#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 -1.19 4.33 7.27 -1.25 -3.97 117.38 122.57 1l6i n GLN 2 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 1l6i n GLN 2 Cb 0.00 -1.26 0.10 0.00 2.41 0.00 0.00 30.24 31.49 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 3.44 2.08 -0.17 3.69 0.02 -1.26 -4.95 135.00 137.84 1l6i s PRO 3 Ca 0.93 1.21 -0.03 0.00 0.02 0.00 0.00 61.00 63.13 1l6i s PRO 3 Cb -1.26 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 31.37 1l6i s PRO 3 CO 0.64 -1.78 -0.06 0.42 -0.33 0.00 0.00 177.00 175.89 1l6i s ILE 4 N -2.87 3.51 0.16 2.83 1.09 -1.26 -4.98 121.20 119.67 1l6i s ILE 4 Ca 0.62 -0.48 -0.28 0.00 -1.10 0.00 0.00 60.65 59.41 1l6i s ILE 4 Cb -0.18 -2.54 -0.07 0.00 -1.06 0.00 0.00 42.46 38.60 1l6i s ILE 4 CO 0.56 0.47 0.89 0.12 -0.10 0.00 0.00 174.94 176.89 1l6i s PHE 5 N 0.76 3.88 -0.07 3.97 5.36 -1.26 -5.05 117.98 125.58 1l6i s PHE 5 Ca -0.02 1.77 -0.01 0.00 -0.96 0.00 0.00 56.93 57.70 1l6i s PHE 5 Cb -0.15 -2.94 0.03 0.00 -0.34 0.00 0.00 43.02 39.62 1l6i s PHE 5 CO 0.02 0.36 0.01 1.21 -1.46 0.00 0.00 175.22 175.36 1l6i s ASN 6 N -0.64 1.55 0.38 6.13 3.84 -1.26 -5.04 114.94 119.89 1l6i s ASN 6 Ca 0.42 -0.07 0.07 0.00 0.21 0.00 0.00 52.86 53.49 1l6i s ASN 6 Cb -0.24 -0.41 0.80 0.00 -0.55 0.00 0.00 41.25 40.85 1l6i s ASN 6 CO 0.29 -0.20 1.97 -0.78 -2.79 0.00 0.00 177.10 175.59 1l6i h ASP 7 N 8.33 0.60 -0.04 -4.21 3.58 -1.99 -1.60 116.42 121.11 1l6i h ASP 7 Ca -0.19 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.07 1l6i h ASP 7 Cb 1.12 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.05 1l6i h ASP 7 CO 0.25 0.38 -0.66 0.50 -2.88 0.00 0.00 179.24 176.83 1l6i h LYS 8 N 0.68 0.66 -0.63 0.28 3.64 -1.99 -1.16 116.57 118.06 1l6i h LYS 8 Ca 0.30 -0.48 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 1l6i h LYS 8 Cb 0.30 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 1l6i h LYS 8 CO -0.10 1.10 0.32 1.96 -2.27 0.00 0.00 179.45 180.46 1l6i h GLN 9 N 0.48 0.89 -0.44 1.90 4.20 -1.75 -2.01 115.11 118.39 1l6i h GLN 9 Ca -0.02 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 1l6i h GLN 9 Cb 1.25 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.85 1l6i h GLN 9 CO 0.13 0.70 0.19 0.35 -0.67 0.00 0.00 178.83 179.53 1l6i h PHE 10 N 0.86 0.66 -0.63 2.96 3.57 -1.08 -1.84 116.94 121.43 1l6i h PHE 10 Ca 0.22 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 1l6i h PHE 10 Cb 0.09 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 1l6i h PHE 10 CO -0.00 0.56 0.24 1.96 -2.23 0.00 0.00 178.31 178.84 1l6i h GLN 11 N 0.57 0.95 -0.71 1.11 1.08 -1.09 -0.41 115.11 116.60 1l6i h GLN 11 Ca 0.15 -0.18 -0.06 0.00 -1.45 0.00 0.00 58.65 57.11 1l6i h GLN 11 Cb 0.17 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 1l6i h GLN 11 CO -0.01 0.81 0.22 0.93 -0.95 0.00 0.00 178.83 179.82 1l6i h GLU 12 N 0.88 1.10 -0.25 1.46 5.08 -1.22 -0.86 114.58 120.76 1l6i h GLU 12 Ca 0.21 -0.23 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1l6i h GLU 12 Cb 0.22 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1l6i h GLU 12 CO -0.02 0.94 -0.47 0.00 -1.00 0.00 0.00 179.01 178.46 1l6i h ALA 13 N 1.18 0.70 -0.40 3.43 0.00 -0.74 -1.63 119.26 121.80 1l6i h ALA 13 Ca 0.23 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1l6i h ALA 13 Cb 0.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1l6i h ALA 13 CO -0.01 0.67 0.04 1.25 0.00 0.00 0.00 179.25 181.21 1l6i h LEU 14 N 0.53 0.65 -1.47 0.00 5.85 -0.95 -2.18 115.31 117.74 1l6i h LEU 14 Ca 0.03 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1l6i h LEU 14 Cb 1.01 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1l6i h LEU 14 CO 0.10 0.77 0.27 0.77 -0.34 0.00 0.00 178.44 180.00 1l6i h SER 15 N 0.52 0.55 -0.25 1.25 4.64 -0.54 -1.77 113.55 117.95 1l6i h SER 15 Ca 0.12 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.42 1l6i h SER 15 Cb 0.40 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1l6i h SER 15 CO 0.01 0.43 0.16 0.03 -0.87 0.00 0.00 176.83 176.60 1l6i h ARG 16 N 0.64 0.28 0.04 4.77 3.08 -0.65 -2.02 114.38 120.51 1l6i h ARG 16 Ca 0.17 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1l6i h ARG 16 Cb -0.01 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1l6i h ARG 16 CO -0.03 0.19 -0.02 1.96 -1.07 0.00 0.00 179.97 181.00 1l6i h GLN 17 N 0.29 -0.05 0.00 0.04 1.08 -1.25 -0.58 115.11 114.64 1l6i h GLN 17 Ca 0.10 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.23 1l6i h GLN 17 Cb 0.03 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 1l6i h GLN 17 CO -0.02 0.58 -0.33 0.11 -0.95 0.00 0.00 178.83 178.22 1l6i h TRP 18 N -0.74 0.00 -0.19 2.96 5.08 -1.55 0.12 115.95 121.62 1l6i h TRP 18 Ca -0.00 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.93 1l6i h TRP 18 Cb 0.65 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.81 1l6i h TRP 18 CO 0.15 0.33 -0.02 1.96 -1.28 0.00 0.00 178.44 179.59 1l6i h GLN 19 N 0.00 0.35 -0.05 0.12 4.20 -1.43 -0.90 115.11 117.40 1l6i h GLN 19 Ca -0.00 -0.12 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1l6i h GLN 19 Cb 0.81 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 1l6i h GLN 19 CO 0.04 0.57 0.04 -0.09 -0.67 0.00 0.00 178.83 178.73 1l6i h ARG 20 N 0.09 0.00 -0.00 1.46 2.43 0.05 0.52 114.38 118.93 1l6i h ARG 20 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1l6i h ARG 20 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1l6i h ARG 20 CO 0.01 0.00 -0.08 0.66 -1.51 0.00 0.00 179.97 179.06 1l6i n TYR 21 N -4.12 0.00 -1.75 2.20 4.01 0.32 -4.92 117.16 112.90 1l6i n TYR 21 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1l6i n TYR 21 Cb 0.14 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 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 1.27 0.64 3.84 2.72 0.00 0.18 -5.07 105.19 108.77 1l6i n GLY 22 Ca 0.15 -0.74 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.09 3.77 0.17 0.99 1.43 -0.36 -5.03 118.68 119.56 1l6i s LEU 23 Ca 0.00 -0.31 0.24 0.00 -1.03 0.00 0.00 54.13 53.03 1l6i s LEU 23 Cb 0.00 -2.33 0.38 0.00 0.03 0.00 0.00 46.19 44.27 1l6i s LEU 23 CO 0.00 -0.13 1.38 0.78 0.23 0.00 0.00 176.35 178.61 1l6i h ASN 24 N 1.41 0.00 -4.97 2.29 2.35 -1.97 -3.41 115.58 111.28 1l6i h ASN 24 Ca -0.47 -0.13 0.15 0.00 -0.55 0.00 0.00 56.30 55.29 1l6i h ASN 24 Cb 1.24 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.49 1l6i h ASN 24 CO 0.60 0.07 0.51 -0.94 -1.65 0.00 0.00 177.43 176.01 1l6i s SER 25 N -4.57 -0.27 0.27 5.81 1.04 -1.26 -5.03 113.70 109.69 1l6i s SER 25 Ca 0.06 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1l6i s SER 25 Cb 0.12 0.42 0.57 0.00 0.10 0.00 0.00 66.02 67.22 1l6i s SER 25 CO 0.70 -0.72 1.78 0.00 0.98 0.00 0.00 173.24 175.98 1l6i h ALA 26 N 2.00 1.38 0.00 5.32 0.00 -1.94 -1.04 119.26 124.98 1l6i h ALA 26 Ca -0.23 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1l6i h ALA 26 Cb 1.23 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1l6i h ALA 26 CO 0.28 -0.02 0.14 0.00 0.00 0.00 0.00 179.25 179.65 1l6i h ALA 27 N 1.56 1.13 0.00 0.00 0.00 -1.95 -0.57 119.26 119.44 1l6i h ALA 27 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1l6i h ALA 27 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1l6i h ALA 27 CO -0.34 -0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.16 1l6i n GLU 28 N -2.83 0.07 -1.85 0.00 1.02 -0.39 -4.91 120.64 111.74 1l6i n GLU 28 Ca -0.02 0.11 -0.34 0.00 -0.02 0.00 0.00 57.16 56.89 1l6i n GLU 28 Cb 0.19 -1.59 0.04 0.00 -0.02 0.00 0.00 31.44 30.07 1l6i n GLU 28 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1l6i s MET 29 N -3.04 2.88 0.56 3.49 -1.94 -0.22 -5.03 119.30 116.00 1l6i s MET 29 Ca 0.12 1.49 -0.04 0.00 -1.71 0.00 0.00 55.69 55.54 1l6i s MET 29 Cb 0.16 -1.95 0.01 0.00 2.01 0.00 0.00 34.83 35.05 1l6i s MET 29 CO 0.50 -1.21 0.85 0.95 -0.01 0.00 0.00 175.02 176.11 1l6i s THR 30 N -2.15 3.62 0.27 2.05 -4.23 -1.26 -4.81 115.64 109.13 1l6i s THR 30 Ca 0.69 -0.14 -0.02 0.00 -1.18 0.00 0.00 61.69 61.04 1l6i s THR 30 Cb -0.22 -3.42 0.31 0.00 1.34 0.00 0.00 72.50 70.51 1l6i s THR 30 CO 0.38 -0.40 1.63 -0.65 -0.54 0.00 0.00 174.62 175.05 1l6i h PRO 31 N -0.07 0.14 -0.27 3.99 0.11 -1.99 0.33 132.00 134.25 1l6i h PRO 31 Ca -0.45 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 1l6i h PRO 31 Cb 1.26 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1l6i h PRO 31 CO 0.60 0.09 -0.09 -0.09 -0.21 0.00 0.00 178.00 178.30 1l6i h ARG 32 N 0.15 0.54 -0.62 1.05 2.43 -1.96 -2.38 114.38 113.58 1l6i h ARG 32 Ca 0.50 -0.22 0.02 0.00 -0.81 0.00 0.00 59.98 59.48 1l6i h ARG 32 Cb 0.96 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.45 1l6i h ARG 32 CO -0.69 0.76 0.39 1.96 -1.51 0.00 0.00 179.97 180.88 1l6i h GLN 33 N 0.28 0.75 -0.38 0.20 4.20 -1.52 0.50 115.11 119.14 1l6i h GLN 33 Ca 0.07 -0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.79 1l6i h GLN 33 Cb 0.58 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.13 1l6i h GLN 33 CO 0.03 0.49 0.04 -1.49 -0.67 0.00 0.00 178.83 177.24 1l6i h TRP 34 N 0.77 0.06 -0.64 2.96 4.06 -0.34 0.64 115.95 123.45 1l6i h TRP 34 Ca 0.24 0.03 -0.08 0.00 2.06 0.00 0.00 58.89 61.14 1l6i h TRP 34 Cb -0.01 0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.16 1l6i h TRP 34 CO -0.05 -0.03 0.10 2.35 -3.56 0.00 0.00 178.44 177.25 1l6i h TRP 35 N 0.15 1.11 -0.83 0.49 7.01 -0.78 -1.67 115.95 121.43 1l6i h TRP 35 Ca 0.19 -0.15 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 1l6i h TRP 35 Cb 0.24 -0.31 -0.04 0.00 -2.10 0.00 0.00 29.16 26.96 1l6i h TRP 35 CO -0.23 0.94 0.45 -0.07 -2.79 0.00 0.00 178.44 176.75 1l6i h LEU 36 N 0.98 1.03 -0.30 0.65 3.38 -0.46 -2.37 115.31 118.23 1l6i h LEU 36 Ca 0.20 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1l6i h LEU 36 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1l6i h LEU 36 CO 0.01 0.83 -0.15 0.00 0.09 0.00 0.00 178.44 179.22 1l6i h ALA 37 N 1.24 0.42 -0.60 1.53 0.00 0.50 -1.90 119.26 120.44 1l6i h ALA 37 Ca 0.29 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1l6i h ALA 37 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1l6i h ALA 37 CO -0.05 0.32 0.18 -0.39 0.00 0.00 0.00 179.25 179.31 1l6i h VAL 38 N 0.38 1.25 -0.58 0.00 -1.51 -1.29 0.31 116.25 114.80 1l6i h VAL 38 Ca 0.07 -0.85 -0.04 0.00 -1.23 0.00 0.00 66.70 64.65 1l6i h VAL 38 Cb 0.68 0.66 -0.03 0.00 -2.13 0.00 0.00 31.29 30.47 1l6i h VAL 38 CO 0.05 0.32 0.20 0.28 -1.23 0.00 0.00 177.57 177.19 1l6i h SER 39 N 0.86 0.83 0.28 4.19 0.02 -1.46 0.36 113.55 118.63 1l6i h SER 39 Ca 0.19 -0.19 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 1l6i h SER 39 Cb 0.30 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1l6i h SER 39 CO -0.00 0.80 -0.60 -0.33 -1.14 0.00 0.00 176.83 175.56 1l6i h GLU 40 N 0.81 0.31 -0.66 3.45 5.08 -1.17 0.16 114.58 122.56 1l6i h GLU 40 Ca 0.19 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1l6i h GLU 40 Cb 0.25 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1l6i h GLU 40 CO -0.01 0.81 0.11 0.00 -1.00 0.00 0.00 179.01 178.93 1l6i h ALA 41 N 1.14 0.94 -0.42 3.43 0.00 0.96 -2.72 119.26 122.59 1l6i h ALA 41 Ca -0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1l6i h ALA 41 Cb 1.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1l6i h ALA 41 CO 0.10 0.66 -0.21 -0.07 0.00 0.00 0.00 179.25 179.73 1l6i h LEU 42 N 1.02 0.84 -1.21 0.00 3.38 -0.04 -2.64 115.31 116.66 1l6i h LEU 42 Ca 0.20 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1l6i h LEU 42 Cb 0.43 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1l6i h LEU 42 CO 0.01 1.03 -0.05 0.00 0.09 0.00 0.00 178.44 179.52 1l6i h ALA 43 N 1.04 1.35 -0.27 1.53 0.00 -0.84 -1.21 119.26 120.86 1l6i h ALA 43 Ca 0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1l6i h ALA 43 Cb 0.73 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1l6i h ALA 43 CO 0.06 0.44 0.03 0.93 0.00 0.00 0.00 179.25 180.71 1l6i h GLU 44 N 0.46 0.46 -0.54 0.00 5.08 -1.29 -1.88 114.58 116.87 1l6i h GLU 44 Ca 0.09 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1l6i h GLU 44 Cb 0.38 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1l6i h GLU 44 CO 0.02 0.59 0.24 0.52 -1.00 0.00 0.00 179.01 179.38 1l6i h MET 45 N 0.27 0.79 -0.56 2.33 2.86 -1.44 -1.16 114.93 118.02 1l6i h MET 45 Ca 0.08 -0.13 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1l6i h MET 45 Cb 0.36 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1l6i h MET 45 CO 0.01 0.67 0.35 1.25 1.06 0.00 0.00 176.91 180.25 1l6i h LEU 46 N 0.72 0.59 -0.12 1.22 5.85 -1.00 -2.43 115.31 120.15 1l6i h LEU 46 Ca 0.18 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1l6i h LEU 46 Cb 0.16 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1l6i h LEU 46 CO -0.02 0.42 0.00 0.54 -0.34 0.00 0.00 178.44 179.04 1l6i n ARG 47 N -4.73 0.19 0.00 1.25 1.74 -0.73 -1.82 116.66 112.56 1l6i n ARG 47 Ca 0.04 0.21 0.16 0.00 -0.77 0.00 0.00 57.85 57.48 1l6i n ARG 47 Cb 0.05 -1.74 0.87 0.00 -1.02 0.00 0.00 32.46 30.62 1l6i n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1l6i n ALA 48 N -1.72 2.63 -1.97 7.54 0.00 -0.46 -4.90 120.51 121.64 1l6i n ALA 48 Ca 0.05 -0.20 -0.38 0.00 0.00 0.00 0.00 53.44 52.92 1l6i n ALA 48 Cb 0.37 -1.49 -0.06 0.00 0.00 0.00 0.00 19.45 18.26 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 -2.17 4.48 0.58 0.00 -1.52 -0.75 -5.05 119.66 115.22 1l6i s GLN 49 Ca 0.42 1.11 -0.20 0.00 -1.95 0.00 0.00 55.36 54.74 1l6i s GLN 49 Cb 0.21 -3.05 -0.04 0.00 -0.22 0.00 0.00 33.01 29.92 1l6i s GLN 49 CO 0.40 0.46 1.34 -2.14 -0.25 0.00 0.00 175.29 175.09 1l6i s PRO 50 N -1.59 2.94 -0.08 2.91 0.02 -1.26 -4.93 135.00 133.01 1l6i s PRO 50 Ca 0.41 2.18 -0.30 0.00 0.02 0.00 0.00 61.00 63.31 1l6i s PRO 50 Cb -0.20 -2.12 -0.04 0.00 0.02 0.00 0.00 34.50 32.16 1l6i s PRO 50 CO 0.24 -1.33 1.45 0.12 -0.33 0.00 0.00 177.00 177.15 1l6i s PHE 51 N -1.33 2.51 -0.25 6.54 5.36 -1.26 -4.96 117.98 124.59 1l6i s PHE 51 Ca 0.75 0.64 -0.17 0.00 -0.96 0.00 0.00 56.93 57.19 1l6i s PHE 51 Cb -0.40 -3.71 -0.03 0.00 -0.34 0.00 0.00 43.02 38.54 1l6i s PHE 51 CO 0.45 -2.75 0.46 0.00 -1.46 0.00 0.00 175.22 171.92 1l6i s ALA 52 N 3.40 3.57 0.39 11.12 0.00 -1.25 -4.94 121.76 134.05 1l6i s ALA 52 Ca 0.64 -0.64 -0.24 0.00 0.00 0.00 0.00 51.96 51.72 1l6i s ALA 52 Cb -0.29 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 19.95 1l6i s ALA 52 CO 0.24 -0.63 1.02 -1.59 0.00 0.00 0.00 175.76 174.79 1l6i s LYS 53 N 2.04 4.26 1.06 0.00 -2.85 -1.26 -4.70 119.74 118.28 1l6i s LYS 53 Ca 0.19 1.43 -0.16 0.00 -1.00 0.00 0.00 55.97 56.43 1l6i s LYS 53 Cb -0.16 -2.56 0.22 0.00 -2.06 0.00 0.00 37.83 33.28 1l6i s LYS 53 CO 0.09 -0.04 1.16 -2.14 0.10 0.00 0.00 175.35 174.52 1l6i s PRO 54 N -2.47 -0.07 0.39 1.78 0.02 -1.26 -4.99 135.00 128.39 1l6i s PRO 54 Ca 0.57 0.02 -0.27 0.00 0.02 0.00 0.00 61.00 61.34 1l6i s PRO 54 Cb -0.20 -1.72 -0.10 0.00 0.02 0.00 0.00 34.50 32.50 1l6i s PRO 54 CO 0.25 -2.96 1.42 0.08 -0.33 0.00 0.00 177.00 175.45 1l6i s VAL 55 N -3.24 2.25 0.60 3.83 1.01 0.81 -4.96 120.40 120.69 1l6i s VAL 55 Ca 0.69 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.93 1l6i s VAL 55 Cb -0.11 -3.15 0.07 0.00 0.00 0.00 0.00 36.38 33.19 1l6i s VAL 55 CO 0.55 0.05 0.83 0.00 0.00 0.00 0.00 175.10 176.53 1l6i s ALA 56 N -1.16 3.98 -1.36 5.51 0.00 -1.26 -4.53 121.76 122.95 1l6i s ALA 56 Ca 0.54 -1.58 -0.09 0.00 0.00 0.00 0.00 51.96 50.83 1l6i s ALA 56 Cb -0.44 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 20.74 1l6i s ALA 56 CO 0.58 -0.95 0.44 0.09 0.00 0.00 0.00 175.76 175.92 1l6i n ASN 57 N -2.45 -1.52 -3.92 0.00 5.03 -1.26 -4.99 115.26 106.14 1l6i n ASN 57 Ca 0.11 -1.11 -0.10 0.00 0.87 0.00 0.00 54.58 54.36 1l6i n ASN 57 Cb 0.60 -2.62 -0.10 0.00 -1.02 0.00 0.00 39.78 36.64 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 -6.74 0.48 0.44 3.52 -2.07 -1.26 -5.14 119.66 108.89 1l6i s GLN 58 Ca 0.16 -0.58 -0.25 0.00 -1.82 0.00 0.00 55.36 52.87 1l6i s GLN 58 Cb -0.07 0.19 -0.09 0.00 -1.09 0.00 0.00 33.01 31.95 1l6i s GLN 58 CO 0.92 -0.11 1.32 0.54 -1.32 0.00 0.00 175.29 176.64 1l6i n ARG 59 N 1.23 1.99 -2.78 9.60 1.74 -1.26 -4.96 116.66 122.22 1l6i n ARG 59 Ca -0.22 0.71 -0.40 0.00 -0.77 0.00 0.00 57.85 57.17 1l6i n ARG 59 Cb 0.56 -2.46 -0.05 0.00 -1.02 0.00 0.00 32.46 29.49 1l6i n ARG 59 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1l6i s HIS 60 N -1.21 3.88 -0.16 -1.55 5.65 -0.26 -4.81 115.29 116.83 1l6i s HIS 60 Ca 0.62 1.80 -0.13 0.00 0.25 0.00 0.00 55.06 57.60 1l6i s HIS 60 Cb -0.48 -2.98 -0.05 0.00 -1.18 0.00 0.00 32.58 27.88 1l6i s HIS 60 CO 0.57 0.33 0.26 0.08 -0.65 0.00 0.00 174.74 175.33 1l6i s VAL 61 N -0.53 5.32 -0.30 0.89 1.01 -0.46 -1.81 120.40 124.52 1l6i s VAL 61 Ca 0.43 0.48 -0.03 0.00 0.00 0.00 0.00 61.98 62.86 1l6i s VAL 61 Cb -0.24 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.58 1l6i s VAL 61 CO 0.30 0.41 0.02 0.20 0.00 0.00 0.00 175.10 176.03 1l6i s ASN 62 N 0.36 4.92 -0.39 3.32 0.01 -0.18 -0.78 114.94 122.20 1l6i s ASN 62 Ca 0.15 -1.11 -0.15 0.00 -0.71 0.00 0.00 52.86 51.04 1l6i s ASN 62 Cb -0.13 -1.76 0.01 0.00 0.41 0.00 0.00 41.25 39.78 1l6i s ASN 62 CO 0.03 -0.25 0.32 -0.47 -1.51 0.00 0.00 177.10 175.23 1l6i s TYR 63 N 1.33 3.22 -0.29 2.20 5.04 -0.13 -1.53 117.35 127.19 1l6i s TYR 63 Ca -0.03 -0.40 -0.11 0.00 -2.44 0.00 0.00 57.07 54.09 1l6i s TYR 63 Cb -0.19 -2.64 -0.04 0.00 0.35 0.00 0.00 41.96 39.44 1l6i s TYR 63 CO -0.00 -0.54 0.19 0.42 -1.34 0.00 0.00 175.55 174.27 1l6i s ILE 64 N 1.82 5.24 -0.03 3.14 1.01 -0.71 -1.18 121.20 130.49 1l6i s ILE 64 Ca 0.07 0.