01 -0.07 -0.92 -0.67 0.00 0.00 178.83 177.17 1l6i h TYR 273 N 0.01 -0.18 -0.25 2.96 3.20 -1.54 0.38 116.97 121.55 1l6i h TYR 273 Ca 0.14 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.07 1l6i h TYR 273 Cb 0.20 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.46 1l6i h TYR 273 CO -0.27 -0.07 -0.26 0.35 -1.64 0.00 0.00 178.16 176.28 1l6i h PHE 274 N -0.25 -0.68 -0.67 -3.82 3.57 -0.87 0.84 116.94 115.06 1l6i h PHE 274 Ca -0.02 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1l6i h PHE 274 Cb 0.19 0.34 -0.07 0.00 2.79 0.00 0.00 35.95 39.21 1l6i h PHE 274 CO -0.05 -0.33 0.33 0.37 -2.23 0.00 0.00 178.31 176.39 1l6i h GLN 275 N -0.26 0.56 0.02 1.11 4.15 -0.48 -2.34 115.11 117.87 1l6i h GLN 275 Ca 0.14 -0.03 -0.27 0.00 0.77 0.00 0.00 58.65 59.26 1l6i h GLN 275 Cb 0.48 -0.13 0.02 0.00 0.21 0.00 0.00 27.48 28.06 1l6i h GLN 275 CO -0.40 0.37 -1.05 0.00 -1.93 0.00 0.00 178.83 175.81 1l6i h ALA 277 N 0.37 0.83 -0.50 0.00 0.00 0.85 -0.74 119.26 120.07 1l6i h ALA 277 Ca -0.14 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1l6i h ALA 277 Cb 1.71 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1l6i h ALA 277 CO 0.21 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 179.33 1l6i h SER 279 N 0.82 0.30 -0.23 0.00 0.02 -1.25 0.11 113.55 113.32 1l6i h SER 279 Ca 0.12 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1l6i h SER 279 Cb 0.69 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1l6i h SER 279 CO 0.05 0.57 0.05 0.58 -1.14 0.00 0.00 176.83 176.95 1l6i h VAL 280 N 0.03 0.90 -0.66 2.27 2.07 -1.22 0.33 116.25 119.98 1l6i h VAL 280 Ca 0.04 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.57 1l6i h VAL 280 Cb 0.43 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1l6i h VAL 280 CO 0.01 0.03 0.37 0.00 0.02 0.00 0.00 177.57 178.00 1l6i h ALA 281 N 1.16 0.87 0.25 1.67 0.00 -1.11 -1.68 119.26 120.43 1l6i h ALA 281 Ca 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1l6i h ALA 281 Cb 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1l6i h ALA 281 CO -0.13 0.05 -0.12 0.22 0.00 0.00 0.00 179.25 179.27 1l6i h ASP 282 N 0.68 -0.29 -0.64 0.00 3.58 -0.38 0.21 116.42 119.58 1l6i h ASP 282 Ca 0.29 -0.10 0.12 0.00 0.42 0.00 0.00 57.03 57.77 1l6i h ASP 282 Cb 0.17 0.07 -0.09 0.00 1.72 0.00 0.00 39.33 41.20 1l6i h ASP 282 CO -0.17 -0.07 0.16 0.40 -2.88 0.00 0.00 179.24 176.67 1l6i h ILE 283 N -0.50 0.62 -0.30 2.25 2.04 -0.69 0.19 117.51 121.12 1l6i h ILE 283 Ca -0.03 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1l6i h ILE 283 Cb 0.37 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 1l6i h ILE 283 CO 0.06 0.05 -0.06 -0.07 0.00 0.00 0.00 178.15 178.13 1l6i h LEU 284 N 0.29 0.46 -0.27 1.44 3.38 -1.16 -2.27 115.31 117.19 1l6i h LEU 284 Ca 0.34 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 58.07 1l6i h LEU 284 Cb 0.52 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1l6i h LEU 284 CO -0.42 0.58 -0.38 -0.09 0.09 0.00 0.00 178.44 178.22 1l6i h ARG 285 N 0.46 0.74 -0.64 1.13 2.43 0.10 0.71 114.38 119.30 1l6i h ARG 285 Ca 0.09 -0.43 -0.06 0.00 -0.81 0.00 0.00 59.98 58.77 1l6i h ARG 285 Cb 0.40 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1l6i h ARG 285 CO 0.02 1.06 0.15 -0.09 -1.51 0.00 0.00 179.97 179.60 1l6i h ARG 286 N 0.48 1.01 -0.30 0.20 2.43 -0.84 -0.47 114.38 116.89 1l6i h ARG 286 Ca 0.03 -0.23 -0.07 0.00 -0.81 0.00 0.00 59.98 58.90 1l6i h ARG 286 Cb 0.97 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 1l6i h ARG 286 CO 0.09 0.90 -0.10 1.25 -1.51 0.00 0.00 179.97 180.60 1l6i h HIS 287 N 0.96 0.68 -0.25 2.20 2.76 -1.19 -1.74 115.15 118.58 1l6i h HIS 287 Ca 0.20 -0.16 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 1l6i h HIS 287 Cb 0.34 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 1l6i h HIS 287 CO 0.02 0.81 0.10 1.25 -1.30 0.00 0.00 177.93 178.81 1l6i h HIS 288 N 0.36 0.37 -0.01 5.26 -0.00 -0.73 -2.47 115.15 117.94 1l6i h HIS 288 Ca 0.07 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 1l6i h HIS 288 Cb 0.60 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 27.90 1l6i h HIS 288 CO 0.05 0.39 0.02 -0.07 -0.00 0.00 0.00 177.93 178.33 1l6i h LEU 289 N 0.25 0.00 -0.86 0.26 -0.00 -0.89 -0.20 115.31 113.88 1l6i h LEU 289 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 1l6i h LEU 289 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.83 1l6i h LEU 289 CO -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.43 1l6i n ALA 290 N -2.17 2.52 -1.07 1.53 0.00 -0.67 -4.88 120.51 115.77 1l6i n ALA 290 Ca -0.03 -0.43 -0.03 0.00 0.00 0.00 0.00 53.44 52.96 1l6i n ALA 290 Cb 0.10 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 1l6i n ALA 290 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l6i n GLY 291 N 1.01 0.50 3.90 0.00 0.00 -0.08 -5.01 105.19 105.51 1l6i n GLY 291 Ca 0.14 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1l6i n GLY 291 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l6i s ARG 292 N -1.42 3.36 0.13 1.61 0.52 -1.00 -5.04 118.95 117.11 1l6i s ARG 292 Ca 0.00 0.22 -0.03 0.00 -0.52 0.00 0.00 55.73 55.40 1l6i s ARG 292 Cb 0.00 -2.30 -0.05 0.00 0.52 0.00 0.00 34.95 33.12 1l6i s ARG 292 CO 0.00 -0.41 0.33 0.15 0.02 0.00 0.00 175.30 175.39 1l6i s LYS 293 N -4.88 3.56 0.08 3.54 -0.14 -1.26 -4.45 119.74 116.19 1l6i s LYS 293 Ca 0.50 -0.22 -0.22 0.00 -1.36 0.00 0.00 55.97 54.68 1l6i s LYS 293 Cb -0.10 -2.90 -0.13 0.00 -1.68 0.00 0.00 37.83 33.02 1l6i s LYS 293 CO 0.46 0.49 1.68 1.25 -0.76 0.00 0.00 175.35 178.48 1l6i h LEU 294 N 2.77 0.08 -1.16 3.17 5.85 -1.96 -0.83 115.31 123.23 1l6i h LEU 294 Ca -0.46 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1l6i h LEU 294 Cb 1.17 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.18 1l6i h LEU 294 CO 0.73 0.14 0.03 0.00 -0.34 0.00 0.00 178.44 179.00 1l6i n HIS 295 N -5.00 0.59 -0.77 1.25 1.44 -1.26 -2.01 115.22 109.47 1l6i n HIS 295 Ca -0.06 0.31 0.08 0.00 -2.01 0.00 0.00 57.72 56.04 1l6i n HIS 295 Cb 0.07 -0.97 0.35 0.00 0.12 0.00 0.00 29.99 29.55 1l6i n HIS 295 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 1l6i n GLU 296 N -2.11 3.96 -0.10 -1.40 0.28 -0.32 -4.63 120.64 116.31 1l6i n GLU 296 Ca -0.01 -2.93 -0.07 0.00 -0.16 0.00 0.00 57.16 53.98 1l6i n GLU 296 Cb 0.06 -1.98 -0.01 0.00 1.43 0.00 0.00 31.44 30.94 1l6i n GLU 296 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 1l6i h LEU 297 N 3.52 -0.96 -1.14 -1.84 6.46 -1.43 0.10 115.31 120.02 1l6i h LEU 297 Ca 0.00 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 57.94 1l6i h LEU 297 Cb 1.60 0.46 0.00 0.00 -0.73 0.00 0.00 40.66 41.99 1l6i h LEU 297 CO 0.31 -0.30 0.00 0.00 -0.62 0.00 0.00 178.44 177.83 1l6i n ALA 298 N -2.95 1.11 0.28 1.25 0.00 -1.26 0.04 120.51 118.98 1l6i n ALA 298 Ca 0.01 0.16 0.12 0.00 0.00 0.00 0.00 53.44 53.73 1l6i n ALA 298 Cb 0.32 -1.28 0.19 0.00 0.00 0.00 0.00 19.45 18.68 1l6i n ALA 298 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1l6i h ASP 299 N 0.00 0.00 0.00 0.00 3.32 -1.31 -3.37 116.42 115.06 1l6i h ASP 299 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1l6i h ASP 299 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1l6i h ASP 299 CO 0.00 0.00 -0.70 -1.22 -1.72 0.00 0.00 179.24 175.61 1l6i n TYR 300 N -2.90 0.00 -4.44 4.55 4.01 0.11 -4.64 117.16 113.84 1l6i n TYR 300 Ca 0.04 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.57 1l6i n TYR 300 Cb 0.51 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.37 1l6i n TYR 300 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1l6i s GLU 301 N -1.72 1.10 -0.03 -0.72 0.41 0.76 -1.52 118.70 116.97 1l6i s GLU 301 Ca -0.00 -0.34 0.07 0.00 -0.41 0.00 0.00 54.97 54.29 1l6i s GLU 301 Cb 0.01 -1.00 -0.02 0.00 -1.78 0.00 0.00 34.13 31.34 1l6i s GLU 301 CO 0.04 0.11 -0.25 0.54 -0.49 0.00 0.00 175.26 175.21 1l6i s VAL 302 N 0.24 1.99 -0.23 2.63 0.11 -0.59 -4.43 120.40 120.12 1l6i s VAL 302 Ca -0.04 -1.06 0.00 0.00 -2.93 0.00 0.00 61.98 57.95 1l6i s VAL 302 Cb -0.10 -1.66 0.03 0.00 -1.53 0.00 0.00 36.38 33.12 1l6i s VAL 302 CO 0.01 0.56 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.59 1l6i s ILE 303 N -0.43 2.47 -0.32 7.04 1.01 -0.06 -1.76 121.20 129.16 1l6i s ILE 303 Ca 0.05 -1.12 -0.16 0.00 0.00 0.00 0.00 60.65 59.42 1l6i s ILE 303 Cb -0.11 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 40.11 1l6i s ILE 303 CO 0.01 0.26 0.41 -1.58 0.00 0.00 0.00 174.94 174.04 1l6i s GLN 304 N 1.27 3.75 -0.25 2.79 2.00 -0.46 -1.57 119.66 127.19 1l6i s GLN 304 Ca -0.00 -0.18 -0.15 0.00 -2.00 0.00 0.00 55.36 53.04 1l6i s GLN 304 Cb -0.16 -3.75 -0.04 0.00 0.80 0.00 0.00 33.01 29.86 1l6i s GLN 304 CO -0.07 -0.47 0.36 -0.51 -0.50 0.00 0.00 175.29 174.10 1l6i s LEU 305 N 2.14 4.07 -0.41 3.68 1.43 0.74 -1.77 118.68 128.57 1l6i s LEU 305 Ca 0.15 0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 53.43 1l6i s LEU 305 Cb -0.16 -2.41 0.02 0.00 0.03 0.00 0.00 46.19 43.67 1l6i s LEU 305 CO 0.11 -0.13 0.29 0.20 0.23 0.00 0.00 176.35 177.06 1l6i s ASN 306 N 1.43 6.07 0.91 2.29 0.01 -1.19 -0.10 114.94 124.36 1l6i s ASN 306 Ca 0.15 -0.90 0.00 0.00 -0.71 0.00 0.00 52.86 51.40 1l6i s ASN 306 Cb -0.15 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.36 1l6i s ASN 306 CO 0.09 -0.44 0.00 0.47 -1.51 0.00 0.00 177.10 175.71 1l6i n ASP 307 N 5.14 -2.61 -0.15 -1.22 8.00 -0.25 -4.02 116.55 121.44 1l6i n ASP 307 Ca -0.11 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.50 1l6i n ASP 307 Cb 0.47 0.00 0.13 0.00 -0.02 0.00 0.00 41.12 41.70 1l6i n ASP 307 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1l6i n THR 308 N 0.00 0.00 -0.31 -3.53 -2.24 -1.25 -4.48 114.28 102.47 1l6i n THR 308 Ca 0.00 -0.08 0.11 0.00 -2.27 0.00 0.00 64.05 61.81 1l6i n THR 308 Cb 0.00 0.68 0.24 0.00 -2.10 0.00 0.00 70.33 69.14 1l6i n THR 308 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1l6i h HIS 309 N 0.73 -0.02 -0.74 4.78 3.86 -1.89 -1.43 115.15 120.45 1l6i h HIS 309 Ca 0.00 0.06 -0.32 0.00 -1.16 0.00 0.00 60.37 58.95 1l6i h HIS 309 Cb 0.55 0.15 -0.19 0.00 1.06 0.00 0.00 27.41 28.98 1l6i h HIS 309 CO 0.00 -0.34 0.41 -0.35 0.86 0.00 0.00 177.93 178.52 1l6i n PRO 310 N -5.41 2.55 -0.11 2.45 -0.04 -1.26 -4.48 135.00 128.70 1l6i n PRO 310 Ca 0.19 -2.50 0.02 0.00 -0.04 0.00 0.00 63.50 61.18 1l6i n PRO 310 Cb 0.64 -2.01 0.34 0.00 -0.04 0.00 0.00 33.50 32.42 1l6i n PRO 310 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1l6i h THR 311 N 1.41 1.14 0.00 0.52 2.02 -1.53 -2.71 112.91 113.77 1l6i h THR 311 Ca 0.40 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 67.29 1l6i h THR 311 Cb 2.35 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1l6i h THR 311 CO 0.79 0.14 -0.07 -0.29 0.37 0.00 0.00 175.52 176.46 1l6i h ILE 312 N 0.79 0.28 -0.57 3.11 6.09 -1.83 -1.61 117.51 123.77 1l6i h ILE 312 Ca 0.22 -0.47 0.16 0.00 -1.37 0.00 0.00 64.86 63.40 1l6i h ILE 312 Cb -0.07 1.36 -0.02 0.00 0.47 0.00 0.00 36.82 38.56 1l6i h ILE 312 CO -0.05 0.07 0.49 0.00 -3.07 0.00 0.00 178.15 175.59 1l6i h ALA 313 N 1.93 2.40 0.55 0.18 0.00 -1.82 -2.16 119.26 120.34 1l6i h ALA 313 Ca -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1l6i h ALA 313 Cb 0.36 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1l6i h ALA 313 CO 0.01 -0.78 -0.26 0.82 0.00 0.00 0.00 179.25 179.03 1l6i h ILE 314 N 0.00 0.31 0.00 0.00 2.04 -1.49 -1.72 117.51 116.65 1l6i h ILE 314 Ca 0.27 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1l6i h ILE 314 Cb 1.25 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.76 1l6i h ILE 314 CO -0.00 0.04 0.00 1.55 0.00 0.00 0.00 178.15 179.74 1l6i h PRO 315 N -1.01 0.00 -0.07 2.37 0.13 -1.75 -2.11 132.00 129.56 1l6i h PRO 315 Ca -0.07 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.82 1l6i h PRO 315 Cb 0.63 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.78 1l6i h PRO 315 CO 0.12 0.00 -0.90 1.49 -0.23 0.00 0.00 178.00 178.49 1l6i h GLU 316 N 0.00 0.68 -0.18 0.86 4.57 -1.20 -0.05 114.58 119.26 1l6i h GLU 316 Ca 0.00 -0.64 -0.07 0.00 -1.18 0.00 0.00 59.36 57.47 1l6i h GLU 316 Cb 0.28 0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1l6i h GLU 316 CO 0.00 1.24 -0.17 1.25 -1.18 0.00 0.00 179.01 180.15 1l6i h LEU 317 N 0.43 0.47 -0.40 1.64 5.85 -1.18 -1.86 115.31 120.24 1l6i h LEU 317 Ca -0.08 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.24 1l6i h LEU 317 Cb 1.53 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 42.35 1l6i h LEU 317 CO 0.17 0.84 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.98 1l6i h LEU 318 N 0.10 -0.31 -0.46 2.25 3.38 -1.37 -2.05 115.31 116.84 1l6i h LEU 318 Ca 0.03 0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.21 1l6i h LEU 318 Cb 0.71 0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 1l6i h LEU 318 CO 0.04 -0.11 -0.13 -0.09 0.09 0.00 0.00 178.44 178.24 1l6i h ARG 319 N 0.03 -0.02 -0.53 1.13 2.43 -0.83 0.20 114.38 116.80 1l6i h ARG 319 Ca 0.20 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1l6i h ARG 319 Cb 0.30 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 1l6i h ARG 319 CO -0.39 -0.02 0.34 0.28 -1.51 0.00 0.00 179.97 178.67 1l6i h VAL 320 N -0.02 1.12 -0.29 0.20 2.07 -1.07 0.22 116.25 118.48 1l6i h VAL 320 Ca 0.22 -0.24 -0.17 0.00 0.82 0.00 0.00 66.70 67.33 1l6i h VAL 320 Cb 0.36 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1l6i h VAL 320 CO -0.49 0.13 -0.50 -0.07 0.02 0.00 0.00 177.57 176.66 1l6i h LEU 321 N 0.69 0.88 -0.00 2.57 4.07 -0.80 -0.85 115.31 121.87 1l6i h LEU 321 Ca 0.20 -0.45 -0.02 0.00 0.08 0.00 0.00 57.88 57.69 1l6i h LEU 321 Cb -0.06 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.43 1l6i h LEU 321 CO -0.05 1.22 -0.06 0.40 -1.08 0.00 0.00 178.44 178.86 1l6i h ILE 322 N 0.63 1.60 0.17 1.22 2.04 -0.75 -1.69 117.51 120.73 1l6i h ILE 322 Ca 0.03 -1.85 -0.31 0.00 1.00 0.00 0.00 64.86 63.73 1l6i h ILE 322 Cb 1.08 2.83 0.01 0.00 -0.74 0.00 0.00 36.82 40.00 1l6i h ILE 322 CO 0.11 0.49 -1.47 0.44 0.00 0.00 0.00 178.15 177.72 1l6i h ASP 323 N -0.70 0.56 0.42 1.72 3.32 -0.65 -2.72 116.42 118.37 1l6i h ASP 323 Ca -0.01 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.37 1l6i h ASP 323 Cb 0.83 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1l6i h ASP 323 CO 0.01 1.54 -1.29 -0.62 -1.72 0.00 0.00 179.24 177.16 1l6i n GLU 324 N -3.57 0.45 -0.04 3.56 1.02 -0.35 -4.30 120.64 117.41 1l6i n GLU 324 Ca -0.15 -0.03 0.02 0.00 -0.02 0.00 0.00 57.16 56.98 1l6i n GLU 324 Cb 1.06 -1.62 0.03 0.00 -0.02 0.00 0.00 31.44 30.89 1l6i n GLU 324 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1l6i n HIS 325 N -2.19 0.00 -3.49 -0.32 8.25 -1.04 -5.01 115.22 111.42 1l6i n HIS 325 Ca -0.00 -0.54 -0.26 0.00 -0.26 0.00 0.00 57.72 56.67 1l6i n HIS 325 Cb 0.50 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.55 1l6i n HIS 325 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1l6i n GLN 326 N -0.65 -4.21 -3.19 -0.41 3.00 -1.03 -4.90 117.38 106.00 1l6i n GLN 326 Ca 0.04 0.58 -0.37 0.00 -0.01 0.00 0.00 57.00 57.24 1l6i n GLN 326 Cb 0.40 -5.36 -0.06 0.00 0.00 0.00 0.00 30.24 25.22 1l6i n GLN 326 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 1l6i s MET 327 N -6.16 4.20 0.92 -1.09 -1.94 -0.66 -4.98 119.30 109.59 1l6i s MET 327 Ca 0.47 0.78 -0.11 0.00 -1.71 0.00 0.00 55.69 55.12 1l6i s MET 327 Cb -0.24 -3.00 0.15 0.00 2.01 0.00 0.00 34.83 33.74 1l6i s MET 327 CO 0.58 0.48 1.09 -1.54 -0.01 0.00 0.00 175.02 175.63 1l6i s SER 328 N -1.51 3.11 0.20 3.03 1.04 -1.26 -4.42 113.70 113.88 1l6i s SER 328 Ca 0.38 1.71 -0.11 0.00 0.48 0.00 0.00 55.95 58.42 1l6i s SER 328 Cb -0.17 -2.34 0.23 0.00 0.10 0.00 0.00 66.02 63.84 1l6i s SER 328 CO 0.21 -2.90 1.75 -0.25 0.98 0.00 0.00 173.24 173.02 1l6i h TRP 329 N -1.73 0.38 -0.19 5.02 2.91 -1.98 -1.56 115.95 118.80 1l6i h TRP 329 Ca -0.49 0.03 -0.14 0.00 1.13 0.00 0.00 58.89 59.42 1l6i h TRP 329 Cb 1.28 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.84 1l6i h TRP 329 CO 0.44 0.11 -0.48 -0.44 -1.03 0.00 0.00 178.44 177.05 1l6i h ASP 330 N 0.40 0.52 -0.13 2.65 3.32 -1.98 0.12 116.42 121.33 1l6i h ASP 330 Ca 0.28 -0.25 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1l6i h ASP 330 Cb 0.32 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1l6i h ASP 330 CO -0.28 0.92 -0.36 0.44 -1.72 0.00 0.00 179.24 178.24 1l6i h ASP 331 N 0.39 0.67 -0.14 6.45 3.32 -1.85 -0.73 116.42 124.53 1l6i h ASP 331 Ca 0.02 -0.29 -0.17 0.00 0.02 0.00 0.00 57.03 56.61 1l6i h ASP 331 Cb 0.98 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 40.35 1l6i h ASP 331 CO 0.09 0.97 -0.59 0.00 -1.72 0.00 0.00 179.24 177.99 1l6i h ALA 332 N 1.07 0.26 0.00 3.45 0.00 -0.86 -2.95 119.26 120.23 1l6i h ALA 332 Ca 0.05 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1l6i h ALA 332 Cb 0.87 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1l6i h ALA 332 CO 0.08 0.50 -0.25 2.35 0.00 0.00 0.00 179.25 181.93 1l6i h TRP 333 N 0.31 0.00 -0.21 0.00 2.91 -0.75 -1.34 115.95 116.88 1l6i h TRP 333 Ca -0.03 0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.94 1l6i h TRP 333 Cb 1.22 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.86 1l6i h TRP 333 CO 0.10 0.25 -0.09 0.00 -1.03 0.00 0.00 178.44 177.67 1l6i h ALA 334 N 1.75 1.46 0.00 2.65 0.00 -0.96 -0.91 119.26 123.26 1l6i h ALA 334 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1l6i h ALA 334 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1l6i h ALA 334 CO 0.03 0.38 -0.00 0.82 0.00 0.00 0.00 179.25 180.48 1l6i h ILE 335 N 0.31 1.68 -0.13 0.00 2.04 -1.33 -3.35 117.51 116.72 1l6i h ILE 335 Ca 0.06 -2.09 -0.14 0.00 1.00 0.00 0.00 64.86 63.69 1l6i h ILE 335 Cb 0.36 3.08 -0.01 0.00 -0.74 0.00 0.00 36.82 39.52 1l6i h ILE 335 CO 0.02 0.54 -0.52 0.71 0.00 0.00 0.00 178.15 178.89 1l6i h THR 336 N -0.91 1.34 0.00 -0.27 1.35 -1.14 -2.57 112.91 110.71 1l6i h THR 336 Ca -0.00 -1.