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.76 1l6i s ILE 64 Cb -0.18 -3.52 0.01 0.00 0.01 0.00 0.00 42.46 38.78 1l6i s ILE 64 CO 0.11 0.22 0.16 -0.55 0.00 0.00 0.00 174.94 174.88 1l6i s SER 65 N 1.75 -0.08 0.39 3.58 0.15 -1.02 -2.68 113.70 115.79 1l6i s SER 65 Ca 0.07 0.06 0.15 0.00 0.70 0.00 0.00 55.95 56.94 1l6i s SER 65 Cb -0.16 0.28 0.80 0.00 -1.71 0.00 0.00 66.02 65.23 1l6i s SER 65 CO 0.10 -0.22 1.84 0.24 1.20 0.00 0.00 173.24 176.40 1l6i h MET 66 N 5.03 0.00 -5.70 5.44 2.86 -1.86 -3.38 114.93 117.32 1l6i h MET 66 Ca -0.28 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 56.84 1l6i h MET 66 Cb 1.20 0.00 -0.26 0.00 0.06 0.00 0.00 31.60 32.60 1l6i h MET 66 CO 0.40 0.35 -0.82 -1.83 1.06 0.00 0.00 176.91 176.07 1l6i s GLU 67 N -4.10 1.18 -0.30 1.72 -1.05 -1.26 -4.42 118.70 110.47 1l6i s GLU 67 Ca -0.02 -0.83 -0.03 0.00 -0.15 0.00 0.00 54.97 53.94 1l6i s GLU 67 Cb 0.14 -1.24 0.10 0.00 -0.44 0.00 0.00 34.13 32.69 1l6i s GLU 67 CO 0.70 0.31 0.12 -0.06 0.95 0.00 0.00 175.26 177.29 1l6i s PHE 68 N -0.79 0.87 -1.01 4.83 0.08 -0.49 -4.23 117.98 117.25 1l6i s PHE 68 Ca 0.05 -1.24 -0.14 0.00 0.12 0.00 0.00 56.93 55.72 1l6i s PHE 68 Cb -0.08 -1.22 0.20 0.00 -0.57 0.00 0.00 43.02 41.35 1l6i s PHE 68 CO 0.01 -0.85 1.09 -1.17 -0.10 0.00 0.00 175.22 174.21 1l6i s LEU 69 N 1.87 5.83 0.28 -0.37 2.96 0.29 -3.71 118.68 125.84 1l6i s LEU 69 Ca 0.10 -2.81 0.23 0.00 -0.22 0.00 0.00 54.13 51.43 1l6i s LEU 69 Cb -0.17 -2.30 0.16 0.00 0.50 0.00 0.00 46.19 44.38 1l6i s LEU 69 CO -0.31 -0.67 1.27 0.16 -1.32 0.00 0.00 176.35 175.48 1l6i h ILE 70 N 4.76 0.00 -1.56 6.68 3.07 -1.85 -3.41 117.51 125.21 1l6i h ILE 70 Ca 0.19 -0.95 0.18 0.00 1.55 0.00 0.00 64.86 65.82 1l6i h ILE 70 Cb 0.96 1.64 -0.04 0.00 -0.27 0.00 0.00 36.82 39.10 1l6i h ILE 70 CO 1.02 0.00 -0.23 0.61 -1.05 0.00 0.00 178.15 178.49 1l6i n GLY 71 N 1.17 -2.02 3.76 0.16 0.00 -1.26 -4.79 105.19 102.20 1l6i n GLY 71 Ca 0.02 -1.33 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 1l6i n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l6i n ARG 72 N -2.46 2.20 -0.04 1.61 1.74 -1.26 -4.47 116.66 113.98 1l6i n ARG 72 Ca 0.00 0.78 -0.00 0.00 -0.77 0.00 0.00 57.85 57.87 1l6i n ARG 72 Cb 0.30 -2.62 -0.10 0.00 -1.02 0.00 0.00 32.46 29.02 1l6i n ARG 72 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1l6i n LEU 73 N -0.22 0.00 -0.09 0.55 4.32 -1.26 -4.54 117.00 115.76 1l6i n LEU 73 Ca 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.95 1l6i n LEU 73 Cb 0.41 0.17 -0.03 0.00 -1.62 0.00 0.00 43.42 42.35 1l6i n LEU 73 CO 0.59 0.17 0.87 0.74 -1.22 0.00 0.00 177.39 178.54 1l6i h THR 74 N 0.00 1.19 -0.57 -5.08 2.02 -1.95 0.06 112.91 108.58 1l6i h THR 74 Ca -0.18 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.34 1l6i h THR 74 Cb 1.24 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 1l6i h THR 74 CO 0.01 0.19 0.06 1.23 0.37 0.00 0.00 175.52 177.38 1l6i h GLY 75 N 0.30 1.04 0.97 2.16 0.00 -1.94 -2.47 103.07 103.12 1l6i h GLY 75 Ca 0.09 -0.72 0.01 0.00 0.00 0.00 0.00 47.33 46.71 1l6i h GLY 75 CO -0.01 0.67 0.37 -0.57 0.00 0.00 0.00 176.54 177.01 1l6i h ASN 76 N 0.85 0.64 -0.64 0.19 -1.24 -1.74 0.34 115.58 113.98 1l6i h ASN 76 Ca 0.17 -0.01 -0.05 0.00 0.71 0.00 0.00 56.30 57.12 1l6i h ASN 76 Cb 0.47 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.34 1l6i h ASN 76 CO 0.02 0.46 0.21 0.78 -1.29 0.00 0.00 177.43 177.61 1l6i h ASN 77 N 0.76 0.92 0.05 1.15 2.35 -0.93 0.17 115.58 120.05 1l6i h ASN 77 Ca 0.22 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1l6i h ASN 77 Cb -0.06 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.07 1l6i h ASN 77 CO -0.06 0.88 -0.02 -0.07 -1.65 0.00 0.00 177.43 176.50 1l6i h LEU 78 N 0.92 -0.05 -0.43 1.61 3.38 -1.12 -1.58 115.31 118.03 1l6i h LEU 78 Ca 0.21 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.22 1l6i h LEU 78 Cb 0.28 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1l6i h LEU 78 CO -0.01 -0.03 0.16 0.25 0.09 0.00 0.00 178.44 178.90 1l6i h LEU 79 N -0.07 0.18 -1.21 1.67 6.46 -0.70 -1.09 115.31 120.55 1l6i h LEU 79 Ca -0.01 0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 57.74 1l6i h LEU 79 Cb 0.06 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 1l6i h LEU 79 CO 0.01 0.14 -0.07 0.78 -0.62 0.00 0.00 178.44 178.68 1l6i h ASN 80 N 0.33 0.44 1.12 1.25 4.21 -0.40 -2.36 115.58 120.17 1l6i h ASN 80 Ca 0.20 -0.09 -0.04 0.00 1.21 0.00 0.00 56.30 57.58 1l6i h ASN 80 Cb 0.18 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.26 1l6i h ASN 80 CO -0.20 0.56 -0.17 -0.07 -1.29 0.00 0.00 177.43 176.26 1l6i h LEU 81 N 0.43 0.00 -0.16 1.61 3.38 -1.07 0.21 115.31 119.71 1l6i h LEU 81 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1l6i h LEU 81 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1l6i h LEU 81 CO 0.02 0.17 0.00 0.61 0.09 0.00 0.00 178.44 179.33 1l6i n GLY 82 N 0.33 0.72 0.04 0.83 0.00 -0.58 -4.63 105.19 101.90 1l6i n GLY 82 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 -3.20 0.00 0.08 1.61 7.02 -0.52 -4.79 117.44 117.65 1l6i n TRP 83 Ca 0.00 -0.04 -0.12 0.00 -1.02 0.00 0.00 57.50 56.32 1l6i n TRP 83 Cb 0.41 -0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.25 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 0.18 -0.47 -0.55 -5.99 5.03 -1.89 -0.90 116.97 112.38 1l6i h TYR 84 Ca 0.00 0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.22 1l6i h TYR 84 Cb 0.08 0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.54 1l6i h TYR 84 CO 0.00 -0.26 -0.05 0.37 -1.32 0.00 0.00 178.16 176.90 1l6i h GLN 85 N -0.32 0.99 0.66 1.82 5.75 -1.93 0.12 115.11 122.19 1l6i h GLN 85 Ca 0.04 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.18 1l6i h GLN 85 Cb 0.37 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.83 1l6i h GLN 85 CO -0.13 1.00 -0.34 -0.44 -2.65 0.00 0.00 178.83 176.26 1l6i h ASP 86 N 0.89 -0.83 -0.85 -0.69 3.32 -1.85 0.61 116.42 117.03 1l6i h ASP 86 Ca 0.15 0.04 0.10 0.00 0.02 0.00 0.00 57.03 57.34 1l6i h ASP 86 Cb 0.59 0.22 -0.07 0.00 0.22 0.00 0.00 39.33 40.29 1l6i h ASP 86 CO 0.04 -0.57 0.49 0.58 -1.72 0.00 0.00 179.24 178.06 1l6i h VAL 87 N -0.92 0.91 -0.93 -1.35 2.07 -1.15 0.76 116.25 115.64 1l6i h VAL 87 Ca -0.09 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1l6i h VAL 87 Cb 0.72 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1l6i h VAL 87 CO 0.13 0.15 0.56 -0.61 0.02 0.00 0.00 177.57 177.82 1l6i h GLN 88 N 0.82 1.25 -0.37 1.57 4.15 0.38 -2.17 115.11 120.74 1l6i h GLN 88 Ca 0.41 -0.11 -0.09 0.00 0.77 0.00 0.00 58.65 59.63 1l6i h GLN 88 Cb 0.38 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1l6i h GLN 88 CO -0.25 0.87 -0.14 -0.44 -1.93 0.00 0.00 178.83 176.95 1l6i h ASP 89 N 1.28 0.76 -0.05 -0.69 3.32 0.22 -3.03 116.42 118.22 1l6i h ASP 89 Ca 0.33 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 57.01 1l6i h ASP 89 Cb -0.06 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.28 1l6i h ASP 89 CO -0.06 0.98 0.04 0.28 -1.72 0.00 0.00 179.24 178.75 1l6i h SER 90 N 0.54 0.01 1.85 6.45 0.02 0.89 -2.74 113.55 120.57 1l6i h SER 90 Ca 0.09 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1l6i h SER 90 Cb 0.67 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1l6i h SER 90 CO 0.05 0.01 -0.00 -0.07 -1.14 0.00 0.00 176.83 175.67 1l6i h LEU 91 N 0.01 0.00 -0.67 5.07 3.38 -1.29 -3.21 115.31 118.61 1l6i h LEU 91 Ca 0.02 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1l6i h LEU 91 Cb 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1l6i h LEU 91 CO -0.00 0.00 0.44 0.07 0.09 0.00 0.00 178.44 179.04 1l6i h LYS 92 N 0.00 0.87 0.00 1.13 2.10 -1.43 0.24 116.57 119.49 1l6i h LYS 92 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1l6i h LYS 92 Cb 0.93 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.06 1l6i h LYS 92 CO 0.00 0.58 0.12 0.00 -2.00 0.00 0.00 179.45 178.15 1l6i n ALA 93 N -2.28 0.76 0.01 0.07 0.00 -1.21 -0.27 120.51 117.59 1l6i n ALA 93 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.52 1l6i n ALA 93 Cb 0.02 -0.74 0.04 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.34 0.12 -2.46 0.00 4.01 0.74 -4.97 117.16 113.26 1l6i n TYR 94 Ca 0.00 -0.34 -0.17 0.00 -0.16 0.00 0.00 57.90 57.23 1l6i n TYR 94 Cb 0.12 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.01 -5.12 -4.63 7.72 8.00 0.63 -4.98 116.55 118.16 1l6i n ASP 95 Ca 0.04 -0.07 -0.34 0.00 0.71 0.00 0.00 54.79 55.12 1l6i n ASP 95 Cb 0.25 -4.15 -0.10 0.00 -0.02 0.00 0.00 41.12 37.10 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 -2.91 4.73 -0.34 0.53 -1.09 -0.60 -5.01 121.20 116.51 1l6i s ILE 96 Ca 0.06 -0.06 -0.16 0.00 -2.23 0.00 0.00 60.65 58.27 1l6i s ILE 96 Cb -0.03 -3.13 -0.01 0.00 -1.58 0.00 0.00 42.46 37.72 1l6i s ILE 96 CO 0.08 0.47 0.40 0.21 -1.23 0.00 0.00 174.94 174.86 1l6i s ASN 97 N 0.34 6.21 0.20 3.58 2.47 -1.26 -4.14 114.94 122.35 1l6i s ASN 97 Ca 0.03 -0.18 -0.10 0.00 0.42 0.00 0.00 52.86 53.03 1l6i s ASN 97 Cb -0.12 -2.21 0.25 0.00 -1.45 0.00 0.00 41.25 37.71 1l6i s ASN 97 CO 0.00 -0.37 1.76 0.25 -3.72 0.00 0.00 177.10 175.02 1l6i h LEU 98 N 8.83 0.31 -0.88 3.21 5.85 -1.95 -2.02 115.31 128.66 1l6i h LEU 98 Ca -0.29 0.06 0.13 0.00 0.84 0.00 0.00 57.88 58.62 1l6i h LEU 98 Cb 1.14 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.10 1l6i h LEU 98 CO 0.71 0.19 0.49 0.74 -0.34 0.00 0.00 178.44 180.24 1l6i h THR 99 N 0.47 0.82 -0.08 1.05 2.02 -1.99 0.38 112.91 115.58 1l6i h THR 99 Ca 0.29 -0.26 -0.23 0.00 0.77 0.00 0.00 66.41 66.98 1l6i h THR 99 Cb 0.31 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1l6i h THR 99 CO -0.26 0.14 -0.87 0.44 0.37 0.00 0.00 175.52 175.34 1l6i h ASP 100 N 0.75 0.81 -0.94 4.18 3.32 -1.82 -3.07 116.42 119.65 1l6i h ASP 100 Ca 0.46 -0.58 0.10 0.00 0.02 0.00 0.00 57.03 57.03 1l6i h ASP 100 Cb 0.55 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.78 1l6i h ASP 100 CO -0.31 1.37 0.58 0.25 -1.72 0.00 0.00 179.24 179.40 1l6i h LEU 101 N 0.42 0.86 -1.83 1.55 5.85 -0.50 -2.63 115.31 119.03 1l6i h LEU 101 Ca -0.07 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1l6i h LEU 101 Cb 1.49 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 1l6i h LEU 101 CO 0.17 0.49 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.64 1l6i h LEU 102 N 0.96 0.04 -0.22 2.25 3.38 -0.88 -2.04 115.31 118.80 1l6i h LEU 102 Ca 0.45 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1l6i h LEU 102 Cb 0.37 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1l6i h LEU 102 CO -0.24 0.10 0.00 -0.62 0.09 0.00 0.00 178.44 177.77 1l6i n GLU 103 N -4.45 0.08 0.25 1.13 -0.58 -0.99 -2.83 120.64 113.24 1l6i n GLU 103 Ca -0.02 0.27 0.10 0.00 -0.42 0.00 0.00 57.16 57.09 1l6i n GLU 103 Cb 0.15 -1.64 0.63 0.00 -0.57 0.00 0.00 31.44 30.01 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 -6.42 3.49 4.39 -1.45 -3.45 114.58 111.15 1l6i h GLU 104 Ca 0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.16 1l6i h GLU 104 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1l6i h GLU 104 CO 0.00 0.16 0.80 -2.00 -1.16 0.00 0.00 179.01 176.81 1l6i s GLU 105 N -4.27 4.30 -0.23 2.33 2.12 -1.13 -5.01 118.70 116.80 1l6i s GLU 105 Ca -0.03 1.98 -0.24 0.00 0.36 0.00 0.00 54.97 57.04 1l6i s GLU 105 Cb 0.14 -3.49 -0.01 0.00 0.26 0.00 0.00 34.13 31.03 1l6i s GLU 105 CO 0.62 -0.53 0.80 0.42 -0.54 0.00 0.00 175.26 176.03 1l6i s ILE 106 N 2.05 4.87 0.15 -3.70 1.01 -1.26 -4.95 121.20 119.37 1l6i s ILE 106 Ca 0.64 1.51 -0.33 0.00 0.00 0.00 0.00 60.65 62.47 1l6i s ILE 106 Cb -0.33 -4.09 -0.16 0.00 0.01 0.00 0.00 42.46 37.89 1l6i s ILE 106 CO 0.28 -0.04 1.09 0.47 0.00 0.00 0.00 174.94 176.74 1l6i n ASP 107 N 5.80 0.91 -4.66 3.58 9.92 -1.26 -4.83 116.55 126.02 1l6i n ASP 107 Ca 0.04 1.14 -0.46 0.00 -0.53 0.00 0.00 54.79 54.98 1l6i n ASP 107 Cb 0.48 -1.15 -0.04 0.00 -0.64 0.00 0.00 41.12 39.77 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 1.65 1.95 -3.08 -0.24 -0.02 -1.26 -4.85 135.00 129.15 1l6i n PRO 108 Ca 0.16 0.70 -0.44 0.00 -2.02 0.00 0.00 63.50 61.90 1l6i n PRO 108 Cb 0.22 -2.40 -0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1l6i n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l6i s ALA 109 N 0.45 4.16 0.00 3.55 0.00 -1.26 -4.54 121.76 124.12 1l6i s ALA 109 Ca 0.75 -3.45 0.00 0.00 0.00 0.00 0.00 51.96 49.27 1l6i s ALA 109 Cb -0.71 -3.93 0.00 0.00 0.00 0.00 0.00 23.12 18.49 1l6i s ALA 109 CO 0.44 -2.60 0.50 1.28 0.00 0.00 0.00 175.76 175.37 1l6i n LEU 110 N 4.80 0.98 -4.12 0.00 4.77 -1.26 -2.91 117.00 119.26 1l6i n LEU 110 Ca 0.31 -0.98 -0.13 0.00 -0.03 0.00 0.00 56.01 55.18 1l6i n LEU 110 Cb 0.43 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 1l6i n LEU 110 CO 0.55 0.24 0.00 -0.83 -1.33 0.00 0.00 177.39 176.03 1l6i s GLY 111 N -0.10 1.30 0.00 -0.72 0.00 -1.24 -1.40 107.32 105.16 1l6i s GLY 111 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.26 1l6i s GLY 111 CO 0.00 -1.07 0.00 -2.01 0.00 0.00 0.00 173.10 170.02 1l6i n ASN 112 N -0.78 0.00 0.00 1.64 2.85 -1.26 -4.55 115.26 113.16 1l6i n ASN 112 Ca 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 1l6i n ASN 112 Cb 0.63 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.65 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 3.36 5.02 0.30 8.20 0.00 -1.26 -4.98 105.19 115.83 1l6i n GLY 113 Ca 0.00 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.41 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 1.33 1.04 -0.02 0.00 -2.02 -0.89 103.07 102.52 1l6i h GLY 114 Ca 0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 47.33 47.05 1l6i h GLY 114 CO 0.00 -0.19 -0.30 -2.00 0.00 0.00 0.00 176.54 174.05 1l6i h LEU 115 N 0.40 0.87 -0.65 3.11 5.85 -1.96 0.17 115.31 123.11 1l6i h LEU 115 Ca 0.49 -0.45 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 1l6i h LEU 115 Cb 0.86 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1l6i h LEU 115 CO -0.49 1.14 -0.55 1.23 -0.34 0.00 0.00 178.44 179.44 1l6i h GLY 116 N 0.61 0.40 2.00 3.75 0.00 -1.51 -2.39 103.07 105.93 1l6i h GLY 116 Ca 0.06 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1l6i h GLY 116 CO 0.08 0.42 -0.26 -0.09 0.00 0.00 0.00 176.54 176.68 1l6i h ARG 117 N 0.28 0.00 -0.01 4.80 9.65 -1.04 0.90 114.38 128.96 1l6i h ARG 117 Ca 0.00 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.85 1l6i h ARG 117 Cb 1.05 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.63 1l6i h ARG 117 CO 0.09 0.26 -0.13 1.25 2.80 0.00 0.00 179.97 184.24 1l6i h LEU 118 N 0.00 0.13 -0.95 3.80 5.85 -0.80 -1.87 115.31 121.48 1l6i h LEU 118 Ca -0.00 -0.73 0.13 0.00 0.84 0.00 0.00 57.88 58.12 1l6i h LEU 118 Cb 0.72 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.62 1l6i h LEU 118 CO 0.03 0.85 0.57 0.00 -0.34 0.00 0.00 178.44 179.55 1l6i h ALA 119 N 0.29 1.44 -0.39 1.25 0.00 -1.48 1.13 119.26 121.50 1l6i h ALA 119 Ca -0.01 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1l6i h ALA 119 Cb 0.86 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1l6i h ALA 119 CO 0.03 0.10 -0.31 0.00 0.00 0.00 0.00 179.25 179.07 1l6i h ALA 120 N 1.55 0.71 -0.30 0.00 0.00 -1.47 -0.46 119.26 119.28 1l6i h ALA 120 Ca 0.49 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1l6i h ALA 120 Cb 0.57 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1l6i h ALA 120 CO -0.30 0.66 -0.27 0.00 0.00 0.00 0.00 179.25 179.34 1l6i h PHE 122 N 0.46 0.61 -0.29 0.00 -1.00 0.13 0.66 116.94 117.51 1l6i h PHE 122 Ca 0.05 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.89 1l6i h PHE 122 Cb 0.84 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 40.17 1l6i h PHE 122 CO 0.07 0.31 0.08 -0.07 -1.61 0.00 0.00 178.31 177.09 1l6i h LEU 123 N 0.63 0.06 -0.79 1.54 3.38 -0.94 -0.43 115.31 118.76 1l6i h LEU 123 Ca 0.25 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.30 1l6i h LEU 123 Cb 0.11 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1l6i h LEU 123 CO -0.15 0.07 0.50 -0.78 0.09 0.00 0.00 178.44 178.18 1l6i h ASP 124 N 0.20 0.83 -0.59 -0.43 1.82 -0.71 -2.35 116.42 115.18 1l6i h ASP 124 Ca 0.13 -0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.69 1l6i h ASP 124 Cb 0.12 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.93 1l6i h ASP 124 CO -0.16 0.57 0.05 0.28 -1.61 0.00 0.00 179.24 178.37 1l6i h SER 125 N 0.98 0.98 -0.19 2.28 0.02 -0.68 -2.46 113.55 114.47 1l6i h SER 125 Ca 0.32 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 1l6i h SER 125 Cb 0.03 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 1l6i h SER 125 CO -0.12 1.02 -0.06 0.24 -1.14 0.00 0.00 176.83 176.77 1l6i h MET 126 N 0.91 0.51 -0.42 3.45 2.86 -0.96 0.90 114.93 122.18 1l6i h MET 126 Ca 0.17 -0.13 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 1l6i h MET 126 Cb 0.49 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 1l6i h MET 126 CO 0.02 0.58 -0.11 0.00 1.06 0.00 0.00 176.91 178.46 1l6i h ALA 127 N 1.46 0.58 -0.40 6.32 0.00 -1.38 -0.34 119.26 125.49 1l6i h ALA 127 Ca 0.10 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1l6i h ALA 127 Cb 0.40 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1l6i h ALA 127 CO 0.02 0.47 -0.09 1.15 0.00 0.00 0.00 179.25 180.80 1l6i h THR 128 N 0.64 1.25 -0.53 0.00 2.02 -1.12 -2.71 112.91 112.47 1l6i h THR 128 Ca 0.10 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.20 1l6i h THR 128 Cb 0.65 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1l6i h THR 128 CO 0.04 0.37 0.00 1.33 0.37 0.00 0.00 175.52 177.63 1l6i n VAL 129 N -4.19 0.70 -1.55 3.16 0.24 0.28 -4.77 118.33 112.21 1l6i n VAL 129 Ca 0.01 -0.75 -0.08 0.00 -2.04 0.00 0.00 64.34 61.49 1l6i n VAL 129 Cb 0.34 0.48 -0.02 0.00 -1.47 0.00 0.00 33.84 33.16 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 1.43 0.65 3.49 7.63 0.00 -0.79 -4.76 105.19 112.84 1l6i n GLY 130 Ca 0.19 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.27 3.23 -0.32 1.61 2.00 -0.21 -0.14 119.66 122.56 1l6i s GLN 131 Ca 0.00 -0.50 -0.41 0.00 -2.00 0.00 0.00 55.36 52.45 1l6i s GLN 131 Cb 0.00 -4.13 -0.16 0.00 0.80 0.00 0.00 33.01 29.52 1l6i s GLN 131 CO 0.00 -1.65 1.79 0.45 -0.50 0.00 0.00 175.29 175.38 1l6i n SER 132 N 7.65 2.16 -3.76 6.67 2.88 -1.26 -4.54 113.62 123.42 1l6i n SER 132 Ca -0.01 1.02 -0.11 0.00 -1.33 0.00 0.00 58.87 58.44 1l6i n SER 132 Cb 0.47 -1.11 -0.07 0.00 -0.75 0.00 0.00 64.21 62.75 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 3.93 -0.61 -0.06 -1.46 0.00 -1.26 -1.36 121.76 120.94 1l6i s ALA 133 Ca 1.01 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 1l6i s ALA 133 Cb -1.12 0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.43 1l6i s ALA 133 CO 0.66 -0.46 -0.03 0.99 0.00 0.00 0.00 175.76 176.92 1l6i s THR 134 N -3.01 0.52 0.12 0.00 2.01 0.04 -4.50 115.64 110.82 1l6i s THR 134 Ca -0.02 -0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.65 1l6i s THR 134 Cb 0.01 -0.60 -0.06 0.00 0.01 0.00 0.00 72.50 71.86 1l6i s THR 134 CO -0.06 0.25 0.97 -0.83 -0.69 0.00 0.00 174.62 174.26 1l6i s GLY 135 N 1.44 3.00 -0.26 4.40 0.00 -1.03 -0.96 107.32 113.92 1l6i s GLY 135 Ca -0.03 0.60 0.01 0.00 0.00 0.00 0.00 44.72 45.30 1l6i s GLY 135 CO -0.03 1.46 -0.02 -0.19 0.00 0.00 0.00 173.10 174.32 1l6i s TYR 136 N -0.06 2.53 0.00 1.90 2.02 -0.32 -0.28 117.35 123.14 1l6i s TYR 136 Ca 0.47 -1.95 0.00 0.00 -0.37 0.00 0.00 57.07 55.22 1l6i s TYR 136 Cb -0.24 -1.79 0.00 0.00 -0.40 0.00 0.00 41.96 39.53 1l6i s TYR 136 CO 0.30 -0.81 0.00 0.41 -1.57 0.00 0.00 175.55 173.88 1l6i n GLY 137 N 4.63 4.98 3.42 0.71 0.00 -0.97 -2.45 105.19 115.51 1l6i n GLY 137 Ca -0.09 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.67 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 2.48 -1.32 0.99 1.43 -1.26 -1.49 118.68 119.50 1l6i s LEU 138 Ca 0.00 -0.35 -0.12 0.00 -1.03 0.00 0.00 54.13 52.63 1l6i s LEU 138 Cb 0.00 -1.47 0.12 0.00 0.03 0.00 0.00 46.19 44.87 1l6i s LEU 138 CO 0.00 0.31 1.90 -3.20 0.23 0.00 0.00 176.35 175.60 1l6i n ASN 139 N 2.14 4.75 -4.67 2.29 4.05 0.34 -4.63 115.26 119.54 1l6i n ASN 139 Ca -0.17 -3.00 -0.46 0.00 0.45 0.00 0.00 54.58 51.40 1l6i n ASN 139 Cb 0.52 -1.57 -0.04 0.00 1.23 0.00 0.00 39.78 39.92 1l6i n ASN 139 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 1l6i n TYR 140 N 5.13 2.28 0.06 1.20 4.01 -1.26 -4.85 117.16 123.73 1l6i n TYR 140 Ca 0.44 0.22 -0.08 0.00 -0.16 0.00 0.00 57.90 58.32 1l6i n TYR 140 Cb 0.39 -2.56 0.07 0.00 -0.31 0.00 0.00 39.34 36.92 1l6i n TYR 140 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1l6i h GLN 141 N 6.47 0.34 0.00 -0.72 4.15 -0.88 -3.32 115.11 121.14 1l6i h GLN 141 Ca -0.46 -0.25 -0.02 0.00 0.77 0.00 0.00 58.65 58.69 1l6i h GLN 141 Cb 1.26 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.96 1l6i h GLN 141 CO 0.90 0.88 -0.35 0.66 -1.93 0.00 0.00 178.83 178.99 1l6i n TYR 142 N -3.85 0.00 -2.43 3.99 4.01 0.16 -4.11 117.16 114.94 1l6i n TYR 142 Ca -0.03 -0.59 0.00 0.00 -0.16 0.00 0.00 57.90 57.12 1l6i n TYR 142 Cb 0.67 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 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 -0.63 1.48 0.03 2.72 0.00 -1.15 -2.35 105.19 105.30 1l6i n GLY 143 Ca 0.09 -0.47 -0.01 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.03 -7.00 0.99 5.85 -1.80 0.26 115.31 113.58 1l6i h LEU 144 Ca 0.00 0.00 0.26 0.00 0.84 0.00 0.00 57.88 58.98 1l6i h LEU 144 Cb 0.00 0.01 -0.24 0.00 0.37 0.00 0.00 40.66 40.80 1l6i h LEU 144 CO 0.00 0.17 0.92 0.72 -0.34 0.00 0.00 178.44 179.90 1l6i s PHE 145 N -1.42 -0.06 -0.14 1.25 -0.71 -1.26 -4.72 117.98 110.92 1l6i s PHE 145 Ca -0.01 0.08 -0.22 0.00 -1.04 0.00 0.00 56.93 55.74 1l6i s PHE 145 Cb 0.00 0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 1l6i s PHE 145 CO 0.02 -0.07 0.68 0.50 -1.34 0.00 0.00 175.22 175.00 1l6i s ARG 146 N -1.49 4.32 -0.17 1.99 3.52 0.21 -4.75 118.95 122.58 1l6i s ARG 146 Ca 0.09 0.77 -0.12 0.00 -0.13 0.00 0.00 55.73 56.34 1l6i s ARG 146 Cb -0.01 -3.52 -0.05 0.00 -1.56 0.00 0.00 34.95 29.81 1l6i s ARG 146 CO -0.05 -0.12 0.22 -1.14 -0.81 0.00 0.00 175.30 173.40 1l6i s GLN 147 N 1.46 4.19 0.29 5.12 0.74 -1.26 -1.69 119.66 128.52 1l6i s GLN 147 Ca 0.33 -0.03 0.03 0.00 0.05 0.00 0.00 55.36 55.74 1l6i s GLN 147 Cb -0.17 -3.41 -0.06 0.00 1.10 0.00 0.00 33.01 30.48 1l6i s GLN 147 CO 0.13 0.30 0.08 -1.54 -0.55 0.00 0.00 175.29 173.71 1l6i s SER 148 N 0.33 1.83 -0.09 6.67 1.04 -0.89 -3.65 113.70 118.94 1l6i s SER 148 Ca 0.13 -1.38 0.05 0.00 0.48 0.00 0.00 55.95 55.23 1l6i s SER 148 Cb -0.12 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.03 1l6i s SER 148 CO 0.02 -0.67 -0.24 -0.36 0.98 0.00 0.00 173.24 172.97 1l6i s PHE 149 N -3.51 2.52 -0.10 5.02 0.08 -1.26 -0.31 117.98 120.42 1l6i s PHE 149 Ca 0.37 -0.94 0.01 0.00 0.12 0.00 0.00 56.93 56.50 1l6i s PHE 149 Cb 0.08 -1.67 0.02 0.00 -0.57 0.00 0.00 43.02 40.88 1l6i s PHE 149 CO 0.15 -0.35 -0.13 0.08 -0.10 0.00 0.00 175.22 174.86 1l6i s VAL 150 N 0.17 1.32 -1.51 -0.44 1.01 0.01 -4.68 120.40 116.28 1l6i s VAL 150 Ca -0.14 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 1l6i s VAL 150 Cb -0.17 -1.23 0.11 0.00 0.00 0.00 0.00 36.38 35.09 1l6i s VAL 150 CO 0.07 0.41 0.73 0.47 0.00 0.00 0.00 175.10 176.78 1l6i n ASP 151 N 4.24 -3.87 0.00 3.32 8.00 -1.26 -1.94 116.55 125.04 1l6i n ASP 151 Ca -0.19 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.59 1l6i n ASP 151 Cb 0.51 -3.15 0.00 0.00 -0.02 0.00 0.00 41.12 38.46 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 -1.38 0.63 3.69 0.44 0.00 -1.26 -5.01 105.19 102.30 1l6i n GLY 152 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.18 2.56 0.04 1.61 1.02 -0.82 -3.96 119.74 120.02 1l6i s LYS 153 Ca 0.00 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.86 1l6i s LYS 153 Cb 0.00 -2.55 -0.07 0.00 -0.52 0.00 0.00 37.83 34.69 1l6i s LYS 153 CO 0.00 0.54 1.64 -1.14 -0.92 0.00 0.00 175.35 175.47 1l6i s GLN 154 N -2.29 4.20 -0.12 1.68 0.74 -1.26 -0.81 119.66 121.80 1l6i s GLN 154 Ca 0.26 2.28 -0.03 0.00 0.05 0.00 0.00 55.36 57.91 1l6i s GLN 154 Cb -0.12 -3.69 -0.03 0.00 1.10 0.00 0.00 33.01 30.27 1l6i s GLN 154 CO 0.18 -0.75 0.01 0.08 -0.55 0.00 0.00 175.29 174.27 1l6i s VAL 155 N 2.95 4.38 -0.20 1.34 1.01 0.58 -4.88 120.40 125.58 1l6i s VAL 155 Ca 0.73 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 1l6i s VAL 155 Cb -0.38 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1l6i s VAL 155 CO 0.31 0.56 0.08 -1.61 0.00 0.00 0.00 175.10 174.44 1l6i s GLU 156 N -0.42 3.97 0.19 2.72 8.01 -1.26 -2.10 118.70 129.81 1l6i s GLU 156 Ca 0.08 -0.34 0.01 0.00 0.01 0.00 0.00 54.97 54.73 1l6i s GLU 156 Cb -0.12 -3.27 -0.05 0.00 -4.31 0.00 0.00 34.13 26.38 1l6i s GLU 156 CO 0.02 0.21 0.04 0.00 0.01 0.00 0.00 175.26 175.54 1l6i s ALA 157 N 0.56 1.39 0.39 5.21 0.00 -0.68 -4.95 121.76 123.68 1l6i s ALA 157 Ca 0.04 -1.66 -0.27 0.00 0.00 0.00 0.00 51.96 50.07 1l6i s ALA 157 Cb -0.13 0.75 -0.10 0.00 0.00 0.00 0.00 23.12 23.64 1l6i s ALA 157 CO 0.01 -0.38 1.39 -2.14 0.00 0.00 0.00 175.76 174.63 1l6i s PRO 158 N -3.97 4.06 -1.11 0.00 0.02 -1.26 0.63 135.00 133.37 1l6i s PRO 158 Ca 0.28 2.36 -0.08 0.00 0.02 0.00 0.00 61.00 63.58 1l6i s PRO 158 Cb 0.07 -2.89 0.28 0.00 0.02 0.00 0.00 34.50 31.98 1l6i s PRO 158 CO 0.07 -0.49 1.21 -3.47 -0.33 0.00 0.00 177.00 173.99 1l6i n ASP 159 N 0.34 5.72 -4.67 2.53 -0.08 -0.99 -4.20 116.55 115.20 1l6i n ASP 159 Ca 0.02 -3.12 -0.43 0.00 -1.51 0.00 0.00 54.79 49.75 1l6i n ASP 159 Cb 0.41 -1.36 -0.02 0.00 2.34 0.00 0.00 41.12 42.49 1l6i n ASP 159 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1l6i s ASP 160 N 0.64 7.03 -0.11 1.67 -1.08 -1.26 -3.97 116.67 119.61 1l6i s ASP 160 Ca 0.31 1.62 0.15 0.00 -0.52 0.00 0.00 52.55 54.12 1l6i s ASP 160 Cb -0.06 -2.54 0.24 0.00 -1.46 0.00 0.00 42.92 39.09 1l6i s ASP 160 CO -0.04 -0.67 1.12 -2.67 0.52 0.00 0.00 175.17 173.43 1l6i n TRP 161 N 6.09 0.00 -3.15 -5.34 4.27 -1.26 -4.94 117.44 113.11 1l6i n TRP 161 Ca 0.12 -0.90 -0.14 0.00 -3.89 0.00 0.00 57.50 52.70 1l6i n TRP 161 Cb 0.46 -0.13 0.07 0.00 -1.36 0.00 0.00 31.31 30.35 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 -1.25 -1.84 -0.09 -2.67 8.25 -1.26 -4.86 115.22 111.49 1l6i n HIS 162 Ca 0.13 0.77 -0.07 0.00 -0.26 0.00 0.00 57.72 58.28 1l6i n HIS 162 Cb 0.58 -4.46 0.00 0.00 1.12 0.00 0.00 29.99 27.22 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 -1.48 0.32 0.00 -0.41 2.43 -1.92 -2.00 114.38 111.31 1l6i h ARG 163 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1l6i h ARG 163 Cb 1.28 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1l6i h ARG 163 CO 0.41 0.21 0.01 0.66 -1.51 0.00 0.00 179.97 179.75 1l6i h SER 164 N 0.33 0.00 -0.28 -3.80 4.64 -1.97 -0.03 113.55 112.43 1l6i h SER 164 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 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 -0.10 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.45 1l6i n ASN 165 N -2.62 3.79 -4.69 4.97 3.02 -0.78 -5.01 115.26 113.94 1l6i n ASN 165 Ca -0.02 -2.86 -0.42 0.00 -0.03 0.00 0.00 54.58 51.25 1l6i n ASN 165 Cb 0.06 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 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 -2.54 3.04 -0.38 3.10 5.04 -0.03 -4.89 117.35 120.69 1l6i s TYR 166 Ca 0.40 0.97 0.27 0.00 -2.44 0.00 0.00 57.07 56.26 1l6i s TYR 166 Cb 0.31 -3.59 0.99 0.00 0.35 0.00 0.00 41.96 40.02 1l6i s TYR 166 CO 0.10 -2.09 1.78 -1.00 -1.34 0.00 0.00 175.55 173.00 1l6i h PRO 167 N 7.50 0.00 0.00 4.97 0.13 -1.92 -2.86 132.00 139.82 1l6i h PRO 167 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1l6i h PRO 167 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1l6i h PRO 167 CO 0.88 0.00 -0.14 0.91 -0.23 0.00 0.00 178.00 179.42 1l6i n TRP 168 N -2.53 0.50 -1.83 1.56 7.02 -1.26 -4.62 117.44 116.28 1l6i n TRP 168 Ca 0.03 0.14 -0.33 0.00 -1.02 0.00 0.00 57.50 56.31 1l6i n TRP 168 Cb 0.31 -0.70 0.04 0.00 -2.42 0.00 0.00 31.31 28.55 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 -3.07 2.59 0.00 -5.99 0.08 -1.08 -4.44 117.98 106.07 1l6i s PHE 169 Ca 0.11 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.71 1l6i s PHE 169 Cb 0.15 -3.22 -0.00 0.00 -0.57 0.00 0.00 43.02 39.38 1l6i s PHE 169 CO 0.60 -1.74 -0.01 0.50 -0.10 0.00 0.00 175.22 174.47 1l6i s ARG 170 N -3.93 0.09 -0.10 0.44 3.52 0.59 -4.97 118.95 114.59 1l6i s ARG 170 Ca 0.69 -0.15 -0.01 0.00 -0.13 0.00 0.00 55.73 56.12 1l6i s ARG 170 Cb -0.22 0.01 0.03 0.00 -1.56 0.00 0.00 34.95 33.21 1l6i s ARG 170 CO 0.39 -0.01 -0.02 -1.58 -0.81 0.00 0.00 175.30 173.27 1l6i s HIS 171 N -0.34 1.02 -0.37 5.12 5.65 -1.26 -0.16 115.29 124.95 1l6i s HIS 171 Ca -0.04 -0.48 -0.09 0.00 0.25 0.00 0.00 55.06 54.71 1l6i s HIS 171 Cb -0.02 -0.99 0.04 0.00 -1.18 0.00 0.00 32.58 30.43 1l6i s HIS 171 CO -0.00 -0.43 0.17 1.21 -0.65 0.00 0.00 174.74 175.03 1l6i s ASN 172 N 1.86 5.54 0.57 9.88 2.47 -1.25 -4.97 114.94 129.03 1l6i s ASN 172 Ca 0.04 -1.14 0.33 0.00 0.42 0.00 0.00 52.86 52.51 1l6i s ASN 172 Cb -0.13 -1.95 1.70 0.00 -1.45 0.00 0.00 41.25 39.42 1l6i s ASN 172 CO -0.07 -0.38 2.14 1.05 -3.72 0.00 0.00 177.10 176.12 1l6i h GLU 173 N 8.34 0.00 0.00 0.43 4.11 -1.99 -0.92 114.58 124.55 1l6i h GLU 173 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.19 1l6i h GLU 173 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1l6i h GLU 173 CO 0.65 0.06 0.00 0.00 0.07 0.00 0.00 179.01 179.79 1l6i n ALA 174 N -2.19 1.69 0.00 1.06 0.00 -1.26 -1.57 120.51 118.25 1l6i n ALA 174 Ca -0.02 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.47 1l6i n ALA 174 Cb 0.20 -1.27 0.27 0.00 0.00 0.00 0.00 19.45 18.66 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 -1.62 3.50 -4.72 0.00 4.77 -0.35 -4.93 117.00 113.66 1l6i n LEU 175 Ca 0.03 -1.76 -0.34 0.00 -0.03 0.00 0.00 56.01 53.92 1l6i n LEU 175 Cb 0.19 -0.45 0.10 0.00 -2.33 0.00 0.00 43.42 40.93 1l6i n LEU 175 CO 0.15 0.70 0.78 -1.81 -1.33 0.00 0.00 177.39 175.89 1l6i s ASP 176 N -0.89 4.00 -0.01 -1.43 1.01 -0.61 -4.56 116.67 114.19 1l6i s ASP 176 Ca 0.39 2.33 0.01 0.00 0.71 0.00 0.00 52.55 56.00 1l6i s ASP 176 Cb 0.23 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.58 1l6i s ASP 176 CO 0.22 -2.39 -0.04 0.54 0.21 0.00 0.00 175.17 173.71 1l6i s VAL 177 N -2.09 0.34 -0.12 -1.27 0.11 -0.96 -4.98 120.40 111.44 1l6i s VAL 177 Ca 0.73 -0.17 -0.15 0.00 -2.93 0.00 0.00 61.98 59.46 1l6i s VAL 177 Cb -0.28 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1l6i s VAL 177 CO 0.47 0.11 0.38 -1.10 -3.33 0.00 0.00 175.10 171.63 1l6i s GLN 178 N 0.01 4.20 -0.11 1.54 -1.52 -1.26 -1.47 119.66 121.05 1l6i s GLN 178 Ca 0.00 0.27 0.01 0.00 -1.95 0.00 0.00 55.36 53.69 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 0.30 -0.11 0.08 -0.25 0.00 0.00 175.29 175.31 1l6i s VAL 179 N 0.21 1.26 0.53 1.09 1.01 -0.29 -4.98 120.40 119.24 1l6i s VAL 179 Ca 0.21 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 1l6i s VAL 179 Cb -0.14 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1l6i s VAL 179 CO 0.08 0.40 0.89 -0.83 0.00 0.00 0.00 175.10 175.64 1l6i s GLY 180 N 1.35 1.64 -0.24 4.51 0.00 -1.26 -1.67 107.32 111.66 1l6i s GLY 180 Ca -0.00 -0.27 -0.20 0.00 0.00 0.00 0.00 44.72 44.25 1l6i s GLY 180 CO -0.06 -0.05 0.63 -1.50 0.00 0.00 0.00 173.10 172.12 1l6i s ILE 181 N -2.87 -0.00 0.00 0.90 2.07 -0.68 -4.99 121.20 115.63 1l6i s ILE 181 Ca 0.51 0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.76 1l6i s ILE 181 Cb -0.11 -0.89 0.00 0.00 0.13 0.00 0.00 42.46 41.60 1l6i s ILE 181 CO 0.46 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.11 1l6i n GLY 182 N 3.20 0.04 7.00 1.50 0.00 0.80 -1.47 105.19 116.26 1l6i n GLY 182 Ca -0.16 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.06 3.41 -0.02 0.00 -1.26 -4.07 105.19 103.20 1l6i n GLY 183 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 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 1.33 -0.26 1.61 -2.85 -0.64 -4.86 119.74 114.06 1l6i s LYS 184 Ca 0.00 -1.29 -0.09 0.00 -1.00 0.00 0.00 55.97 53.59 1l6i s LYS 184 Cb 0.00 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.13 1l6i s LYS 184 CO 0.00 -0.51 0.12 0.08 0.10 0.00 0.00 175.35 175.15 1l6i s VAL 185 N -4.03 4.78 0.42 1.79 1.01 -1.25 0.11 120.40 123.23 1l6i s VAL 185 Ca 0.24 -0.01 -0.24 0.00 0.00 0.00 0.00 61.98 61.96 1l6i s VAL 185 Cb 0.02 -3.26 -0.08 0.00 0.00 0.00 0.00 36.38 33.07 1l6i s VAL 185 CO 0.06 0.30 1.18 0.42 0.00 0.00 0.00 175.10 177.06 1l6i s THR 186 N 1.66 3.07 0.34 3.92 -4.23 0.38 -4.79 115.64 115.98 1l6i s THR 186 Ca 0.07 0.86 0.11 0.00 -1.18 0.00 0.00 61.69 61.55 1l6i s THR 186 Cb -0.15 -3.47 0.38 0.00 1.34 0.00 0.00 72.50 70.60 1l6i s THR 186 CO 0.07 0.05 1.56 0.29 -0.54 0.00 0.00 174.62 176.05 1l6i n LYS 187 N -0.14 -0.07 0.00 3.99 4.76 -1.26 0.41 118.16 125.84 1l6i n LYS 187 Ca 0.05 1.43 0.04 0.00 -2.87 0.00 0.00 58.31 56.96 1l6i n LYS 187 Cb 0.47 -2.40 0.21 0.00 -1.84 0.00 0.00 35.03 31.46 1l6i n LYS 187 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1l6i n ASP 188 N -5.37 0.00 0.00 4.39 5.75 -1.26 -4.92 116.55 115.14 1l6i n ASP 188 Ca 0.30 -1.19 0.00 0.00 -0.01 0.00 0.00 54.79 53.89 1l6i n ASP 188 Cb 1.