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.08 1l6i h THR 336 Cb 0.88 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1l6i h THR 336 CO 0.00 0.54 0.00 -1.54 -0.25 0.00 0.00 175.52 174.27 1l6i n SER 337 N -3.95 0.23 -0.64 5.36 3.41 -0.36 -1.02 113.62 116.66 1l6i n SER 337 Ca -0.02 0.55 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 1l6i n SER 337 Cb 0.57 -0.60 0.14 0.00 -0.26 0.00 0.00 64.21 64.06 1l6i n SER 337 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1l6i n LYS 338 N -1.75 2.31 -0.06 4.33 4.76 -0.98 -3.11 118.16 123.66 1l6i n LYS 338 Ca 0.04 -1.87 -0.09 0.00 -2.87 0.00 0.00 58.31 53.51 1l6i n LYS 338 Cb 0.22 -1.27 -0.06 0.00 -1.84 0.00 0.00 35.03 32.08 1l6i n LYS 338 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1l6i n THR 339 N 0.61 0.72 -3.01 -0.18 -1.04 -0.19 -4.81 114.28 106.38 1l6i n THR 339 Ca 0.11 -0.26 -0.40 0.00 -2.04 0.00 0.00 64.05 61.46 1l6i n THR 339 Cb 0.40 -1.03 -0.05 0.00 -1.82 0.00 0.00 70.33 67.84 1l6i n THR 339 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1l6i s PHE 340 N -2.25 3.61 0.05 -1.42 0.08 -1.01 -0.88 117.98 116.16 1l6i s PHE 340 Ca -0.17 1.32 0.09 0.00 0.12 0.00 0.00 56.93 58.29 1l6i s PHE 340 Cb 0.05 -2.83 -0.03 0.00 -0.57 0.00 0.00 43.02 39.64 1l6i s PHE 340 CO 0.28 0.11 -0.25 0.00 -0.10 0.00 0.00 175.22 175.27 1l6i s ALA 341 N 0.66 2.32 -0.11 5.36 0.00 -0.61 -1.10 121.76 128.28 1l6i s ALA 341 Ca 0.39 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1l6i s ALA 341 Cb -0.18 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 1l6i s ALA 341 CO 0.20 0.54 -0.13 -0.47 0.00 0.00 0.00 175.76 175.90 1l6i s TYR 342 N -0.84 2.80 -0.23 0.00 5.04 0.17 -0.19 117.35 124.10 1l6i s TYR 342 Ca 0.12 -0.52 -0.06 0.00 -2.44 0.00 0.00 57.07 54.17 1l6i s TYR 342 Cb -0.10 -1.80 -0.02 0.00 0.35 0.00 0.00 41.96 40.38 1l6i s TYR 342 CO 0.03 -0.12 0.03 0.99 -1.34 0.00 0.00 175.55 175.14 1l6i s THR 343 N 0.12 4.04 -0.14 4.34 2.01 0.85 -0.99 115.64 125.87 1l6i s THR 343 Ca -0.06 -0.27 -0.20 0.00 0.31 0.00 0.00 61.69 61.47 1l6i s THR 343 Cb -0.15 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.46 1l6i s THR 343 CO 0.05 0.38 0.59 0.21 -0.69 0.00 0.00 174.62 175.16 1l6i s ASN 344 N 1.40 6.76 0.00 3.53 3.84 -0.41 -1.09 114.94 128.96 1l6i s ASN 344 Ca 0.05 0.91 0.05 0.00 0.21 0.00 0.00 52.86 54.08 1l6i s ASN 344 Cb -0.15 -2.34 0.06 0.00 -0.55 0.00 0.00 41.25 38.27 1l6i s ASN 344 CO 0.02 -0.13 0.75 1.41 -2.79 0.00 0.00 177.10 176.36 1l6i n HIS 345 N 4.22 0.04 -3.61 0.43 8.25 -1.26 -4.14 115.22 119.16 1l6i n HIS 345 Ca -0.03 -0.11 -0.06 0.00 -0.26 0.00 0.00 57.72 57.25 1l6i n HIS 345 Cb 0.51 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.56 1l6i n HIS 345 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1l6i s THR 346 N -0.53 0.00 -2.51 1.59 -1.32 -1.26 -4.71 115.64 106.91 1l6i s THR 346 Ca 0.06 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.78 1l6i s THR 346 Cb 0.04 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.45 1l6i s THR 346 CO 0.06 0.00 1.49 0.18 -2.21 0.00 0.00 174.62 174.14 1l6i n LEU 347 N 0.57 2.36 -4.76 9.08 4.77 -1.26 -4.87 117.00 122.89 1l6i n LEU 347 Ca -0.05 -0.93 -0.41 0.00 -0.03 0.00 0.00 56.01 54.59 1l6i n LEU 347 Cb 0.58 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 1l6i n LEU 347 CO 0.11 0.46 1.18 -0.04 -1.33 0.00 0.00 177.39 177.78 1l6i s MET 348 N -1.79 4.13 0.28 3.23 -1.94 -1.26 -4.91 119.30 117.04 1l6i s MET 348 Ca 0.34 2.54 -0.03 0.00 -1.71 0.00 0.00 55.69 56.84 1l6i s MET 348 Cb 0.20 -3.01 0.40 0.00 2.01 0.00 0.00 34.83 34.43 1l6i s MET 348 CO 0.30 -0.56 1.92 -1.35 -0.01 0.00 0.00 175.02 175.31 1l6i h PRO 349 N 4.00 1.05 -0.22 2.03 0.11 -1.93 -2.36 132.00 134.67 1l6i h PRO 349 Ca -0.49 -0.11 0.06 0.00 0.11 0.00 0.00 66.00 65.58 1l6i h PRO 349 Cb 1.23 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1l6i h PRO 349 CO 0.72 0.76 0.42 1.05 -0.21 0.00 0.00 178.00 180.74 1l6i h GLU 350 N 1.06 0.00 -0.06 1.05 9.09 -1.98 0.83 114.58 124.56 1l6i h GLU 350 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.68 1l6i h GLU 350 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1l6i h GLU 350 CO -0.05 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.01 1l6i n ALA 351 N -2.11 2.52 -3.54 1.06 0.00 -0.89 -4.45 120.51 113.10 1l6i n ALA 351 Ca 0.03 -0.58 -0.32 0.00 0.00 0.00 0.00 53.44 52.58 1l6i n ALA 351 Cb 0.54 -1.01 -0.07 0.00 0.00 0.00 0.00 19.45 18.90 1l6i n ALA 351 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1l6i n LEU 352 N 0.69 4.07 -4.75 0.00 4.77 0.29 -3.82 117.00 118.25 1l6i n LEU 352 Ca 0.17 -5.28 -0.36 0.00 -0.03 0.00 0.00 56.01 50.51 1l6i n LEU 352 Cb 0.46 -0.89 0.04 0.00 -2.33 0.00 0.00 43.42 40.70 1l6i n LEU 352 CO 0.16 1.80 0.85 -1.61 -1.33 0.00 0.00 177.39 177.26 1l6i s GLU 353 N -1.98 2.84 -0.01 3.23 2.02 -1.26 -4.91 118.70 118.63 1l6i s GLU 353 Ca 0.32 1.88 0.01 0.00 0.02 0.00 0.00 54.97 57.20 1l6i s GLU 353 Cb 0.03 -1.91 0.01 0.00 0.10 0.00 0.00 34.13 32.36 1l6i s GLU 353 CO -0.07 -1.32 -0.03 1.03 0.02 0.00 0.00 175.26 174.90 1l6i s ARG 354 N -3.37 0.33 -0.04 1.61 0.52 -1.26 -2.54 118.95 114.21 1l6i s ARG 354 Ca 0.79 -0.07 0.07 0.00 -0.52 0.00 0.00 55.73 56.00 1l6i s ARG 354 Cb -0.32 -0.37 -0.02 0.00 0.52 0.00 0.00 34.95 34.76 1l6i s ARG 354 CO 0.35 0.00 -0.25 -1.58 0.02 0.00 0.00 175.30 173.85 1l6i s TRP 355 N 0.30 2.29 0.33 -0.53 0.52 -0.68 -4.92 118.94 116.26 1l6i s TRP 355 Ca -0.03 -0.54 -0.29 0.00 0.02 0.00 0.00 56.10 55.26 1l6i s TRP 355 Cb -0.06 -1.49 -0.12 0.00 -1.15 0.00 0.00 33.47 30.65 1l6i s TRP 355 CO -0.01 -0.11 1.45 -0.25 0.02 0.00 0.00 176.95 178.05 1l6i n ASP 356 N 2.69 3.41 -0.11 2.95 8.00 -1.26 -0.52 116.55 131.70 1l6i n ASP 356 Ca -0.17 1.19 0.01 0.00 0.71 0.00 0.00 54.79 56.54 1l6i n ASP 356 Cb 0.52 -1.56 0.30 0.00 -0.02 0.00 0.00 41.12 40.36 1l6i n ASP 356 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1l6i h VAL 357 N 2.94 1.17 0.00 2.53 2.07 -0.98 -0.96 116.25 123.02 1l6i h VAL 357 Ca -0.48 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 1l6i h VAL 357 Cb 1.25 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1l6i h VAL 357 CO 0.68 0.19 -0.21 0.07 0.02 0.00 0.00 177.57 178.32 1l6i h LYS 358 N 0.78 0.00 0.04 1.57 5.09 -1.89 -0.14 116.57 122.02 1l6i h LYS 358 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.94 1l6i h LYS 358 Cb 0.01 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.34 1l6i h LYS 358 CO -0.03 0.21 -0.02 1.25 -2.09 0.00 0.00 179.45 178.76 1l6i h LEU 359 N 0.00 -0.05 -0.38 7.07 5.85 -1.57 -2.45 115.31 123.78 1l6i h LEU 359 Ca -0.00 -0.52 0.02 0.00 0.84 0.00 0.00 57.88 58.22 1l6i h LEU 359 Cb 0.52 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1l6i h LEU 359 CO 0.03 0.51 0.20 0.58 -0.34 0.00 0.00 178.44 179.42 1l6i h VAL 360 N -0.64 1.00 -0.97 1.05 2.07 -1.17 -2.54 116.25 115.04 1l6i h VAL 360 Ca -0.01 -0.14 0.10 0.00 0.82 0.00 0.00 66.70 67.47 1l6i h VAL 360 Cb 0.56 0.56 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 1l6i h VAL 360 CO 0.01 0.07 0.61 0.50 0.02 0.00 0.00 177.57 178.79 1l6i h LYS 361 N 0.40 0.99 -0.03 1.57 3.64 -1.00 0.48 116.57 122.63 1l6i h LYS 361 Ca 0.16 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.29 1l6i h LYS 361 Cb 0.05 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1l6i h LYS 361 CO -0.10 0.66 -0.77 0.78 -2.27 0.00 0.00 179.45 177.74 1l6i h GLY 362 N 1.02 0.29 0.45 5.01 0.00 -1.08 -3.01 103.07 105.76 1l6i h GLY 362 Ca 0.46 -0.44 -0.32 0.00 0.00 0.00 0.00 47.33 47.03 1l6i h GLY 362 CO -0.23 0.39 -1.76 -2.00 0.00 0.00 0.00 176.54 172.94 1l6i h LEU 363 N 0.17 0.31 -6.16 3.11 5.85 -1.10 -3.40 115.31 114.08 1l6i h LEU 363 Ca -0.03 -0.83 -0.58 0.00 0.84 0.00 0.00 57.88 57.28 1l6i h LEU 363 Cb 1.36 -0.10 -0.40 0.00 0.37 0.00 0.00 40.66 41.89 1l6i h LEU 363 CO 0.12 1.75 -0.90 0.18 -0.34 0.00 0.00 178.44 179.25 1l6i n LEU 364 N -3.77 1.45 -0.32 2.25 4.77 0.17 0.18 117.00 121.72 1l6i n LEU 364 Ca -0.31 -4.94 0.10 0.00 -0.03 0.00 0.00 56.01 50.83 1l6i n LEU 364 Cb 0.94 0.12 0.31 0.00 -2.33 0.00 0.00 43.42 42.47 1l6i n LEU 364 CO 0.36 2.03 1.23 1.55 -1.33 0.00 0.00 177.39 181.23 1l6i h PRO 365 N 4.29 0.81 -0.10 3.23 0.13 -1.67 -0.50 132.00 138.19 1l6i h PRO 365 Ca 0.14 -0.05 -0.24 0.00 -0.87 0.00 0.00 66.00 64.98 1l6i h PRO 365 Cb 0.80 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 31.76 1l6i h PRO 365 CO 0.59 0.54 -0.87 -0.09 -0.23 0.00 0.00 178.00 177.94 1l6i h ARG 366 N 0.84 0.77 -0.51 0.86 9.65 -1.93 -2.30 114.38 121.76 1l6i h ARG 366 Ca 0.48 -0.69 -0.06 0.00 -1.10 0.00 0.00 59.98 58.61 1l6i h ARG 366 Cb 0.62 0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.35 1l6i h ARG 366 CO -0.24 1.28 0.08 0.45 2.80 0.00 0.00 179.97 184.34 1l6i h HIS 367 N 0.49 0.90 -0.27 2.20 3.86 -1.79 -1.55 115.15 118.99 1l6i h HIS 367 Ca -0.08 -0.13 0.05 0.00 -1.16 0.00 0.00 60.37 59.06 1l6i h HIS 367 Cb 1.51 -0.25 -0.05 0.00 1.06 0.00 0.00 27.41 29.68 1l6i h HIS 367 CO 0.09 0.82 -0.04 1.98 0.86 0.00 0.00 177.93 181.64 1l6i h MET 368 N 0.73 0.03 -0.80 2.45 1.85 -0.98 0.12 114.93 118.33 1l6i h MET 368 Ca 0.15 -0.00 0.19 0.00 -0.61 0.00 0.00 59.70 59.43 1l6i h MET 368 Cb 0.41 -0.01 -0.13 0.00 0.43 0.00 0.00 31.60 32.30 1l6i h MET 368 CO 0.01 0.02 0.17 1.96 -0.40 0.00 0.00 176.91 178.67 1l6i h GLN 369 N 0.03 0.21 -0.18 0.39 4.20 -1.04 -1.32 115.11 117.40 1l6i h GLN 369 Ca 0.13 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 1l6i h GLN 369 Cb 0.19 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1l6i h GLN 369 CO -0.26 0.14 -0.51 0.82 -0.67 0.00 0.00 178.83 178.35 1l6i h ILE 370 N 0.22 1.32 -0.22 2.54 2.04 -0.65 -2.04 117.51 120.72 1l6i h ILE 370 Ca 0.47 -1.74 -0.11 0.00 1.00 0.00 0.00 64.86 64.48 1l6i h ILE 370 Cb 0.87 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 1l6i h ILE 370 CO -0.60 0.54 -0.34 0.40 0.00 0.00 0.00 178.15 178.15 1l6i h ILE 371 N 0.38 1.29 -0.65 -0.67 2.04 -0.33 -1.39 117.51 118.18 1l6i h ILE 371 Ca 0.02 -1.43 -0.08 0.00 1.00 0.00 0.00 64.86 64.36 1l6i h ILE 371 Cb 1.03 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1l6i h ILE 371 CO 0.09 0.45 0.08 0.78 0.00 0.00 0.00 178.15 179.55 1l6i h ASN 372 N 0.40 1.05 -0.18 1.72 2.35 -0.94 -1.57 115.58 118.42 1l6i h ASN 372 Ca 0.05 -0.27 0.01 0.00 -0.55 0.00 0.00 56.30 55.54 1l6i h ASN 372 Cb 0.78 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 1l6i h ASN 372 CO 0.06 1.06 0.08 -0.08 -1.65 0.00 0.00 177.43 176.91 1l6i h GLU 373 N 1.01 0.18 -0.45 0.81 4.57 -1.02 0.21 114.58 119.89 1l6i h GLU 373 Ca 0.19 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.43 1l6i h GLU 373 Cb 0.47 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.97 1l6i h GLU 373 CO 0.02 0.12 0.14 0.82 -1.18 0.00 0.00 179.01 178.92 1l6i h ILE 374 N 0.18 0.83 -0.16 2.32 2.04 -0.90 -1.65 117.51 120.17 1l6i h ILE 374 Ca 0.07 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1l6i h ILE 374 Cb 0.02 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 1l6i h ILE 374 CO -0.06 0.05 -0.02 -1.13 0.00 0.00 0.00 178.15 176.99 1l6i h ASN 375 N 0.30 -0.11 -0.04 1.72 -1.24 -0.98 0.54 115.58 115.77 1l6i h ASN 375 Ca 0.21 0.04 0.01 0.00 0.71 0.00 0.00 56.30 57.28 1l6i h ASN 375 Cb 0.23 0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.35 1l6i h ASN 375 CO -0.24 -0.04 -0.03 0.74 -1.29 0.00 0.00 177.43 176.58 1l6i h THR 376 N 0.02 0.91 -0.75 -3.57 2.02 0.17 -1.13 112.91 110.58 1l6i h THR 376 Ca 0.07 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 1l6i h THR 376 Cb 0.11 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1l6i h THR 376 CO -0.15 0.00 0.36 0.03 0.37 0.00 0.00 175.52 176.13 1l6i h ARG 377 N -0.04 1.06 -0.61 6.66 3.08 -1.27 -2.11 114.38 121.16 1l6i h ARG 377 Ca 0.03 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1l6i h ARG 377 Cb 0.08 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 1l6i h ARG 377 CO -0.06 0.82 0.34 0.35 -1.07 0.00 0.00 179.97 180.34 1l6i h PHE 378 N 1.06 0.84 -1.02 3.04 3.57 -0.23 -2.87 116.94 121.32 1l6i h PHE 378 Ca 0.26 -0.02 0.29 0.00 3.53 0.00 0.00 57.97 62.02 1l6i h PHE 378 Cb 0.11 -0.27 -0.13 0.00 2.79 0.00 0.00 35.95 38.45 1l6i h PHE 378 CO 0.01 0.60 0.61 -0.22 -2.23 0.00 0.00 178.31 177.08 1l6i h LYS 379 N 0.83 0.43 0.19 1.11 3.64 -0.51 -0.75 116.57 121.50 1l6i h LYS 379 Ca 0.21 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1l6i h LYS 379 Cb 0.04 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1l6i h LYS 379 CO -0.03 0.28 -0.43 1.15 -2.27 0.00 0.00 179.45 178.14 1l6i h THR 380 N 0.44 0.00 -0.89 1.00 2.02 -1.46 0.59 112.91 114.61 1l6i h THR 380 Ca 0.68 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.96 1l6i h THR 380 Cb 1.49 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.83 1l6i h THR 380 CO -0.50 0.00 0.54 0.25 0.37 0.00 0.00 175.52 176.18 1l6i h LEU 381 N -0.68 0.80 -0.43 2.58 5.85 -1.28 0.31 115.31 122.46 1l6i h LEU 381 Ca -0.02 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 1l6i h LEU 381 Cb 0.66 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1l6i h LEU 381 CO -0.19 0.46 0.02 0.58 -0.34 0.00 0.00 178.44 178.97 1l6i h VAL 382 N 0.91 1.26 -0.40 1.05 2.07 -0.95 -1.35 116.25 118.84 1l6i h VAL 382 Ca 0.42 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.98 1l6i h VAL 382 Cb 0.35 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 1l6i h VAL 382 CO -0.23 0.34 0.20 -0.08 0.02 0.00 0.00 177.57 177.82 1l6i h GLU 383 N 0.59 0.40 -0.90 1.57 4.22 0.21 0.73 114.58 121.41 1l6i h GLU 383 Ca 0.12 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.54 1l6i h GLU 383 Cb 0.46 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 1l6i h GLU 383 CO 0.02 0.26 0.55 -0.22 -2.18 0.00 0.00 179.01 177.45 1l6i h LYS 384 N 0.41 1.22 0.02 1.92 3.64 -0.28 -0.97 116.57 122.53 1l6i h LYS 384 Ca 0.17 -0.10 -0.22 0.00 -1.27 0.00 0.00 60.65 59.22 1l6i h LYS 384 Cb 0.07 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 1l6i h LYS 384 CO -0.11 0.84 -1.08 1.15 -2.27 0.00 0.00 179.45 177.98 1l6i h THR 385 N 1.24 1.64 -2.26 1.00 2.02 -0.40 -3.37 112.91 112.77 1l6i h THR 385 Ca 0.32 -3.33 -0.58 0.00 0.77 0.00 0.00 66.41 63.59 1l6i h THR 385 Cb -0.07 2.84 -0.40 0.00 -1.74 0.00 0.00 68.15 68.78 1l6i h THR 385 CO -0.06 0.94 -0.92 0.79 0.37 0.00 0.00 175.52 176.64 1l6i n TRP 386 N -3.36 0.63 -1.41 3.16 8.01 0.17 -5.09 117.44 119.54 1l6i n TRP 386 Ca -0.02 -3.69 -0.60 0.00 -1.31 0.00 0.00 57.50 51.88 1l6i n TRP 386 Cb 0.96 -0.25 -0.10 0.00 -2.01 0.00 0.00 31.31 29.91 1l6i n TRP 386 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 1l6i n PRO 387 N 1.77 0.00 -0.73 -0.99 -0.02 -0.37 -1.80 135.00 132.86 1l6i n PRO 387 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1l6i n PRO 387 Cb 0.47 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 1l6i n PRO 387 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l6i n GLY 388 N 5.51 0.41 3.60 -1.23 0.00 -1.26 -4.95 105.19 107.27 1l6i n GLY 388 Ca 0.41 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 1l6i n GLY 388 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l6i s ASP 389 N -2.40 6.36 0.16 1.61 -1.08 -0.74 -4.84 116.67 115.73 1l6i s ASP 389 Ca 0.00 0.80 0.25 0.00 -0.52 0.00 0.00 52.55 53.08 1l6i s ASP 389 Cb 0.00 -2.54 0.56 0.00 -1.46 0.00 0.00 42.92 39.48 1l6i s ASP 389 CO 0.00 -1.42 1.53 -0.62 0.52 0.00 0.00 175.17 175.18 1l6i n GLU 390 N 8.05 0.27 0.05 4.34 -0.58 -1.26 -2.69 120.64 128.83 1l6i n GLU 390 Ca 0.16 0.14 -0.20 0.00 -0.42 0.00 0.00 57.16 56.84 1l6i n GLU 390 Cb 0.48 -1.74 -0.14 0.00 -0.57 0.00 0.00 31.44 29.48 1l6i n GLU 390 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1l6i h LYS 391 N 0.00 0.39 -0.59 3.49 6.56 -1.99 -1.12 116.57 123.31 1l6i h LYS 391 Ca 0.00 -0.58 -0.08 0.00 -1.06 0.00 0.00 60.65 58.93 1l6i h LYS 391 Cb 0.74 0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 32.58 1l6i h LYS 391 CO 0.00 1.25 0.04 0.28 -2.06 0.00 0.00 179.45 178.96 1l6i h VAL 392 N -0.18 1.26 -0.33 0.50 2.07 -1.97 -2.62 116.25 114.98 1l6i h VAL 392 Ca -0.14 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.27 1l6i h VAL 392 Cb 1.65 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1l6i h VAL 392 CO 0.17 0.39 0.05 -0.25 0.02 0.00 0.00 177.57 177.95 1l6i h TRP 393 N 0.92 0.58 -0.95 1.57 2.91 -1.49 -1.71 115.95 117.78 1l6i h TRP 393 Ca 0.17 -0.08 0.25 0.00 1.13 0.00 0.00 58.89 60.36 1l6i h TRP 393 Cb 0.48 -0.16 -0.13 0.00 -0.51 0.00 0.00 29.16 28.84 1l6i h TRP 393 CO 0.03 0.62 0.48 0.00 -1.03 0.00 0.00 178.44 178.55 1l6i h ALA 394 N 0.89 1.65 0.00 2.65 0.00 -0.99 0.87 119.26 124.33 1l6i h ALA 394 Ca 0.10 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1l6i h ALA 394 Cb 0.35 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1l6i h ALA 394 CO 0.01 -0.37 -0.46 -0.22 0.00 0.00 0.00 179.25 178.21 1l6i h LYS 395 N 0.43 0.00 0.00 0.00 3.64 -0.99 -3.30 116.57 116.36 1l6i h LYS 395 Ca 0.62 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.00 1l6i h LYS 395 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1l6i h LYS 395 CO -0.54 0.46 -0.83 1.28 -2.27 0.00 0.00 179.45 177.55 1l6i n LEU 396 N -3.30 0.51 -4.77 5.20 4.77 -0.49 -5.02 117.00 113.90 1l6i n LEU 396 Ca 0.01 -0.40 -0.41 0.00 -0.03 0.00 0.00 56.01 55.18 1l6i n LEU 396 Cb 0.66 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.75 1l6i n LEU 396 CO 0.39 0.13 1.15 0.00 -1.33 0.00 0.00 177.39 177.73 1l6i s ALA 397 N -2.41 3.60 0.11 -1.18 0.00 0.18 -4.90 121.76 117.17 1l6i s ALA 397 Ca 0.03 1.56 -0.13 0.00 0.00 0.00 0.00 51.96 53.42 1l6i s ALA 397 Cb 0.10 -3.61 -0.10 0.00 0.00 0.00 0.00 23.12 19.51 1l6i s ALA 397 CO 0.56 -1.02 1.39 0.28 0.00 0.00 0.00 175.76 176.97 1l6i h VAL 398 N 3.06 1.29 -3.50 0.00 2.07 -1.91 -3.43 116.25 113.83 1l6i h VAL 398 Ca -0.50 -1.68 -0.67 0.00 0.82 0.00 0.00 66.70 64.67 1l6i h VAL 398 Cb 1.23 1.66 -0.29 0.00 -1.52 0.00 0.00 31.29 32.37 1l6i h VAL 398 CO 0.67 0.54 -0.81 -0.69 0.02 0.00 0.00 177.57 177.30 1l6i s VAL 399 N -4.14 2.66 -0.20 2.57 1.01 -1.26 -1.16 120.40 119.87 1l6i s VAL 399 Ca -0.11 -0.82 -0.28 0.00 0.00 0.00 0.00 61.98 60.77 1l6i s VAL 399 Cb 0.09 -2.07 0.12 0.00 0.00 0.00 0.00 36.38 34.53 1l6i s VAL 399 CO 0.88 0.55 0.99 -2.28 0.00 0.00 0.00 175.10 175.23 1l6i s HIS 400 N 0.15 -0.43 -1.46 5.22 5.04 -0.39 -4.94 115.29 118.47 1l6i s HIS 400 Ca -0.10 0.89 -0.03 0.00 -1.54 0.00 0.00 55.06 54.28 1l6i s HIS 400 Cb -0.16 0.41 0.02 0.00 0.04 0.00 0.00 32.58 32.90 1l6i s HIS 400 CO 0.06 -0.32 0.42 -3.47 -2.34 0.00 0.00 174.74 169.09 1l6i n ASP 401 N 1.35 -0.60 -0.17 9.88 2.03 -1.26 -1.09 116.55 126.69 1l6i n ASP 401 Ca -0.12 -1.04 -0.02 0.00 0.52 0.00 0.00 54.79 54.13 1l6i n ASP 401 Cb 0.57 -2.85 -0.01 0.00 -0.72 0.00 0.00 41.12 38.11 1l6i n ASP 401 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1l6i n LYS 402 N -4.42 -1.68 -4.34 -0.67 4.76 -1.26 -4.97 118.16 105.58 1l6i n LYS 402 Ca -0.26 0.52 -0.26 0.00 -2.87 0.00 0.00 58.31 55.45 1l6i n LYS 402 Cb 0.66 -4.82 -0.12 0.00 -1.84 0.00 0.00 35.03 28.91 1l6i n LYS 402 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1l6i s GLN 403 N -1.96 1.28 -0.16 1.97 -0.21 -0.25 -0.29 119.66 120.04 1l6i s GLN 403 Ca 0.00 -1.30 -0.08 0.00 0.02 0.00 0.00 55.36 54.00 1l6i s GLN 403 Cb 0.00 -1.60 -0.04 0.00 1.00 0.00 0.00 33.01 32.36 1l6i s GLN 403 CO 0.00 0.37 0.12 0.08 -2.12 0.00 0.00 175.29 173.74 1l6i s VAL 404 N -1.30 5.31 -0.49 1.09 1.01 0.32 -1.26 120.40 125.08 1l6i s VAL 404 Ca 0.12 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 62.08 1l6i s VAL 404 Cb -0.09 -3.37 0.08 0.00 0.00 0.00 0.00 36.38 33.00 1l6i s VAL 404 CO 0.06 0.52 0.47 -1.00 0.00 0.00 0.00 175.10 175.15 1l6i s HIS 405 N -0.27 3.20 0.14 5.22 0.09 -0.31 -1.68 115.29 121.68 1l6i s HIS 405 Ca 0.10 -0.91 -0.15 0.00 -0.00 0.00 0.00 55.06 54.10 1l6i s HIS 405 Cb -0.12 -3.37 0.01 0.00 -0.00 0.00 0.00 32.58 29.11 1l6i s HIS 405 CO 0.01 -0.90 1.70 0.52 -0.00 0.00 0.00 174.74 176.08 1l6i h MET 406 N 8.84 0.64 -0.95 1.40 2.86 -1.80 -2.66 114.93 123.26 1l6i h MET 406 Ca -0.29 -0.11 0.04 0.00 -2.06 0.00 0.00 59.70 57.29 1l6i h MET 406 Cb 1.11 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 32.60 1l6i h MET 406 CO 0.93 0.57 0.62 0.00 1.06 0.00 0.00 176.91 180.09 1l6i h ALA 407 N 1.03 1.28 -0.72 6.32 0.00 -1.92 -0.72 119.26 124.53 1l6i h ALA 407 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1l6i h ALA 407 Cb 0.16 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1l6i h ALA 407 CO -0.01 0.46 0.48 -0.91 0.00 0.00 0.00 179.25 179.27 1l6i h ASN 408 N 1.17 0.83 -0.11 0.00 4.21 -1.89 0.86 115.58 120.64 1l6i h ASN 408 Ca 0.39 -0.02 -0.08 0.00 1.21 0.00 0.00 56.30 57.80 1l6i h ASN 408 Cb 0.05 -0.21 -0.02 0.00 -1.12 0.00 0.00 38.32 37.03 1l6i h ASN 408 CO -0.14 0.60 -0.17 0.25 -1.29 0.00 0.00 177.43 176.68 1l6i h LEU 409 N 0.98 0.49 -0.31 1.61 5.85 -0.82 -1.50 115.31 121.59 1l6i h LEU 409 Ca 0.27 -0.14 -0.17 0.00 0.84 0.00 0.00 57.88 58.68 1l6i h LEU 409 Cb -0.11 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 1l6i h LEU 409 CO -0.06 0.67 -0.46 0.00 -0.34 0.00 0.00 178.44 178.25 1l6i h VAL 411 N 0.66 1.27 -0.07 0.00 3.04 -0.66 -2.81 116.25 117.68 1l6i h VAL 411 Ca 0.03 -1.45 -0.11 0.00 -1.01 0.00 0.00 66.70 64.16 1l6i h VAL 411 Cb 1.06 1.25 -0.01 0.00 -2.01 0.00 0.00 31.29 31.58 1l6i h VAL 411 CO 0.11 0.49 -0.47 0.58 -1.01 0.00 0.00 177.57 177.26 1l6i h VAL 412 N 0.78 1.34 -0.02 1.51 2.07 -1.08 -3.27 116.25 117.57 1l6i h VAL 412 Ca 0.09 -1.66 0.00 0.00 0.82 0.00 0.00 66.70 65.95 1l6i h VAL 412 Cb 0.86 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.44 1l6i h VAL 412 CO 0.08 0.49 -0.39 0.61 0.02 0.00 0.00 177.57 178.37 1l6i n GLY 413 N -0.08 -0.01 2.91 2.17 0.00 0.63 -4.98 105.19 105.82 1l6i n GLY 413 Ca -0.02 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 1l6i n GLY 413 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l6i n GLY 414 N 1.40 3.43 0.45 -0.02 0.00 -1.06 -4.20 105.19 105.19 1l6i n GLY 414 Ca 0.10 -2.32 0.09 0.00 0.00 0.00 0.00 46.02 43.89 1l6i n GLY 414 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1l6i n PHE 415 N -1.16 0.00 -3.66 1.61 -1.74 -0.26 -4.94 117.46 107.31 1l6i n PHE 415 Ca -0.12 0.00 -0.15 0.00 -0.56 0.00 0.00 57.45 56.62 1l6i n PHE 415 Cb 0.50 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.42 1l6i n PHE 415 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1l6i s ALA 416 N -2.00 -1.35 -0.05 1.98 0.00 -1.26 -4.75 121.76 114.33 1l6i s ALA 416 Ca 0.16 1.25 -0.00 0.00 0.00 0.00 0.00 51.96 53.36 1l6i s ALA 416 Cb 0.15 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.81 1l6i s ALA 416 CO 0.42 -0.29 -0.01 0.08 0.00 0.00 0.00 175.76 175.97 1l6i s VAL 417 N -0.41 0.34 0.03 0.00 1.01 -0.70 0.41 120.40 121.08 1l6i s VAL 417 Ca -0.06 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1l6i s VAL 417 Cb -0.03 -0.45 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 1l6i s VAL 417 CO 0.04 0.21 -0.10 0.54 0.00 0.00 0.00 175.10 175.79 1l6i s ASN 418 N 1.39 1.18 0.66 3.32 4.22 -0.17 -0.80 114.94 124.74 1l6i s ASN 418 Ca -0.04 -0.44 0.01 0.00 -2.14 0.00 0.00 52.86 50.25 1l6i s ASN 418 Cb -0.13 -0.04 0.10 0.00 1.28 0.00 0.00 41.25 42.45 1l6i s ASN 418 CO -0.02 -0.06 0.91 -0.83 -2.04 0.00 0.00 177.10 175.06 1l6i s GLY 419 N -1.16 1.78 -0.13 0.45 0.00 -0.92 -1.29 107.32 106.05 1l6i s GLY 419 Ca -0.03 -1.66 0.15 0.00 0.00 0.00 0.00 44.72 43.18 1l6i s GLY 419 CO 0.01 -1.18 1.30 3.33 0.00 0.00 0.00 173.10 176.56 1l6i n VAL 420 N -2.64 1.89 -3.61 1.40 0.24 -1.26 -2.12 118.33 112.23 1l6i n VAL 420 Ca 0.13 -1.75 -0.06 0.00 -2.04 0.00 0.00 64.34 60.62 1l6i n VAL 420 Cb 0.60 -0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.86 1l6i n VAL 420 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l6i s ALA 421 N -2.40 -2.04 0.23 2.33 0.00 -1.25 -1.99 121.76 116.65 1l6i s ALA 421 Ca 0.34 1.76 -0.11 0.00 0.00 0.00 0.00 51.96 53.94 1l6i s ALA 421 Cb 0.27 -1.18 0.33 0.00 0.00 0.00 0.00 23.12 22.54 1l6i s ALA 421 CO 0.08 -0.27 1.61 0.00 0.00 0.00 0.00 175.76 177.18 1l6i h ALA 422 N 2.33 0.54 -0.52 0.00 0.00 -1.92 1.05 119.26 120.75 1l6i h ALA 422 Ca -0.13 0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1l6i h ALA 422 Cb 1.18 0.54 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1l6i h ALA 422 CO 0.26 -0.42 -0.06 1.25 0.00 0.00 0.00 179.25 180.28 1l6i h LEU 423 N 0.01 0.96 -0.19 0.00 6.46 -1.91 -2.17 115.31 118.46 1l6i h LEU 423 Ca 0.37 -0.34 -0.08 0.00 -0.12 0.00 0.00 57.88 57.71 1l6i h LEU 423 Cb 0.58 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1l6i h LEU 423 CO -0.75 1.07 -0.18 -0.74 -0.62 0.00 0.00 178.44 177.21 1l6i h HIS 424 N 0.83 0.55 0.00 1.25 2.76 -0.67 -1.97 115.15 117.89 1l6i h HIS 424 Ca 0.14 -0.16 -0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1l6i h HIS 424 Cb 0.61 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 1l6i h HIS 424 CO 0.04 0.82 -0.02 0.77 -1.30 0.00 0.00 177.93 178.24 1l6i h SER 425 N 0.13 0.00 0.10 3.26 0.02 0.10 0.64 113.55 117.81 1l6i h SER 425 Ca 0.03 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.75 1l6i h SER 425 Cb 0.72 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.28 1l6i h SER 425 CO 0.05 0.02 -0.99 -0.78 -1.14 0.00 0.00 176.83 173.99 1l6i h ASP 426 N 0.00 0.69 -0.22 3.07 3.58 -0.72 -3.07 116.42 119.75 1l6i h ASP 426 Ca -0.00 -0.85 -0.06 0.00 0.42 0.00 0.00 57.03 56.55 1l6i h ASP 426 Cb 0.13 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.95 1l6i h ASP 426 CO 0.00 1.47 -0.03 -0.07 -2.88 0.00 0.00 179.24 177.73 1l6i h LEU 427 N 0.01 0.52 -0.21 2.28 3.38 -0.49 0.25 115.31 121.04 1l6i h LEU 427 Ca -0.15 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.74 1l6i h LEU 427 Cb 1.71 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.30 1l6i h LEU 427 CO 0.19 0.61 0.03 0.58 0.09 0.00 0.00 178.44 179.94 1l6i h VAL 428 N 0.52 0.89 -0.32 1.22 2.07 -0.94 -0.71 116.25 118.99 1l6i h VAL 428 Ca 0.11 -0.04 -0.08 0.00 0.82 0.00 0.00 66.70 67.51 1l6i h VAL 428 Cb 0.38 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1l6i h VAL 428 CO 0.02 0.02 -0.10 0.58 0.02 0.00 0.00 177.57 178.11 1l6i h VAL 429 N 0.12 1.28 0.12 2.57 2.07 -1.37 0.44 116.25 121.48 1l6i h VAL 429 Ca 0.10 -1.16 -0.29 0.00 0.82 0.00 0.00 66.70 66.16 1l6i h VAL 429 Cb 0.10 1.38 0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1l6i h VAL 429 CO -0.14 0.38 -1.24 0.11 0.02 0.00 0.00 177.57 176.70 1l6i h LYS 430 N 0.41 0.55 0.00 1.57 1.57 -0.77 -2.37 116.57 117.53 1l6i h LYS 430 Ca 0.08 -0.76 -0.19 0.00 -1.87 0.00 0.00 60.65 57.92 1l6i h LYS 430 Cb 0.60 0.25 -0.03 0.00 0.08 0.00 0.00 32.23 33.13 1l6i h LYS 430 CO 0.04 1.34 -1.70 -0.25 -0.57 0.00 0.00 179.45 178.31 1l6i n ASP 431 N -3.74 2.56 -0.11 0.86 9.92 -0.32 -4.43 116.55 121.29 1l6i n ASP 431 Ca -0.13 -0.01 -0.21 0.00 -0.53 0.00 0.00 54.79 53.91 1l6i n ASP 431 Cb 0.99 0.64 -0.09 0.00 -0.64 0.00 0.00 41.12 42.02 1l6i n ASP 431 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1l6i n LEU 432 N -2.43 1.89 -2.48 0.64 7.94 -0.80 -4.71 117.00 117.05 1l6i n LEU 432 Ca -0.17 0.42 -0.19 0.00 -1.11 0.00 0.00 56.01 54.95 1l6i n LEU 432 Cb 0.82 -0.89 0.02 0.00 0.53 0.00 0.00 43.42 43.89 1l6i n LEU 432 CO 0.21 0.23 0.09 0.49 -1.11 0.00 0.00 177.39 177.29 1l6i n PHE 433 N -4.40 2.50 -0.20 1.96 3.72 0.08 -4.92 117.46 116.19 1l6i n PHE 433 Ca -0.35 -2.79 0.00 0.00 -0.05 0.00 0.00 57.45 54.27 1l6i n PHE 433 Cb 0.68 -0.22 0.11 0.00 -0.94 0.00 0.00 39.48 39.11 1l6i n PHE 433 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1l6i h PRO 434 N 2.63 0.37 -0.06 -1.08 0.11 -1.63 -1.32 132.00 131.00 1l6i h PRO 434 Ca 0.16 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 1l6i h PRO 434 Cb 1.13 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1l6i h PRO 434 CO 0.68 0.24 -0.00 0.93 -0.21 0.00 0.00 178.00 179.64 1l6i h GLU 435 N 0.38 0.11 -0.77 1.05 3.07 -1.91 -1.06 114.58 115.44 1l6i h GLU 435 Ca 0.31 -0.04 0.04 0.00 -0.50 0.00 0.00 59.36 59.17 1l6i h GLU 435 Cb 0.40 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 1l6i h GLU 435 CO -0.33 0.39 0.51 1.88 -1.40 0.00 0.00 179.01 180.06 1l6i h TYR 436 N -0.18 0.90 -0.39 4.33 0.05 -1.92 -0.95 116.97 118.81 1l6i h TYR 436 Ca 0.02 0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.73 1l6i h TYR 436 Cb 0.34 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 1l6i h TYR 436 CO 0.03 0.52 -0.14 1.25 -1.05 0.00 0.00 178.16 178.77 1l6i h HIS 437 N 0.93 0.78 -0.28 4.88 2.76 -1.02 0.43 115.15 123.63 1l6i h HIS 437 Ca 0.31 -0.14 0.06 0.00 -2.20 0.00 0.00 60.37 58.40 1l6i h HIS 437 Cb 0.07 -0.20 -0.06 0.00 1.55 0.00 0.00 27.41 28.77 1l6i h HIS 437 CO -0.00 0.81 -0.11 1.96 -1.30 0.00 0.00 177.93 179.29 1l6i h GLN 438 N 0.64 -0.05 -0.20 5.26 4.20 0.11 0.14 115.11 125.21 1l6i h GLN 438 Ca 0.11 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.70 1l6i h GLN 438 Cb 0.60 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1l6i h GLN 438 CO 0.04 -0.04 -0.39 -0.07 -0.67 0.00 0.00 178.83 177.71 1l6i h LEU 439 N -0.06 0.48 -5.98 1.46 3.38 -0.76 -3.37 115.31 110.47 1l6i h LEU 439 Ca 0.14 -0.20 -0.50 0.00 0.09 0.00 0.00 57.88 57.40 1l6i h LEU 439 Cb 0.27 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 40.49 1l6i h LEU 439 CO -0.32 0.82 -1.15 0.79 0.09 0.00 0.00 178.44 178.68 1l6i n TRP 440 N -4.04 0.23 -0.34 1.13 8.01 0.15 -4.97 117.44 117.60 1l6i n TRP 440 Ca -0.01 -3.77 0.07 0.00 -1.31 0.00 0.00 57.50 52.48 1l6i n TRP 440 Cb 0.49 -0.41 0.24 0.00 -2.01 0.00 0.00 31.31 29.62 1l6i n TRP 440 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1l6i h PRO 441 N 3.25 0.87 0.00 -0.99 0.13 -0.90 -1.40 132.00 132.95 1l6i h PRO 441 Ca 0.10 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1l6i h PRO 441 Cb 0.93 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1l6i h PRO 441 CO 0.51 0.57 0.00 0.09 -0.23 0.00 0.00 178.00 178.94 1l6i n ASN 442 N -4.69 0.00 0.02 1.44 3.02 -1.26 -3.18 115.26 110.61 1l6i n ASN 442 Ca 0.19 -1.05 0.11 0.00 -0.03 0.00 0.00 54.58 53.80 1l6i n ASN 442 Cb 0.38 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.54 1l6i n ASN 442 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1l6i n LYS 443 N -0.66 0.25 -3.69 3.52 4.81 -0.53 -4.95 118.16 116.92 1l6i n LYS 443 Ca 0.05 -0.03 -0.37 0.00 -0.87 0.00 0.00 58.31 57.09 1l6i n LYS 443 Cb 0.02 -1.56 -0.06 0.00 0.02 0.00 0.00 35.03 33.45 1l6i n LYS 443 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1l6i s PHE 444 N -3.18 3.59 0.30 5.64 0.40 -1.19 -1.73 117.98 121.81 1l6i s PHE 444 Ca 0.04 0.66 0.00 0.00 -0.60 0.00 0.00 56.93 57.03 1l6i s PHE 444 Cb 0.15 -2.14 -0.02 0.00 0.51 0.00 0.00 43.02 41.52 1l6i s PHE 444 CO 0.82 0.57 0.33 -1.01 0.70 0.00 0.00 175.22 176.63 1l6i s HIS 445 N -0.62 1.25 -0.01 0.36 3.76 0.02 -4.98 115.29 115.08 1l6i s HIS 445 Ca 0.17 -1.38 0.07 0.00 -0.15 0.00 0.00 55.06 53.77 1l6i s HIS 445 Cb -0.13 -0.38 -0.02 0.00 1.11 0.00 0.00 32.58 33.15 1l6i s HIS 445 CO 0.06 -0.92 -0.22 1.21 -0.85 0.00 0.00 174.74 174.03 1l6i s ASN 446 N -3.24 2.60 -0.05 1.40 3.04 -1.26 -2.16 114.94 115.27 1l6i s ASN 446 Ca 0.35 -0.42 -0.01 0.00 0.04 0.00 0.00 52.86 52.82 1l6i s ASN 446 Cb 0.02 -0.28 0.03 0.00 -1.54 0.00 0.00 41.25 39.48 1l6i s ASN 446 CO 0.20 0.26 0.03 -0.69 -3.04 0.00 0.00 177.10 173.85 1l6i s VAL 447 N -0.56 0.12 0.27 -5.21 1.01 -0.90 -4.93 120.40 110.20 1l6i s VAL 447 Ca 0.09 0.24 -0.29 0.00 0.00 0.00 0.00 61.98 62.02 1l6i s VAL 447 Cb -0.09 -0.30 -0.09 0.00 0.00 0.00 0.00 36.38 35.90 1l6i s VAL 447 CO -0.00 0.20 1.02 -0.89 0.00 0.00 0.00 175.10 175.42 1l6i s THR 448 N 1.81 3.78 1.39 3.92 2.01 -1.26 -3.95 115.64 123.34 1l6i s THR 448 Ca 0.01 1.75 -0.21 0.00 0.31 0.00 0.00 61.69 63.56 1l6i s THR 448 Cb -0.12 -4.10 0.36 0.00 0.01 0.00 0.00 72.50 68.64 1l6i s THR 448 CO -0.03 0.39 0.93 0.20 -0.69 0.00 0.00 174.62 175.41 1l6i s ASN 449 N -1.08 -0.85 0.17 3.53 0.01 -0.84 -4.61 114.94 111.27 1l6i s ASN 449 Ca 0.44 1.05 -0.24 0.00 -0.71 0.00 0.00 52.86 53.40 1l6i s ASN 449 Cb -0.28 -1.54 0.06 0.00 0.41 0.00 0.00 41.25 39.89 1l6i s ASN 449 CO 0.36 -5.26 0.87 -0.83 -1.51 0.00 0.00 177.10 170.73 1l6i s GLY 450 N -2.87 -0.24 0.08 0.66 0.00 -1.26 -4.82 107.32 98.87 1l6i s GLY 450 Ca 0.68 0.11 0.03 0.00 0.00 0.00 0.00 44.72 45.54 1l6i s GLY 450 CO 0.60 0.02 -0.09 -0.26 0.00 0.00 0.00 173.10 173.37 1l6i s ILE 451 N -3.46 0.79 -0.06 0.90 -5.25 -0.47 -4.59 121.20 109.05 1l6i s ILE 451 Ca 0.11 -1.56 -0.22 0.00 -0.99 0.00 0.00 60.65 57.99 1l6i s ILE 451 Cb -0.02 -1.23 -0.04 0.00 2.95 0.00 0.00 42.46 44.11 1l6i s ILE 451 CO 0.02 -0.58 0.64 0.28 -1.79 0.00 0.00 174.94 173.51 1l6i s THR 452 N -2.41 5.05 -0.99 8.37 -1.32 -1.26 -1.72 115.64 121.35 1l6i s THR 452 Ca 0.03 1.31 0.20 0.00 -1.21 0.00 0.00 61.69 62.02 1l6i s THR 452 Cb -0.03 -3.98 0.16 0.00 -1.51 0.00 0.00 72.50 67.15 1l6i s THR 452 CO -0.01 0.30 1.63 -2.65 -2.21 0.00 0.00 174.62 171.68 1l6i n PRO 453 N 3.56 0.00 0.00 7.08 -0.02 -1.26 -1.63 135.00 142.73 1l6i n PRO 453 Ca -0.03 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1l6i n PRO 453 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 1l6i n PRO 453 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1l6i n ARG 454 N -1.51 0.00 -0.15 -0.52 3.00 -1.26 -1.83 116.66 114.39 1l6i n ARG 454 Ca 0.05 0.21 -0.03 0.00 -0.01 0.00 0.00 57.85 58.06 1l6i n ARG 454 Cb 0.23 -1.04 0.05 0.00 0.00 0.00 0.00 32.46 31.70 1l6i n ARG 454 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1l6i h ARG 455 N 0.00 0.27 -0.01 5.56 2.43 -1.96 0.58 114.38 121.24 1l6i h ARG 455 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1l6i h ARG 455 Cb 0.00 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1l6i h ARG 455 CO 0.00 0.18 0.00 0.91 -1.51 0.00 0.00 179.97 179.55 1l6i n TRP 456 N -5.06 0.01 0.10 2.20 7.02 -0.65 -2.47 117.44 118.59 1l6i n TRP 456 Ca 0.04 -0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 1l6i n TRP 456 Cb 0.20 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.09 1l6i n TRP 456 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 1l6i n ILE 457 N -0.29 0.00 -0.20 -0.99 5.41 -1.01 -4.80 119.36 117.47 1l6i n ILE 457 Ca 0.21 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.87 1l6i n ILE 457 Cb 0.25 -0.45 0.02 0.00 -0.71 0.00 0.00 39.64 38.75 1l6i n ILE 457 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1l6i h LYS 458 N 0.00 0.92 0.01 0.38 3.64 -0.52 -1.03 116.57 119.96 1l6i h LYS 458 Ca 0.00 -0.24 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1l6i h LYS 458 Cb 0.00 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1l6i h LYS 458 CO 0.00 0.88 -0.00 0.37 -2.27 0.00 0.00 179.45 178.42 1l6i h GLN 459 N 0.82 -0.01 0.00 1.90 4.15 -1.01 -3.36 115.11 117.60 1l6i h GLN 459 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 1l6i h GLN 459 Cb 0.39 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1l6i h GLN 459 CO 0.01 0.76 -0.02 0.00 -1.93 0.00 0.00 178.83 177.65 1l6i n ASN 461 N -2.29 1.05 0.26 0.00 2.85 -0.39 -4.82 115.26 111.92 1l6i n ASN 461 Ca 0.05 -2.92 0.14 0.00 -0.11 0.00 0.00 54.58 51.74 1l6i n ASN 461 Cb 0.43 -0.63 0.65 0.00 1.24 0.00 0.00 39.78 41.47 1l6i n ASN 461 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1l6i h PRO 462 N 3.72 0.00 -0.00 1.20 0.13 -1.71 -1.13 132.00 134.21 1l6i h PRO 462 Ca 0.10 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.08 1l6i h PRO 462 Cb 0.85 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 1l6i h PRO 462 CO 0.54 0.12 -0.70 0.00 -0.23 0.00 0.00 178.00 177.73 1l6i h ALA 463 N 1.88 0.84 -0.27 -0.56 0.00 -1.91 -0.93 119.26 118.30 1l6i h ALA 463 Ca -0.00 -0.64 -0.19 0.00 0.00 0.00 0.00 54.91 54.08 1l6i h ALA 463 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1l6i h ALA 463 CO 0.02 0.88 -0.57 1.25 0.00 0.00 0.00 179.25 180.82 1l6i h LEU 464 N 0.00 0.94 -0.48 0.00 5.85 -1.59 -2.53 115.31 117.51 1l6i h LEU 464 Ca -0.01 -0.52 -0.10 0.00 0.84 0.00 0.00 57.88 58.10 1l6i h LEU 464 Cb 1.25 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1l6i h LEU 464 CO 0.09 1.31 -0.08 0.00 -0.34 0.00 0.00 178.44 179.42 1l6i h ALA 465 N 0.71 0.66 -0.42 1.25 0.00 -1.26 -1.04 119.26 119.15 1l6i h ALA 465 Ca 0.01 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1l6i h ALA 465 Cb 1.18 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1l6i h ALA 465 CO 0.12 0.53 0.05 0.00 0.00 0.00 0.00 179.25 179.95 1l6i h ALA 466 N 0.90 1.31 -0.24 0.00 0.00 -1.10 -1.07 119.26 119.04 1l6i h ALA 466 Ca 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1l6i h ALA 466 Cb 0.62 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1l6i h ALA 466 CO 0.04 0.48 0.14 1.25 0.00 0.00 0.00 179.25 181.16 1l6i h LEU 467 N 0.62 0.29 -1.11 0.00 5.85 -0.93 -2.10 115.31 117.93 1l6i h LEU 467 Ca 0.14 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1l6i h LEU 467 Cb 0.32 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1l6i h LEU 467 CO 0.01 0.26 0.29 -0.07 -0.34 0.00 0.00 178.44 178.58 1l6i h LEU 468 N 0.30 0.82 -1.46 2.25 3.38 -1.00 -0.42 115.31 119.18 1l6i h LEU 468 Ca 0.09 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1l6i h LEU 468 Cb 0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1l6i h LEU 468 CO -0.02 0.72 0.37 0.44 0.09 0.00 0.00 178.44 180.04 1l6i h ASP 469 N 0.90 0.63 0.38 -0.43 3.32 -0.93 -2.03 116.42 118.26 1l6i h ASP 469 Ca 0.22 -0.01 -0.32 0.00 0.02 0.00 0.00 57.03 56.94 1l6i h ASP 469 Cb 0.12 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.53 1l6i h ASP 469 CO -0.03 0.45 -1.50 0.50 -1.72 0.00 0.00 179.24 176.94 1l6i h LYS 470 N 0.74 0.37 0.00 3.56 3.64 -0.44 -3.31 116.57 121.12 1l6i h LYS 470 Ca 0.21 -0.63 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1l6i h LYS 470 Cb -0.05 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1l6i h LYS 470 CO -0.05 1.28 -0.35 0.43 -2.27 0.00 0.00 179.45 178.49 1l6i n SER 471 N -3.57 0.62 -4.35 4.20 7.64 -0.41 -4.89 113.62 112.85 1l6i n SER 471 Ca -0.16 0.25 -0.32 0.00 1.01 0.00 0.00 58.87 59.64 1l6i n SER 471 Cb 1.07 -0.18 -0.15 0.00 -1.01 0.00 0.00 64.21 63.93 1l6i n SER 471 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1l6i s LEU 472 N -3.98 2.26 0.19 -3.43 1.43 -0.77 -4.97 118.68 109.41 1l6i s LEU 472 Ca 0.09 -0.40 -0.10 0.00 -1.03 0.00 0.00 54.13 52.70 1l6i s LEU 472 Cb 0.14 -1.41 0.10 0.00 0.03 0.00 0.00 46.19 45.05 1l6i s LEU 472 CO 0.66 0.31 1.72 1.56 0.23 0.00 0.00 176.35 180.83 1l6i h GLN 473 N 5.59 1.06 -6.41 1.70 1.08 -1.88 -3.45 115.11 112.80 1l6i h GLN 473 Ca -0.41 -0.23 -0.63 0.00 -1.45 0.00 0.00 58.65 55.92 1l6i h GLN 473 Cb 1.14 -0.15 -0.13 0.00 -0.05 0.00 0.00 27.48 28.29 1l6i h GLN 473 CO 0.48 0.93 -0.69 0.15 -0.95 0.00 0.00 178.83 178.75 1l6i s LYS 474 N -5.39 2.33 -0.10 1.46 1.02 -1.26 -5.08 119.74 112.71 1l6i s LYS 474 Ca -0.12 -1.03 -0.39 0.00 0.02 0.00 0.00 55.97 54.44 1l6i s LYS 474 Cb 0.14 -2.37 -0.17 0.00 -0.52 0.00 0.00 37.83 34.91 1l6i s LYS 474 CO 0.83 0.49 1.51 -1.91 -0.92 0.00 0.00 175.35 175.35 1l6i n GLU 475 N 0.28 1.03 -0.01 1.68 4.07 -1.26 -4.87 120.64 121.57 1l6i n GLU 475 Ca -0.11 0.38 0.09 0.00 -0.06 0.00 0.00 57.16 57.45 1l6i n GLU 475 Cb 0.54 -2.02 -0.13 0.00 -0.06 0.00 0.00 31.44 29.77 1l6i n GLU 475 CO 0.00 0.00 0.00 -2.67 -0.06 0.00 0.00 177.13 174.40 1l6i n TRP 476 N 3.78 0.00 0.03 4.31 4.27 -1.26 -4.38 117.44 124.19 1l6i n TRP 476 Ca 0.23 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.94 1l6i n TRP 476 Cb 0.15 -0.30 0.54 0.00 -1.36 0.00 0.00 31.31 30.34 1l6i n TRP 476 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1l6i h ALA 477 N 1.85 2.00 0.00 -1.67 0.00 -1.95 0.12 119.26 119.62 1l6i h ALA 477 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1l6i h ALA 477 Cb 0.70 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1l6i h ALA 477 CO 0.00 -0.08 -0.43 0.27 0.00 0.00 0.00 179.25 179.02 1l6i n ASN 478 N -4.48 1.75 -2.87 0.00 0.23 -1.26 -4.54 115.26 104.08 1l6i n ASN 478 Ca 0.05 -3.49 -0.12 0.00 -0.53 0.00 0.00 54.58 50.49 1l6i n ASN 478 Cb 0.26 -0.48 0.03 0.00 -2.08 0.00 0.00 39.78 37.51 1l6i n ASN 478 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1l6i n ASP 479 N -1.02 -1.87 0.29 0.53 -0.08 0.39 -5.02 116.55 109.76 1l6i n ASP 479 Ca 0.17 -3.23 0.17 0.00 -1.51 0.00 0.00 54.79 50.39 1l6i n ASP 479 Cb 0.72 1.14 0.84 0.00 2.34 0.00 0.00 41.12 46.16 1l6i n ASP 479 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1l6i h LEU 480 N 3.75 0.00 -1.64 -2.67 5.85 -1.74 -1.00 115.31 117.86 1l6i h LEU 480 Ca -0.08 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1l6i h LEU 480 Cb 1.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1l6i h LEU 480 CO 0.33 0.06 0.00 0.44 -0.34 0.00 0.00 178.44 178.93 1l6i h ASP 481 N 0.00 0.00 -0.01 1.25 3.32 -1.87 -1.16 116.42 117.96 1l6i h ASP 481 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1l6i h ASP 481 Cb 0.31 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1l6i h ASP 481 CO 0.01 0.00 0.02 1.56 -1.72 0.00 0.00 179.24 179.11 1l6i h GLN 482 N 0.00 0.00 0.00 3.56 1.08 -1.51 -2.37 115.11 115.87 1l6i h GLN 482 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1l6i h GLN 482 Cb 0.11 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1l6i h GLN 482 CO 0.00 0.00 -0.05 -0.07 -0.95 0.00 0.00 178.83 177.76 1l6i h LEU 483 N 0.00 0.00 -2.12 1.46 4.07 -1.42 -2.37 115.31 114.93 1l6i h LEU 483 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.04 1l6i h LEU 483 Cb 0.04 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1l6i h LEU 483 CO -0.00 0.05 0.23 -0.29 -1.08 0.00 0.00 178.44 177.35 1l6i h ILE 484 N 0.00 0.62 0.00 1.22 6.09 -1.32 0.24 117.51 124.36 1l6i h ILE 484 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1l6i h ILE 484 Cb 0.10 0.83 0.00 0.00 0.47 0.00 0.00 36.82 38.22 1l6i h ILE 484 CO 0.01 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 175.68 1l6i n ASN 485 N -4.07 0.00 0.03 2.19 3.02 -0.89 -1.73 115.26 113.81 1l6i n ASN 485 Ca 0.03 0.23 0.14 0.00 -0.03 0.00 0.00 54.58 54.95 1l6i n ASN 485 Cb 0.38 -0.29 0.56 0.00 -0.61 0.00 0.00 39.78 39.81 1l6i n ASN 485 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1l6i n LEU 486 N -1.29 0.21 -0.27 3.41 4.77 0.85 -4.09 117.00 120.58 1l6i n LEU 486 Ca 0.02 0.52 0.04 0.00 -0.03 0.00 0.00 56.01 56.56 1l6i n LEU 486 Cb 0.04 -0.46 0.18 0.00 -2.33 0.00 0.00 43.42 40.85 1l6i n LEU 486 CO 0.03 -0.06 1.08 -0.33 -1.33 0.00 0.00 177.39 176.79 1l6i h GLU 487 N 0.00 0.60 0.00 3.23 5.08 -1.52 -1.85 114.58 120.12 1l6i h GLU 487 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1l6i h GLU 487 Cb 0.55 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1l6i h GLU 487 CO 0.00 0.40 0.00 1.57 -1.00 0.00 0.00 179.01 179.98 1l6i h LYS 488 N 0.62 0.00 0.00 2.33 5.09 -1.84 -2.99 116.57 119.79 1l6i h LYS 488 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.14 1l6i h LYS 488 Cb 0.50 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.83 1l6i h LYS 488 CO -0.31 0.00 0.00 0.74 -2.09 0.00 0.00 179.45 177.79 1l6i h PHE 489 N 0.00 0.00 0.00 0.07 0.04 -1.60 -2.31 116.94 113.14 1l6i h PHE 489 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1l6i h PHE 489 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 1l6i h PHE 489 CO 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.71 1l6i n ALA 490 N -1.95 1.27 1.04 2.45 0.00 -1.13 -0.28 120.51 121.92 1l6i n ALA 490 Ca 0.03 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.68 1l6i n ALA 490 Cb 0.39 -1.26 0.05 0.00 0.00 0.00 0.00 19.45 18.63 1l6i n ALA 490 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1l6i n ASP 491 N -2.01 1.56 -4.50 0.00 8.00 -0.87 -4.80 116.55 113.93 1l6i n ASP 491 Ca 0.00 -1.23 -0.42 0.00 0.71 0.00 0.00 54.79 53.85 1l6i n ASP 491 Cb 0.09 0.51 -0.09 0.00 -0.02 0.00 0.00 41.12 41.62 1l6i n ASP 491 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1l6i s ASP 492 N -2.62 6.22 0.44 -2.24 2.15 0.62 -4.97 116.67 116.27 1l6i s ASP 492 Ca 0.17 -0.51 0.15 0.00 0.43 0.00 0.00 52.55 52.80 1l6i s ASP 492 Cb 0.18 -2.23 1.08 0.00 -0.30 0.00 0.00 42.92 41.64 1l6i s ASP 492 CO 0.63 -0.55 1.97 0.00 -0.17 0.00 0.00 175.17 177.06 1l6i h ALA 493 N 8.67 2.09 0.04 3.66 0.00 -1.88 -0.44 119.26 131.40 1l6i h ALA 493 Ca -0.27 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.40 1l6i h ALA 493 Cb 1.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1l6i h ALA 493 CO 0.78 -0.23 -1.03 -0.22 0.00 0.00 0.00 179.25 178.55 1l6i h LYS 494 N 0.36 0.18 -0.19 0.00 3.64 -1.93 -2.24 116.57 116.39 1l6i h LYS 494 Ca 0.29 -0.25 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 1l6i h LYS 494 Cb 0.64 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1l6i h LYS 494 CO -0.07 1.06 -0.27 0.35 -2.27 0.00 0.00 179.45 178.24 1l6i h PHE 495 N 0.07 0.64 -0.29 1.91 3.04 -1.58 -1.81 116.94 118.92 1l6i h PHE 495 Ca -0.07 -0.21 0.02 0.00 3.98 0.00 0.00 57.97 61.69 1l6i h PHE 495 Cb 1.73 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 40.10 1l6i h PHE 495 CO 0.03 0.92 0.19 0.00 -2.02 0.00 0.00 178.31 177.44 1l6i h ARG 496 N 0.18 0.30 -0.13 1.11 3.08 -0.99 -0.79 114.38 117.13 1l6i h ARG 496 Ca 0.02 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1l6i h ARG 496 Cb 0.85 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1l6i h ARG 496 CO 0.06 0.20 -0.43 0.37 -1.07 0.00 0.00 179.97 179.10 1l6i h GLN 497 N 0.31 0.52 0.00 0.04 4.15 -1.19 -0.89 115.11 118.05 1l6i h GLN 497 Ca 0.12 -0.39 -0.06 0.00 0.77 0.00 0.00 58.65 59.08 1l6i h GLN 497 Cb 0.09 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 1l6i h GLN 497 CO -0.02 1.01 -0.30 1.96 -1.93 0.00 0.00 178.83 179.55 1l6i h GLN 498 N 0.13 0.00 -0.03 1.69 4.20 -0.56 -2.02 115.11 118.53 1l6i h GLN 498 Ca -0.02 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1l6i h GLN 498 Cb 1.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.84 1l6i h GLN 498 CO 0.09 0.30 -0.16 -0.92 -0.67 0.00 0.00 178.83 177.47 1l6i h TYR 499 N 0.00 0.22 -0.77 2.96 5.03 -1.00 -2.20 116.97 121.21 1l6i h TYR 499 Ca -0.00 -0.10 -0.03 0.00 2.58 0.00 0.00 58.73 61.18 1l6i h TYR 499 Cb 0.55 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.76 1l6i h TYR 499 CO 0.00 0.81 0.35 -0.09 -1.32 0.00 0.00 178.16 177.91 1l6i h ARG 500 N -0.43 1.12 -0.76 1.82 2.43 -0.98 -1.24 114.38 116.34 1l6i h ARG 500 Ca -0.01 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.00 1l6i h ARG 500 Cb 0.83 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 1l6i h ARG 500 CO 0.03 0.89 0.49 0.93 -1.51 0.00 0.00 179.97 180.80 1l6i h GLU 501 N 1.10 0.94 -0.63 0.20 5.08 -1.41 -0.88 114.58 118.98 1l6i h GLU 501 Ca 0.26 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1l6i h GLU 501 Cb 0.15 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1l6i h GLU 501 CO -0.03 0.62 0.40 0.82 -1.00 0.00 0.00 179.01 179.82 1l6i h ILE 502 N 0.97 1.18 -0.81 3.13 2.04 -0.60 0.12 117.51 123.54 1l6i h ILE 502 Ca 0.29 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 1l6i h ILE 502 Cb -0.04 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 1l6i h ILE 502 CO -0.09 0.18 0.34 0.50 0.00 0.00 0.00 178.15 179.07 1l6i h LYS 503 N 0.86 1.19 -0.37 2.37 1.63 -0.89 -1.66 116.57 119.70 1l6i h LYS 503 Ca 0.23 -0.21 -0.15 0.00 -0.85 0.00 0.00 60.65 59.67 1l6i h LYS 503 Cb -0.05 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.37 1l6i h LYS 503 CO -0.05 0.95 -0.37 1.96 -3.45 0.00 0.00 179.45 178.50 1l6i h GLN 504 N 1.17 0.89 -0.26 1.90 1.08 -0.79 -1.65 115.11 117.43 1l6i h GLN 504 Ca 0.27 -0.45 -0.04 0.00 -1.45 0.00 0.00 58.65 56.98 1l6i h GLN 504 Cb 0.19 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 1l6i h GLN 504 CO -0.03 1.10 0.01 0.00 -0.95 0.00 0.00 178.83 178.96 1l6i h ALA 505 N 0.85 1.53 -0.60 3.87 0.00 -0.44 -1.93 119.26 122.53 1l6i h ALA 505 Ca 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1l6i h ALA 505 Cb 0.94 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1l6i h ALA 505 CO 0.09 0.35 0.18 -0.91 0.00 0.00 0.00 179.25 178.96 1l6i h ASN 506 N 0.38 0.88 -0.30 0.00 2.35 -0.89 -2.22 115.58 115.80 1l6i h ASN 506 Ca 0.09 -0.21 -0.11 0.00 -0.55 0.00 0.00 56.30 55.51 1l6i h ASN 506 Cb 0.25 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1l6i h ASN 506 CO 0.01 0.86 -0.21 0.11 -1.65 0.00 0.00 177.43 176.55 1l6i h LYS 507 N 0.86 0.77 0.04 0.81 1.57 -0.81 -1.63 116.57 118.19 1l6i h LYS 507 Ca 0.19 -0.30 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1l6i h LYS 507 Cb 0.30 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1l6i h LYS 507 CO -0.00 0.91 -0.06 0.28 -0.57 0.00 0.00 179.45 180.00 1l6i h VAL 508 N 0.68 0.84 -0.53 0.50 2.07 -1.20 -1.01 116.25 117.60 1l6i h VAL 508 Ca 0.10 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.70 1l6i h VAL 508 Cb 0.71 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1l6i h VAL 508 CO 0.05 0.00 0.36 0.03 0.02 0.00 0.00 177.57 178.03 1l6i h ARG 509 N -0.14 0.37 -0.09 1.57 3.08 -1.04 -1.62 114.38 116.51 1l6i h ARG 509 Ca 0.01 -0.02 -0.20 0.00 0.07 0.00 0.00 59.98 59.84 1l6i h ARG 509 Cb 0.14 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1l6i h ARG 509 CO -0.04 0.25 -0.78 1.25 -1.07 0.00 0.00 179.97 179.58 1l6i h LEU 510 N 0.38 0.65 -0.61 3.04 5.85 -0.86 -2.26 115.31 121.51 1l6i h LEU 510 Ca 0.24 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 58.58 1l6i h LEU 510 Cb 0.45 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 1l6i h LEU 510 CO -0.06 1.21 0.32 0.00 -0.34 0.00 0.00 178.44 179.56 1l6i h ALA 511 N 0.78 0.80 -0.47 1.25 0.00 -0.23 0.80 119.26 122.19 1l6i h ALA 511 Ca -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1l6i h ALA 511 Cb 1.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1l6i h ALA 511 CO 0.14 -0.02 0.15 0.93 0.00 0.00 0.00 179.25 180.46 1l6i h GLU 512 N 0.60 0.69 -0.14 0.00 5.08 -1.01 -0.68 114.58 119.12 1l6i h GLU 512 Ca 0.27 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1l6i h GLU 512 Cb 0.18 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1l6i h GLU 512 CO -0.18 0.60 -0.16 0.35 -1.00 0.00 0.00 179.01 178.61 1l6i h PHE 513 N 0.68 0.44 -0.89 4.33 3.57 -0.96 -1.55 116.94 122.54 1l6i h PHE 513 Ca 0.16 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1l6i h PHE 513 Cb 0.19 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1l6i h PHE 513 CO 0.01 0.77 0.53 0.28 -2.23 0.00 0.00 178.31 177.66 1l6i h VAL 514 N -0.02 1.25 -0.42 1.41 2.07 -0.68 0.10 116.25 119.95 1l6i h VAL 514 Ca 0.02 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1l6i h VAL 514 Cb 0.70 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1l6i h VAL 514 CO 0.04 0.27 0.14 0.50 0.02 0.00 0.00 177.57 178.53 1l6i h LYS 515 N 1.24 0.65 0.00 1.57 1.63 -0.85 0.52 116.57 121.33 1l6i h LYS 515 Ca 0.32 -0.14 -0.08 0.00 -0.85 0.00 0.00 60.65 59.90 1l6i h LYS 515 Cb -0.03 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.49 1l6i h LYS 515 CO -0.06 0.64 -0.39 -0.39 -3.45 0.00 0.00 179.45 175.80 1l6i h VAL 516 N 0.54 0.79 0.00 2.00 -1.51 -0.60 -1.79 116.25 115.68 1l6i h VAL 516 Ca 0.14 -1.69 -0.04 0.00 -1.23 0.00 0.00 66.70 63.87 1l6i h VAL 516 Cb 0.25 2.08 -0.01 0.00 -2.13 0.00 0.00 31.29 31.49 1l6i h VAL 516 CO -0.01 0.38 -1.08 0.03 -1.23 0.00 0.00 177.57 175.67 1l6i h ARG 517 N 0.00 0.00 0.00 5.19 2.47 -0.76 -3.41 114.38 117.87 1l6i h ARG 517 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1l6i h ARG 517 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 1l6i h ARG 517 CO 0.05 0.07 -0.18 0.25 0.56 0.00 0.00 179.97 180.72 1l6i n THR 518 N -2.74 0.00 0.00 2.04 -2.24 0.15 -4.97 114.28 106.53 1l6i n THR 518 Ca -0.02 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1l6i n THR 518 Cb 0.62 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 1l6i n THR 518 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l6i n GLY 519 N 0.76 2.62 3.74 3.38 0.00 -0.67 -5.02 105.19 110.00 1l6i n GLY 519 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1l6i n GLY 519 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l6i s ILE 520 N -2.20 4.31 -0.28 -0.61 1.01 -1.26 -4.94 121.20 117.23 1l6i s ILE 520 Ca 0.00 2.05 -0.18 0.00 0.00 0.00 0.00 60.65 62.52 1l6i s ILE 520 Cb 0.00 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 1l6i s ILE 520 CO 0.00 0.38 0.52 -0.70 0.00 0.00 0.00 174.94 175.14 1l6i s GLU 521 N -0.44 3.96 0.12 2.79 2.12 -1.26 -3.70 118.70 122.29 1l6i s GLU 521 Ca 0.45 0.21 0.05 0.00 0.36 0.00 0.00 54.97 56.04 1l6i s GLU 521 Cb -0.25 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.41 1l6i s GLU 521 CO 0.31 -0.43 0.06 0.96 -0.54 0.00 0.00 175.26 175.62 1l6i s ILE 522 N 2.35 4.26 -0.48 -3.70 -4.36 -1.26 -5.05 121.20 112.96 1l6i s ILE 522 Ca 0.21 -1.00 -0.24 0.00 -0.26 0.00 0.00 60.65 59.36 1l6i s ILE 522 Cb -0.15 -3.09 0.03 0.00 1.25 0.00 0.00 42.46 40.49 1l6i s ILE 522 CO 0.10 0.03 0.88 0.21 0.24 0.00 0.00 174.94 176.41 1l6i s ASN 523 N -2.62 6.44 0.00 4.36 2.47 -1.26 -4.91 114.94 119.42 1l6i s ASN 523 Ca 0.28 -0.05 0.18 0.00 0.42 0.00 0.00 52.86 53.69 1l6i s ASN 523 Cb -0.11 -2.43 1.05 0.00 -1.45 0.00 0.00 41.25 38.32 1l6i s ASN 523 CO 0.21 -1.04 1.47 -0.81 -3.72 0.00 0.00 177.10 173.20 1l6i n PRO 524 N 7.07 0.54 0.00 0.43 -0.05 -1.26 -0.75 135.00 140.99 1l6i n PRO 524 Ca 0.04 0.01 0.11 0.00 -0.05 0.00 0.00 63.50 63.61 1l6i n PRO 524 Cb 0.48 -1.50 0.03 0.00 -0.05 0.00 0.00 33.50 32.46 1l6i n PRO 524 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 175.50 176.49 1l6i n GLN 525 N -1.02 0.83 -1.63 0.54 1.13 -1.26 -4.91 117.38 111.07 1l6i n GLN 525 Ca 0.13 -0.66 -0.30 0.00 -1.94 0.00 0.00 57.00 54.22 1l6i n GLN 525 Cb 0.07 -1.49 0.06 0.00 0.11 0.00 0.00 30.24 28.99 1l6i n GLN 525 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1l6i s ALA 526 N -2.62 2.56 -0.08 -1.58 0.00 0.07 -4.93 121.76 115.18 1l6i s ALA 526 Ca 0.17 -0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 1l6i s ALA 526 Cb 0.18 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 1l6i s ALA 526 CO 0.64 -1.38 1.44 0.42 0.00 0.00 0.00 175.76 176.87 1l6i s ILE 527 N -3.15 3.88 -0.49 0.00 1.01 -0.43 -4.81 121.20 117.22 1l6i s ILE 527 Ca 0.59 1.13 -0.21 0.00 0.00 0.00 0.00 60.65 62.16 1l6i s ILE 527 Cb -0.14 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.65 1l6i s ILE 527 CO 0.54 -0.07 0.73 -0.36 0.00 0.00 0.00 174.94 175.78 1l6i s PHE 528 N 3.38 2.98 -0.53 3.97 0.40 -1.26 -0.47 117.98 126.45 1l6i s PHE 528 Ca 0.64 -0.20 -0.14 0.00 -0.60 0.00 0.00 56.93 56.62 1l6i s PHE 528 Cb -0.28 -3.64 0.13 0.00 0.51 0.00 0.00 43.02 39.74 1l6i s PHE 528 CO 0.23 -1.07 0.47 0.34 0.70 0.00 0.00 175.22 175.89 1l6i s ASP 529 N 2.49 6.08 -0.25 1.36 -1.08 0.37 -0.59 116.67 125.05 1l6i s ASP 529 Ca 0.23 -1.86 -0.09 0.00 -0.52 0.00 0.00 52.55 50.31 1l6i s ASP 529 Cb -0.15 -2.16 -0.04 0.00 -1.46 0.00 0.00 42.92 39.11 1l6i s ASP 529 CO 0.17 -0.81 0.12 -0.63 0.52 0.00 0.00 175.17 174.54 1l6i s ILE 530 N 1.48 4.82 -0.32 4.11 1.01 0.18 -1.11 121.20 131.36 1l6i s ILE 530 Ca 0.04 -0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.72 1l6i s ILE 530 Cb -0.28 -3.26 0.09 0.00 0.01 0.00 0.00 42.46 39.01 1l6i s ILE 530 CO 0.02 0.32 0.01 -1.58 0.00 0.00 0.00 174.94 173.71 1l6i s GLN 531 N 1.46 1.79 -0.17 2.79 0.74 -0.62 -1.67 119.66 123.98 1l6i s GLN 531 Ca 0.06 -1.69 -0.00 0.00 0.05 0.00 0.00 55.36 53.78 1l6i s GLN 531 Cb -0.15 -3.15 0.04 0.00 1.10 0.00 0.00 33.01 30.86 1l6i s GLN 531 CO 0.06 -0.83 -0.06 0.96 -0.55 0.00 0.00 175.29 174.87 1l6i s ILE 532 N 1.00 1.22 0.00 -2.34 -4.36 -1.26 -2.90 121.20 112.55 1l6i s ILE 532 Ca 0.04 -0.70 0.00 0.00 -0.26 0.00 0.00 60.65 59.73 1l6i s ILE 532 Cb -0.20 -1.37 0.00 0.00 1.25 0.00 0.00 42.46 42.14 1l6i s ILE 532 CO -0.06 0.14 0.00 2.29 0.24 0.00 0.00 174.94 177.55 1l6i n LYS 533 N 4.84 -0.40 -1.72 0.37 2.85 -0.86 -4.94 118.16 118.30 1l6i n LYS 533 Ca -0.13 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.76 1l6i n LYS 533 Cb 0.48 0.00 0.06 0.00 -0.65 0.00 0.00 35.03 34.91 1l6i n LYS 533 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1l6i n ARG 534 N -0.11 1.31 -2.23 -1.58 1.74 -1.26 -3.98 116.66 110.56 1l6i n ARG 534 Ca 