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.09 1l6i n ASP 188 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1l6i n GLY 189 N 0.27 1.09 3.73 6.12 0.00 1.34 -5.08 105.19 112.66 1l6i n GLY 189 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.35 4.63 -0.29 1.61 0.52 -1.24 -4.73 118.95 119.09 1l6i s ARG 190 Ca 0.00 1.53 -0.19 0.00 -0.52 0.00 0.00 55.73 56.54 1l6i s ARG 190 Cb 0.00 -3.37 -0.01 0.00 0.52 0.00 0.00 34.95 32.09 1l6i s ARG 190 CO 0.00 0.11 0.58 -0.46 0.02 0.00 0.00 175.30 175.55 1l6i s TRP 191 N 0.19 3.23 -0.46 -0.53 -0.00 -1.26 0.15 118.94 120.25 1l6i s TRP 191 Ca 0.49 0.57 -0.10 0.00 -0.00 0.00 0.00 56.10 57.06 1l6i s TRP 191 Cb -0.25 -2.89 0.11 0.00 -0.00 0.00 0.00 33.47 30.44 1l6i s TRP 191 CO 0.30 -0.42 0.34 -1.21 -0.00 0.00 0.00 176.95 175.96 1l6i s GLU 192 N 2.49 2.56 0.78 5.86 2.02 0.30 -4.97 118.70 127.74 1l6i s GLU 192 Ca 0.23 -1.67 -0.11 0.00 0.02 0.00 0.00 54.97 53.44 1l6i s GLU 192 Cb -0.15 -3.92 0.06 0.00 0.10 0.00 0.00 34.13 30.22 1l6i s GLU 192 CO 0.11 -1.14 1.10 -2.14 0.02 0.00 0.00 175.26 173.21 1l6i s PRO 193 N 1.40 2.14 -0.01 0.39 0.02 -1.26 -1.62 135.00 136.06 1l6i s PRO 193 Ca 0.05 1.25 0.10 0.00 0.02 0.00 0.00 61.00 62.43 1l6i s PRO 193 Cb -0.26 -1.88 -0.14 0.00 0.02 0.00 0.00 34.50 32.25 1l6i s PRO 193 CO 0.00 -1.74 0.32 -0.85 -0.33 0.00 0.00 177.00 174.40 1l6i n GLU 194 N -3.49 1.72 -4.24 5.54 0.28 -0.54 -4.72 120.64 115.18 1l6i n GLU 194 Ca 0.10 -0.06 -0.18 0.00 -0.16 0.00 0.00 57.16 56.87 1l6i n GLU 194 Cb 0.53 -1.14 -0.15 0.00 1.43 0.00 0.00 31.44 32.11 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 -2.40 0.65 -0.10 -1.84 5.36 -0.78 -4.94 117.98 113.93 1l6i s PHE 195 Ca -0.01 -0.13 0.03 0.00 -0.96 0.00 0.00 56.93 55.86 1l6i s PHE 195 Cb 0.07 -0.45 0.01 0.00 -0.34 0.00 0.00 43.02 42.31 1l6i s PHE 195 CO 0.43 -0.04 -0.20 0.99 -1.46 0.00 0.00 175.22 174.94 1l6i s THR 196 N 0.02 1.79 -0.11 0.12 2.01 -1.26 -1.69 115.64 116.52 1l6i s THR 196 Ca 0.00 -0.85 -0.03 0.00 0.31 0.00 0.00 61.69 61.12 1l6i s THR 196 Cb -0.05 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 1l6i s THR 196 CO -0.00 0.50 0.02 -0.63 -0.69 0.00 0.00 174.62 173.82 1l6i s ILE 197 N 0.52 4.48 -0.24 1.82 1.01 -0.67 -4.76 121.20 123.36 1l6i s ILE 197 Ca -0.16 -0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 1l6i s ILE 197 Cb -0.17 -2.92 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 1l6i s ILE 197 CO 0.06 0.58 0.47 -0.89 0.00 0.00 0.00 174.94 175.16 1l6i s THR 198 N -0.62 5.12 -0.16 2.92 2.01 -0.48 -1.13 115.64 123.29 1l6i s THR 198 Ca 0.10 0.81 -0.07 0.00 0.31 0.00 0.00 61.69 62.85 1l6i s THR 198 Cb -0.12 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 1l6i s THR 198 CO 0.02 0.15 0.06 -0.83 -0.69 0.00 0.00 174.62 173.34 1l6i s GLY 199 N 1.36 1.93 -0.02 4.40 0.00 -0.54 0.13 107.32 114.58 1l6i s GLY 199 Ca 0.20 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 44.21 1l6i s GLY 199 CO 0.09 -0.08 -0.07 1.20 0.00 0.00 0.00 173.10 174.24 1l6i s GLN 200 N 0.03 2.61 -0.27 2.90 -0.21 0.61 -2.25 119.66 123.07 1l6i s GLN 200 Ca 0.06 -0.66 -0.14 0.00 0.02 0.00 0.00 55.36 54.64 1l6i s GLN 200 Cb -0.12 -2.52 -0.04 0.00 1.00 0.00 0.00 33.01 31.33 1l6i s GLN 200 CO 0.01 0.62 0.33 0.00 -2.12 0.00 0.00 175.29 174.14 1l6i s ALA 201 N -0.91 3.56 -0.30 6.09 0.00 -1.26 -0.83 121.76 128.10 1l6i s ALA 201 Ca 0.15 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 1l6i s ALA 201 Cb -0.11 -2.66 0.05 0.00 0.00 0.00 0.00 23.12 20.40 1l6i s ALA 201 CO 0.05 -0.64 -0.00 -1.58 0.00 0.00 0.00 175.76 173.58 1l6i s TRP 202 N 2.00 3.28 -0.15 0.00 0.52 -0.63 -3.97 118.94 120.00 1l6i s TRP 202 Ca 0.13 -1.96 -0.10 0.00 0.02 0.00 0.00 56.10 54.20 1l6i s TRP 202 Cb -0.16 -2.15 -0.05 0.00 -1.15 0.00 0.00 33.47 29.97 1l6i s TRP 202 CO 0.10 -0.82 0.17 -0.51 0.02 0.00 0.00 176.95 175.91 1l6i s ASP 203 N 1.25 6.35 -0.07 2.95 1.01 0.77 0.69 116.67 129.62 1l6i s ASP 203 Ca -0.05 0.41 0.02 0.00 0.71 0.00 0.00 52.55 53.64 1l6i s ASP 203 Cb -0.20 -2.10 -0.02 0.00 1.01 0.00 0.00 42.92 41.60 1l6i s ASP 203 CO -0.02 0.28 -0.12 -0.76 0.21 0.00 0.00 175.17 174.76 1l6i s LEU 204 N -0.30 2.83 0.05 1.23 1.43 -0.80 -0.30 118.68 122.83 1l6i s LEU 204 Ca 0.13 -0.19 -0.23 0.00 -1.03 0.00 0.00 54.13 52.82 1l6i s LEU 204 Cb -0.12 -1.60 -0.06 0.00 0.03 0.00 0.00 46.19 44.44 1l6i s LEU 204 CO 0.02 0.31 0.69 -2.16 0.23 0.00 0.00 176.35 175.43 1l6i s PRO 205 N -0.49 4.41 -0.32 1.29 0.04 -1.26 -0.85 135.00 137.82 1l6i s PRO 205 Ca 0.07 0.93 -0.14 0.00 0.04 0.00 0.00 61.00 61.89 1l6i s PRO 205 Cb -0.12 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.07 1l6i s PRO 205 CO 0.02 0.40 0.32 0.08 0.04 0.00 0.00 177.00 177.85 1l6i s VAL 206 N -0.39 5.21 -0.35 -0.36 1.01 0.19 -4.90 120.40 120.82 1l6i s VAL 206 Ca 0.34 0.09 -0.15 0.00 0.00 0.00 0.00 61.98 62.26 1l6i s VAL 206 Cb -0.20 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 1l6i s VAL 206 CO 0.21 0.01 0.37 -0.69 0.00 0.00 0.00 175.10 175.00 1l6i s VAL 207 N 1.93 5.16 0.71 2.92 1.01 -1.26 -2.14 120.40 128.73 1l6i s VAL 207 Ca 0.10 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.99 1l6i s VAL 207 Cb -0.17 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1l6i s VAL 207 CO 0.11 -0.11 1.11 -0.83 0.00 0.00 0.00 175.10 175.38 1l6i s GLY 208 N 1.74 2.01 -0.63 4.51 0.00 -0.78 -4.83 107.32 109.33 1l6i s GLY 208 Ca 0.12 0.49 -0.27 0.00 0.00 0.00 0.00 44.72 45.06 1l6i s GLY 208 CO 0.12 0.85 1.19 -0.47 0.00 0.00 0.00 173.10 174.78 1l6i s TYR 209 N -2.49 2.53 -1.46 1.90 5.04 -1.26 -4.25 117.35 117.36 1l6i s TYR 209 Ca 0.66 0.20 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 1l6i s TYR 209 Cb -0.20 -4.50 0.00 0.00 0.35 0.00 0.00 41.96 37.61 1l6i s TYR 209 CO 0.47 -1.71 0.00 0.54 -1.34 0.00 0.00 175.55 173.50 1l6i n ARG 210 N 8.60 -1.02 0.00 4.97 5.12 0.73 -4.82 116.66 130.24 1l6i n ARG 210 Ca 0.06 0.95 0.00 0.00 -1.93 0.00 0.00 57.85 56.92 1l6i n ARG 210 Cb 0.49 -5.08 0.00 0.00 -1.16 0.00 0.00 32.46 26.70 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 -0.37 0.21 0.00 0.55 6.94 -1.26 -3.86 115.26 117.47 1l6i n ASN 211 Ca -0.15 -0.54 0.00 0.00 -0.02 0.00 0.00 54.58 53.87 1l6i n ASN 211 Cb 0.50 0.53 0.00 0.00 -2.36 0.00 0.00 39.78 38.45 1l6i n ASN 211 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1l6i n GLY 212 N 0.53 0.74 3.80 4.83 0.00 -1.25 -3.44 105.19 110.40 1l6i n GLY 212 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.95 4.36 -0.19 1.61 1.01 -1.26 -3.93 120.40 119.05 1l6i s VAL 213 Ca 0.00 1.58 -0.08 0.00 0.00 0.00 0.00 61.98 63.48 1l6i s VAL 213 Cb 0.00 -3.90 0.08 0.00 0.00 0.00 0.00 36.38 32.56 1l6i s VAL 213 CO 0.00 0.09 0.41 0.00 0.00 0.00 0.00 175.10 175.61 1l6i s ALA 214 N -1.67 -1.11 0.05 5.51 0.00 -1.26 -1.87 121.76 121.41 1l6i s ALA 214 Ca 0.50 1.50 -0.08 0.00 0.00 0.00 0.00 51.96 53.88 1l6i s ALA 214 Cb -0.16 -1.19 -0.00 0.00 0.00 0.00 0.00 23.12 21.77 1l6i s ALA 214 CO 0.21 -0.59 0.17 1.14 0.00 0.00 0.00 175.76 176.69 1l6i s GLN 215 N 2.20 0.72 0.37 0.00 -2.07 -0.91 -4.93 119.66 115.04 1l6i s GLN 215 Ca -0.04 -0.77 -0.11 0.00 -1.82 0.00 0.00 55.36 52.61 1l6i s GLN 215 Cb -0.11 0.29 -0.07 0.00 -1.09 0.00 0.00 33.01 32.03 1l6i s GLN 215 CO -0.13 -0.21 0.73 -1.25 -1.32 0.00 0.00 175.29 173.12 1l6i s PRO 216 N -3.02 3.82 -0.46 9.60 0.05 -1.26 -0.63 135.00 143.10 1l6i s PRO 216 Ca -0.02 0.47 -0.09 0.00 0.05 0.00 0.00 61.00 61.41 1l6i s PRO 216 Cb 0.01 -2.43 0.11 0.00 0.05 0.00 0.00 34.50 32.23 1l6i s PRO 216 CO -0.06 0.05 0.32 -1.17 0.05 0.00 0.00 177.00 176.18 1l6i s LEU 217 N -3.56 5.53 -0.44 -3.56 2.96 -0.03 -2.45 118.68 117.13 1l6i s LEU 217 Ca 0.51 -1.77 -0.24 0.00 -0.22 0.00 0.00 54.13 52.41 1l6i s LEU 217 Cb -0.10 -2.01 0.02 0.00 0.50 0.00 0.00 46.19 44.60 1l6i s LEU 217 CO 0.27 -0.65 0.84 -0.60 -1.32 0.00 0.00 176.35 174.90 1l6i s ARG 218 N 1.39 3.51 -0.33 1.98 3.52 0.62 -1.91 118.95 127.73 1l6i s ARG 218 Ca 0.05 0.07 -0.11 0.00 -0.13 0.00 0.00 55.73 55.61 1l6i s ARG 218 Cb -0.25 -3.91 -0.01 0.00 -1.56 0.00 0.00 34.95 29.22 1l6i s ARG 218 CO 0.00 -1.12 0.20 -0.51 -0.81 0.00 0.00 175.30 173.07 1l6i s LEU 219 N 3.45 4.38 0.19 -0.88 1.43 0.22 -2.29 118.68 125.18 1l6i s LEU 219 Ca 0.33 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.63 1l6i s LEU 219 Cb -0.11 -2.08 -0.08 0.00 0.03 0.00 0.00 46.19 43.95 1l6i s LEU 219 CO 0.23 -0.23 1.05 0.26 0.23 0.00 0.00 176.35 177.89 1l6i s TRP 220 N 1.67 3.70 -0.09 0.29 0.52 -0.56 -1.60 118.94 122.88 1l6i s TRP 220 Ca 0.05 1.71 0.03 0.00 0.02 0.00 0.00 56.10 57.91 1l6i s TRP 220 Cb -0.17 -3.19 0.01 0.00 -1.15 0.00 0.00 33.47 28.97 1l6i s TRP 220 CO 0.09 -0.26 -0.17 -1.14 0.02 0.00 0.00 176.95 175.48 1l6i s GLN 221 N -0.63 2.30 0.04 4.98 0.74 -0.01 0.13 119.66 127.20 1l6i s GLN 221 Ca 0.47 -0.61 -0.15 0.00 0.05 0.00 0.00 55.36 55.11 1l6i s GLN 221 Cb -0.28 -1.83 -0.06 0.00 1.10 0.00 0.00 33.01 31.93 1l6i s GLN 221 CO 0.35 0.06 0.45 0.00 -0.55 0.00 0.00 175.29 175.60 1l6i s ALA 222 N 0.63 3.67 0.29 1.58 0.00 -1.26 -0.29 121.76 126.38 1l6i s ALA 222 Ca -0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.61 1l6i s ALA 222 Cb -0.16 -2.44 -0.01 0.00 0.00 0.00 0.00 23.12 20.51 1l6i s ALA 222 CO 0.04 0.47 0.39 0.95 0.00 0.00 0.00 175.76 177.62 1l6i s THR 223 N -1.15 0.00 0.02 0.00 -4.23 0.12 -4.31 115.64 106.09 1l6i s THR 223 Ca 0.27 -1.66 0.04 0.00 -1.18 0.00 0.00 61.69 59.15 1l6i s THR 223 Cb -0.17 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 1l6i s THR 223 CO 0.16 0.00 -0.12 -2.28 -0.54 0.00 0.00 174.62 171.84 1l6i s HIS 224 N -3.52 1.03 0.35 3.99 2.46 -1.26 -1.39 115.29 116.96 1l6i s HIS 224 Ca 0.31 -0.29 0.12 0.00 0.47 0.00 0.00 55.06 55.67 1l6i s HIS 224 Cb 0.01 -0.63 0.64 0.00 -0.13 0.00 0.00 32.58 32.47 1l6i s HIS 224 CO 0.17 0.00 1.78 0.00 -2.47 0.00 0.00 174.74 174.22 1l6i h ALA 225 N 5.31 1.30 -2.31 1.58 0.00 -1.94 -3.33 119.26 119.86 1l6i h ALA 225 Ca -0.35 -0.38 -0.59 0.00 0.00 0.00 0.00 54.91 53.60 1l6i h ALA 225 Cb 1.18 -0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.50 1l6i h ALA 225 CO 0.46 0.52 -0.79 0.72 0.00 0.00 0.00 179.25 180.16 1l6i n HIS 226 N -4.05 1.78 0.83 0.00 8.25 -1.26 -4.97 115.22 115.81 1l6i n HIS 226 Ca -0.02 -3.89 0.11 0.00 -0.26 0.00 0.00 57.72 53.66 1l6i n HIS 226 Cb 0.44 -0.40 0.50 0.00 1.12 0.00 0.00 29.99 31.65 1l6i n HIS 226 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1l6i n PRO 227 N 1.46 0.06 -4.09 -0.41 -0.05 -1.25 -4.62 135.00 126.11 1l6i n PRO 227 Ca 0.26 0.11 -0.17 0.00 -0.05 0.00 0.00 63.50 63.64 1l6i n PRO 227 Cb 0.45 -1.50 -0.16 0.00 -0.05 0.00 0.00 33.50 32.24 1l6i n PRO 227 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 175.50 175.57 1l6i s PHE 228 N -2.92 0.50 -0.41 0.54 5.36 -1.26 -2.57 117.98 117.22 1l6i s PHE 228 Ca 0.13 -0.09 -0.07 0.00 -0.96 0.00 0.00 56.93 55.93 1l6i s PHE 228 Cb 0.15 -0.44 0.09 0.00 -0.34 0.00 0.00 43.02 42.47 1l6i s PHE 228 CO 0.40 -0.10 0.24 0.34 -1.46 0.00 0.00 175.22 174.64 1l6i s ASP 229 N 0.54 5.52 0.45 6.13 -1.08 0.06 -4.98 116.67 123.32 1l6i s ASP 229 Ca -0.06 -1.63 0.11 0.00 -0.52 0.00 0.00 52.55 50.45 1l6i s ASP 229 Cb -0.10 -1.94 1.02 0.00 -1.46 0.00 0.00 42.92 40.44 1l6i s ASP 229 CO -0.00 -0.54 2.06 0.25 0.52 0.00 0.00 175.17 177.46 1l6i h LEU 230 N 8.32 0.31 0.01 -1.34 5.85 -1.99 -1.84 115.31 124.64 1l6i h LEU 230 Ca -0.21 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 1l6i h LEU 230 Cb 1.07 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.03 1l6i h LEU 230 CO 0.74 0.22 -0.01 0.74 -0.34 0.00 0.00 178.44 179.79 1l6i h THR 231 N 0.37 1.26 -0.48 1.05 2.02 -1.98 0.20 112.91 115.35 1l6i h THR 231 Ca 0.14 -0.84 0.04 0.00 0.77 0.00 0.00 66.41 66.52 1l6i h THR 231 Cb 0.12 1.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 1l6i h THR 231 CO -0.03 0.22 0.26 0.11 0.37 0.00 0.00 175.52 176.44 1l6i h LYS 232 N -0.38 0.49 -0.38 6.66 1.57 -1.85 -1.74 116.57 120.94 1l6i h LYS 232 Ca -0.00 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1l6i h LYS 232 Cb 0.37 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1l6i h LYS 232 CO 0.00 0.33 0.20 0.35 -0.57 0.00 0.00 179.45 179.76 1l6i h PHE 233 N 0.51 0.37 0.00 -1.35 3.04 -1.13 -0.02 116.94 118.36 1l6i h PHE 233 Ca 0.21 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.17 1l6i h PHE 233 Cb 0.09 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 38.49 1l6i h PHE 233 CO -0.09 0.20 0.00 0.09 -2.02 0.00 0.00 178.31 176.49 1l6i n ASN 234 N -4.92 0.00 -0.58 0.41 3.02 0.68 -0.85 115.26 113.02 1l6i n ASN 234 Ca 0.01 0.41 0.13 0.00 -0.03 0.00 0.00 54.58 55.11 1l6i n ASN 234 Cb 0.09 -0.46 0.44 0.00 -0.61 0.00 0.00 39.78 39.23 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 -1.46 1.80 0.00 6.41 8.00 -0.67 -4.94 116.55 125.69 1l6i n ASP 235 Ca 0.05 -1.61 0.00 0.00 0.71 0.00 0.00 54.79 53.94 1l6i n ASP 235 Cb 0.19 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 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 1.21 0.50 3.42 0.44 0.00 -0.03 -4.98 105.19 105.74 1l6i n GLY 236 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1l6i n GLY 236 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l6i s ASP 237 N -2.93 7.08 0.25 1.61 1.01 -0.07 -4.82 116.67 118.79 1l6i s ASP 237 Ca 0.00 -3.04 0.02 0.00 0.71 0.00 0.00 52.55 50.24 1l6i s ASP 237 Cb 0.00 -2.33 0.29 0.00 1.01 0.00 0.00 42.92 41.89 1l6i s ASP 237 CO 0.00 -0.64 1.61 -0.26 0.21 0.00 0.00 175.17 176.09 1l6i h PHE 238 N 7.25 0.46 -0.02 4.23 0.04 -1.85 -2.43 116.94 124.62 1l6i h PHE 238 Ca 0.24 -0.14 -0.04 0.00 2.80 0.00 0.00 57.97 60.84 1l6i h PHE 238 Cb 0.90 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.96 1l6i h PHE 238 CO 1.01 0.78 -0.13 1.25 -0.60 0.00 0.00 178.31 180.62 1l6i h LEU 239 N 0.30 0.15 -1.22 1.54 5.85 -1.96 -3.24 115.31 116.73 1l6i h LEU 239 Ca 0.02 -0.69 0.00 0.00 0.84 0.00 0.00 57.88 58.05 1l6i h LEU 239 Cb 0.94 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1l6i h LEU 239 CO 0.08 0.81 0.00 0.03 -0.34 0.00 0.00 178.44 179.02 1l6i h ARG 240 N -0.51 0.00 0.00 1.25 3.08 -1.95 -1.97 114.38 114.28 1l6i h ARG 240 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1l6i h ARG 240 Cb 0.81 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 1l6i h ARG 240 CO 0.03 0.00 -0.04 0.00 -1.07 0.00 0.00 179.97 178.89 1l6i h ALA 241 N 2.13 1.32 -0.49 0.04 0.00 -1.46 -2.72 119.26 118.08 1l6i h ALA 241 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1l6i h ALA 241 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1l6i h ALA 241 CO 0.00 0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.69 1l6i n GLU 242 N -3.59 2.58 -0.24 0.00 -0.58 -0.74 -0.76 120.64 117.31 1l6i n GLU 242 Ca -0.02 -2.40 -0.01 0.00 -0.42 0.00 0.00 57.16 54.30 1l6i n GLU 242 Cb 0.14 -1.53 0.11 0.00 -0.57 0.00 0.00 31.44 29.58 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 4.47 0.67 -0.84 3.49 5.75 -1.58 -1.21 115.11 125.85 1l6i h GLN 243 Ca 0.00 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1l6i h GLN 243 Cb 0.99 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.35 1l6i h GLN 243 CO 0.00 0.45 0.46 0.37 -2.65 0.00 0.00 178.83 177.45 1l6i h GLN 244 N 0.69 1.18 -0.14 1.69 4.15 -1.83 0.19 115.11 121.05 1l6i h GLN 244 Ca 0.31 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 1l6i h GLN 244 Cb 0.21 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.67 1l6i h GLN 244 CO -0.19 0.86 -0.11 0.78 -1.93 0.00 0.00 178.83 178.24 1l6i h GLY 245 N 1.20 0.34 1.43 2.39 0.00 -1.12 -2.93 103.07 104.38 1l6i h GLY 245 Ca 0.30 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1l6i h GLY 245 CO -0.05 0.31 0.16 -2.22 0.00 0.00 0.00 176.54 174.74 1l6i h ILE 246 N -0.06 1.20 -0.19 2.60 2.04 -1.07 0.15 117.51 122.19 1l6i h ILE 246 Ca 0.02 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 1l6i h ILE 246 Cb 0.63 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1l6i h ILE 246 CO 0.03 0.26 0.06 0.78 0.00 0.00 0.00 178.15 179.28 1l6i h ASN 247 N 0.71 0.23 0.20 1.72 2.35 -0.45 -2.61 115.58 117.73 1l6i h ASN 247 Ca 0.17 -0.02 -0.31 0.00 -0.55 0.00 0.00 56.30 55.59 1l6i h ASN 247 Cb 0.21 -0.06 0.02 0.00 0.05 0.00 0.00 38.32 38.54 1l6i h ASN 247 CO -0.01 0.23 -1.48 0.00 -1.65 0.00 0.00 177.43 174.51 1l6i h ALA 248 N 1.81 0.01 0.00 -0.83 0.00 -1.21 -3.38 119.26 115.66 1l6i h ALA 248 Ca 0.07 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1l6i h ALA 248 Cb 0.08 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1l6i h ALA 248 CO -0.01 0.79 0.00 0.39 0.00 0.00 0.00 179.25 180.42 1l6i n GLU 249 N -3.76 0.11 0.12 0.00 1.02 0.46 -2.58 120.64 116.01 1l6i n GLU 249 Ca -0.21 0.32 0.13 0.00 -0.02 0.00 0.00 57.16 57.38 1l6i n GLU 249 Cb 1.03 -1.70 0.37 0.00 -0.02 0.00 0.00 31.44 31.12 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 -1.71 -2.19 116.57 118.26 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 0.34 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 1l6i h LYS 250 CO 0.00 0.00 -0.27 -0.07 -2.00 0.00 0.00 179.45 177.11 1l6i h LEU 251 N 0.00 0.00 -3.13 7.07 3.38 -1.76 -3.15 115.31 117.71 1l6i h LEU 251 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1l6i h LEU 251 Cb 0.77 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 1l6i h LEU 251 CO 0.00 0.27 -0.57 0.35 0.09 0.00 0.00 178.44 178.58 1l6i n THR 252 N -3.57 2.20 -0.04 0.22 -2.24 -0.83 -4.71 114.28 105.31 1l6i n THR 252 Ca -0.01 -3.35 -0.19 0.00 -2.27 0.00 0.00 64.05 58.24 1l6i n THR 252 Cb 0.41 -0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 68.16 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 1.20 0.10 -3.94 -0.78 1.79 -1.50 -0.67 116.57 112.78 1l6i h LYS 253 Ca 0.05 -0.18 -0.22 0.00 -2.18 0.00 0.00 60.65 58.13 1l6i h LYS 253 Cb 1.11 0.07 -0.25 0.00 -1.58 0.00 0.00 32.23 31.58 1l6i h LYS 253 CO 0.13 1.08 -0.72 0.08 -1.08 0.00 0.00 179.45 178.95 1l6i s VAL 254 N -2.35 0.12 0.06 0.50 1.01 -1.26 -0.66 120.40 117.82 1l6i s VAL 254 Ca -0.21 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.11 1l6i s VAL 254 Cb 0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 36.38 36.15 1l6i s VAL 254 CO 0.71 -0.21 0.63 -0.22 0.00 0.00 0.00 175.10 176.01 1l6i s LEU 255 N -0.68 4.49 -1.32 3.92 1.98 0.08 -4.24 118.68 122.91 1l6i s LEU 255 Ca -0.07 1.31 -0.08 0.00 -2.89 0.00 0.00 54.13 52.40 1l6i s LEU 255 Cb -0.05 -3.00 -0.00 0.00 0.66 0.00 0.00 46.19 43.80 1l6i s LEU 255 CO -0.00 0.18 0.54 -1.22 -1.89 0.00 0.00 176.35 173.96 1l6i n TYR 256 N 2.15 -1.71 -1.76 5.38 4.01 -1.26 -4.48 117.16 119.49 1l6i n TYR 256 Ca -0.08 0.63 -0.37 0.00 -0.16 0.00 0.00 57.90 57.92 1l6i n TYR 256 Cb 0.50 -3.62 0.07 0.00 -0.31 0.00 0.00 39.34 35.98 1l6i n TYR 256 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1l6i s PRO 257 N -6.42 2.59 -0.09 -0.72 0.04 -1.26 -4.79 135.00 124.34 1l6i s PRO 257 Ca 0.16 2.06 -0.38 0.00 0.04 0.00 0.00 61.00 62.88 1l6i s PRO 257 Cb -0.06 -1.86 -0.15 0.00 0.04 0.00 0.00 34.50 32.46 1l6i s PRO 257 CO 0.88 -1.57 1.61 -1.71 0.04 0.00 0.00 177.00 176.26 1l6i n ASN 258 N -1.86 2.34 -1.08 6.66 2.85 -1.26 -4.86 115.26 118.05 1l6i n ASN 258 Ca 0.16 1.08 -0.02 0.00 -0.11 0.00 0.00 54.58 55.69 1l6i n ASN 258 Cb 0.48 -1.21 0.21 0.00 1.24 0.00 0.00 39.78 40.50 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 4.41 2.68 0.06 1.20 5.75 -1.26 -4.39 116.55 125.00 1l6i n ASP 259 Ca 0.22 -3.64 -0.05 0.00 -0.01 0.00 0.00 54.79 51.32 1l6i n ASP 259 Cb 0.19 -0.61 0.15 0.00 -1.03 0.00 0.00 41.12 39.81 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 0.36 -2.66 -1.12 -0.26 -1.94 -3.40 115.58 107.66 1l6i h ASN 260 Ca 0.18 -0.18 -0.54 0.00 -0.56 0.00 0.00 56.30 55.20 1l6i h ASN 260 Cb 1.60 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 38.73 1l6i h ASN 260 CO 0.35 0.80 -0.43 0.00 -1.06 0.00 0.00 177.43 177.08 1l6i s ALA 261 N -4.00 3.93 0.23 -0.83 0.00 -1.26 -5.01 121.76 114.82 1l6i s ALA 261 Ca -0.05 -0.96 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 1l6i s ALA 261 Cb 0.12 -1.85 0.28 0.00 0.00 0.00 0.00 23.12 21.67 1l6i s ALA 261 CO 0.80 0.52 1.85 0.35 0.00 0.00 0.00 175.76 179.28 1l6i h PHE 262 N 2.14 0.94 0.00 0.00 3.57 -1.95 0.21 116.94 121.85 1l6i h PHE 262 Ca -0.48 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1l6i h PHE 262 Cb 1.19 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.63 1l6i h PHE 262 CO 0.54 0.50 0.00 1.49 -2.23 0.00 0.00 178.31 178.62 1l6i h GLU 263 N 0.95 0.00 0.25 1.11 4.57 -1.95 0.32 114.58 119.83 1l6i h GLU 263 Ca 0.34 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 58.19 1l6i h GLU 263 Cb 0.10 0.00 0.04 0.00 -0.16 0.00 0.00 28.75 28.73 1l6i h GLU 263 CO -0.15 0.00 -1.44 0.78 -1.18 0.00 0.00 179.01 177.03 1l6i h GLY 264 N 0.67 0.62 1.10 1.92 0.00 -1.18 -1.37 103.07 104.82 1l6i h GLY 264 Ca 0.00 -1.56 -0.10 0.00 0.00 0.00 0.00 47.33 45.67 1l6i h GLY 264 CO 0.00 1.37 -0.03 0.50 0.00 0.00 0.00 176.54 178.37 1l6i h LYS 265 N 0.12 1.07 -0.32 4.80 1.57 0.15 -2.19 116.57 121.77 1l6i h LYS 265 Ca -0.25 -0.36 -0.14 0.00 -1.87 0.00 0.00 60.65 58.03 1l6i h LYS 265 Cb 2.13 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 34.35 1l6i h LYS 265 CO 0.27 1.06 -0.38 -0.22 -0.57 0.00 0.00 179.45 179.61 1l6i h LYS 266 N 0.97 0.75 -0.39 3.15 3.64 -1.35 -2.48 116.57 120.86 1l6i h LYS 266 Ca 0.16 -0.38 -0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1l6i h LYS 266 Cb 0.60 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 1l6i h LYS 266 CO 0.04 1.01 0.02 1.25 -2.27 0.00 0.00 179.45 179.50 1l6i h LEU 267 N 0.62 0.57 -0.08 5.20 5.85 -1.05 -2.24 115.31 124.19 1l6i h LEU 267 Ca 0.05 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1l6i h LEU 267 Cb 0.93 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 1l6i h LEU 267 CO 0.08 0.63 0.01 0.03 -0.34 0.00 0.00 178.44 178.85 1l6i h ARG 268 N 0.59 0.14 -0.29 1.25 2.47 -0.95 -0.88 114.38 116.70 1l6i h ARG 268 Ca 0.13 -0.04 0.02 0.00 -1.26 0.00 0.00 59.98 58.83 1l6i h ARG 268 Cb 0.34 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.62 1l6i h ARG 268 CO 0.01 0.37 0.13 1.25 0.56 0.00 0.00 179.97 182.29 1l6i h LEU 269 N -0.11 0.18 -0.67 3.04 5.85 -1.45 -1.67 115.31 120.47 1l6i h LEU 269 Ca 0.02 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.86 1l6i h LEU 269 Cb 0.30 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 1l6i h LEU 269 CO 0.00 0.14 0.29 0.24 -0.34 0.00 0.00 178.44 178.78 1l6i h MET 270 N 0.28 0.48 -0.35 1.25 2.86 -1.30 -1.31 114.93 116.84 1l6i h MET 270 Ca 0.12 -0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.80 1l6i h MET 270 Cb 0.06 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.55 1l6i h MET 270 CO -0.10 0.32 -0.05 1.96 1.06 0.00 0.00 176.91 180.10 1l6i h GLN 271 N 0.50 0.04 -0.73 1.72 4.20 -0.51 -1.30 115.11 119.03 1l6i h GLN 271 Ca 0.34 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.04 1l6i h GLN 271 Cb 0.41 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 1l6i h GLN 271 CO -0.30 0.03 0.43 1.96 -0.67 0.00 0.00 178.83 180.28 1l6i h GLN 272 N 0.04 1.00 -0.60 1.46 4.20 -0.50 -1.50 115.11 119.21 1l6i h GLN 272 Ca 0.17 -0.09 -0.09 0.00 0.06 0.00 0.00 58.65 58.69 1l6i h GLN 272 Cb 0.25 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1l6i h GLN 272 CO -0.33 0.71 0.01 -0.92 -0.67 0.00 0.00 178.83 177.64 1l6i h TYR 273 N 1.00 1.13 -0.16 2.96 3.20 -1.19 -1.53 116.97 122.38 1l6i h TYR 273 Ca 0.26 -0.19 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1l6i h TYR 273 Cb -0.02 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.95 1l6i h TYR 273 CO -0.01 1.00 -0.03 0.35 -1.64 0.00 0.00 178.16 177.83 1l6i h PHE 274 N 0.94 0.34 -0.50 -3.82 3.57 -0.95 0.68 116.94 117.20 1l6i h PHE 274 Ca 0.17 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.70 1l6i h PHE 274 Cb 0.54 -0.09 -0.08 0.00 2.79 0.00 0.00 35.95 39.11 1l6i h PHE 274 CO 0.04 0.56 0.01 0.37 -2.23 0.00 0.00 178.31 177.06 1l6i h GLN 275 N 0.03 0.12 -0.06 1.11 4.15 -1.17 -1.37 115.11 117.92 1l6i h GLN 275 Ca 0.04 -0.01 -0.25 0.00 0.77 0.00 0.00 58.65 59.21 1l6i h GLN 275 Cb 0.44 -0.03 0.02 0.00 0.21 0.00 0.00 27.48 28.12 1l6i h GLN 275 CO 0.01 0.08 -0.93 0.00 -1.93 0.00 0.00 178.83 176.07 1l6i h ALA 277 N 0.46 1.20 -0.02 0.00 0.00 0.60 0.18 119.26 121.66 1l6i h ALA 277 Ca -0.10 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.49 1l6i h ALA 277 Cb 1.57 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 19.02 1l6i h ALA 277 CO 0.19 0.65 -0.74 0.00 0.00 0.00 0.00 179.25 179.35 1l6i h SER 279 N 0.12 0.95 -0.50 0.00 0.02 -0.85 -0.36 113.55 112.93 1l6i h SER 279 Ca -0.09 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.62 1l6i h SER 279 Cb 1.42 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 1l6i h SER 279 CO 0.15 0.81 -0.12 0.58 -1.14 0.00 0.00 176.83 177.11 1l6i h VAL 280 N 1.03 1.27 -0.66 2.27 2.07 -1.03 -1.94 116.25 119.25 1l6i h VAL 280 Ca 0.25 -1.27 -0.07 0.00 0.82 0.00 0.00 66.70 66.43 1l6i h VAL 280 Cb 0.10 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1l6i h VAL 280 CO -0.03 0.45 0.12 0.00 0.02 0.00 0.00 177.57 178.12 1l6i h ALA 281 N 0.97 0.87 -0.65 1.67 0.00 -1.05 -1.45 119.26 119.62 1l6i h ALA 281 Ca 0.14 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1l6i h ALA 281 Cb 0.68 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1l6i h ALA 281 CO 0.05 0.62 0.18 0.22 0.00 0.00 0.00 179.25 180.32 1l6i h ASP 282 N 1.00 0.96 -0.60 0.00 3.58 -0.92 -1.15 116.42 119.29 1l6i h ASP 282 Ca 0.20 -0.22 -0.07 0.00 0.42 0.00 0.00 57.03 57.36 1l6i h ASP 282 Cb 0.42 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 1l6i h ASP 282 CO 0.01 0.93 0.10 0.40 -2.88 0.00 0.00 179.24 177.80 1l6i h ILE 283 N 0.94 1.26 0.00 2.25 2.04 -0.98 0.07 117.51 123.09 1l6i h ILE 283 Ca 0.21 -0.98 -0.09 0.00 1.00 0.00 0.00 64.86 64.99 1l6i h ILE 283 Cb 0.33 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1l6i h ILE 283 CO -0.00 0.36 -0.44 -0.07 0.00 0.00 0.00 178.15 178.00 1l6i h LEU 284 N 0.89 0.00 -0.26 1.44 3.38 -1.20 -2.41 115.31 117.15 1l6i h LEU 284 Ca 0.18 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 1l6i h LEU 284 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1l6i h LEU 284 CO 0.01 0.44 -0.74 -0.09 0.09 0.00 0.00 178.44 178.15 1l6i h ARG 285 N 0.00 0.68 -0.59 1.13 2.43 -0.22 -2.24 114.38 115.58 1l6i h ARG 285 Ca -0.00 -0.54 -0.07 0.00 -0.81 0.00 0.00 59.98 58.56 1l6i h ARG 285 Cb 1.03 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 1l6i h ARG 285 CO 0.06 1.16 0.08 -0.09 -1.51 0.00 0.00 179.97 179.67 1l6i h ARG 286 N 0.47 0.96 0.16 0.20 2.43 -0.83 -0.60 114.38 117.17 1l6i h ARG 286 Ca -0.04 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 58.88 1l6i h ARG 286 Cb 1.34 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1l6i h ARG 286 CO 0.15 0.89 -0.07 1.25 -1.51 0.00 0.00 179.97 180.67 1l6i h HIS 287 N 0.90 -0.19 -0.30 2.20 2.76 -1.42 -1.66 115.15 117.43 1l6i h HIS 287 Ca 0.18 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.39 1l6i h HIS 287 Cb 0.41 0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 1l6i h HIS 287 CO 0.03 0.07 0.04 1.25 -1.30 0.00 0.00 177.93 178.01 1l6i h HIS 288 N -0.45 0.05 0.00 5.26 -0.00 -1.41 -1.35 115.15 117.25 1l6i h HIS 288 Ca -0.02 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1l6i h HIS 288 Cb 0.35 0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 27.78 1l6i h HIS 288 CO 0.01 -0.01 -0.00 -0.07 -0.00 0.00 0.00 177.93 177.86 1l6i h LEU 289 N 0.13 0.00 -0.43 0.26 -0.00 -0.76 0.13 115.31 114.64 1l6i h LEU 289 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 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 -0.21 0.00 -0.05 0.00 -0.00 0.00 0.00 178.44 178.19 1l6i n ALA 290 N -2.11 2.70 -0.90 1.53 0.00 -0.55 -4.88 120.51 116.29 1l6i n ALA 290 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1l6i n ALA 290 Cb 0.08 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 1.17 0.87 3.85 0.00 0.00 0.44 -5.03 105.19 106.50 1l6i n GLY 291 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.10 3.21 0.01 1.61 0.52 -0.98 -5.02 118.95 118.20 1l6i s ARG 292 Ca 0.00 0.77 -0.15 0.00 -0.52 0.00 0.00 55.73 55.83 1l6i s ARG 292 Cb 0.00 -2.03 -0.06 0.00 0.52 0.00 0.00 34.95 33.38 1l6i s ARG 292 CO 0.00 -0.86 0.43 0.15 0.02 0.00 0.00 175.30 175.05 1l6i s LYS 293 N -5.16 3.96 0.22 3.54 -0.14 -1.26 -4.49 119.74 116.41 1l6i s LYS 293 Ca 0.57 0.46 -0.07 0.00 -1.36 0.00 0.00 55.97 55.56 1l6i s LYS 293 Cb -0.12 -3.22 0.33 0.00 -1.68 0.00 0.00 37.83 33.14 1l6i s LYS 293 CO 0.54 0.68 1.76 1.25 -0.76 0.00 0.00 175.35 178.82 1l6i h LEU 294 N 4.66 0.35 -0.58 3.17 5.85 -1.96 -0.19 115.31 126.61 1l6i h LEU 294 Ca -0.51 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1l6i h LEU 294 Cb 1.22 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1l6i h LEU 294 CO 0.62 0.19 0.00 0.00 -0.34 0.00 0.00 178.44 178.91 1l6i n HIS 295 N -4.93 0.43 -0.90 1.25 1.44 -1.26 -2.62 115.22 108.62 1l6i n HIS 295 Ca 0.11 0.19 0.08 0.00 -2.01 0.00 0.00 57.72 56.09 1l6i n HIS 295 Cb 0.29 -0.81 0.35 0.00 0.12 0.00 0.00 29.99 29.94 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 -1.92 4.08 -0.11 -1.40 0.28 -0.09 -4.61 120.64 116.87 1l6i n GLU 296 Ca 0.01 -3.01 -0.05 0.00 -0.16 0.00 0.00 57.16 53.95 1l6i n GLU 296 Cb 0.12 -2.07 0.02 0.00 1.43 0.00 0.00 31.44 30.93 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 3.18 -0.27 -2.02 -1.84 6.46 -1.55 0.13 115.31 119.40 1l6i h LEU 297 Ca 0.00 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1l6i h LEU 297 Cb 1.73 0.20 0.00 0.00 -0.73 0.00 0.00 40.66 41.86 1l6i h LEU 297 CO 0.37 -0.09 0.00 0.00 -0.62 0.00 0.00 178.44 178.10 1l6i h ALA 298 N 1.37 1.00 0.00 1.25 0.00 -1.82 0.51 119.26 121.57 1l6i h ALA 298 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1l6i h ALA 298 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1l6i h ALA 298 CO -0.36 0.00 -0.08 -0.25 0.00 0.00 0.00 179.25 178.56 1l6i n ASP 299 N -2.68 0.19 0.00 0.00 8.00 0.44 -4.25 116.55 118.25 1l6i n ASP 299 Ca -0.02 0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.89 1l6i n ASP 299 Cb 0.10 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 1l6i n ASP 299 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1l6i n TYR 300 N -1.62 0.00 -4.57 1.24 4.01 0.05 -4.63 117.16 111.64 1l6i n TYR 300 Ca 0.07 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.58 1l6i n TYR 300 Cb 0.35 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.24 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 -1.57 1.14 0.00 -0.72 0.41 -0.47 -1.10 118.70 116.40 1l6i s GLU 301 Ca 0.00 -0.67 0.04 0.00 -0.41 0.00 0.00 54.97 53.93 1l6i s GLU 301 Cb 0.00 -1.15 -0.01 0.00 -1.78 0.00 0.00 34.13 31.19 1l6i s GLU 301 CO 0.00 0.30 -0.13 0.54 -0.49 0.00 0.00 175.26 175.48 1l6i s VAL 302 N -0.59 1.06 -0.24 2.63 0.11 -0.75 -4.51 120.40 118.10 1l6i s VAL 302 Ca 0.05 -0.66 0.00 0.00 -2.93 0.00 0.00 61.98 58.44 1l6i s VAL 302 Cb -0.07 -0.90 0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1l6i s VAL 302 CO 0.00 0.23 -0.10 -0.63 -3.33 0.00 0.00 175.10 171.28 1l6i s ILE 303 N -0.43 2.50 -0.18 7.04 1.01 -0.58 -1.01 121.20 129.55 1l6i s ILE 303 Ca 0.04 -1.24 -0.22 0.00 0.00 0.00 0.00 60.65 59.24 1l6i s ILE 303 Cb -0.06 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 1l6i s ILE 303 CO -0.00 0.16 0.66 -1.58 0.00 0.00 0.00 174.94 174.18 1l6i s GLN 304 N 1.24 4.24 -0.24 2.79 2.00 -0.59 -1.57 119.66 127.53 1l6i s GLN 304 Ca -0.02 0.69 -0.09 0.00 -2.00 0.00 0.00 55.36 53.94 1l6i s GLN 304 Cb -0.17 -3.56 -0.04 0.00 0.80 0.00 0.00 33.01 30.03 1l6i s GLN 304 CO -0.06 -0.22 0.12 -0.51 -0.50 0.00 0.00 175.29 174.11 1l6i s LEU 305 N 1.84 3.76 -0.47 3.68 1.43 0.98 -1.74 118.68 128.17 1l6i s LEU 305 Ca 0.31 -0.06 -0.16 0.00 -1.03 0.00 0.00 54.13 53.19 1l6i s LEU 305 Cb -0.16 -2.01 0.06 0.00 0.03 0.00 0.00 46.19 44.11 1l6i s LEU 305 CO 0.11 0.01 0.42 0.20 0.23 0.00 0.00 176.35 177.33 1l6i s ASN 306 N 1.36 6.16 0.56 2.29 0.01 -1.09 -0.44 114.94 123.79 1l6i s ASN 306 Ca 0.06 -1.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.06 1l6i s ASN 306 Cb -0.15 -2.20 0.00 0.00 0.41 0.00 0.00 41.25 39.31 1l6i s ASN 306 CO 0.05 -0.65 0.00 0.47 -1.51 0.00 0.00 177.10 175.46 1l6i n ASP 307 N 5.38 -2.31 -0.29 -1.22 8.00 -0.67 -3.92 116.55 121.52 1l6i n ASP 307 Ca -0.11 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.52 1l6i n ASP 307 Cb 0.45 0.00 0.44 0.00 -0.02 0.00 0.00 41.12 41.99 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 -0.41 0.00 -0.21 -3.53 -2.24 -1.26 -4.45 114.28 102.18 1l6i n THR 308 Ca 0.00 -0.15 -0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1l6i n THR 308 Cb 0.00 0.36 0.11 0.00 -2.10 0.00 0.00 70.33 68.70 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 1.41 0.48 -0.46 4.78 3.86 -1.91 -0.94 115.15 122.36 1l6i h HIS 309 Ca 0.00 0.03 -0.18 0.00 -1.16 0.00 0.00 60.37 59.06 1l6i h HIS 309 Cb 0.48 -0.12 -0.11 0.00 1.06 0.00 0.00 27.41 28.73 1l6i h HIS 309 CO 0.00 0.16 0.23 -0.35 0.86 0.00 0.00 177.93 178.83 1l6i n PRO 310 N -4.94 2.20 -0.20 2.45 -0.04 -1.26 -4.51 135.00 128.70 1l6i n PRO 310 Ca 0.09 -1.67 -0.02 0.00 -0.04 0.00 0.00 63.50 61.87 1l6i n PRO 310 Cb 0.25 -1.74 0.09 0.00 -0.04 0.00 0.00 33.50 32.06 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 1.13 0.88 0.00 0.52 2.02 -1.45 -2.70 112.91 113.32 1l6i h THR 311 Ca 0.22 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.22 1l6i h THR 311 Cb 1.77 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.49 1l6i h THR 311 CO 0.48 0.10 0.30 -0.29 0.37 0.00 0.00 175.52 176.48 1l6i h ILE 312 N 0.52 0.00 -0.39 3.11 6.09 -1.83 -1.27 117.51 123.75 1l6i h ILE 312 Ca 0.28 0.00 0.11 0.00 -1.37 0.00 0.00 64.86 63.89 1l6i h ILE 312 Cb 0.26 0.68 -0.02 0.00 0.47 0.00 0.00 36.82 38.21 1l6i h ILE 312 CO -0.23 0.00 0.29 0.00 -3.07 0.00 0.00 178.15 175.15 1l6i h ALA 313 N 1.39 2.32 0.40 0.18 0.00 -1.82 -1.75 119.26 119.98 1l6i h ALA 313 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1l6i h ALA 313 Cb 0.61 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1l6i h ALA 313 CO 0.00 -0.50 -0.19 0.82 0.00 0.00 0.00 179.25 179.38 1l6i h ILE 314 N 0.00 0.56 0.00 0.00 2.04 -1.45 -0.88 117.51 117.79 1l6i h ILE 314 Ca 0.19 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 1l6i h ILE 314 Cb 0.77 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1l6i h ILE 314 CO -0.00 0.08 -0.10 1.55 0.00 0.00 0.00 178.15 179.68 1l6i h PRO 315 N -0.81 0.00 -0.08 2.37 0.13 -1.76 -2.36 132.00 129.49 1l6i h PRO 315 Ca -0.05 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.03 1l6i h PRO 315 Cb 0.54 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.67 1l6i h PRO 315 CO 0.09 0.10 -0.11 1.49 -0.23 0.00 0.00 178.00 179.34 1l6i h GLU 316 N 0.00 0.21 -0.60 0.86 4.57 -1.17 -0.42 114.58 118.04 1l6i h GLU 316 Ca -0.00 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.06 1l6i h GLU 316 Cb 0.49 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 1l6i h GLU 316 CO 0.01 0.68 0.40 1.25 -1.18 0.00 0.00 179.01 180.17 1l6i h LEU 317 N -0.24 0.69 -0.69 1.64 5.85 -1.07 -1.40 115.31 120.09 1l6i h LEU 317 Ca 0.01 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1l6i h LEU 317 Cb 0.66 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 1l6i h LEU 317 CO 0.03 0.50 0.42 -0.07 -0.34 0.00 0.00 178.44 178.98 1l6i h LEU 318 N 0.81 0.69 -0.06 2.25 3.38 -1.38 -1.83 115.31 119.16 1l6i h LEU 318 Ca 0.22 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.23 1l6i h LEU 318 Cb -0.09 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1l6i h LEU 318 CO -0.05 0.47 -0.13 -0.09 0.09 0.00 0.00 178.44 178.74 1l6i h ARG 319 N 0.82 -0.18 0.02 1.13 2.43 -0.04 0.51 114.38 119.08 1l6i h ARG 319 Ca 0.28 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.49 1l6i h ARG 319 Cb 0.05 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 1l6i h ARG 319 CO -0.12 -0.12 -0.20 0.28 -1.51 0.00 0.00 179.97 178.31 1l6i h VAL 320 N -0.18 0.53 -0.53 0.20 2.07 -1.18 0.33 116.25 117.50 1l6i h VAL 320 Ca 0.07 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1l6i h VAL 320 Cb 0.27 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1l6i h VAL 320 CO -0.17 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.68 1l6i h LEU 321 N -0.33 0.56 -0.09 2.57 -0.00 -0.99 0.18 115.31 117.20 1l6i h LEU 321 Ca 0.05 -0.01 -0.10 0.00 -0.00 0.00 0.00 57.88 57.83 1l6i h LEU 321 Cb 0.39 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 40.93 1l6i h LEU 321 CO -0.17 0.40 -0.32 0.40 -0.00 0.00 0.00 178.44 178.75 1l6i h ILE 322 N 0.67 1.40 0.09 1.22 2.04 0.45 -0.49 117.51 122.89 1l6i h ILE 322 Ca 0.20 -1.67 -0.31 0.00 1.00 0.00 0.00 64.86 64.09 1l6i h ILE 322 Cb -0.03 2.