0.00 0.50 -0.43 0.00 -0.77 0.00 0.00 57.85 57.15 1l6i n ARG 534 Cb 0.00 -2.50 -0.02 0.00 -1.02 0.00 0.00 32.46 28.92 1l6i n ARG 534 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1l6i s LEU 535 N -3.65 3.59 -0.14 0.55 1.98 -0.94 -4.88 118.68 115.19 1l6i s LEU 535 Ca 0.77 1.05 -0.11 0.00 -2.89 0.00 0.00 54.13 52.95 1l6i s LEU 535 Cb -0.40 -3.53 0.04 0.00 0.66 0.00 0.00 46.19 42.96 1l6i s LEU 535 CO 0.45 -1.49 0.36 -2.28 -1.89 0.00 0.00 176.35 171.50 1l6i s HIS 536 N 5.82 -0.44 0.33 5.38 2.46 -1.26 -4.69 115.29 122.89 1l6i s HIS 536 Ca 0.68 1.03 0.12 0.00 0.47 0.00 0.00 55.06 57.36 1l6i s HIS 536 Cb -0.17 0.16 1.03 0.00 -0.13 0.00 0.00 32.58 33.47 1l6i s HIS 536 CO 0.32 -0.24 1.62 0.93 -2.47 0.00 0.00 174.74 174.91 1l6i h GLU 537 N 6.16 0.15 0.00 2.88 5.08 -1.97 0.18 114.58 127.06 1l6i h GLU 537 Ca -0.31 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1l6i h GLU 537 Cb 1.18 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1l6i h GLU 537 CO 0.29 0.10 0.00 0.10 -1.00 0.00 0.00 179.01 178.50 1l6i h TYR 538 N 0.15 0.00 0.00 4.33 -0.00 -1.97 -2.40 116.97 117.08 1l6i h TYR 538 Ca 0.71 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.44 1l6i h TYR 538 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.38 1l6i h TYR 538 CO -0.15 0.00 -0.03 0.87 -0.00 0.00 0.00 178.16 178.85 1l6i h LYS 539 N 0.00 0.00 -5.90 0.10 1.57 -0.98 -2.86 116.57 108.50 1l6i h LYS 539 Ca 0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.39 1l6i h LYS 539 Cb 0.50 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.92 1l6i h LYS 539 CO 0.00 0.00 -0.75 0.54 -0.57 0.00 0.00 179.45 178.67 1l6i n ARG 540 N -2.96 -6.65 -0.12 3.15 1.74 -0.90 -3.77 116.66 107.14 1l6i n ARG 540 Ca 0.04 0.76 0.27 0.00 -0.77 0.00 0.00 57.85 58.15 1l6i n ARG 540 Cb 0.52 -5.70 0.72 0.00 -1.02 0.00 0.00 32.46 26.97 1l6i n ARG 540 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1l6i h GLN 541 N -2.21 0.00 0.00 5.56 7.50 -1.85 -0.30 115.11 123.80 1l6i h GLN 541 Ca -0.59 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.56 1l6i h GLN 541 Cb 1.36 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.89 1l6i h GLN 541 CO 0.56 0.00 0.00 1.12 -1.50 0.00 0.00 178.83 179.01 1l6i h HIS 542 N 0.00 0.00 0.13 2.96 2.07 -1.92 -2.25 115.15 116.14 1l6i h HIS 542 Ca 0.38 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 57.63 1l6i h HIS 542 Cb 1.62 0.00 0.03 0.00 2.57 0.00 0.00 27.41 31.62 1l6i h HIS 542 CO 0.00 0.00 -1.12 1.25 -3.07 0.00 0.00 177.93 174.99 1l6i h LEU 543 N 0.00 0.76 -0.69 6.12 5.85 -1.43 -2.17 115.31 123.75 1l6i h LEU 543 Ca 0.00 -0.85 0.10 0.00 0.84 0.00 0.00 57.88 57.97 1l6i h LEU 543 Cb 0.70 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.42 1l6i h LEU 543 CO 0.00 1.54 0.31 -1.13 -0.34 0.00 0.00 178.44 178.82 1l6i h ASN 544 N 0.09 0.36 -0.60 1.25 -0.00 -1.38 -1.64 115.58 113.66 1l6i h ASN 544 Ca -0.18 0.08 -0.02 0.00 -0.00 0.00 0.00 56.30 56.18 1l6i h ASN 544 Cb 1.83 0.02 -0.03 0.00 -0.00 0.00 0.00 38.32 40.14 1l6i h ASN 544 CO 0.21 0.20 0.30 0.25 -0.00 0.00 0.00 177.43 178.39 1l6i h LEU 545 N 0.52 0.81 -0.51 0.34 5.85 -1.28 -0.57 115.31 120.45 1l6i h LEU 545 Ca 0.35 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.88 1l6i h LEU 545 Cb 0.43 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1l6i h LEU 545 CO -0.31 0.69 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.30 1l6i h LEU 546 N 0.89 0.99 -1.27 2.25 3.38 -0.71 -2.41 115.31 118.42 1l6i h LEU 546 Ca 0.22 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1l6i h LEU 546 Cb 0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1l6i h LEU 546 CO -0.03 1.11 -0.10 -0.74 0.09 0.00 0.00 178.44 178.77 1l6i h HIS 547 N 0.84 0.39 -0.67 1.13 2.76 -0.41 -2.54 115.15 116.65 1l6i h HIS 547 Ca 0.13 -0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.18 1l6i h HIS 547 Cb 0.67 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.50 1l6i h HIS 547 CO 0.05 0.47 0.15 0.82 -1.30 0.00 0.00 177.93 178.12 1l6i h ILE 548 N 0.35 1.26 -0.81 6.26 2.04 -0.92 -2.69 117.51 123.00 1l6i h ILE 548 Ca 0.07 -0.98 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 1l6i h ILE 548 Cb 0.40 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1l6i h ILE 548 CO 0.02 0.37 0.37 -0.07 0.00 0.00 0.00 178.15 178.84 1l6i h LEU 549 N 1.02 1.08 -0.54 1.44 3.38 -1.10 -0.48 115.31 120.11 1l6i h LEU 549 Ca 0.21 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1l6i h LEU 549 Cb 0.39 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1l6i h LEU 549 CO 0.01 0.93 0.00 0.00 0.09 0.00 0.00 178.44 179.47 1l6i h ALA 550 N 1.20 0.73 -0.75 1.53 0.00 -1.35 0.54 119.26 121.14 1l6i h ALA 550 Ca 0.28 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1l6i h ALA 550 Cb 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1l6i h ALA 550 CO -0.03 0.55 0.29 -0.07 0.00 0.00 0.00 179.25 179.98 1l6i h LEU 551 N 0.83 1.05 -0.45 0.00 3.38 -1.24 -0.26 115.31 118.62 1l6i h LEU 551 Ca 0.15 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1l6i h LEU 551 Cb 0.53 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1l6i h LEU 551 CO 0.03 0.95 0.20 0.22 0.09 0.00 0.00 178.44 179.92 1l6i h TYR 552 N 1.10 0.67 -0.06 1.13 3.20 -0.36 -1.62 116.97 121.02 1l6i h TYR 552 Ca 0.25 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 1l6i h TYR 552 Cb 0.23 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 1l6i h TYR 552 CO 0.02 0.56 0.00 -0.22 -1.64 0.00 0.00 178.16 176.88 1l6i h LYS 553 N 0.59 0.11 -0.80 1.82 3.64 -0.72 -0.76 116.57 120.45 1l6i h LYS 553 Ca 0.15 -0.04 0.19 0.00 -1.27 0.00 0.00 60.65 59.68 1l6i h LYS 553 Cb 0.16 -0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 31.82 1l6i h LYS 553 CO -0.02 0.38 -0.01 1.49 -2.27 0.00 0.00 179.45 179.02 1l6i h GLU 554 N -0.17 0.08 0.00 1.90 4.81 -0.77 0.40 114.58 120.83 1l6i h GLU 554 Ca 0.02 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 1l6i h GLU 554 Cb 0.33 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1l6i h GLU 554 CO 0.00 0.05 -0.46 -0.84 -0.73 0.00 0.00 179.01 177.03 1l6i h ILE 555 N 0.08 0.80 -0.31 2.32 3.07 -1.12 -2.61 117.51 119.74 1l6i h ILE 555 Ca 0.44 -2.11 -0.08 0.00 1.55 0.00 0.00 64.86 64.66 1l6i h ILE 555 Cb 0.79 2.38 -0.01 0.00 -0.27 0.00 0.00 36.82 39.71 1l6i h ILE 555 CO -0.72 0.45 -0.12 0.03 -1.05 0.00 0.00 178.15 176.73 1l6i h ARG 556 N 0.00 0.64 -0.88 0.16 3.08 0.42 -3.28 114.38 114.51 1l6i h ARG 556 Ca -0.00 -0.27 -0.28 0.00 0.07 0.00 0.00 59.98 59.50 1l6i h ARG 556 Cb 1.34 -0.02 -0.17 0.00 0.08 0.00 0.00 29.97 31.20 1l6i h ARG 556 CO 0.06 0.85 0.35 0.39 -1.07 0.00 0.00 179.97 180.55 1l6i n GLU 557 N -4.41 2.75 0.00 0.04 1.02 0.13 -4.60 120.64 115.57 1l6i n GLU 557 Ca -0.03 -2.49 0.00 0.00 -0.02 0.00 0.00 57.16 54.63 1l6i n GLU 557 Cb 0.36 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 1l6i n GLU 557 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1l6i n ASN 558 N -0.38 0.00 0.06 1.62 5.15 -0.99 -4.97 115.26 115.75 1l6i n ASN 558 Ca 0.40 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.44 1l6i n ASN 558 Cb 1.31 0.00 0.31 0.00 -0.53 0.00 0.00 39.78 40.87 1l6i n ASN 558 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1l6i n PRO 559 N 0.00 0.07 -0.73 1.20 -0.04 -1.26 -1.52 135.00 132.73 1l6i n PRO 559 Ca 0.00 0.46 0.06 0.00 -0.04 0.00 0.00 63.50 63.98 1l6i n PRO 559 Cb 0.00 -1.68 0.33 0.00 -0.04 0.00 0.00 33.50 32.11 1l6i n PRO 559 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1l6i n GLN 560 N -1.82 4.15 -2.52 0.54 3.00 -1.26 -5.01 117.38 114.45 1l6i n GLN 560 Ca 0.01 -2.58 -0.35 0.00 -0.01 0.00 0.00 57.00 54.06 1l6i n GLN 560 Cb 0.09 -2.11 -0.04 0.00 0.00 0.00 0.00 30.24 28.19 1l6i n GLN 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1l6i s ALA 561 N -2.40 2.98 -1.28 -1.58 0.00 -0.57 -4.92 121.76 113.99 1l6i s ALA 561 Ca 0.45 0.68 -0.06 0.00 0.00 0.00 0.00 51.96 53.03 1l6i s ALA 561 Cb 0.34 -3.27 0.08 0.00 0.00 0.00 0.00 23.12 20.27 1l6i s ALA 561 CO 0.14 -0.29 2.51 -0.25 0.00 0.00 0.00 175.76 177.86 1l6i n ASP 562 N -0.50 7.99 -4.48 0.00 8.00 -1.26 -4.95 116.55 121.36 1l6i n ASP 562 Ca 0.07 -3.07 -0.34 0.00 0.71 0.00 0.00 54.79 52.17 1l6i n ASP 562 Cb 0.51 -1.38 -0.12 0.00 -0.02 0.00 0.00 41.12 40.11 1l6i n ASP 562 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1l6i s ARG 563 N -0.76 3.63 0.40 -1.24 1.81 -1.26 -5.05 118.95 116.48 1l6i s ARG 563 Ca 0.57 -0.54 -0.26 0.00 -1.72 0.00 0.00 55.73 53.78 1l6i s ARG 563 Cb 0.20 -2.89 -0.09 0.00 -0.45 0.00 0.00 34.95 31.73 1l6i s ARG 563 CO -0.10 0.22 1.25 0.54 -0.68 0.00 0.00 175.30 176.53 1l6i s VAL 564 N 0.41 2.84 0.41 3.52 0.11 -1.26 -4.94 120.40 121.49 1l6i s VAL 564 Ca -0.05 0.73 -0.27 0.00 -2.93 0.00 0.00 61.98 59.47 1l6i s VAL 564 Cb -0.14 -3.42 -0.10 0.00 -1.53 0.00 0.00 36.38 31.18 1l6i s VAL 564 CO 0.03 0.09 1.47 -2.84 -3.33 0.00 0.00 175.10 170.53 1l6i s PRO 565 N -2.24 3.90 0.07 1.54 0.02 -1.26 -4.91 135.00 132.12 1l6i s PRO 565 Ca 0.57 2.53 0.07 0.00 0.02 0.00 0.00 61.00 64.19 1l6i s PRO 565 Cb -0.35 -2.82 -0.03 0.00 0.02 0.00 0.00 34.50 31.32 1l6i s PRO 565 CO 0.45 -0.69 -0.19 1.03 -0.33 0.00 0.00 177.00 177.27 1l6i s ARG 566 N -2.27 1.11 -0.26 5.54 0.52 -0.51 -1.31 118.95 121.77 1l6i s ARG 566 Ca 0.57 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.76 1l6i s ARG 566 Cb -0.46 -1.26 0.04 0.00 0.52 0.00 0.00 34.95 33.79 1l6i s ARG 566 CO 0.61 0.30 -0.08 0.08 0.02 0.00 0.00 175.30 176.23 1l6i s VAL 567 N -1.05 2.59 -0.30 3.52 1.01 0.38 -2.35 120.40 124.21 1l6i s VAL 567 Ca 0.05 -1.28 -0.24 0.00 0.00 0.00 0.00 61.98 60.51 1l6i s VAL 567 Cb -0.09 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1l6i s VAL 567 CO 0.03 0.10 0.80 -0.36 0.00 0.00 0.00 175.10 175.67 1l6i s PHE 568 N 1.24 3.21 -0.09 5.22 0.40 -0.56 -0.48 117.98 126.91 1l6i s PHE 568 Ca -0.03 0.85 -0.00 0.00 -0.60 0.00 0.00 56.93 57.15 1l6i s PHE 568 Cb -0.18 -3.21 -0.03 0.00 0.51 0.00 0.00 43.02 40.11 1l6i s PHE 568 CO -0.05 -0.55 -0.07 -0.51 0.70 0.00 0.00 175.22 174.74 1l6i s LEU 569 N 2.96 3.14 0.02 -0.37 1.02 -0.27 -0.79 118.68 124.40 1l6i s LEU 569 Ca 0.33 -0.07 0.07 0.00 0.02 0.00 0.00 54.13 54.48 1l6i s LEU 569 Cb -0.14 -1.70 -0.02 0.00 0.02 0.00 0.00 46.19 44.34 1l6i s LEU 569 CO 0.12 0.30 -0.21 -0.36 0.02 0.00 0.00 176.35 176.22 1l6i s PHE 570 N -0.45 1.89 -0.04 0.29 0.40 0.13 -1.59 117.98 118.61 1l6i s PHE 570 Ca 0.07 -0.37 -0.00 0.00 -0.60 0.00 0.00 56.93 56.02 1l6i s PHE 570 Cb -0.12 -1.15 0.03 0.00 0.51 0.00 0.00 43.02 42.28 1l6i s PHE 570 CO 0.02 0.05 0.00 0.20 0.70 0.00 0.00 175.22 176.20 1l6i s GLY 571 N -0.96 0.32 -0.29 4.36 0.00 -1.14 -0.72 107.32 108.88 1l6i s GLY 571 Ca 0.08 0.07 -0.29 0.00 0.00 0.00 0.00 44.72 44.58 1l6i s GLY 571 CO 0.01 0.80 1.39 0.00 0.00 0.00 0.00 173.10 175.30 1l6i s ALA 572 N 1.36 -2.15 0.08 3.20 0.00 -1.26 -2.03 121.76 120.97 1l6i s ALA 572 Ca -0.05 1.88 0.09 0.00 0.00 0.00 0.00 51.96 53.89 1l6i s ALA 572 Cb -0.13 -1.61 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 1l6i s ALA 572 CO -0.02 -0.21 -0.25 0.15 0.00 0.00 0.00 175.76 175.42 1l6i s LYS 573 N -0.87 1.50 -0.12 0.00 1.02 -1.26 -4.72 119.74 115.29 1l6i s LYS 573 Ca 0.09 -1.17 -0.08 0.00 0.02 0.00 0.00 55.97 54.84 1l6i s LYS 573 Cb -0.02 -1.79 -0.04 0.00 -0.52 0.00 0.00 37.83 35.46 1l6i s LYS 573 CO -0.10 0.44 0.15 0.00 -0.92 0.00 0.00 175.35 174.93 1l6i s ALA 574 N -0.94 3.85 0.22 5.17 0.00 -1.26 -2.22 121.76 126.58 1l6i s ALA 574 Ca 0.11 -0.62 -0.32 0.00 0.00 0.00 0.00 51.96 51.13 1l6i s ALA 574 Cb -0.10 -2.01 -0.14 0.00 0.00 0.00 0.00 23.12 20.87 1l6i s ALA 574 CO 0.04 0.56 1.35 0.00 0.00 0.00 0.00 175.76 177.71 1l6i n ALA 575 N 2.13 0.62 0.19 0.00 0.00 -1.26 -4.81 120.51 117.38 1l6i n ALA 575 Ca -0.19 0.43 0.17 0.00 0.00 0.00 0.00 53.44 53.84 1l6i n ALA 575 Cb 0.55 -2.21 0.80 0.00 0.00 0.00 0.00 19.45 18.58 1l6i n ALA 575 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1l6i h PRO 576 N 4.09 0.00 -0.56 0.00 0.11 -1.97 0.71 132.00 134.38 1l6i h PRO 576 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1l6i h PRO 576 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1l6i h PRO 576 CO 0.75 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.95 1l6i n GLY 577 N -1.44 2.10 3.46 -0.55 0.00 -1.26 -4.75 105.19 102.74 1l6i n GLY 577 Ca 0.02 -0.77 -0.44 0.00 0.00 0.00 0.00 46.02 44.83 1l6i n GLY 577 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1l6i s TYR 578 N -1.26 3.52 0.23 1.61 6.14 0.25 -4.90 117.35 122.93 1l6i s TYR 578 Ca 0.44 -2.13 -0.08 0.00 0.64 0.00 0.00 57.07 55.94 1l6i s TYR 578 Cb 0.24 -4.29 0.20 0.00 0.42 0.00 0.00 41.96 38.53 1l6i s TYR 578 CO 0.33 -1.38 1.87 1.88 0.64 0.00 0.00 175.55 178.89 1l6i h TYR 579 N 7.20 1.14 -0.60 4.97 0.05 -1.85 -1.91 116.97 125.96 1l6i h TYR 579 Ca 0.30 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.08 1l6i h TYR 579 Cb 0.88 -0.37 -0.03 0.00 1.01 0.00 0.00 36.73 38.22 1l6i h TYR 579 CO 1.09 0.75 0.36 1.25 -1.05 0.00 0.00 178.16 180.56 1l6i h LEU 580 N 1.19 0.73 -0.88 3.88 5.85 -1.95 -1.54 115.31 122.58 1l6i h LEU 580 Ca 0.31 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 1l6i h LEU 580 Cb -0.06 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 1l6i h LEU 580 CO -0.06 0.58 -0.04 0.00 -0.34 0.00 0.00 178.44 178.57 1l6i h ALA 581 N 1.18 1.07 0.00 1.25 0.00 -1.82 -1.64 119.26 119.30 1l6i h ALA 581 Ca 0.22 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1l6i h ALA 581 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1l6i h ALA 581 CO -0.04 0.58 -0.21 0.87 0.00 0.00 0.00 179.25 180.45 1l6i h LYS 582 N 0.72 0.00 0.00 0.00 1.57 -1.05 -2.46 116.57 115.35 1l6i h LYS 582 Ca 0.13 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.74 1l6i h LYS 582 Cb 0.50 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1l6i h LYS 582 CO 0.03 0.21 -0.82 -0.97 -0.57 0.00 0.00 179.45 177.32 1l6i h ASN 583 N 0.00 0.07 0.25 0.86 -0.00 -0.38 -2.72 115.58 113.66 1l6i h ASN 583 Ca -0.00 -0.06 -0.13 0.00 -0.00 0.00 0.00 56.30 56.11 1l6i h ASN 583 Cb 0.48 -0.02 -0.01 0.00 -0.00 0.00 0.00 38.32 38.76 1l6i h ASN 583 CO 0.03 0.86 -0.49 0.40 -0.00 0.00 0.00 177.43 178.22 1l6i h ILE 584 N 0.03 1.34 -0.19 2.57 2.04 -0.94 -1.97 117.51 120.39 1l6i h ILE 584 Ca -0.02 -1.72 0.03 0.00 1.00 0.00 0.00 64.86 64.15 1l6i h ILE 584 Cb 1.44 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 39.29 1l6i h ILE 584 CO 0.11 0.51 0.02 0.40 0.00 0.00 0.00 178.15 179.19 1l6i h ILE 585 N 0.23 0.89 -0.20 -0.67 2.04 -1.37 -2.17 117.51 116.26 1l6i h ILE 585 Ca 0.01 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1l6i h ILE 585 Cb 0.95 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 1l6i h ILE 585 CO 0.08 0.02 -0.00 0.15 0.00 0.00 0.00 178.15 178.39 1l6i h PHE 586 N 0.08 -0.01 -0.53 1.37 3.57 -1.37 -1.66 116.94 118.39 1l6i h PHE 586 Ca 0.09 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1l6i h PHE 586 Cb 0.09 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1l6i h PHE 586 CO -0.15 -0.03 0.28 0.00 -2.23 0.00 0.00 178.31 176.18 1l6i h ALA 587 N 1.17 0.68 -0.07 2.41 0.00 -1.19 -1.55 119.26 120.72 1l6i h ALA 587 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1l6i h ALA 587 Cb 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1l6i h ALA 587 CO -0.16 -0.05 0.04 0.82 0.00 0.00 0.00 179.25 179.90 1l6i h ILE 588 N 0.55 1.00 -0.88 0.00 2.04 -0.87 -1.38 117.51 117.97 1l6i h ILE 588 Ca 0.23 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 1l6i h ILE 588 Cb 0.12 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1l6i h ILE 588 CO -0.15 0.01 0.53 0.78 0.00 0.00 0.00 178.15 179.33 1l6i h ASN 589 N 0.08 1.06 -0.28 1.72 2.35 -1.02 -0.24 115.58 119.24 1l6i h ASN 589 Ca 0.03 -0.07 -0.13 0.00 -0.55 0.00 0.00 56.30 55.58 1l6i h ASN 589 Cb 0.00 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.10 1l6i h ASN 589 CO -0.02 0.82 -0.32 0.11 -1.65 0.00 0.00 177.43 176.37 1l6i h LYS 590 N 1.21 0.72 -0.93 0.81 1.79 -1.16 -1.05 116.57 117.96 1l6i h LYS 590 Ca 0.32 -0.39 0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1l6i h LYS 590 Cb -0.05 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.58 1l6i h LYS 590 CO -0.06 1.01 0.62 0.28 -1.08 0.00 0.00 179.45 180.22 1l6i h VAL 591 N 0.46 1.24 -0.55 0.50 2.07 -1.01 -3.01 116.25 115.95 1l6i h VAL 591 Ca 0.04 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 1l6i h VAL 591 Cb 0.90 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1l6i h VAL 591 CO 0.08 0.23 0.08 0.00 0.02 0.00 0.00 177.57 177.98 1l6i h ALA 592 N 1.34 0.73 -0.72 1.67 0.00 -0.82 -0.70 119.26 120.76 1l6i h ALA 592 Ca 0.34 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1l6i h ALA 592 Cb -0.14 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.39 1l6i h ALA 592 CO -0.07 0.49 0.48 -0.44 0.00 0.00 0.00 179.25 179.70 1l6i h ASP 593 N 0.81 0.65 0.23 0.00 3.32 -1.08 0.12 116.42 120.47 1l6i h ASP 593 Ca 0.17 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1l6i h ASP 593 Cb 0.43 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1l6i h ASP 593 CO 0.01 0.41 -0.11 0.58 -1.72 0.00 0.00 179.24 178.42 1l6i h VAL 594 N 0.73 0.66 -0.40 -1.35 2.07 -1.30 -3.17 116.25 113.50 1l6i h VAL 594 Ca 0.32 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1l6i h VAL 594 Cb 0.30 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1l6i h VAL 594 CO -0.11 0.16 0.26 0.40 0.02 0.00 0.00 177.57 178.31 1l6i h ILE 595 N -0.90 1.07 0.00 4.57 2.04 -0.84 -1.96 117.51 121.49 1l6i h ILE 595 Ca -0.03 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1l6i h ILE 595 Cb 0.50 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1l6i h ILE 595 CO 0.05 0.09 0.00 0.78 0.00 0.00 0.00 178.15 179.07 1l6i h ASN 596 N 0.49 0.00 -0.12 1.72 2.35 -0.82 -3.23 115.58 115.98 1l6i h ASN 596 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1l6i h ASN 596 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1l6i h ASN 596 CO -0.03 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.34 1l6i n ASN 597 N -2.80 2.58 -4.49 5.81 3.02 -0.75 -4.95 115.26 113.68 1l6i n ASN 597 Ca 0.02 -2.38 -0.43 0.00 -0.03 0.00 0.00 54.58 51.76 1l6i n ASN 597 Cb 0.35 -0.23 -0.07 0.00 -0.61 0.00 0.00 39.78 39.22 1l6i n ASN 597 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1l6i s ASP 598 N -1.54 6.25 0.66 6.41 -1.08 -1.10 -4.92 116.67 121.35 1l6i s ASP 598 Ca 0.19 -0.61 0.38 0.00 -0.52 0.00 0.00 52.55 51.99 1l6i s ASP 598 Cb 0.14 -2.28 2.08 0.00 -1.46 0.00 0.00 42.92 41.40 1l6i s ASP 598 CO 0.06 -0.73 2.20 1.55 0.52 0.00 0.00 175.17 178.77 1l6i h PRO 599 N 8.85 0.00 0.00 4.34 0.13 -1.92 0.27 132.00 143.67 1l6i h PRO 599 Ca -0.26 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.84 1l6i h PRO 599 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1l6i h PRO 599 CO 0.87 0.00 -0.15 1.25 -0.23 0.00 0.00 178.00 179.74 1l6i h LEU 600 N 0.00 0.00 0.00 1.56 5.85 -1.97 -3.30 115.31 117.45 1l6i h LEU 600 Ca 0.01 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.52 1l6i h LEU 600 Cb 0.26 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1l6i h LEU 600 CO -0.00 0.15 -1.21 0.52 -0.34 0.00 0.00 178.44 177.56 1l6i n VAL 601 N -3.58 1.52 0.00 1.05 0.31 0.94 -4.97 118.33 113.60 1l6i n VAL 601 Ca -0.01 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1l6i n VAL 601 Cb 0.29 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 31.13 1l6i n VAL 601 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1l6i n GLY 602 N 1.45 4.06 1.38 2.92 0.00 -1.14 -1.72 105.19 112.15 1l6i n GLY 602 Ca -0.29 0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.89 1l6i n GLY 602 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l6i n ASP 603 N 7.57 4.02 0.09 1.61 8.00 -1.26 -4.15 116.55 132.45 1l6i n ASP 603 Ca 0.00 -2.57 0.12 0.00 0.71 0.00 0.00 54.79 53.05 1l6i n ASP 603 Cb 0.00 -0.60 0.10 0.00 -0.02 0.00 0.00 41.12 40.60 1l6i n ASP 603 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1l6i h LYS 604 N 2.67 0.00 -1.55 -1.24 1.57 -1.67 -3.43 116.57 112.93 1l6i h LYS 604 Ca 0.00 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 1l6i h LYS 604 Cb 1.42 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.51 1l6i h LYS 604 CO 0.30 0.00 0.00 -1.17 -0.57 0.00 0.00 179.45 178.01 1l6i s LEU 605 N -4.86 -0.93 0.10 2.94 0.20 -1.25 -1.42 118.68 113.46 1l6i s LEU 605 Ca 0.04 1.23 0.06 0.00 0.69 0.00 0.00 54.13 56.14 1l6i s LEU 605 Cb 0.11 2.04 -0.03 0.00 -0.43 0.00 0.00 46.19 47.88 1l6i s LEU 605 CO 0.74 -0.18 -0.14 -0.54 -0.29 0.00 0.00 176.35 175.94 1l6i s LYS 606 N 2.73 0.95 -0.25 1.98 -0.14 -0.99 -4.73 119.74 119.28 1l6i s LYS 606 Ca -0.04 -1.13 0.01 0.00 -1.36 0.00 0.00 55.97 53.46 1l6i s LYS 606 Cb -0.10 -0.89 0.06 0.00 -1.68 0.00 0.00 37.83 35.23 1l6i s LYS 606 CO -0.18 0.18 -0.05 0.08 -0.76 0.00 0.00 175.35 174.62 1l6i s VAL 607 N -1.79 1.64 -0.26 3.17 1.01 -1.26 -1.50 120.40 121.41 1l6i s VAL 607 Ca 0.05 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.59 1l6i s VAL 607 Cb -0.07 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1l6i s VAL 607 CO 0.03 -0.14 0.11 -0.69 0.00 0.00 0.00 175.10 174.41 1l6i s VAL 608 N 1.33 4.62 -0.53 2.92 1.01 0.03 -4.87 120.40 124.91 1l6i s VAL 608 Ca -0.05 -0.