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.24 1l6i h ILE 322 CO -0.07 0.49 -1.64 0.44 0.00 0.00 0.00 178.15 177.37 1l6i h ASP 323 N -0.07 0.30 0.00 1.72 3.32 -0.32 -2.06 116.42 119.31 1l6i h ASP 323 Ca -0.01 -0.49 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1l6i h ASP 323 Cb 0.95 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.40 1l6i h ASP 323 CO 0.07 1.42 -1.37 -0.62 -1.72 0.00 0.00 179.24 177.02 1l6i n GLU 324 N -3.37 0.53 0.00 3.56 1.02 0.58 -4.40 120.64 118.56 1l6i n GLU 324 Ca -0.19 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 1l6i n GLU 324 Cb 1.04 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 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 -1.79 0.00 -2.80 -0.32 8.25 -0.98 -4.99 115.22 112.59 1l6i n HIS 325 Ca 0.00 -0.39 -0.18 0.00 -0.26 0.00 0.00 57.72 56.89 1l6i n HIS 325 Cb 0.41 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.48 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 -0.39 -2.98 -2.45 -0.41 3.00 -0.78 -4.93 117.38 108.44 1l6i n GLN 326 Ca 0.00 0.66 -0.37 0.00 -0.01 0.00 0.00 57.00 57.28 1l6i n GLN 326 Cb 0.26 -5.34 -0.03 0.00 0.00 0.00 0.00 30.24 25.13 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 -5.43 4.07 0.84 -1.09 -1.94 -0.21 -4.98 119.30 110.56 1l6i s MET 327 Ca 0.17 1.61 -0.10 0.00 -1.71 0.00 0.00 55.69 55.65 1l6i s MET 327 Cb -0.08 -2.53 0.10 0.00 2.01 0.00 0.00 34.83 34.32 1l6i s MET 327 CO 0.21 -0.25 1.11 -1.54 -0.01 0.00 0.00 175.02 174.54 1l6i s SER 328 N -1.46 3.78 0.18 3.03 1.04 -1.26 -4.48 113.70 114.52 1l6i s SER 328 Ca 0.59 1.91 -0.13 0.00 0.48 0.00 0.00 55.95 58.80 1l6i s SER 328 Cb -0.25 -2.50 0.13 0.00 0.10 0.00 0.00 66.02 63.50 1l6i s SER 328 CO 0.30 -2.51 1.78 -0.25 0.98 0.00 0.00 173.24 173.54 1l6i h TRP 329 N -1.46 0.42 -0.50 5.02 2.91 -1.98 -2.63 115.95 117.73 1l6i h TRP 329 Ca -0.44 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 59.53 1l6i h TRP 329 Cb 1.25 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.76 1l6i h TRP 329 CO 0.53 0.19 0.02 -0.44 -1.03 0.00 0.00 178.44 177.72 1l6i h ASP 330 N 0.45 0.78 0.17 2.65 3.32 -1.99 0.16 116.42 121.97 1l6i h ASP 330 Ca 0.22 -0.18 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1l6i h ASP 330 Cb 0.15 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1l6i h ASP 330 CO -0.17 0.83 -0.46 0.44 -1.72 0.00 0.00 179.24 178.17 1l6i h ASP 331 N 0.77 0.37 -0.04 6.45 3.32 -1.88 -1.17 116.42 124.23 1l6i h ASP 331 Ca 0.15 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1l6i h ASP 331 Cb 0.43 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1l6i h ASP 331 CO 0.02 0.78 -0.21 0.00 -1.72 0.00 0.00 179.24 178.10 1l6i h ALA 332 N 1.24 0.08 -0.70 3.45 0.00 -1.08 -3.10 119.26 119.15 1l6i h ALA 332 Ca 0.02 -0.41 0.13 0.00 0.00 0.00 0.00 54.91 54.65 1l6i h ALA 332 Cb 0.92 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1l6i h ALA 332 CO 0.08 0.06 0.47 2.35 0.00 0.00 0.00 179.25 182.21 1l6i h TRP 333 N -0.34 0.47 -0.16 0.00 2.91 -0.91 -0.03 115.95 117.88 1l6i h TRP 333 Ca -0.01 0.01 -0.10 0.00 1.13 0.00 0.00 58.89 59.92 1l6i h TRP 333 Cb 0.87 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 29.36 1l6i h TRP 333 CO 0.14 0.20 -0.33 0.00 -1.03 0.00 0.00 178.44 177.42 1l6i h ALA 334 N 1.66 1.14 -0.00 2.65 0.00 -1.17 0.79 119.26 124.33 1l6i h ALA 334 Ca 0.34 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1l6i h ALA 334 Cb 0.73 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1l6i h ALA 334 CO -0.10 0.56 -0.02 0.82 0.00 0.00 0.00 179.25 180.50 1l6i h ILE 335 N 0.28 1.57 -0.37 0.00 2.04 -1.24 -3.32 117.51 116.47 1l6i h ILE 335 Ca 0.04 -1.71 -0.16 0.00 1.00 0.00 0.00 64.86 64.02 1l6i h ILE 335 Cb 0.73 2.73 -0.00 0.00 -0.74 0.00 0.00 36.82 39.53 1l6i h ILE 335 CO 0.06 0.45 -0.41 0.71 0.00 0.00 0.00 178.15 178.95 1l6i h THR 336 N -0.70 1.27 0.00 -0.27 1.35 -0.59 -2.42 112.91 111.55 1l6i h THR 336 Ca -0.00 -1.58 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 1l6i h THR 336 Cb 0.74 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1l6i h THR 336 CO 0.00 0.53 0.00 -1.54 -0.25 0.00 0.00 175.52 174.26 1l6i n SER 337 N -4.06 0.41 -0.87 5.36 3.41 0.23 -0.74 113.62 117.37 1l6i n SER 337 Ca -0.03 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.29 1l6i n SER 337 Cb 0.56 -0.71 0.20 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.98 2.76 -0.08 4.33 4.76 -0.93 -3.19 118.16 123.83 1l6i n LYS 338 Ca 0.01 -2.23 -0.12 0.00 -2.87 0.00 0.00 58.31 53.11 1l6i n LYS 338 Cb 0.14 -1.37 -0.07 0.00 -1.84 0.00 0.00 35.03 31.89 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 0.89 0.90 -3.44 -0.18 -1.04 0.08 -4.82 114.28 106.68 1l6i n THR 339 Ca 0.16 -0.33 -0.37 0.00 -2.04 0.00 0.00 64.05 61.46 1l6i n THR 339 Cb 0.49 -1.14 -0.06 0.00 -1.82 0.00 0.00 70.33 67.80 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 -2.31 3.71 0.14 -1.42 0.08 -1.17 -1.52 117.98 115.48 1l6i s PHE 340 Ca -0.21 1.04 0.06 0.00 0.12 0.00 0.00 56.93 57.94 1l6i s PHE 340 Cb 0.06 -2.33 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 1l6i s PHE 340 CO 0.35 0.58 -0.15 0.00 -0.10 0.00 0.00 175.22 175.91 1l6i s ALA 341 N -1.19 1.62 -0.04 5.36 0.00 -0.61 -1.25 121.76 125.65 1l6i s ALA 341 Ca 0.28 -1.36 0.05 0.00 0.00 0.00 0.00 51.96 50.93 1l6i s ALA 341 Cb -0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1l6i s ALA 341 CO 0.16 0.12 -0.20 -0.47 0.00 0.00 0.00 175.76 175.36 1l6i s TYR 342 N -2.23 1.99 -0.20 0.00 5.04 0.64 -0.01 117.35 122.57 1l6i s TYR 342 Ca 0.11 -0.56 -0.04 0.00 -2.44 0.00 0.00 57.07 54.15 1l6i s TYR 342 Cb -0.04 -1.32 -0.01 0.00 0.35 0.00 0.00 41.96 40.94 1l6i s TYR 342 CO 0.04 -0.17 -0.05 0.99 -1.34 0.00 0.00 175.55 175.02 1l6i s THR 343 N -0.10 3.42 -0.15 4.34 2.01 0.42 -1.51 115.64 124.07 1l6i s THR 343 Ca -0.02 -0.49 -0.23 0.00 0.31 0.00 0.00 61.69 61.26 1l6i s THR 343 Cb -0.12 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1l6i s THR 343 CO 0.02 0.44 0.71 0.21 -0.69 0.00 0.00 174.62 175.31 1l6i s ASN 344 N 1.25 6.84 0.00 3.53 3.84 -0.02 -1.68 114.94 128.71 1l6i s ASN 344 Ca 0.03 1.03 0.14 0.00 0.21 0.00 0.00 52.86 54.26 1l6i s ASN 344 Cb -0.14 -2.39 0.05 0.00 -0.55 0.00 0.00 41.25 38.21 1l6i s ASN 344 CO -0.01 -0.27 0.84 1.41 -2.79 0.00 0.00 177.10 176.28 1l6i n HIS 345 N 4.75 0.00 -3.61 0.43 8.25 -1.26 -4.25 115.22 119.53 1l6i n HIS 345 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 1l6i n HIS 345 Cb 0.50 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.55 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 -1.42 0.00 -2.02 1.59 -1.32 -1.26 -4.69 115.64 106.52 1l6i s THR 346 Ca 0.14 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.91 1l6i s THR 346 Cb 0.11 -1.00 0.59 0.00 -1.51 0.00 0.00 72.50 70.70 1l6i s THR 346 CO 0.26 0.00 1.90 0.18 -2.21 0.00 0.00 174.62 174.75 1l6i n LEU 347 N 1.43 0.71 -4.75 9.08 4.77 -1.26 -4.89 117.00 122.09 1l6i n LEU 347 Ca -0.11 -0.17 -0.41 0.00 -0.03 0.00 0.00 56.01 55.29 1l6i n LEU 347 Cb 0.57 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 1l6i n LEU 347 CO 0.08 0.12 1.23 -0.04 -1.33 0.00 0.00 177.39 177.46 1l6i s MET 348 N -2.20 4.12 0.21 3.23 -1.94 -1.26 -4.93 119.30 116.53 1l6i s MET 348 Ca 0.37 2.57 -0.08 0.00 -1.71 0.00 0.00 55.69 56.83 1l6i s MET 348 Cb 0.21 -3.02 0.15 0.00 2.01 0.00 0.00 34.83 34.18 1l6i s MET 348 CO 0.40 -0.62 1.78 -1.00 -0.01 0.00 0.00 175.02 175.58 1l6i h PRO 349 N 4.64 1.14 -0.54 2.03 0.14 -1.94 -1.60 132.00 135.88 1l6i h PRO 349 Ca -0.47 -0.20 0.16 0.00 0.14 0.00 0.00 66.00 65.63 1l6i h PRO 349 Cb 1.22 -0.19 -0.02 0.00 0.14 0.00 0.00 31.00 32.15 1l6i h PRO 349 CO 0.78 0.92 0.81 1.05 0.14 0.00 0.00 178.00 181.69 1l6i h GLU 350 N 1.11 0.00 -0.70 0.86 9.09 -1.98 0.58 114.58 123.55 1l6i h GLU 350 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 1l6i h GLU 350 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1l6i h GLU 350 CO -0.03 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.03 1l6i n ALA 351 N -2.12 2.72 -3.28 1.06 0.00 -0.60 -4.41 120.51 113.88 1l6i n ALA 351 Ca 0.11 -1.45 -0.27 0.00 0.00 0.00 0.00 53.44 51.83 1l6i n ALA 351 Cb 0.99 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 19.41 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 1.40 3.96 -4.75 0.00 4.77 0.20 -4.03 117.00 118.56 1l6i n LEU 352 Ca 0.25 -5.51 -0.38 0.00 -0.03 0.00 0.00 56.01 50.34 1l6i n LEU 352 Cb 0.76 -0.63 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1l6i n LEU 352 CO 0.20 2.15 0.97 -1.61 -1.33 0.00 0.00 177.39 177.77 1l6i s GLU 353 N -2.76 3.03 -0.01 3.23 2.02 -1.26 -4.87 118.70 118.08 1l6i s GLU 353 Ca 0.43 2.21 0.04 0.00 0.02 0.00 0.00 54.97 57.67 1l6i s GLU 353 Cb 0.19 -2.18 -0.01 0.00 0.10 0.00 0.00 34.13 32.22 1l6i s GLU 353 CO -0.05 -1.27 -0.14 1.03 0.02 0.00 0.00 175.26 174.85 1l6i s ARG 354 N -2.99 1.11 0.08 1.61 0.52 -1.26 -2.44 118.95 115.59 1l6i s ARG 354 Ca 0.74 -0.50 0.09 0.00 -0.52 0.00 0.00 55.73 55.54 1l6i s ARG 354 Cb -0.40 -1.08 -0.03 0.00 0.52 0.00 0.00 34.95 33.96 1l6i s ARG 354 CO 0.47 0.29 -0.25 -1.58 0.02 0.00 0.00 175.30 174.25 1l6i s TRP 355 N -0.34 2.15 -0.04 -0.53 0.52 -0.32 -4.95 118.94 115.43 1l6i s TRP 355 Ca 0.05 -0.40 -0.30 0.00 0.02 0.00 0.00 56.10 55.48 1l6i s TRP 355 Cb -0.05 -1.22 -0.05 0.00 -1.15 0.00 0.00 33.47 30.99 1l6i s TRP 355 CO -0.00 0.21 1.47 -0.51 0.02 0.00 0.00 176.95 178.13 1l6i s ASP 356 N -1.62 6.80 0.39 2.95 1.01 -1.26 0.84 116.67 125.78 1l6i s ASP 356 Ca 0.11 2.09 0.23 0.00 0.71 0.00 0.00 52.55 55.69 1l6i s ASP 356 Cb -0.10 -2.55 1.27 0.00 1.01 0.00 0.00 42.92 42.55 1l6i s ASP 356 CO 0.04 -0.80 1.65 0.58 0.21 0.00 0.00 175.17 176.84 1l6i h VAL 357 N 5.23 0.21 0.00 -1.27 2.07 -1.14 0.94 116.25 122.29 1l6i h VAL 357 Ca -0.36 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1l6i h VAL 357 Cb 1.16 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1l6i h VAL 357 CO 0.93 0.03 -0.09 0.50 0.02 0.00 0.00 177.57 178.97 1l6i h LYS 358 N 0.19 0.00 0.07 1.57 3.64 -1.89 -0.57 116.57 119.58 1l6i h LYS 358 Ca 0.77 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.80 1l6i h LYS 358 Cb 2.11 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.90 1l6i h LYS 358 CO -0.51 0.09 -2.03 -0.11 -2.27 0.00 0.00 179.45 174.62 1l6i n LEU 359 N -3.56 2.09 -0.24 5.20 7.94 0.32 -2.85 117.00 125.90 1l6i n LEU 359 Ca -0.02 0.19 -0.07 0.00 -1.11 0.00 0.00 56.01 55.00 1l6i n LEU 359 Cb 0.21 -0.67 0.06 0.00 0.53 0.00 0.00 43.42 43.55 1l6i n LEU 359 CO 0.29 0.73 0.94 0.58 -1.11 0.00 0.00 177.39 178.82 1l6i h VAL 360 N 0.04 1.26 -0.53 1.96 2.07 -0.97 -2.26 116.25 117.82 1l6i h VAL 360 Ca -0.42 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.07 1l6i h VAL 360 Cb 2.02 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 1l6i h VAL 360 CO 0.05 0.37 0.16 0.50 0.02 0.00 0.00 177.57 178.68 1l6i h LYS 361 N 1.05 0.79 0.04 1.57 3.64 -1.20 0.32 116.57 122.78 1l6i h LYS 361 Ca 0.22 -0.14 -0.23 0.00 -1.27 0.00 0.00 60.65 59.23 1l6i h LYS 361 Cb 0.38 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1l6i h LYS 361 CO 0.00 0.69 -1.01 0.78 -2.27 0.00 0.00 179.45 177.64 1l6i h GLY 362 N 0.93 0.25 0.57 5.01 0.00 -1.33 -3.12 103.07 105.37 1l6i h GLY 362 Ca 0.18 -0.51 -0.34 0.00 0.00 0.00 0.00 47.33 46.66 1l6i h GLY 362 CO -0.01 0.45 -1.81 -2.00 0.00 0.00 0.00 176.54 173.16 1l6i h LEU 363 N 0.10 0.39 -6.09 3.11 5.85 -1.34 -3.40 115.31 113.94 1l6i h LEU 363 Ca -0.07 -0.89 -0.58 0.00 0.84 0.00 0.00 57.88 57.19 1l6i h LEU 363 Cb 1.69 -0.13 -0.40 0.00 0.37 0.00 0.00 40.66 42.19 1l6i h LEU 363 CO 0.16 1.78 -0.91 0.18 -0.34 0.00 0.00 178.44 179.31 1l6i n LEU 364 N -3.67 1.49 -0.21 2.25 4.77 0.11 -0.14 117.00 121.61 1l6i n LEU 364 Ca -0.30 -4.96 -0.00 0.00 -0.03 0.00 0.00 56.01 50.71 1l6i n LEU 364 Cb 0.99 0.15 0.07 0.00 -2.33 0.00 0.00 43.42 42.30 1l6i n LEU 364 CO 0.41 2.06 0.76 -0.65 -1.33 0.00 0.00 177.39 178.64 1l6i h PRO 365 N 4.10 0.02 -0.12 3.23 0.10 -1.67 0.13 132.00 137.79 1l6i h PRO 365 Ca 0.12 -0.00 -0.23 0.00 0.10 0.00 0.00 66.00 65.99 1l6i h PRO 365 Cb 0.80 -0.00 0.01 0.00 0.10 0.00 0.00 31.00 31.91 1l6i h PRO 365 CO 0.60 0.01 -0.82 -0.09 0.10 0.00 0.00 178.00 177.81 1l6i h ARG 366 N 0.02 0.77 -0.71 1.05 9.65 -1.93 -2.71 114.38 120.53 1l6i h ARG 366 Ca 0.31 -0.66 -0.04 0.00 -1.10 0.00 0.00 59.98 58.49 1l6i h ARG 366 Cb 0.48 0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 29.18 1l6i h ARG 366 CO -0.63 1.26 0.29 0.45 2.80 0.00 0.00 179.97 184.15 1l6i h HIS 367 N 0.49 1.07 -0.50 2.20 3.86 -1.73 -2.20 115.15 118.35 1l6i h HIS 367 Ca -0.07 -0.08 0.06 0.00 -1.16 0.00 0.00 60.37 59.12 1l6i h HIS 367 Cb 1.45 -0.32 -0.05 0.00 1.06 0.00 0.00 27.41 29.55 1l6i h HIS 367 CO 0.09 0.83 0.20 1.98 0.86 0.00 0.00 177.93 181.89 1l6i h MET 368 N 1.01 0.38 -0.97 2.45 1.85 -0.77 -0.03 114.93 118.84 1l6i h MET 368 Ca 0.24 -0.02 0.11 0.00 -0.61 0.00 0.00 59.70 59.42 1l6i h MET 368 Cb 0.20 -0.09 -0.08 0.00 0.43 0.00 0.00 31.60 32.07 1l6i h MET 368 CO -0.02 0.25 0.62 1.96 -0.40 0.00 0.00 176.91 179.32 1l6i h GLN 369 N 0.39 0.93 -0.29 0.39 4.20 -1.18 -1.24 115.11 118.31 1l6i h GLN 369 Ca 0.23 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.72 1l6i h GLN 369 Cb 0.22 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 1l6i h GLN 369 CO -0.22 0.61 -0.48 0.82 -0.67 0.00 0.00 178.83 178.90 1l6i h ILE 370 N 0.96 1.28 -0.38 2.54 2.04 -0.67 -2.53 117.51 120.75 1l6i h ILE 370 Ca 0.47 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.66 1l6i h ILE 370 Cb 0.47 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1l6i h ILE 370 CO -0.23 0.54 0.24 0.40 0.00 0.00 0.00 178.15 179.10 1l6i h ILE 371 N 0.60 1.11 -0.60 -0.67 2.04 -0.67 -2.17 117.51 117.15 1l6i h ILE 371 Ca 0.02 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1l6i h ILE 371 Cb 1.08 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1l6i h ILE 371 CO 0.11 0.11 0.39 0.78 0.00 0.00 0.00 178.15 179.54 1l6i h ASN 372 N 0.50 0.70 -0.60 1.72 2.35 -1.15 -0.39 115.58 118.72 1l6i h ASN 372 Ca 0.14 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 1l6i h ASN 372 Cb -0.02 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 1l6i h ASN 372 CO -0.03 0.52 0.00 -0.08 -1.65 0.00 0.00 177.43 176.20 1l6i h GLU 373 N 0.82 1.05 -0.51 0.81 4.57 -1.07 0.18 114.58 120.43 1l6i h GLU 373 Ca 0.22 -0.33 -0.06 0.00 -1.18 0.00 0.00 59.36 58.01 1l6i h GLU 373 Cb -0.07 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 1l6i h GLU 373 CO -0.05 1.03 0.09 0.82 -1.18 0.00 0.00 179.01 179.73 1l6i h ILE 374 N 0.95 1.25 -0.07 2.32 2.04 -0.74 -0.33 117.51 122.93 1l6i h ILE 374 Ca 0.17 -0.92 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 1l6i h ILE 374 Cb 0.55 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1l6i h ILE 374 CO 0.03 0.33 0.04 -1.13 0.00 0.00 0.00 178.15 177.42 1l6i h ASN 375 N 0.73 0.08 -0.21 1.72 -1.24 -0.54 0.21 115.58 116.33 1l6i h ASN 375 Ca 0.16 -0.06 0.05 0.00 0.71 0.00 0.00 56.30 57.16 1l6i h ASN 375 Cb 0.38 -0.02 -0.05 0.00 0.73 0.00 0.00 38.32 39.36 1l6i h ASN 375 CO 0.01 0.12 -0.11 0.74 -1.29 0.00 0.00 177.43 176.90 1l6i h THR 376 N 0.04 0.65 -0.08 -3.57 2.02 -0.37 -0.45 112.91 111.14 1l6i h THR 376 Ca 0.02 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 1l6i h THR 376 Cb 0.05 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1l6i h THR 376 CO -0.00 0.00 -0.18 