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.67 1l6i s VAL 608 Cb -0.19 -3.19 0.11 0.00 0.00 0.00 0.00 36.38 33.11 1l6i s VAL 608 CO -0.07 0.29 0.51 0.12 0.00 0.00 0.00 175.10 175.96 1l6i s PHE 609 N 1.66 3.21 -0.04 5.22 2.19 -1.26 -0.69 117.98 128.26 1l6i s PHE 609 Ca 0.06 -1.16 -0.30 0.00 0.33 0.00 0.00 56.93 55.87 1l6i s PHE 609 Cb -0.16 -3.71 -0.04 0.00 -1.31 0.00 0.00 43.02 37.80 1l6i s PHE 609 CO 0.06 -1.02 1.33 -0.51 1.83 0.00 0.00 175.22 176.91 1l6i s LEU 610 N 1.79 4.29 0.40 6.12 2.01 0.10 -4.95 118.68 128.44 1l6i s LEU 610 Ca 0.05 1.97 -0.26 0.00 0.01 0.00 0.00 54.13 55.90 1l6i s LEU 610 Cb -0.28 -3.56 -0.09 0.00 0.01 0.00 0.00 46.19 42.28 1l6i s LEU 610 CO 0.04 -0.69 1.21 -2.84 1.01 0.00 0.00 176.35 175.08 1l6i s PRO 611 N 2.56 4.06 -0.52 1.29 0.02 -1.26 -4.13 135.00 137.01 1l6i s PRO 611 Ca 0.61 1.93 -0.02 0.00 0.02 0.00 0.00 61.00 63.53 1l6i s PRO 611 Cb -0.28 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.52 1l6i s PRO 611 CO 0.24 -0.34 0.31 -3.47 -0.33 0.00 0.00 177.00 173.40 1l6i n ASP 612 N 0.15 -3.35 -4.58 2.53 2.03 -1.25 -4.93 116.55 107.14 1l6i n ASP 612 Ca 0.04 -0.14 -0.52 0.00 0.52 0.00 0.00 54.79 54.68 1l6i n ASP 612 Cb 0.45 -2.10 -0.06 0.00 -0.72 0.00 0.00 41.12 38.70 1l6i n ASP 612 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1l6i n TYR 613 N -3.55 1.40 -3.92 -0.67 9.36 -1.26 -4.90 117.16 113.62 1l6i n TYR 613 Ca -0.02 0.68 -0.09 0.00 3.32 0.00 0.00 57.90 61.79 1l6i n TYR 613 Cb 0.53 -2.30 -0.02 0.00 -0.63 0.00 0.00 39.34 36.92 1l6i n TYR 613 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1l6i h VAL 615 N 2.08 0.70 -0.77 0.00 2.07 -1.94 -1.41 116.25 116.98 1l6i h VAL 615 Ca -0.26 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1l6i h VAL 615 Cb 1.25 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.48 1l6i h VAL 615 CO 0.34 0.03 0.44 0.28 0.02 0.00 0.00 177.57 178.68 1l6i h SER 616 N 0.16 0.66 0.03 0.57 0.02 -1.98 0.80 113.55 113.81 1l6i h SER 616 Ca 0.22 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1l6i h SER 616 Cb 0.31 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1l6i h SER 616 CO -0.33 0.40 -0.01 0.00 -1.14 0.00 0.00 176.83 175.74 1l6i h ALA 617 N 1.41 -0.04 -1.00 3.77 0.00 -1.73 -2.86 119.26 118.80 1l6i h ALA 617 Ca 0.36 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 55.30 1l6i h ALA 617 Cb 0.26 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.97 1l6i h ALA 617 CO -0.21 -0.39 0.62 0.00 0.00 0.00 0.00 179.25 179.26 1l6i h ALA 618 N 0.66 1.64 -0.18 0.00 0.00 -0.84 0.24 119.26 120.79 1l6i h ALA 618 Ca -0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1l6i h ALA 618 Cb 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1l6i h ALA 618 CO 0.01 0.03 0.04 0.93 0.00 0.00 0.00 179.25 180.25 1l6i h GLU 619 N 0.83 0.26 0.14 0.00 5.08 -0.64 0.82 114.58 121.06 1l6i h GLU 619 Ca 0.55 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.69 1l6i h GLU 619 Cb 0.77 -0.05 0.02 0.00 0.50 0.00 0.00 28.75 29.99 1l6i h GLU 619 CO -0.33 0.25 -0.81 0.87 -1.00 0.00 0.00 179.01 177.98 1l6i h LYS 620 N 0.26 0.30 -0.25 2.33 1.79 -0.72 -3.39 116.57 116.88 1l6i h LYS 620 Ca 0.06 -0.51 -0.12 0.00 -2.18 0.00 0.00 60.65 57.90 1l6i h LYS 620 Cb 0.11 0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 1l6i h LYS 620 CO -0.00 1.24 -0.33 -0.07 -1.08 0.00 0.00 179.45 179.21 1l6i h LEU 621 N -0.38 0.72 -0.57 2.94 3.38 -0.50 -3.37 115.31 117.54 1l6i h LEU 621 Ca -0.14 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.29 1l6i h LEU 621 Cb 1.64 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.16 1l6i h LEU 621 CO 0.15 1.08 0.23 0.40 0.09 0.00 0.00 178.44 180.39 1l6i h ILE 622 N 0.38 1.23 0.00 1.22 2.04 -1.03 -1.32 117.51 120.02 1l6i h ILE 622 Ca 0.03 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.18 1l6i h ILE 622 Cb 0.91 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1l6i h ILE 622 CO 0.08 0.27 0.00 -2.65 0.00 0.00 0.00 178.15 175.85 1l6i n PRO 623 N -4.48 0.09 0.00 2.37 -0.02 -1.26 -2.43 135.00 129.27 1l6i n PRO 623 Ca 0.03 0.44 0.11 0.00 -2.02 0.00 0.00 63.50 62.07 1l6i n PRO 623 Cb 0.16 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1l6i n PRO 623 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l6i n ALA 624 N -1.65 3.62 -1.77 3.55 0.00 -0.51 -4.73 120.51 119.02 1l6i n ALA 624 Ca 0.01 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.44 1l6i n ALA 624 Cb 0.12 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1l6i n ALA 624 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6i s ALA 625 N -2.51 3.02 -0.15 0.00 0.00 -1.02 -4.74 121.76 116.35 1l6i s ALA 625 Ca 0.18 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1l6i s ALA 625 Cb 0.18 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.82 1l6i s ALA 625 CO 0.59 -0.64 -0.14 -0.25 0.00 0.00 0.00 175.76 175.32 1l6i n ASP 626 N -0.36 2.63 -4.44 0.00 8.00 0.24 -4.11 116.55 118.51 1l6i n ASP 626 Ca 0.07 -0.05 -0.33 0.00 0.71 0.00 0.00 54.79 55.18 1l6i n ASP 626 Cb 0.48 -0.27 -0.13 0.00 -0.02 0.00 0.00 41.12 41.18 1l6i n ASP 626 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1l6i s ILE 627 N -2.30 3.32 -0.29 0.53 -1.09 -0.33 -1.05 121.20 119.99 1l6i s ILE 627 Ca -0.21 -0.58 -0.03 0.00 -2.23 0.00 0.00 60.65 57.60 1l6i s ILE 627 Cb 0.06 -2.40 0.04 0.00 -1.58 0.00 0.00 42.46 38.58 1l6i s ILE 627 CO 0.34 0.53 0.01 -0.55 -1.23 0.00 0.00 174.94 174.05 1l6i s SER 628 N 0.07 4.83 -0.23 3.58 0.15 -0.73 -0.65 113.70 120.73 1l6i s SER 628 Ca -0.04 -1.06 -0.24 0.00 0.70 0.00 0.00 55.95 55.31 1l6i s SER 628 Cb -0.14 -1.75 -0.01 0.00 -1.71 0.00 0.00 66.02 62.41 1l6i s SER 628 CO 0.04 -0.22 0.81 -1.61 1.20 0.00 0.00 173.24 173.46 1l6i s GLU 629 N 1.33 4.20 -0.40 5.44 0.41 -0.67 -1.48 118.70 127.54 1l6i s GLU 629 Ca -0.02 0.92 0.08 0.00 -0.41 0.00 0.00 54.97 55.54 1l6i s GLU 629 Cb -0.18 -3.63 0.26 0.00 -1.78 0.00 0.00 34.13 28.80 1l6i s GLU 629 CO -0.01 -0.46 0.60 1.04 -0.49 0.00 0.00 175.26 175.94 1l6i n GLN 630 N 5.79 0.76 -0.50 1.61 1.13 -0.75 -4.71 117.38 120.71 1l6i n GLN 630 Ca 0.05 -3.05 0.05 0.00 -1.94 0.00 0.00 57.00 52.10 1l6i n GLN 630 Cb 0.48 -1.30 0.21 0.00 0.11 0.00 0.00 30.24 29.74 1l6i n GLN 630 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1l6i n ILE 631 N 1.27 2.29 -1.66 5.09 -5.35 -1.26 -2.03 119.36 117.71 1l6i n ILE 631 Ca 0.20 -2.33 -0.34 0.00 -0.27 0.00 0.00 62.75 60.01 1l6i n ILE 631 Cb 0.56 -0.27 0.06 0.00 -1.74 0.00 0.00 39.64 38.25 1l6i n ILE 631 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1l6i s SER 632 N -2.41 4.76 0.12 7.28 1.04 -1.25 -4.71 113.70 118.53 1l6i s SER 632 Ca 0.41 2.18 -0.35 0.00 0.48 0.00 0.00 55.95 58.67 1l6i s SER 632 Cb 0.35 -2.57 -0.15 0.00 0.10 0.00 0.00 66.02 63.75 1l6i s SER 632 CO 0.04 -1.87 1.52 0.41 0.98 0.00 0.00 173.24 174.32 1l6i n THR 633 N -2.43 0.04 -1.64 2.02 -1.04 -1.08 -4.66 114.28 105.48 1l6i n THR 633 Ca 0.12 -0.01 -0.53 0.00 -2.04 0.00 0.00 64.05 61.59 1l6i n THR 633 Cb 0.51 -1.32 -0.06 0.00 -1.82 0.00 0.00 70.33 67.64 1l6i n THR 633 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l6i n ALA 634 N 3.34 -0.41 -0.05 2.41 0.00 -1.26 -0.92 120.51 123.61 1l6i n ALA 634 Ca 0.18 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.08 1l6i n ALA 634 Cb 0.25 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1l6i n ALA 634 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l6i n GLY 635 N 3.23 0.43 0.09 0.00 0.00 -1.26 -4.65 105.19 103.04 1l6i n GLY 635 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 1l6i n GLY 635 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l6i n LYS 636 N -2.00 0.86 -3.02 1.61 4.76 -0.09 -4.88 118.16 115.39 1l6i n LYS 636 Ca 0.00 0.07 -0.41 0.00 -2.87 0.00 0.00 58.31 55.10 1l6i n LYS 636 Cb 0.00 -1.41 -0.06 0.00 -1.84 0.00 0.00 35.03 31.73 1l6i n LYS 636 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1l6i s GLU 637 N -2.40 4.02 0.08 1.97 2.56 -1.26 -4.73 118.70 118.95 1l6i s GLU 637 Ca -0.20 0.56 -0.15 0.00 0.00 0.00 0.00 54.97 55.18 1l6i s GLU 637 Cb 0.06 -3.69 -0.15 0.00 2.00 0.00 0.00 34.13 32.34 1l6i s GLU 637 CO 0.54 -0.56 1.29 0.00 -0.56 0.00 0.00 175.26 175.98 1l6i h ALA 638 N 8.01 0.28 -2.29 6.30 0.00 -1.90 -2.99 119.26 126.68 1l6i h ALA 638 Ca -0.25 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1l6i h ALA 638 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1l6i h ALA 638 CO 0.83 0.54 0.00 0.45 0.00 0.00 0.00 179.25 181.07 1l6i n SER 639 N -4.09 0.00 0.00 0.00 2.88 -1.26 -4.22 113.62 106.93 1l6i n SER 639 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1l6i n SER 639 Cb 0.65 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 1l6i n SER 639 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1l6i n GLY 640 N 0.84 2.41 0.00 0.46 0.00 -1.26 -1.66 105.19 105.98 1l6i n GLY 640 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1l6i n GLY 640 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l6i n THR 641 N 1.45 0.00 0.05 2.61 -2.24 -1.26 -4.74 114.28 110.15 1l6i n THR 641 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1l6i n THR 641 Cb 0.00 -0.03 0.47 0.00 -2.10 0.00 0.00 70.33 68.67 1l6i n THR 641 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1l6i h GLY 642 N 0.00 0.46 0.41 3.38 0.00 -1.95 -1.51 103.07 103.86 1l6i h GLY 642 Ca 0.00 -0.17 0.17 0.00 0.00 0.00 0.00 47.33 47.33 1l6i h GLY 642 CO 0.00 0.17 0.58 3.45 0.00 0.00 0.00 176.54 180.74 1l6i h ASN 643 N 0.44 0.56 -0.08 0.19 7.08 -1.94 -0.57 115.58 121.26 1l6i h ASN 643 Ca 0.12 0.05 -0.19 0.00 -3.08 0.00 0.00 56.30 53.20 1l6i h ASN 643 Cb -0.03 -0.06 0.01 0.00 -2.08 0.00 0.00 38.32 36.16 1l6i h ASN 643 CO -0.03 0.26 -0.71 0.24 -2.08 0.00 0.00 177.43 175.11 1l6i h MET 644 N 0.58 0.62 -0.60 4.14 2.86 -1.62 -2.35 114.93 118.56 1l6i h MET 644 Ca 0.47 -0.56 0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1l6i h MET 644 Cb 0.91 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.65 1l6i h MET 644 CO -0.21 1.18 0.31 0.87 1.06 0.00 0.00 176.91 180.12 1l6i h LYS 645 N 0.26 0.57 0.12 1.72 1.57 -0.59 -1.44 116.57 118.78 1l6i h LYS 645 Ca -0.07 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1l6i h LYS 645 Cb 1.37 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1l6i h LYS 645 CO 0.14 0.37 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.27 1l6i h LEU 646 N 0.58 -0.13 -0.70 2.94 3.38 -1.19 -2.96 115.31 117.23 1l6i h LEU 646 Ca 0.27 -0.32 0.16 0.00 0.09 0.00 0.00 57.88 58.08 1l6i h LEU 646 Cb 0.19 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 40.86 1l6i h LEU 646 CO -0.19 0.27 0.06 0.00 0.09 0.00 0.00 178.44 178.67 1l6i h ALA 647 N 0.24 0.78 0.00 1.53 0.00 -1.33 -1.57 119.26 118.91 1l6i h ALA 647 Ca -0.02 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1l6i h ALA 647 Cb 0.45 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1l6i h ALA 647 CO 0.03 -0.39 -0.09 -0.07 0.00 0.00 0.00 179.25 178.73 1l6i h LEU 648 N 0.15 0.00 -2.97 0.00 3.38 -1.15 -2.70 115.31 112.03 1l6i h LEU 648 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1l6i h LEU 648 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1l6i h LEU 648 CO -0.57 0.09 0.00 0.59 0.09 0.00 0.00 178.44 178.63 1l6i n ASN 649 N -3.60 4.37 0.00 -0.43 3.02 -0.65 -4.47 115.26 113.50 1l6i n ASN 649 Ca -0.02 -2.25 0.00 0.00 -0.03 0.00 0.00 54.58 52.28 1l6i n ASN 649 Cb 0.21 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.85 1l6i n ASN 649 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l6i n GLY 650 N 1.30 0.89 3.95 7.41 0.00 -1.02 -4.90 105.19 112.83 1l6i n GLY 650 Ca 0.25 -0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1l6i n GLY 650 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l6i s ALA 651 N -2.00 3.84 0.07 4.61 0.00 -0.87 -4.81 121.76 122.60 1l6i s ALA 651 Ca 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.96 1l6i s ALA 651 Cb 0.00 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 1l6i s ALA 651 CO 0.00 0.22 0.10 -0.51 0.00 0.00 0.00 175.76 175.57 1l6i s LEU 652 N -3.89 3.88 -0.14 0.00 1.43 -0.21 -4.25 118.68 115.50 1l6i s LEU 652 Ca 0.37 0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 53.44 1l6i s LEU 652 Cb -0.10 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1l6i s LEU 652 CO 0.31 0.18 0.12 -0.89 0.23 0.00 0.00 176.35 176.30 1l6i s THR 653 N -1.39 5.32 -0.36 5.49 2.01 -1.26 -1.77 115.64 123.67 1l6i s THR 653 Ca 0.30 0.14 -0.08 0.00 0.31 0.00 0.00 61.69 62.36 1l6i s THR 653 Cb -0.12 -3.34 0.05 0.00 0.01 0.00 0.00 72.50 69.09 1l6i s THR 653 CO 0.22 0.57 0.15 -0.69 -0.69 0.00 0.00 174.62 174.18 1l6i s VAL 654 N -0.61 3.98 0.22 3.82 1.01 -0.55 -0.56 120.40 127.71 1l6i s VAL 654 Ca 0.12 -1.15 -0.21 0.00 0.00 0.00 0.00 61.98 60.75 1l6i s VAL 654 Cb -0.12 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 33.01 1l6i s VAL 654 CO 0.02 -0.25 0.63 -0.83 0.00 0.00 0.00 175.10 174.67 1l6i s GLY 655 N 1.55 -0.23 0.61 4.51 0.00 -0.62 -1.81 107.32 111.33 1l6i s GLY 655 Ca -0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 44.72 44.56 1l6i s GLY 655 CO 0.03 -0.07 0.97 -0.51 0.00 0.00 0.00 173.10 173.52 1l6i s THR 656 N -3.86 4.24 -1.24 0.90 -4.23 -0.86 -1.14 115.64 109.44 1l6i s THR 656 Ca 0.08 0.46 -0.18 0.00 -1.18 0.00 0.00 61.69 60.87 1l6i s THR 656 Cb -0.03 -3.69 0.09 0.00 1.34 0.00 0.00 72.50 70.21 1l6i s THR 656 CO -0.01 -0.82 1.63 -0.76 -0.54 0.00 0.00 174.62 174.12 1l6i s LEU 657 N -5.09 4.07 0.04 4.79 1.43 -1.26 -4.67 118.68 117.99 1l6i s LEU 657 Ca 0.54 -2.42 -0.07 0.00 -1.03 0.00 0.00 54.13 51.15 1l6i s LEU 657 Cb -0.11 -2.54 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 1l6i s LEU 657 CO 0.50 -1.12 0.12 -0.62 0.23 0.00 0.00 176.35 175.46 1l6i s ASP 658 N 4.03 0.14 0.02 2.29 2.15 -1.26 -4.59 116.67 119.44 1l6i s ASP 658 Ca 0.50 -0.50 0.00 0.00 0.43 0.00 0.00 52.55 52.99 1l6i s ASP 658 Cb 0.02 0.25 0.00 0.00 -0.30 0.00 0.00 42.92 42.89 1l6i s ASP 658 CO 0.04 -0.53 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 1l6i n GLY 659 N 0.72 2.50 0.00 2.66 0.00 -1.13 0.22 105.19 110.16 1l6i n GLY 659 Ca -0.19 0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.04 1l6i n GLY 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l6i n ALA 660 N 7.47 2.46 0.10 4.61 0.00 -0.66 -3.42 120.51 131.05 1l6i n ALA 660 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1l6i n ALA 660 Cb 0.00 -1.47 0.31 0.00 0.00 0.00 0.00 19.45 18.30 1l6i n ALA 660 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1l6i h ASN 661 N 0.00 0.26 -0.18 0.00 2.35 -0.47 -1.66 115.58 115.88 1l6i h ASN 661 Ca 0.00 -0.07 -0.17 0.00 -0.55 0.00 0.00 56.30 55.51 1l6i h ASN 661 Cb 0.21 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1l6i h ASN 661 CO 0.00 0.50 -0.50 -0.37 -1.65 0.00 0.00 177.43 175.42 1l6i h VAL 662 N 0.25 1.29 -0.31 2.81 -1.51 -1.57 -1.71 116.25 115.49 1l6i h VAL 662 Ca 0.04 -1.69 -0.08 0.00 -1.23 0.00 0.00 66.70 63.74 1l6i h VAL 662 Cb 0.54 1.61 -0.02 0.00 -2.13 0.00 0.00 31.29 31.29 1l6i h VAL 662 CO 0.04 0.55 -0.15 -0.33 -1.23 0.00 0.00 177.57 176.44 1l6i h GLU 663 N 0.59 0.55 -0.32 5.19 5.08 -1.62 -1.48 114.58 122.57 1l6i h GLU 663 Ca 0.03 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.07 1l6i h GLU 663 Cb 1.07 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1l6i h GLU 663 CO 0.11 0.69 -0.36 0.82 -1.00 0.00 0.00 179.01 179.26 1l6i h ILE 664 N 0.50 1.29 -0.56 3.13 2.04 -1.30 -2.15 117.51 120.46 1l6i h ILE 664 Ca 0.09 -1.54 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 1l6i h ILE 664 Cb 0.55 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 1l6i h ILE 664 CO 0.04 0.50 0.16 0.00 0.00 0.00 0.00 178.15 178.84 1l6i h ALA 665 N 0.72 0.74 0.00 1.87 0.00 -1.14 0.50 119.26 121.95 1l6i h ALA 665 Ca 0.04 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1l6i h ALA 665 Cb 0.95 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1l6i h ALA 665 CO 0.09 0.42 -0.14 1.05 0.00 0.00 0.00 179.25 180.67 1l6i h GLU 666 N 0.80 0.00 0.07 0.00 4.11 -1.22 0.12 114.58 118.46 1l6i h GLU 666 Ca 0.18 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.42 1l6i h GLU 666 Cb 0.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1l6i h GLU 666 CO -0.00 0.14 -0.96 0.87 0.07 0.00 0.00 179.01 179.13 1l6i h LYS 667 N 0.00 0.15 0.00 1.06 1.79 -0.87 -3.36 116.57 115.34 1l6i h LYS 667 Ca -0.00 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 1l6i h LYS 667 Cb 0.66 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1l6i h LYS 667 CO 0.02 1.12 -0.09 -0.39 -1.08 0.00 0.00 179.45 179.03 1l6i h VAL 668 N -0.62 0.00 0.00 0.50 -1.51 0.19 -3.47 116.25 111.34 1l6i h VAL 668 Ca -0.22 -0.73 0.00 0.00 -1.23 0.00 0.00 66.70 64.52 1l6i h VAL 668 Cb 1.47 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 32.31 1l6i h VAL 668 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1l6i n GLY 669 N 1.21 0.34 0.33 5.19 0.00 0.41 -4.63 105.19 108.04 1l6i n GLY 669 Ca 0.04 -1.39 0.21 0.00 0.00 0.00 0.00 46.02 44.89 1l6i n GLY 669 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1l6i h GLU 670 N 0.00 0.00 -0.00 1.61 4.11 -1.91 0.50 114.58 118.90 1l6i h GLU 670 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1l6i h GLU 670 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1l6i h GLU 670 CO 0.00 0.00 -0.10 -0.85 0.07 0.00 0.00 179.01 178.13 1l6i n GLU 671 N -3.21 0.17 -0.31 1.06 0.00 -1.26 -3.74 120.64 113.35 1l6i n GLU 671 Ca -0.03 -0.03 0.08 0.00 0.00 0.00 0.00 57.16 57.18 1l6i n GLU 671 Cb 0.09 -1.50 0.17 0.00 0.00 0.00 0.00 31.44 30.20 1l6i n GLU 671 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1l6i n ASN 672 N -1.39 2.27 -3.63 -1.84 3.02 0.17 -4.96 115.26 108.90 1l6i n ASN 672 Ca 0.09 -3.39 -0.14 0.00 -0.03 0.00 0.00 54.58 51.11 1l6i n ASN 672 Cb 0.31 -0.48 -0.06 0.00 -0.61 0.00 0.00 39.78 38.94 1l6i n ASN 672 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1l6i s ILE 673 N -3.01 0.04 -0.83 2.41 2.07 -1.24 -4.66 121.20 115.97 1l6i s ILE 673 Ca 0.35 -0.30 -0.03 0.00 -1.41 0.00 0.00 60.65 59.26 1l6i s ILE 673 Cb 0.32 -0.90 0.21 0.00 0.13 0.00 0.00 42.46 42.22 1l6i s ILE 673 CO 0.00 -0.17 0.71 -0.36 -1.91 0.00 0.00 174.94 173.21 1l6i s PHE 674 N -1.96 3.77 0.26 3.50 0.40 0.27 -4.89 117.98 119.34 1l6i s PHE 674 Ca -0.08 -2.86 -0.12 0.00 -0.60 0.00 0.00 56.93 53.27 1l6i s PHE 674 Cb -0.02 -3.30 -0.08 0.00 0.51 0.00 0.00 43.02 40.14 1l6i s PHE 674 CO 0.02 -0.79 0.61 0.42 0.70 0.00 0.00 175.22 176.18 1l6i s ILE 675 N -0.91 4.84 0.25 0.64 -1.09 -1.26 -1.60 121.20 122.07 1l6i s ILE 675 Ca 0.24 0.65 -0.21 0.00 -2.23 0.00 0.00 60.65 59.10 1l6i s ILE 675 Cb -0.11 -3.62 0.05 0.00 -1.58 0.00 0.00 42.46 37.20 1l6i s ILE 675 CO -0.10 -0.10 0.87 0.72 -1.23 0.00 0.00 174.94 175.11 1l6i s PHE 676 N -1.86 -0.05 0.00 3.97 -0.71 -0.29 -4.91 117.98 114.13 1l6i s PHE 676 Ca 0.49 -0.40 0.00 0.00 -1.04 0.00 0.00 56.93 55.98 1l6i s PHE 676 Cb -0.11 0.72 0.00 0.00 -1.21 0.00 0.00 43.02 42.42 1l6i s PHE 676 CO 0.20 -1.13 0.00 0.41 -1.34 0.00 0.00 175.22 173.36 1l6i n GLY 677 N -0.53 -2.49 3.80 1.99 0.00 -1.26 -4.19 105.19 102.51 1l6i n GLY 677 Ca -0.05 -1.67 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 1l6i n GLY 677 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1l6i s HIS 678 N -0.55 3.53 1.00 1.61 3.76 -1.26 -4.93 115.29 118.45 1l6i s HIS 678 Ca 0.00 1.71 -0.15 0.00 -0.15 0.00 0.00 55.06 56.47 1l6i s HIS 678 Cb 0.00 -2.89 0.19 0.00 1.11 0.00 0.00 32.58 30.99 1l6i s HIS 678 CO 0.00 0.07 1.18 0.95 -0.85 0.00 0.00 174.74 176.10 1l6i s THR 679 N -1.85 1.90 0.11 1.30 -4.23 -1.26 -4.47 115.64 107.14 1l6i s THR 679 Ca 0.55 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 1l6i s THR 679 Cb -0.15 -2.76 -0.11 0.00 1.34 0.00 0.00 72.50 70.82 1l6i s THR 679 CO 0.19 0.00 1.75 0.58 -0.54 0.00 0.00 174.62 176.60 1l6i h VAL 680 N -1.80 0.99 -0.74 2.29 2.07 -1.82 0.20 116.25 117.44 1l6i h VAL 680 Ca -0.47 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.09 1l6i h VAL 680 Cb 1.29 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 1l6i h VAL 680 CO 0.48 0.02 0.49 -0.33 0.02 0.00 0.00 177.57 178.24 1l6i h GLU 681 N 0.09 0.70 0.09 1.57 3.07 -1.93 -2.20 114.58 115.98 1l6i h GLU 681 Ca 0.04 -0.04 -0.25 0.00 -0.50 0.00 0.00 59.36 58.60 1l6i h GLU 681 Cb 0.01 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 27.76 1l6i h GLU 681 CO -0.03 0.47 -1.15 1.96 -1.40 0.00 0.00 179.01 178.86 1l6i h GLN 682 N 0.72 0.23 -0.19 2.33 4.20 -1.82 -2.71 115.11 117.88 1l6i h GLN 682 Ca 0.33 -0.36 0.05 0.00 0.06 0.00 0.00 58.65 58.73 1l6i h GLN 682 Cb 0.34 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.20 1l6i h GLN 682 CO -0.11 1.15 -0.11 0.28 -0.67 0.00 0.00 178.83 179.37 1l6i h VAL 683 N 0.07 0.67 -0.92 -0.54 2.07 -0.51 -1.90 116.25 115.20 1l6i h VAL 683 Ca -0.10 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1l6i h VAL 683 Cb 1.87 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1l6i h VAL 683 CO 0.18 0.00 0.61 0.11 0.02 0.00 0.00 177.57 178.49 1l6i h LYS 684 N -0.09 1.16 -0.38 1.57 1.57 -1.47 -1.93 116.57 117.00 1l6i h LYS 684 Ca 0.11 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 1l6i h LYS 684 Cb 0.25 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1l6i h LYS 684 CO -0.25 0.77 -0.07 0.00 -0.57 0.00 0.00 179.45 179.33 1l6i h ALA 685 N 1.45 1.17 -0.11 3.86 0.00 -1.05 -1.27 119.26 123.30 1l6i h ALA 685 Ca 0.35 -0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.78 1l6i h ALA 685 Cb -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1l6i h ALA 685 CO -0.09 0.53 -0.77 0.82 0.00 0.00 0.00 179.25 179.74 1l6i h ILE 686 N 0.59 1.32 -0.45 0.00 2.04 -0.89 0.15 117.51 120.28 1l6i h ILE 686 Ca 0.11 -2.06 -0.08 0.00 1.00 0.00 0.00 64.86 63.83 1l6i h ILE 686 Cb 0.48 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1l6i h ILE 686 CO 0.03 0.64 -0.03 -0.07 0.00 0.00 0.00 178.15 178.71 1l6i h LEU 687 N 0.42 0.74 0.11 1.44 3.38 -1.22 -2.18 115.31 117.99 1l6i h LEU 687 Ca -0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1l6i h LEU 687 Cb 1.37 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1l6i h LEU 687 CO 0.15 0.83 -0.05 0.00 0.09 0.00 0.00 178.44 179.45 1l6i h ALA 688 N 1.25 -0.14 0.00 1.53 0.00 -1.16 -3.19 119.26 117.54 1l6i h ALA 688 Ca 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l6i h ALA 688 Cb 0.48 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1l6i h ALA 688 CO 0.02 -0.43 0.00 -0.22 0.00 0.00 0.00 179.25 178.62 1l6i h LYS 689 N -0.44 0.00 0.00 0.00 3.64 -0.90 -3.48 116.57 115.40 1l6i h LYS 689 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1l6i h LYS 689 Cb 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1l6i h LYS 689 CO 0.02 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.61 1l6i n GLY 690 N 0.25 0.96 3.65 5.01 0.00 -0.85 -5.08 105.19 109.12 1l6i n GLY 690 Ca 0.02 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1l6i n GLY 690 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1l6i s TYR 691 N 0.00 3.33 -0.58 1.61 5.04 -1.06 -4.99 117.35 120.69 1l6i s TYR 691 Ca 0.00 1.20 -0.05 0.00 -2.44 0.00 0.00 57.07 55.78 1l6i s TYR 691 Cb 0.00 -3.08 0.15 0.00 0.35 0.00 0.00 41.96 39.38 1l6i s TYR 691 CO 0.00 -0.40 0.41 0.34 -1.34 0.00 0.00 175.55 174.56 1l6i s ASP 692 N 1.30 5.43 0.26 4.32 -1.08 -1.26 -4.98 116.67 120.66 1l6i s ASP 692 Ca 0.36 -2.56 -0.01 0.00 -0.52 0.00 0.00 52.55 49.82 1l6i s ASP 692 Cb -0.15 -1.90 0.51 0.00 -1.46 0.00 0.00 42.92 39.92 1l6i s ASP 692 CO 0.08 -0.46 1.77 1.55 0.52 0.00 0.00 175.17 178.62 1l6i h PRO 693 N 7.48 0.62 -0.91 4.34 0.13 -1.89 -2.29 132.00 139.48 1l6i h PRO 693 Ca -0.05 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 65.07 1l6i h PRO 693 Cb 0.99 -0.14 -0.05 0.00 0.13 0.00 0.00 31.00 31.93 1l6i h PRO 693 CO 0.73 0.41 0.60 0.28 -0.23 0.00 0.00 178.00 179.79 1l6i h VAL 694 N 0.63 1.18 -0.88 1.56 2.07 -1.90 -0.17 116.25 118.75 1l6i h VAL 694 Ca 0.45 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.58 1l6i h VAL 694 Cb 0.62 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1l6i h VAL 694 CO -0.35 0.21 0.58 0.50 0.02 0.00 0.00 177.57 178.53 1l6i h LYS 695 N 1.17 1.16 -0.18 1.57 3.64 -1.85 0.22 116.57 122.30 1l6i h LYS 695 Ca 0.35 -0.07 -0.20 0.00 -1.27 0.00 0.00 60.65 59.46 1l6i h LYS 695 Cb -0.03 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.53 1l6i h LYS 695 CO -0.10 0.77 -0.68 -1.49 -2.27 0.00 0.00 179.45 175.68 1l6i h TRP 696 N 1.19 0.94 -0.18 1.91 4.06 -1.41 -2.65 115.95 119.80 1l6i h TRP 696 Ca 0.32 -0.38 0.05 0.00 2.06 0.00 0.00 58.89 60.94 1l6i h TRP 696 Cb -0.13 -0.16 -0.06 0.00 -1.00 0.00 0.00 29.16 27.81 1l6i h TRP 696 CO 0.00 1.19 -0.22 -0.09 -3.56 0.00 0.00 178.44 175.75 1l6i h ARG 697 N 0.51 -0.25 -0.80 0.49 2.43 -0.11 -2.73 114.38 113.92 1l6i h ARG 697 Ca -0.02 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 1l6i h ARG 697 Cb 1.28 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.84 1l6i h ARG 697 CO 0.14 -0.17 0.53 0.87 -1.51 0.00 0.00 179.97 179.83 1l6i h LYS 698 N -0.26 0.92 0.00 0.20 1.79 -0.50 -1.26 116.57 117.47 1l6i h LYS 698 Ca 0.12 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1l6i h LYS 698 Cb 0.44 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1l6i h LYS 698 CO -0.33 0.61 0.00 1.63 -1.08 0.00 0.00 179.45 180.28 1l6i n LYS 699 N -4.46 0.05 -3.85 3.15 4.76 -1.01 -4.60 118.16 112.20 1l6i n LYS 699 Ca 0.11 0.09 -0.36 0.00 -2.87 0.00 0.00 58.31 55.28 1l6i n LYS 699 Cb 0.15 -1.56 -0.13 0.00 -1.84 0.00 0.00 35.03 31.65 1l6i n LYS 699 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1l6i s ASP 700 N -3.27 4.90 0.16 4.39 -1.08 -0.47 -4.99 116.67 116.30 1l6i s ASP 700 Ca 0.12 -0.99 -0.15 0.00 -0.52 0.00 0.00 52.55 51.01 1l6i s ASP 700 Cb 0.16 -1.78 0.08 0.00 -1.46 0.00 0.00 42.92 39.92 1l6i s ASP 700 CO 0.49 -0.22 1.77 0.50 0.52 0.00 0.00 175.17 178.23 1l6i h LYS 701 N 8.11 0.37 -0.18 4.34 3.64 -1.81 0.49 116.57 131.53 1l6i h LYS 701 Ca -0.27 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.02 1l6i h LYS 701 Cb 1.10 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1l6i h LYS 701 CO 0.58 0.25 -0.12 0.28 -2.27 0.00 0.00 179.45 178.17 1l6i h VAL 702 N 0.38 1.32 -0.66 2.00 2.07 -1.94 -1.96 116.25 117.47 1l6i h VAL 702 Ca 0.18 -1.21 0.07 0.00 0.82 0.00 0.00 66.70 66.56 1l6i h VAL 702 Cb 0.11 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 1l6i h VAL 702 CO -0.14 0.36 0.35 0.25 0.02 0.00 0.00 177.57 178.41 1l6i h LEU 703 N 0.07 0.48 -0.55 2.57 5.85 -1.74 0.24 115.31 122.24 1l6i h LEU 703 Ca 0.04 0.04 -0.14 0.00 0.84 0.00 0.00 57.88 58.66 1l6i h LEU 703 Cb 0.62 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1l6i h LEU 703 CO 0.03 0.30 -0.33 -0.78 -0.34 0.00 0.00 178.44 177.33 1l6i h ASP 704 N 0.62 0.86 -0.04 1.25 3.58 0.15 -2.59 116.42 120.25 1l6i h ASP 704 Ca 0.31 -0.36 -0.20 0.00 0.42 0.00 0.00 57.03 57.20 1l6i h ASP 704 Cb 0.26 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1l6i h ASP 704 CO -0.22 1.11 -0.71 0.00 -2.88 0.00 0.00 179.24 176.54 1l6i h ALA 705 N 0.94 0.46 -0.57 -0.78 0.00 -0.45 -2.24 119.26 116.61 1l6i h ALA 705 Ca 0.07 -0.58 -0.08 0.00 0.00 0.00 0.00 54.91 54.32 1l6i h ALA 705 Cb 0.88 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1l6i h ALA 705 CO 0.08 0.71 0.05 0.28 0.00 0.00 0.00 179.25 180.36 1l6i h VAL 706 N 0.48 1.25 -0.25 0.00 2.07 -0.51 -1.82 116.25 117.47 1l6i h VAL 706 Ca -0.03 -1.03 -0.10 0.00 0.82 0.00 0.00 66.70 66.36 1l6i h VAL 706 Cb 1.31 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1l6i h VAL 706 CO 0.14 0.37 -0.28 -0.07 0.02 0.00 0.00 177.57 177.76 1l6i h LEU 707 N 0.89 0.49 -1.63 2.57 3.38 -1.38 -2.72 115.31 116.91 1l6i h LEU 707 Ca 0.17 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1l6i h LEU 707 Cb 0.45 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1l6i h LEU 707 CO 0.02 0.76 -0.20 0.11 0.09 0.00 0.00 178.44 179.21 1l6i h LYS 708 N 0.42 0.00 -0.58 1.13 1.57 -0.73 -1.02 116.57 117.36 1l6i h LYS 708 Ca 0.06 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 1l6i h LYS 708 Cb 0.71 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1l6i h LYS 708 CO 0.05 0.20 -0.02 0.93 -0.57 0.00 0.00 179.45 180.04 1l6i h GLU 709 N 0.00 1.04 0.00 3.15 5.08 -1.04 0.23 114.58 123.03 1l6i h GLU 709 Ca -0.00 -0.34 -0.07 0.00 -1.00 0.00 0.00 59.36 57.95 1l6i h GLU 709 Cb 0.44 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1l6i h GLU 709 CO 0.03 1.03 -0.31 -0.07 -1.00 0.00 0.00 179.01 178.68 1l6i h LEU 710 N 0.95 0.00 0.00 1.33 3.38 -1.33 -2.65 115.31 116.98 1l6i h LEU 710 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1l6i h LEU 710 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1l6i h LEU 710 CO 0.03 0.31 -0.48 -0.33 0.09 0.00 0.00 178.44 178.07 1l6i h GLU 711 N 0.00 0.00 -0.00 1.13 5.08 -0.91 -3.38 114.58 116.50 1l6i h GLU 711 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1l6i h GLU 711 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1l6i h GLU 711 CO 0.04 0.00 -0.22 -1.13 -1.00 0.00 0.00 179.01 176.70 1l6i n SER 712 N -2.71 0.49 0.00 1.42 3.41 0.04 -4.70 113.62 111.58 1l6i n SER 712 Ca 0.02 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 1l6i n SER 712 Cb 0.51 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1l6i n SER 712 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l6i n GLY 713 N 1.38 0.85 0.28 5.00 0.00 -1.26 -4.70 105.19 106.75 1l6i n GLY 713 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 1l6i n GLY 713 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1l6i h LYS 714 N 3.84 0.18 -0.03 1.61 3.64 -1.87 0.22 116.57 124.15 1l6i h LYS 714 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1l6i h LYS 714 Cb 0.00 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1l6i h LYS 714 CO 0.00 0.12 0.00 0.66 -2.27 0.00 0.00 179.45 177.96 1l6i n TYR 715 N -4.51 0.02 -2.11 1.91 4.01 -1.26 -4.52 117.16 110.69 1l6i n TYR 715 Ca -0.00 -0.01 -0.17 0.00 -0.16 0.00 0.00 57.90 57.55 1l6i n TYR 715 Cb 0.10 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.17 1l6i n TYR 715 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1l6i n SER 716 N 1.01 4.05 -4.08 7.72 3.41 -0.49 -4.75 113.62 120.49 1l6i n SER 716 Ca 0.11 -3.47 -0.27 0.00 -0.26 0.00 0.00 58.87 54.97 1l6i n SER 716 Cb 0.45 -0.38 -0.05 0.00 -0.26 0.00 0.00 64.21 63.97 1l6i n SER 716 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1l6i n ASP 717 N -0.71 0.15 0.00 4.04 2.03 -1.06 -1.53 116.55 119.47 1l6i n ASP 717 Ca 0.35 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.56 1l6i n ASP 717 Cb 0.92 -2.53 0.00 0.00 -0.72 0.00 0.00 41.12 38.79 1l6i n ASP 717 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l6i n GLY 718 N -2.20 2.83 3.59 0.27 0.00 -0.06 -4.98 105.19 104.65 1l6i n GLY 718 Ca -0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1l6i n GLY 718 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l6i s ASP 719 N 0.02 5.74 0.00 1.61 2.15 -0.58 -4.45 116.67 121.16 1l6i s ASP 719 Ca 0.00 1.19 0.29 0.00 0.43 0.00 0.00 52.55 54.46 1l6i s ASP 719 Cb 0.00 -2.52 1.59 0.00 -0.30 0.00 0.00 42.92 41.68 1l6i s ASP 719 CO 0.00 -1.85 2.02 0.29 -0.17 0.00 0.00 175.17 175.46 1l6i n LYS 720 N 8.56 0.68 -0.02 4.34 5.02 -1.26 -3.38 118.16 132.10 1l6i n LYS 720 Ca 0.23 0.01 0.07 0.00 -2.02 0.00 0.00 58.31 56.60 1l6i n LYS 720 Cb 0.48 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.05 1l6i n LYS 720 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1l6i n HIS 721 N -1.13 0.05 -0.35 2.13 8.25 -1.26 -4.63 115.22 118.28 1l6i n HIS 721 Ca 0.18 -0.05 0.14 0.00 -0.26 0.00 0.00 57.72 57.73 1l6i n HIS 721 Cb 0.15 -0.00 0.34 0.00 1.12 0.00 0.00 29.99 31.60 1l6i n HIS 721 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1l6i h ALA 722 N 2.57 1.72 -0.34 -1.41 0.00 -1.90 -2.61 119.26 117.28 1l6i h ALA 722 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1l6i h ALA 722 Cb 0.57 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 1l6i h ALA 722 CO 0.00 -0.10 -0.02 1.19 0.00 0.00 0.00 179.25 180.32 1l6i n PHE 723 N -4.76 1.10 0.10 0.00 3.72 -1.26 -4.78 117.46 111.58 1l6i n PHE 723 Ca 0.24 -1.38 -0.02 0.00 -0.05 0.00 0.00 57.45 56.23 1l6i n PHE 723 Cb 0.60 -0.45 0.20 0.00 -0.94 0.00 0.00 39.48 38.89 1l6i n PHE 723 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1l6i h ASP 724 N 1.21 0.21 -0.51 4.37 3.04 -1.77 0.11 116.42 123.08 1l6i h ASP 724 Ca 0.17 -0.10 0.09 0.00 -3.24 0.00 0.00 57.03 53.95 1l6i h ASP 724 Cb 1.63 -0.06 -0.07 0.00 -1.04 0.00 0.00 39.33 39.79 1l6i h ASP 724 CO 0.36 0.66 0.09 1.56 -2.04 0.00 0.00 179.24 179.87 1l6i h GLN 725 N 0.16 0.21 -0.02 4.15 4.20 -1.86 2.16 115.11 124.11 1l6i h GLN 725 Ca 0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1l6i h GLN 725 Cb 0.90 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.63 1l6i h GLN 725 CO 0.07 0.14 0.00 1.98 -0.67 0.00 0.00 178.83 180.35 1l6i h MET 726 N 0.22 0.03 -0.52 1.46 4.05 -1.72 -2.69 114.93 115.77 1l6i h MET 726 Ca 0.26 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.67 1l6i h MET 726 Cb 0.36 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.13 1l6i h MET 726 CO -0.35 0.33 0.32 -0.07 0.23 0.00 0.00 176.91 177.37 1l6i h LEU 727 N -0.26 0.62 -0.90 3.39 4.07 0.28 -2.44 115.31 120.07 1l6i h LEU 727 Ca 0.01 -0.05 0.07 0.00 0.08 0.00 0.00 57.88 57.99 1l6i h LEU 727 Cb 0.31 -0.16 -0.06 0.00 1.08 0.00 0.00 40.66 41.83 1l6i h LEU 727 CO 0.00 0.48 0.57 0.45 -1.08 0.00 0.00 178.44 178.86 1l6i h HIS 728 N 0.70 1.05 0.00 1.13 3.86 0.35 -1.77 115.15 120.47 1l6i h HIS 728 Ca 0.19 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.38 1l6i h HIS 728 Cb -0.03 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.09 1l6i h HIS 728 CO -0.03 0.53 -0.22 0.66 0.86 0.00 0.00 177.93 179.73 1l6i h SER 729 N 1.03 0.00 -0.18 2.45 4.64 -1.09 -0.04 113.55 120.36 1l6i h SER 729 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1l6i h SER 729 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1l6i h SER 729 CO -0.18 0.22 0.00 2.30 -0.87 0.00 0.00 176.83 178.30 1l6i n ILE 730 N -4.15 0.28 -2.34 0.95 -5.35 -0.90 -1.14 119.36 106.72 1l6i n ILE 730 Ca -0.02 -0.64 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 