0.03 0.37 0.00 0.00 175.52 175.74 1l6i h ARG 377 N -0.09 0.13 -0.21 6.66 3.08 -0.86 -2.57 114.38 120.53 1l6i h ARG 377 Ca 0.12 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 1l6i h ARG 377 Cb 0.27 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1l6i h ARG 377 CO -0.27 0.31 -0.37 0.35 -1.07 0.00 0.00 179.97 178.93 1l6i h PHE 378 N 0.13 0.53 -1.01 3.04 3.57 0.52 -3.19 116.94 120.52 1l6i h PHE 378 Ca 0.02 -0.14 0.05 0.00 3.53 0.00 0.00 57.97 61.43 1l6i h PHE 378 Cb 0.39 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 1l6i h PHE 378 CO 0.00 0.76 0.66 -0.22 -2.23 0.00 0.00 178.31 177.28 1l6i h LYS 379 N 0.38 1.20 -0.15 1.11 3.64 -0.70 -2.37 116.57 119.69 1l6i h LYS 379 Ca 0.04 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1l6i h LYS 379 Cb 0.82 -0.27 -0.07 0.00 -0.41 0.00 0.00 32.23 32.30 1l6i h LYS 379 CO 0.07 0.80 -0.46 1.15 -2.27 0.00 0.00 179.45 178.73 1l6i h THR 380 N 1.24 0.09 -0.30 1.00 2.02 -1.56 0.29 112.91 115.69 1l6i h THR 380 Ca 0.42 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.65 1l6i h THR 380 Cb 0.07 0.09 -0.05 0.00 -1.74 0.00 0.00 68.15 66.52 1l6i h THR 380 CO -0.15 0.00 0.01 0.25 0.37 0.00 0.00 175.52 176.00 1l6i h LEU 381 N -0.52 -0.10 -0.75 2.58 5.85 -1.59 0.41 115.31 121.19 1l6i h LEU 381 Ca 0.07 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1l6i h LEU 381 Cb 0.65 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1l6i h LEU 381 CO -0.42 -0.02 0.36 0.58 -0.34 0.00 0.00 178.44 178.60 1l6i h VAL 382 N 0.10 1.24 -0.66 1.05 2.07 -0.92 -0.03 116.25 119.10 1l6i h VAL 382 Ca 0.14 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 1l6i h VAL 382 Cb 0.18 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1l6i h VAL 382 CO -0.23 0.29 0.27 -0.08 0.02 0.00 0.00 177.57 177.83 1l6i h GLU 383 N 1.06 0.98 -0.50 1.57 4.57 -0.15 0.12 114.58 122.22 1l6i h GLU 383 Ca 0.26 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.21 1l6i h GLU 383 Cb 0.12 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1l6i h GLU 383 CO -0.03 0.81 0.07 -0.22 -1.18 0.00 0.00 179.01 178.47 1l6i h LYS 384 N 0.92 0.79 0.07 1.92 3.64 0.20 -1.56 116.57 122.56 1l6i h LYS 384 Ca 0.22 -0.18 -0.27 0.00 -1.27 0.00 0.00 60.65 59.15 1l6i h LYS 384 Cb 0.20 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1l6i h LYS 384 CO -0.02 0.75 -1.31 1.15 -2.27 0.00 0.00 179.45 177.75 1l6i h THR 385 N 0.75 1.38 -2.36 1.00 2.02 -0.60 -3.38 112.91 111.73 1l6i h THR 385 Ca 0.16 -3.05 -0.59 0.00 0.77 0.00 0.00 66.41 63.70 1l6i h THR 385 Cb 0.35 2.80 -0.40 0.00 -1.74 0.00 0.00 68.15 69.16 1l6i h THR 385 CO 0.01 0.85 -0.86 0.79 0.37 0.00 0.00 175.52 176.68 1l6i n TRP 386 N -3.40 1.00 -1.69 3.16 8.01 -0.01 -5.09 117.44 119.41 1l6i n TRP 386 Ca -0.09 -3.75 -0.65 0.00 -1.31 0.00 0.00 57.50 51.70 1l6i n TRP 386 Cb 1.01 -0.26 -0.09 0.00 -2.01 0.00 0.00 31.31 29.95 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 1.82 0.17 -1.03 -0.99 -0.02 -0.59 -1.99 135.00 132.37 1l6i n PRO 387 Ca 0.25 0.06 -0.02 0.00 -2.02 0.00 0.00 63.50 61.77 1l6i n PRO 387 Cb 0.46 -1.59 -0.01 0.00 -0.02 0.00 0.00 33.50 32.34 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 3.49 0.20 3.53 -1.23 0.00 -1.26 -4.95 105.19 104.98 1l6i n GLY 388 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.01 6.35 0.11 1.61 -1.08 -0.84 -4.87 116.67 115.94 1l6i s ASP 389 Ca 0.00 -0.28 0.27 0.00 -0.52 0.00 0.00 52.55 52.02 1l6i s ASP 389 Cb 0.00 -2.47 0.95 0.00 -1.46 0.00 0.00 42.92 39.94 1l6i s ASP 389 CO 0.00 -1.35 1.81 -0.62 0.52 0.00 0.00 175.17 175.53 1l6i n GLU 390 N 7.87 0.15 0.08 4.34 -0.58 -1.26 -2.35 120.64 128.89 1l6i n GLU 390 Ca 0.03 0.11 -0.22 0.00 -0.42 0.00 0.00 57.16 56.67 1l6i n GLU 390 Cb 0.48 -1.67 -0.14 0.00 -0.57 0.00 0.00 31.44 29.54 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 0.44 -0.32 3.49 6.56 -1.99 -1.24 116.57 123.50 1l6i h LYS 391 Ca 0.00 -0.69 -0.05 0.00 -1.06 0.00 0.00 60.65 58.85 1l6i h LYS 391 Cb 0.63 0.25 -0.02 0.00 -0.57 0.00 0.00 32.23 32.52 1l6i h LYS 391 CO 0.00 1.32 -0.03 0.28 -2.06 0.00 0.00 179.45 178.96 1l6i h VAL 392 N -0.08 1.20 -0.11 0.50 2.07 -1.95 -2.40 116.25 115.48 1l6i h VAL 392 Ca -0.18 -0.82 -0.23 0.00 0.82 0.00 0.00 66.70 66.29 1l6i h VAL 392 Cb 1.82 0.99 0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1l6i h VAL 392 CO 0.20 0.28 -0.82 -0.25 0.02 0.00 0.00 177.57 177.00 1l6i h TRP 393 N 0.49 1.04 -0.89 1.57 2.91 -1.41 -1.62 115.95 118.03 1l6i h TRP 393 Ca 0.10 -0.49 0.08 0.00 1.13 0.00 0.00 58.89 59.72 1l6i h TRP 393 Cb 0.36 -0.15 -0.06 0.00 -0.51 0.00 0.00 29.16 28.80 1l6i h TRP 393 CO 0.01 1.32 0.57 0.00 -1.03 0.00 0.00 178.44 179.32 1l6i h ALA 394 N 0.50 1.60 -0.09 2.65 0.00 -1.03 -0.30 119.26 122.59 1l6i h ALA 394 Ca -0.07 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 1l6i h ALA 394 Cb 1.46 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.03 1l6i h ALA 394 CO 0.17 0.24 -0.81 -0.22 0.00 0.00 0.00 179.25 178.62 1l6i h LYS 395 N 0.93 0.62 0.00 0.00 3.64 -1.08 -3.34 116.57 117.33 1l6i h LYS 395 Ca 0.40 -0.54 -0.08 0.00 -1.27 0.00 0.00 60.65 59.16 1l6i h LYS 395 Cb 0.33 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1l6i h LYS 395 CO -0.16 1.16 -1.58 1.28 -2.27 0.00 0.00 179.45 177.87 1l6i n LEU 396 N -3.87 0.48 -4.58 5.20 4.77 -0.64 -4.99 117.00 113.37 1l6i n LEU 396 Ca -0.07 0.20 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 1l6i n LEU 396 Cb 0.76 0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1l6i n LEU 396 CO 0.52 0.03 0.52 0.00 -1.33 0.00 0.00 177.39 177.13 1l6i n ALA 397 N -2.32 -0.20 0.11 -1.18 0.00 -0.16 -4.90 120.51 111.85 1l6i n ALA 397 Ca -0.07 0.30 -0.16 0.00 0.00 0.00 0.00 53.44 53.50 1l6i n ALA 397 Cb 0.69 -2.02 -0.13 0.00 0.00 0.00 0.00 19.45 17.99 1l6i n ALA 397 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1l6i h VAL 398 N 1.67 1.48 -3.28 0.00 2.07 -1.90 -3.43 116.25 112.86 1l6i h VAL 398 Ca -0.42 -3.00 -0.62 0.00 0.82 0.00 0.00 66.70 63.47 1l6i h VAL 398 Cb 1.35 2.92 -0.34 0.00 -1.52 0.00 0.00 31.29 33.70 1l6i h VAL 398 CO 0.58 0.88 -0.85 -0.69 0.02 0.00 0.00 177.57 177.51 1l6i s VAL 399 N -2.69 1.75 -0.27 2.57 1.01 -1.26 -1.27 120.40 120.23 1l6i s VAL 399 Ca -0.04 -0.81 -0.25 0.00 0.00 0.00 0.00 61.98 60.88 1l6i s VAL 399 Cb 0.07 -1.56 0.11 0.00 0.00 0.00 0.00 36.38 35.00 1l6i s VAL 399 CO 0.89 0.49 0.97 -2.28 0.00 0.00 0.00 175.10 175.17 1l6i s HIS 400 N 0.76 -0.53 -1.49 5.22 5.04 -0.62 -4.92 115.29 118.75 1l6i s HIS 400 Ca -0.10 1.28 -0.12 0.00 -1.54 0.00 0.00 55.06 54.58 1l6i s HIS 400 Cb -0.16 0.35 0.07 0.00 0.04 0.00 0.00 32.58 32.88 1l6i s HIS 400 CO 0.01 -0.27 0.98 -3.47 -2.34 0.00 0.00 174.74 169.66 1l6i n ASP 401 N 2.23 -5.17 -0.17 9.88 2.03 -1.26 -1.48 116.55 122.62 1l6i n ASP 401 Ca -0.13 -0.68 -0.02 0.00 0.52 0.00 0.00 54.79 54.48 1l6i n ASP 401 Cb 0.56 -4.12 -0.01 0.00 -0.72 0.00 0.00 41.12 36.83 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 -4.67 -0.67 -4.24 -0.67 4.76 -1.26 -4.98 118.16 106.42 1l6i n LYS 402 Ca 0.03 0.35 -0.20 0.00 -2.87 0.00 0.00 58.31 55.62 1l6i n LYS 402 Cb 0.54 -3.98 -0.12 0.00 -1.84 0.00 0.00 35.03 29.63 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 -1.28 1.02 -0.14 1.97 -0.21 -0.55 -0.56 119.66 119.91 1l6i s GLN 403 Ca 0.00 -1.16 -0.14 0.00 0.02 0.00 0.00 55.36 54.08 1l6i s GLN 403 Cb 0.00 -1.04 -0.05 0.00 1.00 0.00 0.00 33.01 32.92 1l6i s GLN 403 CO 0.00 0.22 0.31 0.08 -2.12 0.00 0.00 175.29 173.78 1l6i s VAL 404 N -1.67 5.28 -0.53 1.09 1.01 0.25 -1.59 120.40 124.23 1l6i s VAL 404 Ca 0.06 0.59 -0.16 0.00 0.00 0.00 0.00 61.98 62.48 1l6i s VAL 404 Cb -0.08 -3.64 0.11 0.00 0.00 0.00 0.00 36.38 32.78 1l6i s VAL 404 CO 0.03 0.42 0.49 -1.00 0.00 0.00 0.00 175.10 175.04 1l6i s HIS 405 N 0.20 3.24 0.06 5.22 0.09 -0.40 -1.17 115.29 122.53 1l6i s HIS 405 Ca 0.18 -1.18 -0.20 0.00 -0.00 0.00 0.00 55.06 53.86 1l6i s HIS 405 Cb -0.13 -3.66 -0.12 0.00 -0.00 0.00 0.00 32.58 28.67 1l6i s HIS 405 CO 0.05 -0.98 1.42 0.52 -0.00 0.00 0.00 174.74 175.76 1l6i h MET 406 N 8.87 0.39 -0.56 1.40 2.86 -1.78 -1.86 114.93 124.24 1l6i h MET 406 Ca -0.30 -0.17 0.11 0.00 -2.06 0.00 0.00 59.70 57.29 1l6i h MET 406 Cb 1.10 -0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.66 1l6i h MET 406 CO 1.00 0.68 -0.00 0.00 1.06 0.00 0.00 176.91 179.65 1l6i h ALA 407 N 0.70 0.54 -0.67 6.32 0.00 -1.90 0.64 119.26 124.87 1l6i h ALA 407 Ca 0.04 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1l6i h ALA 407 Cb 0.56 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1l6i h ALA 407 CO 0.03 -0.39 0.38 -0.91 0.00 0.00 0.00 179.25 178.36 1l6i h ASN 408 N 0.12 0.83 -0.48 0.00 4.21 -1.89 0.25 115.58 118.63 1l6i h ASN 408 Ca 0.29 -0.09 -0.01 0.00 1.21 0.00 0.00 56.30 57.70 1l6i h ASN 408 Cb 0.45 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 37.41 1l6i h ASN 408 CO -0.48 0.68 0.27 0.25 -1.29 0.00 0.00 177.43 176.86 1l6i h LEU 409 N 0.92 0.62 -0.74 1.61 5.85 -0.41 -0.52 115.31 122.64 1l6i h LEU 409 Ca 0.24 -0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.78 1l6i h LEU 409 Cb 0.02 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1l6i h LEU 409 CO -0.04 0.51 -0.58 0.00 -0.34 0.00 0.00 178.44 177.99 1l6i h VAL 411 N 0.11 1.40 -0.04 0.00 3.04 0.28 -3.18 116.25 117.86 1l6i h VAL 411 Ca -0.00 -2.51 -0.16 0.00 -1.01 0.00 0.00 66.70 63.02 1l6i h VAL 411 Cb 1.06 2.49 -0.01 0.00 -2.01 0.00 0.00 31.29 32.82 1l6i h VAL 411 CO 0.08 0.75 -0.69 0.58 -1.01 0.00 0.00 177.57 177.29 1l6i h VAL 412 N 0.22 1.43 -0.00 1.51 2.07 -1.08 -3.33 116.25 117.07 1l6i h VAL 412 Ca -0.09 -2.19 0.00 0.00 0.82 0.00 0.00 66.70 65.23 1l6i h VAL 412 Cb 1.65 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 33.58 1l6i h VAL 412 CO 0.17 0.64 -0.60 0.61 0.02 0.00 0.00 177.57 178.42 1l6i n GLY 413 N 0.45 -1.17 0.00 2.17 0.00 -0.30 -4.97 105.19 101.37 1l6i n GLY 413 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.50 5.43 0.47 -0.02 0.00 -1.20 -3.88 105.19 107.49 1l6i n GLY 414 Ca 0.05 -2.13 0.05 0.00 0.00 0.00 0.00 46.02 43.99 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 0.00 0.19 -3.64 1.61 -1.74 -0.38 -4.93 117.46 108.57 1l6i n PHE 415 Ca 0.00 -0.23 -0.10 0.00 -0.56 0.00 0.00 57.45 56.56 1l6i n PHE 415 Cb 0.00 -0.01 -0.07 0.00 1.52 0.00 0.00 39.48 40.92 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 -0.90 -1.91 -0.06 1.98 0.00 -1.26 -4.76 121.76 114.84 1l6i s ALA 416 Ca 0.16 2.03 0.01 0.00 0.00 0.00 0.00 51.96 54.15 1l6i s ALA 416 Cb 0.09 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.87 1l6i s ALA 416 CO 0.13 -0.30 -0.07 0.08 0.00 0.00 0.00 175.76 175.60 1l6i s VAL 417 N 0.54 0.80 0.10 0.00 1.01 -0.79 -0.26 120.40 121.79 1l6i s VAL 417 Ca -0.01 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 61.80 1l6i s VAL 417 Cb -0.05 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 1l6i s VAL 417 CO -0.06 0.29 -0.18 0.54 0.00 0.00 0.00 175.10 175.70 1l6i s ASN 418 N 1.03 2.19 0.59 3.32 4.22 -0.57 -0.58 114.94 125.14 1l6i s ASN 418 Ca -0.09 -0.68 0.08 0.00 -2.14 0.00 0.00 52.86 50.03 1l6i s ASN 418 Cb -0.14 -0.10 0.10 0.00 1.28 0.00 0.00 41.25 42.39 1l6i s ASN 418 CO -0.00 -0.02 0.80 0.61 -2.04 0.00 0.00 177.10 176.46 1l6i n GLY 419 N 1.05 1.75 0.21 0.45 0.00 -0.87 -0.84 105.19 106.93 1l6i n GLY 419 Ca -0.19 -2.19 0.04 0.00 0.00 0.00 0.00 46.02 43.68 1l6i n GLY 419 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1l6i n VAL 420 N -2.31 1.37 -3.57 1.61 0.24 -1.26 -2.38 118.33 112.02 1l6i n VAL 420 Ca 0.16 -1.43 -0.12 0.00 -2.04 0.00 0.00 64.34 60.90 1l6i n VAL 420 Cb 0.58 0.23 -0.06 0.00 -1.47 0.00 0.00 33.84 33.12 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 -1.69 -1.89 0.19 2.33 0.00 -1.26 -1.32 121.76 118.13 1l6i s ALA 421 Ca 0.16 1.57 -0.24 0.00 0.00 0.00 0.00 51.96 53.45 1l6i s ALA 421 Cb 0.13 -0.63 0.08 0.00 0.00 0.00 0.00 23.12 22.70 1l6i s ALA 421 CO 0.04 -0.32 1.55 0.00 0.00 0.00 0.00 175.76 177.03 1l6i h ALA 422 N 2.94 -0.21 -0.70 0.00 0.00 -1.92 0.25 119.26 119.62 1l6i h ALA 422 Ca -0.22 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1l6i h ALA 422 Cb 1.16 1.16 -0.03 0.00 0.00 0.00 0.00 17.79 20.07 1l6i h ALA 422 CO 0.30 -0.80 0.35 1.25 0.00 0.00 0.00 179.25 180.35 1l6i h LEU 423 N -0.04 0.90 0.12 0.00 6.46 -1.93 -2.15 115.31 118.68 1l6i h LEU 423 Ca 0.24 -0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 1l6i h LEU 423 Cb 0.52 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1l6i h LEU 423 CO -0.92 0.77 -0.06 -0.74 -0.62 0.00 0.00 178.44 176.87 1l6i h HIS 424 N 0.97 -0.15 0.00 1.25 2.76 -1.18 -1.64 115.15 117.15 1l6i h HIS 424 Ca 0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 1l6i h HIS 424 Cb 0.10 0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.11 1l6i h HIS 424 CO 0.00 0.01 0.00 0.43 -1.30 0.00 0.00 177.93 177.07 1l6i n SER 425 N -5.10 0.59 0.04 3.26 7.64 0.65 -0.63 113.62 120.08 1l6i n SER 425 Ca -0.08 0.71 -0.21 0.00 1.01 0.00 0.00 58.87 60.30 1l6i n SER 425 Cb 0.14 -0.81 -0.14 0.00 -1.01 0.00 0.00 64.21 62.38 1l6i n SER 425 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1l6i h ASP 426 N 0.00 0.47 0.02 6.43 3.58 -0.65 -3.17 116.42 123.09 1l6i h ASP 426 Ca 0.00 -0.91 -0.02 0.00 0.42 0.00 0.00 57.03 56.52 1l6i h ASP 426 Cb 0.16 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 1l6i h ASP 426 CO 0.00 1.50 -0.04 -0.07 -2.88 0.00 0.00 179.24 177.75 1l6i h LEU 427 N -0.30 0.06 -0.80 2.28 3.38 -0.31 0.10 115.31 119.73 1l6i h LEU 427 Ca -0.21 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1l6i h LEU 427 Cb 1.73 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.43 1l6i h LEU 427 CO 0.13 0.12 0.32 0.58 0.09 0.00 0.00 178.44 179.68 1l6i h VAL 428 N 0.07 1.26 0.04 1.22 2.07 -0.91 -1.23 116.25 118.77 1l6i h VAL 428 Ca 0.02 -0.82 -0.26 0.00 0.82 0.00 0.00 66.70 66.47 1l6i h VAL 428 Cb 0.12 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 1l6i h VAL 428 CO 0.01 0.34 -1.29 0.58 0.02 0.00 0.00 177.57 177.22 1l6i h VAL 429 N 1.16 1.39 0.04 2.57 2.07 -1.40 -0.99 116.25 121.09 1l6i h VAL 429 Ca 0.27 -3.10 -0.30 0.00 0.82 0.00 0.00 66.70 64.39 1l6i h VAL 429 Cb 0.21 2.75 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 1l6i h VAL 429 CO -0.02 0.83 -1.69 0.11 0.02 0.00 0.00 177.57 176.82 1l6i h LYS 430 N 0.02 0.08 0.00 1.57 1.57 -0.85 -2.79 116.57 116.17 1l6i h LYS 430 Ca -0.13 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 1l6i h LYS 430 Cb 1.90 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 34.24 1l6i h LYS 430 CO 0.14 0.73 -1.37 -0.25 -0.57 0.00 0.00 179.45 178.12 1l6i n ASP 431 N -3.19 3.45 -0.13 0.86 9.92 -0.50 -4.54 116.55 122.41 1l6i n ASP 431 Ca -0.18 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.79 1l6i n ASP 431 Cb 1.04 0.96 -0.09 0.00 -0.64 0.00 0.00 41.12 42.39 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 -2.00 1.87 -2.53 0.64 7.94 -1.01 -4.76 117.00 117.15 1l6i n LEU 432 Ca -0.06 0.32 -0.13 0.00 -1.11 0.00 0.00 56.01 55.04 1l6i n LEU 432 Cb 0.46 -0.78 0.03 0.00 0.53 0.00 0.00 43.42 43.66 1l6i n LEU 432 CO 0.14 0.54 0.05 0.49 -1.11 0.00 0.00 177.39 177.50 1l6i n PHE 433 N -4.19 1.97 -0.13 1.96 3.72 -0.39 -4.93 117.46 115.47 1l6i n PHE 433 Ca -0.52 -2.46 -0.04 0.00 -0.05 0.00 0.00 57.45 54.39 1l6i n PHE 433 Cb 0.87 -0.27 0.04 0.00 -0.94 0.00 0.00 39.48 39.18 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 2.58 0.12 -0.25 -1.08 0.11 -1.71 -1.68 132.00 130.08 1l6i h PRO 434 Ca 0.07 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.14 1l6i h PRO 434 Cb 1.27 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1l6i h PRO 434 CO 0.51 0.08 0.03 0.93 -0.21 0.00 0.00 178.00 179.34 1l6i h GLU 435 N 0.12 0.42 -0.51 1.05 3.07 -1.92 -0.97 114.58 115.85 1l6i h GLU 435 Ca 0.21 -0.12 0.05 0.00 -0.50 0.00 0.00 59.36 59.00 1l6i h GLU 435 Cb 0.31 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.14 1l6i h GLU 435 CO -0.35 0.56 0.34 1.88 -1.40 0.00 0.00 179.01 180.04 1l6i h TYR 436 N 0.23 0.50 -0.24 4.33 0.05 -1.86 -0.20 116.97 119.77 1l6i h TYR 436 Ca 0.08 0.01 -0.15 0.00 0.05 0.00 0.00 58.73 58.71 1l6i h TYR 436 Cb 0.35 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 1l6i h TYR 436 CO 0.02 0.28 -0.48 1.25 -1.05 0.00 0.00 178.16 178.19 1l6i h HIS 437 N 0.51 0.79 -0.22 4.88 2.76 -1.05 0.55 115.15 123.37 1l6i h HIS 437 Ca 0.21 -0.26 0.05 0.00 -2.20 0.00 0.00 60.37 58.18 1l6i h HIS 437 Cb 0.20 -0.16 -0.06 0.00 1.55 0.00 0.00 27.41 28.95 1l6i h HIS 437 CO -0.00 1.00 -0.15 1.96 -1.30 0.00 0.00 177.93 179.44 1l6i h GLN 438 N 0.51 -0.14 -0.60 5.26 4.20 0.33 0.12 115.11 124.80 1l6i h GLN 438 Ca 0.03 0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 1l6i h GLN 438 Cb 1.02 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 1l6i h GLN 438 CO 0.10 -0.09 0.02 -0.07 -0.67 0.00 0.00 178.83 178.11 1l6i h LEU 439 N -0.15 1.00 -5.99 1.46 3.38 -0.71 -3.36 115.31 110.95 1l6i h LEU 439 Ca 0.13 -0.27 -0.56 0.00 0.09 0.00 0.00 57.88 57.26 1l6i h LEU 439 Cb 0.33 -0.27 -0.40 0.00 0.09 0.00 0.00 40.66 40.41 1l6i h LEU 439 CO -0.31 1.04 -0.93 0.79 0.09 0.00 0.00 178.44 179.12 1l6i n TRP 440 N -4.19 