1l6i n ILE 730 Cb 0.29 1.13 0.00 0.00 -1.74 0.00 0.00 39.64 39.31 1l6i n ILE 730 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1l6i n GLY 731 N 1.05 3.45 0.30 3.28 0.00 -0.72 -4.38 105.19 108.17 1l6i n GLY 731 Ca 0.13 -2.04 -0.05 0.00 0.00 0.00 0.00 46.02 44.05 1l6i n GLY 731 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1l6i h LYS 732 N 0.00 0.87 -0.38 1.61 1.63 -1.87 -0.09 116.57 118.34 1l6i h LYS 732 Ca 0.00 -0.23 0.07 0.00 -0.85 0.00 0.00 60.65 59.64 1l6i h LYS 732 Cb 0.00 -0.10 -0.06 0.00 -0.60 0.00 0.00 32.23 31.46 1l6i h LYS 732 CO 0.00 0.85 -0.01 1.96 -3.45 0.00 0.00 179.45 178.80 1l6i h GLN 733 N 0.82 0.09 0.00 1.90 7.50 -1.92 -3.16 115.11 120.34 1l6i h GLN 733 Ca 0.16 -0.01 -0.15 0.00 0.50 0.00 0.00 58.65 59.15 1l6i h GLN 733 Cb 0.44 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.92 1l6i h GLN 733 CO 0.02 0.06 -1.64 0.41 -1.50 0.00 0.00 178.83 176.18 1l6i n GLY 734 N -1.26 -1.16 1.66 3.46 0.00 -0.10 -4.98 105.19 102.81 1l6i n GLY 734 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1l6i n GLY 734 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l6i n GLY 735 N 1.41 0.76 3.77 -0.02 0.00 -0.05 -4.45 105.19 106.60 1l6i n GLY 735 Ca -0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1l6i n GLY 735 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l6i n ASP 736 N 0.00 -5.10 0.28 1.61 2.03 -0.29 -4.69 116.55 110.39 1l6i n ASP 736 Ca 0.00 -1.00 0.18 0.00 0.52 0.00 0.00 54.79 54.50 1l6i n ASP 736 Cb 0.00 -2.58 0.96 0.00 -0.72 0.00 0.00 41.12 38.79 1l6i n ASP 736 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1l6i h PRO 737 N -1.43 0.00 -0.40 -0.67 0.11 -1.78 -1.48 132.00 126.35 1l6i h PRO 737 Ca -0.61 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.50 1l6i h PRO 737 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 1l6i h PRO 737 CO 0.44 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.89 1l6i n TYR 738 N -3.39 0.86 -3.81 0.65 4.01 -1.26 -4.99 117.16 109.23 1l6i n TYR 738 Ca -0.01 -0.64 -0.26 0.00 -0.16 0.00 0.00 57.90 56.83 1l6i n TYR 738 Cb 0.23 -0.16 0.01 0.00 -0.31 0.00 0.00 39.34 39.11 1l6i n TYR 738 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1l6i n LEU 739 N 0.38 -2.62 -0.11 7.72 4.77 -0.56 -4.66 117.00 121.91 1l6i n LEU 739 Ca 0.18 -0.97 -0.10 0.00 -0.03 0.00 0.00 56.01 55.09 1l6i n LEU 739 Cb 0.68 -2.37 -0.02 0.00 -2.33 0.00 0.00 43.42 39.38 1l6i n LEU 739 CO 0.14 0.44 0.88 0.58 -1.33 0.00 0.00 177.39 178.10 1l6i h VAL 740 N -1.86 1.20 0.39 4.08 2.07 -1.94 -2.84 116.25 117.36 1l6i h VAL 740 Ca -0.64 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 1l6i h VAL 740 Cb 1.37 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 1l6i h VAL 740 CO 0.57 0.23 -0.19 0.24 0.02 0.00 0.00 177.57 178.43 1l6i h MET 741 N 0.41 -0.51 -0.10 1.57 2.86 -1.90 -2.64 114.93 114.61 1l6i h MET 741 Ca 0.11 0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.82 1l6i h MET 741 Cb 0.24 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 1l6i h MET 741 CO -0.00 -0.27 0.14 0.00 1.06 0.00 0.00 176.91 177.83 1l6i h ALA 742 N -0.09 1.61 0.00 6.32 0.00 -1.91 -2.16 119.26 123.02 1l6i h ALA 742 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1l6i h ALA 742 Cb 0.47 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1l6i h ALA 742 CO 0.09 -0.19 -1.05 -0.25 0.00 0.00 0.00 179.25 177.85 1l6i n ASP 743 N -3.66 0.91 -0.37 0.00 8.00 -1.07 -4.64 116.55 115.72 1l6i n ASP 743 Ca -0.00 -0.89 0.06 0.00 0.71 0.00 0.00 54.79 54.66 1l6i n ASP 743 Cb 0.24 1.04 0.22 0.00 -0.02 0.00 0.00 41.12 42.60 1l6i n ASP 743 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1l6i h PHE 744 N 0.00 1.17 -0.19 1.24 3.57 -1.01 -1.59 116.94 120.12 1l6i h PHE 744 Ca 0.00 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.36 1l6i h PHE 744 Cb 0.54 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.91 1l6i h PHE 744 CO 0.00 0.50 -0.55 0.00 -2.23 0.00 0.00 178.31 176.03 1l6i h ALA 745 N 1.52 0.32 0.00 2.41 0.00 -1.82 -0.77 119.26 120.91 1l6i h ALA 745 Ca 0.48 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1l6i h ALA 745 Cb 0.39 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1l6i h ALA 745 CO -0.24 0.53 -0.59 0.00 0.00 0.00 0.00 179.25 178.96 1l6i h ALA 746 N 0.57 1.01 0.20 0.00 0.00 -1.77 -1.47 119.26 117.81 1l6i h ALA 746 Ca -0.02 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1l6i h ALA 746 Cb 1.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1l6i h ALA 746 CO 0.12 0.73 -0.10 -0.92 0.00 0.00 0.00 179.25 179.08 1l6i h TYR 747 N 0.00 -0.25 -0.84 0.00 3.20 -0.76 -2.28 116.97 116.03 1l6i h TYR 747 Ca -0.01 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.92 1l6i h TYR 747 Cb 1.05 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 39.34 1l6i h TYR 747 CO 0.00 -0.00 0.51 0.28 -1.64 0.00 0.00 178.16 177.31 1l6i h VAL 748 N -0.47 1.02 -0.19 1.81 2.07 -0.95 -1.58 116.25 117.96 1l6i h VAL 748 Ca -0.03 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1l6i h VAL 748 Cb 0.36 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1l6i h VAL 748 CO 0.04 0.17 0.11 -0.08 0.02 0.00 0.00 177.57 177.84 1l6i h GLU 749 N 0.93 0.25 -0.06 1.57 4.57 -1.10 -1.64 114.58 119.09 1l6i h GLU 749 Ca 0.37 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.47 1l6i h GLU 749 Cb 0.20 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1l6i h GLU 749 CO -0.18 0.20 -0.23 0.00 -1.18 0.00 0.00 179.01 177.62 1l6i h ALA 750 N 1.04 1.50 0.00 2.92 0.00 -0.92 0.04 119.26 123.83 1l6i h ALA 750 Ca 0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1l6i h ALA 750 Cb 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1l6i h ALA 750 CO -0.01 0.37 -0.18 1.96 0.00 0.00 0.00 179.25 181.38 1l6i h GLN 751 N 0.10 0.00 -0.24 0.00 1.08 -0.60 -2.10 115.11 113.36 1l6i h GLN 751 Ca 0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1l6i h GLN 751 Cb 0.47 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 1l6i h GLN 751 CO 0.03 0.18 0.12 0.87 -0.95 0.00 0.00 178.83 179.08 1l6i h LYS 752 N 0.00 0.34 0.00 1.46 1.57 -0.08 -1.76 116.57 118.09 1l6i h LYS 752 Ca -0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1l6i h LYS 752 Cb 0.51 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1l6i h LYS 752 CO 0.02 0.34 0.00 1.96 -0.57 0.00 0.00 179.45 181.20 1l6i h GLN 753 N 0.26 0.00 -0.11 3.15 4.20 -1.13 -2.05 115.11 119.43 1l6i h GLN 753 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1l6i h GLN 753 Cb 0.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1l6i h GLN 753 CO -0.01 0.00 0.07 0.28 -0.67 0.00 0.00 178.83 178.50 1l6i h VAL 754 N 0.00 1.02 -0.32 -0.54 2.07 -0.97 -2.36 116.25 115.15 1l6i h VAL 754 Ca 0.00 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1l6i h VAL 754 Cb 0.33 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1l6i h VAL 754 CO 0.00 0.03 -0.01 0.44 0.02 0.00 0.00 177.57 178.05 1l6i h ASP 755 N 0.14 -0.14 -0.86 0.57 5.19 -1.31 -0.23 116.42 119.78 1l6i h ASP 755 Ca 0.04 0.08 0.07 0.00 -0.62 0.00 0.00 57.03 56.60 1l6i h ASP 755 Cb -0.01 0.14 -0.06 0.00 0.18 0.00 0.00 39.33 39.57 1l6i h ASP 755 CO -0.01 -0.04 0.52 0.58 -3.12 0.00 0.00 179.24 177.17 1l6i h VAL 756 N 0.09 1.01 0.00 -1.35 2.07 -1.50 0.12 116.25 116.69 1l6i h VAL 756 Ca 0.16 -0.32 -0.16 0.00 0.82 0.00 0.00 66.70 67.19 1l6i h VAL 756 Cb 0.21 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 1l6i h VAL 756 CO -0.27 0.17 -0.84 0.25 0.02 0.00 0.00 177.57 176.90 1l6i h LEU 757 N 0.93 0.00 -1.16 2.57 5.85 -1.09 -3.19 115.31 119.22 1l6i h LEU 757 Ca 0.38 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.04 1l6i h LEU 757 Cb 0.22 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1l6i h LEU 757 CO -0.19 0.75 -0.30 0.22 -0.34 0.00 0.00 178.44 178.58 1l6i h TYR 758 N 0.00 0.00 -0.20 1.25 3.20 0.10 -2.87 116.97 118.46 1l6i h TYR 758 Ca -0.03 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.65 1l6i h TYR 758 Cb 1.60 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.87 1l6i h TYR 758 CO 0.00 0.30 -0.62 0.00 -1.64 0.00 0.00 178.16 176.20 1l6i h ARG 759 N 0.00 0.76 -5.62 1.82 3.08 -1.26 -3.35 114.38 109.82 1l6i h ARG 759 Ca -0.00 -0.56 -0.64 0.00 0.07 0.00 0.00 59.98 58.84 1l6i h ARG 759 Cb 0.75 0.10 -0.13 0.00 0.08 0.00 0.00 29.97 30.77 1l6i h ARG 759 CO 0.04 1.18 1.22 0.34 -1.07 0.00 0.00 179.97 181.68 1l6i s ASP 760 N -6.93 6.57 0.47 7.04 2.15 -1.08 -4.89 116.67 120.00 1l6i s ASP 760 Ca -0.11 -1.74 0.16 0.00 0.43 0.00 0.00 52.55 51.28 1l6i s ASP 760 Cb 0.08 -2.49 1.12 0.00 -0.30 0.00 0.00 42.92 41.33 1l6i s ASP 760 CO 0.88 -1.30 2.05 1.56 -0.17 0.00 0.00 175.17 178.19 1l6i h GLN 761 N 9.31 0.00 -0.34 4.34 1.08 -1.75 -1.14 115.11 126.60 1l6i h GLN 761 Ca 0.19 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.23 1l6i h GLN 761 Cb 1.01 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 1l6i h GLN 761 CO 1.29 0.12 -0.43 1.49 -0.95 0.00 0.00 178.83 180.36 1l6i h GLU 762 N 0.00 0.86 -0.28 1.46 4.81 -1.91 -2.25 114.58 117.27 1l6i h GLU 762 Ca -0.00 -0.47 -0.15 0.00 -0.13 0.00 0.00 59.36 58.60 1l6i h GLU 762 Cb 0.22 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1l6i h GLU 762 CO 0.02 1.12 -0.44 0.00 -0.73 0.00 0.00 179.01 178.97 1l6i h ALA 763 N 0.81 0.70 0.60 2.92 0.00 -1.55 -2.17 119.26 120.57 1l6i h ALA 763 Ca 0.05 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1l6i h ALA 763 Cb 1.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1l6i h ALA 763 CO 0.10 0.67 -0.37 2.35 0.00 0.00 0.00 179.25 181.99 1l6i h TRP 764 N 0.57 -1.00 -0.80 0.00 2.91 -1.31 -2.23 115.95 114.09 1l6i h TRP 764 Ca 0.04 -0.01 0.15 0.00 1.13 0.00 0.00 58.89 60.20 1l6i h TRP 764 Cb 0.99 0.36 -0.10 0.00 -0.51 0.00 0.00 29.16 29.90 1l6i h TRP 764 CO 0.05 -0.56 0.36 1.15 -1.03 0.00 0.00 178.44 178.41 1l6i h THR 765 N -0.91 0.66 -0.64 2.65 2.02 -1.46 0.06 112.91 115.29 1l6i h THR 765 Ca -0.08 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 66.94 1l6i h THR 765 Cb 0.73 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1l6i h THR 765 CO 0.08 0.09 0.42 0.03 0.37 0.00 0.00 175.52 176.51 1l6i h ARG 766 N 0.50 0.82 -0.65 6.66 3.08 -1.35 0.21 114.38 123.66 1l6i h ARG 766 Ca 0.45 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.37 1l6i h ARG 766 Cb 0.69 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1l6i h ARG 766 CO -0.40 0.54 0.10 0.00 -1.07 0.00 0.00 179.97 179.14 1l6i h ALA 767 N 1.24 0.95 -0.39 0.04 0.00 -0.46 -2.38 119.26 118.26 1l6i h ALA 767 Ca 0.24 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1l6i h ALA 767 Cb -0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1l6i h ALA 767 CO -0.06 0.66 -0.31 0.00 0.00 0.00 0.00 179.25 179.53 1l6i h ALA 768 N 1.10 0.71 0.00 0.00 0.00 -0.66 -2.14 119.26 118.26 1l6i h ALA 768 Ca 0.20 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1l6i h ALA 768 Cb 0.44 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1l6i h ALA 768 CO 0.01 0.66 -0.07 0.82 0.00 0.00 0.00 179.25 180.67 1l6i h ILE 769 N 0.72 0.81 0.00 0.00 2.04 -0.22 -2.57 117.51 118.30 1l6i h ILE 769 Ca 0.08 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1l6i h ILE 769 Cb 0.87 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1l6i h ILE 769 CO 0.08 0.07 -0.34 -0.07 0.00 0.00 0.00 178.15 177.89 1l6i h LEU 770 N 0.00 0.00 -0.11 1.44 3.38 -0.90 0.41 115.31 119.54 1l6i h LEU 770 Ca -0.00 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1l6i h LEU 770 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1l6i h LEU 770 CO 0.01 0.00 -0.53 0.78 0.09 0.00 0.00 178.44 178.79 1l6i h ASN 771 N 0.00 0.65 0.21 -0.43 2.35 -1.07 -1.68 115.58 115.60 1l6i h ASN 771 Ca 0.00 -0.64 -0.01 0.00 -0.55 0.00 0.00 56.30 55.10 1l6i h ASN 771 Cb 0.97 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1l6i h ASN 771 CO 0.00 1.19 -0.10 0.74 -1.65 0.00 0.00 177.43 177.61 1l6i h THR 772 N 0.16 0.81 -0.03 2.81 2.02 -1.25 -2.92 112.91 114.50 1l6i h THR 772 Ca -0.04 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 1l6i h THR 772 Cb 1.17 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1l6i h THR 772 CO 0.11 0.02 -0.19 0.00 0.37 0.00 0.00 175.52 175.83 1l6i h ALA 773 N 0.47 1.63 -0.42 6.16 0.00 -0.95 -3.15 119.26 123.00 1l6i h ALA 773 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1l6i h ALA 773 Cb 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1l6i h ALA 773 CO 0.05 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.11 1l6i n ARG 774 N -4.29 2.44 -0.56 0.00 1.74 -0.63 -2.98 116.66 112.37 1l6i n ARG 774 Ca -0.02 -2.22 0.08 0.00 -0.77 0.00 0.00 57.85 54.92 1l6i n ARG 774 Cb 0.26 -1.44 0.30 0.00 -1.02 0.00 0.00 32.46 30.56 1l6i n ARG 774 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1l6i h GLY 776 N 2.72 0.00 2.00 0.00 0.00 -1.77 -2.79 103.07 103.24 1l6i h GLY 776 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1l6i h GLY 776 CO 0.27 0.00 0.00 1.15 0.00 0.00 0.00 176.54 177.96 1l6i n MET 777 N -3.01 0.06 -0.33 4.80 0.00 -1.26 -3.32 117.12 114.06 1l6i n MET 777 Ca -0.03 0.11 0.06 0.00 0.00 0.00 0.00 57.70 57.84 1l6i n MET 777 Cb 0.16 -1.58 0.21 0.00 0.00 0.00 0.00 33.22 32.02 1l6i n MET 777 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1l6i n PHE 778 N -1.69 0.81 -2.34 3.17 3.72 -1.05 -4.79 117.46 115.29 1l6i n PHE 778 Ca 0.06 -0.34 -0.40 0.00 -0.05 0.00 0.00 57.45 56.72 1l6i n PHE 778 Cb 0.32 -0.12 -0.03 0.00 -0.94 0.00 0.00 39.48 38.71 1l6i n PHE 778 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1l6i s SER 779 N -0.82 7.08 0.52 4.37 0.15 -1.21 -1.37 113.70 122.42 1l6i s SER 779 Ca 0.30 2.43 0.31 0.00 0.70 0.00 0.00 55.95 59.69 1l6i s SER 779 Cb 0.18 -2.64 1.26 0.00 -1.71 0.00 0.00 66.02 63.12 1l6i s SER 779 CO 0.16 -0.29 1.95 0.77 1.20 0.00 0.00 173.24 177.03 1l6i h SER 780 N 3.66 0.00 -0.81 5.45 4.64 -1.58 -2.32 113.55 122.58 1l6i h SER 780 Ca -0.48 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.86 1l6i h SER 780 Cb 1.22 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 1l6i h SER 780 CO 0.66 0.07 0.53 0.44 -0.87 0.00 0.00 176.83 177.67 1l6i h ASP 781 N 0.00 0.91 -0.13 4.97 3.32 -1.91 0.73 116.42 124.31 1l6i h ASP 781 Ca -0.00 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 1l6i h ASP 781 Cb 0.56 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1l6i h ASP 781 CO 0.01 0.65 -0.29 -0.09 -1.72 0.00 0.00 179.24 177.80 1l6i h ARG 782 N 1.07 0.61 -0.43 3.56 1.12 -1.74 -2.38 114.38 116.19 1l6i h ARG 782 Ca 0.30 -0.26 0.02 0.00 -1.11 0.00 0.00 59.98 58.93 1l6i h ARG 782 Cb -0.09 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 29.82 1l6i h ARG 782 CO -0.08 0.83 0.25 0.77 -3.11 0.00 0.00 179.97 178.64 1l6i h SER 783 N 0.53 0.40 -0.56 -3.80 0.02 -1.18 -1.62 113.55 107.35 1l6i h SER 783 Ca 0.07 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 1l6i h SER 783 Cb 0.77 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 1l6i h SER 783 CO 0.06 0.29 0.20 0.40 -1.14 0.00 0.00 176.83 176.64 1l6i h ILE 784 N 0.51 1.23 -0.53 3.27 1.08 -0.62 -0.68 117.51 121.77 1l6i h ILE 784 Ca 0.17 -0.75 -0.00 0.00 -0.39 0.00 0.00 64.86 63.89 1l6i h ILE 784 Cb 0.02 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 1l6i h ILE 784 CO -0.08 0.28 0.32 0.03 -0.69 0.00 0.00 178.15 178.01 1l6i h ARG 785 N 0.77 0.72 -0.51 2.37 -0.00 -1.29 0.17 114.38 116.62 1l6i h ARG 785 Ca 0.18 -0.06 -0.09 0.00 -0.50 0.00 0.00 59.98 59.52 1l6i h ARG 785 Cb 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 29.97 30.04 1l6i h ARG 785 CO -0.01 0.50 -0.01 -0.44 0.00 0.00 0.00 179.97 180.01 1l6i h ASP 786 N 0.73 0.89 -0.42 7.04 5.19 -0.21 -1.79 116.42 127.85 1l6i h ASP 786 Ca 0.19 -0.31 -0.02 0.00 -0.62 0.00 0.00 57.03 56.27 1l6i h ASP 786 Cb -0.03 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.23 1l6i h ASP 786 CO -0.04 0.99 0.17 1.88 -3.12 0.00 0.00 179.24 179.13 1l6i h TYR 787 N 0.77 0.63 0.69 4.55 0.05 -0.64 -1.90 116.97 121.12 1l6i h TYR 787 Ca 0.14 -0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 1l6i h TYR 787 Cb 0.54 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 38.09 1l6i h TYR 787 CO 0.04 0.55 -0.38 1.96 -1.05 0.00 0.00 178.16 179.27 1l6i h GLN 788 N 0.53 -0.96 -0.53 4.88 4.20 -0.37 -0.02 115.11 122.84 1l6i h GLN 788 Ca 0.14 0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.96 1l6i h GLN 788 Cb 0.18 0.22 -0.04 0.00 0.30 0.00 0.00 27.48 28.13 1l6i h GLN 788 CO -0.01 -0.64 0.28 0.00 -0.67 0.00 0.00 178.83 177.79 1l6i h ALA 789 N -0.72 0.69 0.00 3.87 0.00 -1.34 0.02 119.26 121.77 1l6i h ALA 789 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1l6i h ALA 789 Cb 0.79 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1l6i h ALA 789 CO 0.12 -0.05 -0.78 0.00 0.00 0.00 0.00 179.25 178.54 1l6i h ARG 790 N 0.55 0.00 0.00 0.00 3.08 -1.33 -3.39 114.38 113.30 1l6i h ARG 790 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1l6i h ARG 790 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1l6i h ARG 790 CO -0.15 0.00 0.00 -0.89 -1.07 0.00 0.00 179.97 177.86 1l6i n ILE 791 N -2.35 0.00 -0.19 2.04 5.41 -0.19 -4.81 119.36 119.27 1l6i n ILE 791 Ca 0.02 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.70 1l6i n ILE 791 Cb 0.48 -0.30 0.03 0.00 -0.71 0.00 0.00 39.64 39.14 1l6i n ILE 791 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1l6i h TRP 792 N 0.00 0.69 -0.13 1.39 6.55 -1.12 -3.24 115.95 120.09 1l6i h TRP 792 Ca 0.00 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.85 1l6i h TRP 792 Cb 0.00 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 28.07 1l6i h TRP 792 CO 0.00 0.45 0.00 1.04 -1.05 0.00 0.00 178.44 178.88 1l6i n GLN 793 N -4.69 2.20 -1.97 0.49 1.13 -0.01 -4.64 117.38 109.90 1l6i n GLN 793 Ca 0.03 -2.57 -0.28 0.00 -1.94 0.00 0.00 57.00 52.24 1l6i n GLN 793 Cb 0.03 -1.59 0.08 0.00 0.11 0.00 0.00 30.24 28.87 1l6i n GLN 793 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1l6i s ALA 794 N -2.59 2.79 -0.07 -1.58 0.00 -1.22 -4.94 121.76 114.15 1l6i s ALA 794 Ca 0.33 -0.67 -0.27 0.00 0.00 0.00 0.00 51.96 51.36 1l6i s ALA 794 Cb 0.27 -2.89 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 1l6i s ALA 794 CO 0.06 -1.53 0.86 0.21 0.00 0.00 0.00 175.76 175.36 1l6i s LYS 795 N -5.48 4.45 0.00 0.00 2.47 -1.26 -5.01 119.74 114.92 1l6i s LYS 795 Ca 0.61 1.15 0.30 0.00 -1.56 0.00 0.00 55.97 56.47 1l6i s LYS 795 Cb -0.11 -3.49 1.46 0.00 -1.46 0.00 0.00 37.83 34.23 1l6i s LYS 795 CO 0.48 -0.09 1.98 0.54 0.16 0.00 0.00 175.35 178.42