1.29 -0.17 1.13 8.01 0.19 -4.99 117.44 118.72 1l6i n TRP 440 Ca 0.03 -3.81 -0.02 0.00 -1.31 0.00 0.00 57.50 52.38 1l6i n TRP 440 Cb 0.33 -0.43 0.07 0.00 -2.01 0.00 0.00 31.31 29.27 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 3.80 0.32 0.00 -0.99 0.13 -0.93 -2.32 132.00 132.01 1l6i h PRO 441 Ca 0.12 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1l6i h PRO 441 Cb 0.79 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1l6i h PRO 441 CO 0.61 0.21 0.00 0.09 -0.23 0.00 0.00 178.00 178.68 1l6i n ASN 442 N -5.03 0.00 0.02 1.44 3.02 -1.26 -2.80 115.26 110.65 1l6i n ASN 442 Ca 0.06 -0.32 0.11 0.00 -0.03 0.00 0.00 54.58 54.40 1l6i n ASN 442 Cb 0.22 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.42 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 -0.86 0.21 -3.60 3.52 4.81 -0.87 -4.92 118.16 116.45 1l6i n LYS 443 Ca 0.04 -0.01 -0.37 0.00 -0.87 0.00 0.00 58.31 57.11 1l6i n LYS 443 Cb 0.02 -1.56 -0.07 0.00 0.02 0.00 0.00 35.03 33.44 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 -3.15 3.55 0.26 5.64 0.40 -1.12 -1.89 117.98 121.67 1l6i s PHE 444 Ca 0.05 0.67 0.02 0.00 -0.60 0.00 0.00 56.93 57.07 1l6i s PHE 444 Cb 0.15 -2.25 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 1l6i s PHE 444 CO 0.80 0.43 0.17 -1.01 0.70 0.00 0.00 175.22 176.31 1l6i s HIS 445 N -0.17 1.43 -0.04 0.36 3.76 0.25 -4.98 115.29 115.89 1l6i s HIS 445 Ca 0.18 -1.44 0.06 0.00 -0.15 0.00 0.00 55.06 53.70 1l6i s HIS 445 Cb -0.14 -0.68 -0.02 0.00 1.11 0.00 0.00 32.58 32.86 1l6i s HIS 445 CO 0.06 -0.66 -0.21 1.21 -0.85 0.00 0.00 174.74 174.29 1l6i s ASN 446 N -3.27 3.49 -0.12 1.40 3.04 -1.26 -2.06 114.94 116.16 1l6i s ASN 446 Ca 0.39 -0.36 -0.04 0.00 0.04 0.00 0.00 52.86 52.89 1l6i s ASN 446 Cb 0.05 -0.69 0.05 0.00 -1.54 0.00 0.00 41.25 39.12 1l6i s ASN 446 CO 0.17 0.31 0.10 -0.69 -3.04 0.00 0.00 177.10 173.95 1l6i s VAL 447 N -0.53 -0.13 0.40 -5.21 1.01 -1.00 -4.93 120.40 110.01 1l6i s VAL 447 Ca 0.07 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.90 1l6i s VAL 447 Cb -0.11 -0.40 -0.09 0.00 0.00 0.00 0.00 36.38 35.78 1l6i s VAL 447 CO 0.01 -0.06 1.26 -0.89 0.00 0.00 0.00 175.10 175.41 1l6i s THR 448 N 2.18 2.79 1.37 3.92 2.01 -1.26 -4.07 115.64 122.59 1l6i s THR 448 Ca 0.04 0.70 -0.21 0.00 0.31 0.00 0.00 61.69 62.53 1l6i s THR 448 Cb -0.14 -3.41 0.35 0.00 0.01 0.00 0.00 72.50 69.31 1l6i s THR 448 CO -0.07 0.10 0.96 0.20 -0.69 0.00 0.00 174.62 175.12 1l6i s ASN 449 N -0.84 -0.66 0.13 3.53 0.01 -0.43 -4.59 114.94 112.10 1l6i s ASN 449 Ca 0.56 0.93 -0.25 0.00 -0.71 0.00 0.00 52.86 53.39 1l6i s ASN 449 Cb -0.36 -1.34 0.08 0.00 0.41 0.00 0.00 41.25 40.04 1l6i s ASN 449 CO 0.46 -5.12 1.07 -0.83 -1.51 0.00 0.00 177.10 171.16 1l6i s GLY 450 N -3.11 -0.09 0.08 0.66 0.00 -1.26 -4.82 107.32 98.78 1l6i s GLY 450 Ca 0.69 -0.02 -0.00 0.00 0.00 0.00 0.00 44.72 45.39 1l6i s GLY 450 CO 0.59 1.52 -0.02 -0.26 0.00 0.00 0.00 173.10 174.93 1l6i s ILE 451 N -2.56 0.29 -0.11 0.90 -5.25 -0.59 -4.55 121.20 109.33 1l6i s ILE 451 Ca 0.18 -1.86 -0.18 0.00 -0.99 0.00 0.00 60.65 57.80 1l6i s ILE 451 Cb -0.01 -1.68 -0.04 0.00 2.95 0.00 0.00 42.46 43.68 1l6i s ILE 451 CO 0.03 -0.85 0.48 0.28 -1.79 0.00 0.00 174.94 173.09 1l6i s THR 452 N -3.89 5.17 0.12 8.37 -1.32 -1.26 -1.42 115.64 121.42 1l6i s THR 452 Ca 0.12 0.96 0.32 0.00 -1.21 0.00 0.00 61.69 61.88 1l6i s THR 452 Cb 0.07 -3.82 0.36 0.00 -1.51 0.00 0.00 72.50 67.61 1l6i s THR 452 CO -0.06 0.34 1.96 -0.65 -2.21 0.00 0.00 174.62 174.00 1l6i h PRO 453 N 6.62 0.00 0.00 7.08 0.11 -1.93 -1.43 132.00 142.46 1l6i h PRO 453 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1l6i h PRO 453 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1l6i h PRO 453 CO 0.75 0.05 0.00 0.54 -0.21 0.00 0.00 178.00 179.13 1l6i n ARG 454 N -3.17 0.00 -0.27 1.05 3.00 -1.26 -0.67 116.66 115.35 1l6i n ARG 454 Ca 0.00 0.40 -0.07 0.00 -0.01 0.00 0.00 57.85 58.17 1l6i n ARG 454 Cb 0.32 -1.31 0.05 0.00 0.00 0.00 0.00 32.46 31.53 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 1.15 -0.00 5.56 2.43 -1.96 -0.41 114.38 121.14 1l6i h ARG 455 Ca 0.00 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1l6i h ARG 455 Cb 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1l6i h ARG 455 CO 0.00 0.98 -0.08 0.91 -1.51 0.00 0.00 179.97 180.27 1l6i n TRP 456 N -4.26 0.00 0.15 2.20 7.02 -0.54 -2.92 117.44 119.09 1l6i n TRP 456 Ca 0.06 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.54 1l6i n TRP 456 Cb 0.23 -0.17 0.00 0.00 -2.42 0.00 0.00 31.31 28.95 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 -0.95 0.02 -0.32 -0.99 5.41 -0.48 -4.81 119.36 117.24 1l6i n ILE 457 Ca 0.16 0.01 0.09 0.00 1.00 0.00 0.00 62.75 64.00 1l6i n ILE 457 Cb 0.26 -0.52 0.29 0.00 -0.71 0.00 0.00 39.64 38.96 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 0.86 0.00 0.38 3.64 -0.29 -2.14 116.57 119.02 1l6i h LYS 458 Ca 0.00 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.19 1l6i h LYS 458 Cb 0.00 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 1l6i h LYS 458 CO 0.00 0.57 -0.79 0.37 -2.27 0.00 0.00 179.45 177.33 1l6i h GLN 459 N 0.88 0.00 0.00 1.90 4.15 -1.17 -3.35 115.11 117.52 1l6i h GLN 459 Ca 0.47 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.89 1l6i h GLN 459 Cb 0.55 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1l6i h GLN 459 CO -0.24 0.91 -0.24 0.00 -1.93 0.00 0.00 178.83 177.34 1l6i n ASN 461 N -2.82 1.74 0.09 0.00 2.85 -0.80 -4.84 115.26 111.47 1l6i n ASN 461 Ca 0.03 -3.09 0.03 0.00 -0.11 0.00 0.00 54.58 51.44 1l6i n ASN 461 Cb 0.51 -0.63 0.40 0.00 1.24 0.00 0.00 39.78 41.31 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 3.54 0.31 -0.41 1.20 0.13 -1.72 -0.39 132.00 134.66 1l6i h PRO 462 Ca 0.11 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 1l6i h PRO 462 Cb 0.81 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.87 1l6i h PRO 462 CO 0.60 0.37 0.11 0.00 -0.23 0.00 0.00 178.00 178.86 1l6i h ALA 463 N 1.67 0.53 -0.82 -0.56 0.00 -1.92 -1.06 119.26 117.10 1l6i h ALA 463 Ca 0.07 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1l6i h ALA 463 Cb 0.27 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1l6i h ALA 463 CO 0.01 0.19 0.52 1.25 0.00 0.00 0.00 179.25 181.23 1l6i h LEU 464 N 0.51 0.87 -0.38 0.00 5.85 -1.61 -1.88 115.31 118.69 1l6i h LEU 464 Ca 0.13 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 1l6i h LEU 464 Cb 0.28 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1l6i h LEU 464 CO -0.00 0.60 -0.03 0.00 -0.34 0.00 0.00 178.44 178.67 1l6i h ALA 465 N 1.34 0.51 -0.63 1.25 0.00 -0.94 -2.04 119.26 118.74 1l6i h ALA 465 Ca 0.32 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1l6i h ALA 465 Cb -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1l6i h ALA 465 CO -0.11 0.31 0.42 0.00 0.00 0.00 0.00 179.25 179.87 1l6i h ALA 466 N 0.86 0.81 -0.58 0.00 0.00 -1.12 -0.93 119.26 118.30 1l6i h ALA 466 Ca 0.10 -0.04 0.16 0.00 0.00 0.00 0.00 54.91 55.13 1l6i h ALA 466 Cb 0.51 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1l6i h ALA 466 CO 0.02 0.22 0.41 1.25 0.00 0.00 0.00 179.25 181.16 1l6i h LEU 467 N 0.85 0.04 0.02 0.00 5.85 -0.72 -0.63 115.31 120.73 1l6i h LEU 467 Ca 0.24 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.69 1l6i h LEU 467 Cb -0.08 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1l6i h LEU 467 CO -0.06 0.02 -1.43 -0.07 -0.34 0.00 0.00 178.44 176.56 1l6i h LEU 468 N 0.04 0.08 -0.93 2.25 3.38 -0.61 -1.92 115.31 117.60 1l6i h LEU 468 Ca 0.28 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1l6i h LEU 468 Cb 1.04 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 1l6i h LEU 468 CO -0.01 1.10 0.30 0.44 0.09 0.00 0.00 178.44 180.36 1l6i h ASP 469 N 0.01 0.99 -0.04 -0.43 3.32 -0.40 -1.00 116.42 118.88 1l6i h ASP 469 Ca -0.18 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.71 1l6i h ASP 469 Cb 1.93 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 41.22 1l6i h ASP 469 CO 0.11 0.87 -0.05 0.50 -1.72 0.00 0.00 179.24 178.95 1l6i h LYS 470 N 1.05 0.10 0.00 3.56 3.64 -0.98 -3.32 116.57 120.63 1l6i h LYS 470 Ca 0.25 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1l6i h LYS 470 Cb 0.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1l6i h LYS 470 CO -0.02 0.60 -0.35 0.77 -2.27 0.00 0.00 179.45 178.17 1l6i h SER 471 N -0.39 0.00 -3.85 4.20 0.02 -1.30 -3.45 113.55 108.79 1l6i h SER 471 Ca 0.00 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 1l6i h SER 471 Cb 0.58 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.92 1l6i h SER 471 CO 0.01 0.35 -0.75 -0.76 -1.14 0.00 0.00 176.83 174.54 1l6i s LEU 472 N -7.03 2.89 0.14 5.07 1.43 -0.39 -5.01 118.68 115.78 1l6i s LEU 472 Ca 0.00 -0.21 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 1l6i s LEU 472 Cb 0.11 -1.65 0.01 0.00 0.03 0.00 0.00 46.19 44.69 1l6i s LEU 472 CO 0.68 0.31 1.61 -0.61 0.23 0.00 0.00 176.35 178.57 1l6i h GLN 473 N 4.90 0.77 -6.13 1.70 4.15 -1.87 -3.45 115.11 115.17 1l6i h GLN 473 Ca -0.48 -0.22 -0.53 0.00 0.77 0.00 0.00 58.65 58.20 1l6i h GLN 473 Cb 1.16 -0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.70 1l6i h GLN 473 CO 0.51 0.80 -0.52 0.15 -1.93 0.00 0.00 178.83 177.84 1l6i s LYS 474 N -5.14 2.49 0.13 1.69 1.02 -1.26 -5.08 119.74 113.59 1l6i s LYS 474 Ca -0.13 -1.45 -0.31 0.00 0.02 0.00 0.00 55.97 54.10 1l6i s LYS 474 Cb 0.11 -2.27 -0.10 0.00 -0.52 0.00 0.00 37.83 35.04 1l6i s LYS 474 CO 0.80 0.14 1.82 -2.00 -0.92 0.00 0.00 175.35 175.18 1l6i s GLU 475 N -3.87 4.14 -0.02 1.68 2.56 -1.26 -4.89 118.70 117.04 1l6i s GLU 475 Ca 0.38 2.59 0.22 0.00 0.00 0.00 0.00 54.97 58.15 1l6i s GLU 475 Cb -0.04 -3.55 -0.30 0.00 2.00 0.00 0.00 34.13 32.24 1l6i s GLU 475 CO 0.24 -0.83 0.62 -2.67 -0.56 0.00 0.00 175.26 172.06 1l6i n TRP 476 N 5.54 0.00 0.25 5.30 4.27 -1.26 -4.39 117.44 127.15 1l6i n TRP 476 Ca 0.17 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.86 1l6i n TRP 476 Cb 0.38 -0.33 0.62 0.00 -1.36 0.00 0.00 31.31 30.62 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 2.34 1.90 -0.19 -1.67 0.00 -1.96 -1.29 119.26 118.38 1l6i h ALA 477 Ca 0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1l6i h ALA 477 Cb 0.83 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 18.34 1l6i h ALA 477 CO 0.00 0.06 -0.85 0.27 0.00 0.00 0.00 179.25 178.73 1l6i n ASN 478 N -4.45 1.93 -2.73 0.00 6.94 -1.26 -4.47 115.26 111.22 1l6i n ASN 478 Ca -0.03 -2.88 -0.08 0.00 -0.02 0.00 0.00 54.58 51.56 1l6i n ASN 478 Cb 0.13 -0.41 0.08 0.00 -2.36 0.00 0.00 39.78 37.22 1l6i n ASN 478 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1l6i n ASP 479 N -0.39 -2.46 0.26 0.53 -0.08 -0.55 -5.01 116.55 108.84 1l6i n ASP 479 Ca 0.16 -3.47 0.18 0.00 -1.51 0.00 0.00 54.79 50.14 1l6i n ASP 479 Cb 0.92 1.85 0.89 0.00 2.34 0.00 0.00 41.12 47.12 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 3.29 0.00 0.00 -2.67 5.85 -1.67 -1.65 115.31 118.45 1l6i h LEU 480 Ca -0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1l6i h LEU 480 Cb 1.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.11 1l6i h LEU 480 CO 0.18 0.00 0.00 0.47 -0.34 0.00 0.00 178.44 178.75 1l6i n ASP 481 N -2.77 0.00 0.08 1.25 8.00 -1.26 -1.97 116.55 119.88 1l6i n ASP 481 Ca -0.01 0.26 0.10 0.00 0.71 0.00 0.00 54.79 55.85 1l6i n ASP 481 Cb 0.11 -0.37 0.42 0.00 -0.02 0.00 0.00 41.12 41.27 1l6i n ASP 481 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1l6i n GLN 482 N -1.37 0.12 0.27 -1.24 1.13 -0.62 -2.43 117.38 113.25 1l6i n GLN 482 Ca 0.04 0.36 0.16 0.00 -1.94 0.00 0.00 57.00 55.63 1l6i n GLN 482 Cb 0.11 -1.74 0.69 0.00 0.11 0.00 0.00 30.24 29.41 1l6i n GLN 482 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1l6i h LEU 483 N 0.00 0.00 -2.10 1.08 4.07 -1.63 -2.56 115.31 114.17 1l6i h LEU 483 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 1l6i h LEU 483 Cb 0.32 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.06 1l6i h LEU 483 CO 0.00 0.05 0.04 -0.29 -1.08 0.00 0.00 178.44 177.16 1l6i h ILE 484 N 0.00 0.87 0.00 1.22 6.09 -1.31 -1.14 117.51 123.24 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 0.50 0.97 0.00 0.00 0.47 0.00 0.00 36.82 38.76 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 -4.37 0.00 -0.07 2.19 3.02 -0.96 -1.89 115.26 113.17 1l6i n ASN 485 Ca -0.02 -0.17 0.13 0.00 -0.03 0.00 0.00 54.58 54.49 1l6i n ASN 485 Cb 0.14 0.00 0.35 0.00 -0.61 0.00 0.00 39.78 39.65 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 -0.99 0.59 -0.26 3.41 4.77 -0.43 -4.25 117.00 119.84 1l6i n LEU 486 Ca 0.04 -0.02 0.07 0.00 -0.03 0.00 0.00 56.01 56.06 1l6i n LEU 486 Cb 0.02 -0.23 0.21 0.00 -2.33 0.00 0.00 43.42 41.08 1l6i n LEU 486 CO 0.03 0.13 0.98 -0.33 -1.33 0.00 0.00 177.39 176.87 1l6i h GLU 487 N 0.36 0.34 0.00 3.23 5.08 -1.58 -2.01 114.58 120.01 1l6i h GLU 487 Ca 0.00 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1l6i h GLU 487 Cb 0.49 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1l6i h GLU 487 CO 0.00 0.23 -0.16 1.57 -1.00 0.00 0.00 179.01 179.64 1l6i h LYS 488 N 0.35 0.00 0.00 2.33 5.09 -1.85 -2.99 116.57 119.50 1l6i h LYS 488 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.18 1l6i h LYS 488 Cb 0.75 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.08 1l6i h LYS 488 CO -0.48 0.16 0.00 0.74 -2.09 0.00 0.00 179.45 177.78 1l6i h PHE 489 N 0.00 0.00 0.00 0.07 0.04 -1.64 -1.54 116.94 113.87 1l6i h PHE 489 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1l6i h PHE 489 Cb 0.54 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 1l6i h PHE 489 CO 0.00 0.00 -0.04 0.00 -0.60 0.00 0.00 178.31 177.67 1l6i h ALA 490 N 2.09 1.06 0.00 2.45 0.00 -1.61 -0.17 119.26 123.09 1l6i h ALA 490 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1l6i h ALA 490 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1l6i h ALA 490 CO 0.00 0.05 -0.03 -0.25 0.00 0.00 0.00 179.25 179.02 1l6i n ASP 491 N -3.23 0.09 -4.52 0.00 8.00 -0.58 -4.77 116.55 111.54 1l6i n ASP 491 Ca -0.01 0.46 -0.42 0.00 0.71 0.00 0.00 54.79 55.53 1l6i n ASP 491 Cb 0.24 -0.47 -0.08 0.00 -0.02 0.00 0.00 41.12 40.79 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 -3.12 6.27 0.33 -2.24 -1.08 -0.07 -4.98 116.67 111.78 1l6i s ASP 492 Ca 0.14 -0.32 0.06 0.00 -0.52 0.00 0.00 52.55 51.91 1l6i s ASP 492 Cb 0.18 -2.26 0.73 0.00 -1.46 0.00 0.00 42.92 40.12 1l6i s ASP 492 CO 0.55 -0.57 1.86 0.00 0.52 0.00 0.00 175.17 177.52 1l6i h ALA 493 N 8.64 1.73 -0.31 3.66 0.00 -1.86 -0.19 119.26 130.93 1l6i h ALA 493 Ca -0.27 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1l6i h ALA 493 Cb 1.11 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1l6i h ALA 493 CO 0.80 0.02 -0.41 -0.22 0.00 0.00 0.00 179.25 179.45 1l6i h LYS 494 N 0.79 0.75 -0.37 0.00 3.64 -1.93 -0.96 116.57 118.49 1l6i h LYS 494 Ca 0.47 -0.40 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1l6i h LYS 494 Cb 0.65 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1l6i h LYS 494 CO -0.23 1.02 -0.04 0.35 -2.27 0.00 0.00 179.45 178.28 1l6i h PHE 495 N 0.61 0.74 -0.42 1.91 3.04 -1.69 -0.63 116.94 120.50 1l6i h PHE 495 Ca 0.05 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 61.83 1l6i h PHE 495 Cb 0.96 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.26 1l6i h PHE 495 CO 0.05 0.79 0.16 0.00 -2.02 0.00 0.00 178.31 177.29 1l6i h ARG 496 N 0.48 0.60 -0.31 1.11 3.08 -0.78 -0.27 114.38 118.29 1l6i h ARG 496 Ca 0.10 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 1l6i h ARG 496 Cb 0.52 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1l6i h ARG 496 CO 0.03 0.51 0.01 0.37 -1.07 0.00 0.00 179.97 179.81 1l6i h GLN 497 N 0.60 0.55 -0.81 0.04 4.15 -0.78 -1.40 115.11 117.46 1l6i h GLN 497 Ca 0.15 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1l6i h GLN 497 Cb 0.14 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.74 1l6i h GLN 497 CO -0.01 0.68 0.43 1.96 -1.93 0.00 0.00 178.83 179.95 1l6i h GLN 498 N 0.35 1.13 0.03 1.69 4.20 0.07 -2.18 115.11 120.40 1l6i h GLN 498 Ca 0.09 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1l6i h GLN 498 Cb 0.42 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1l6i h GLN 498 CO 0.01 0.84 -0.02 -0.92 -0.67 0.00 0.00 178.83 178.08 1l6i h TYR 499 N 1.13 -0.04 -0.17 2.96 5.03 -1.07 -1.75 116.97 123.06 1l6i h TYR 499 Ca 0.28 -0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.62 1l6i h TYR 499 Cb 0.05 0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.32 1l6i h TYR 499 CO 0.01 0.28 0.01 -0.09 -1.32 0.00 0.00 178.16 177.05 1l6i h ARG 500 N -0.36 0.07 -0.97 1.82 2.43 -1.17 -2.04 114.38 114.16 1l6i h ARG 500 Ca -0.00 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 1l6i h ARG 500 Cb 0.34 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 1l6i h ARG 500 CO 0.01 0.05 0.63 0.93 -1.51 0.00 0.00 179.97 180.07 1l6i h GLU 501 N 0.07 1.15 -0.98 0.20 5.08 -1.41 -0.21 114.58 118.47 1l6i h GLU 501 Ca 0.08 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1l6i h GLU 501 Cb 0.08 -0.26 -0.06 0.00 0.50 0.00 0.00 28.75 29.02 1l6i h GLU 501 CO -0.12 0.76 0.65 0.82 -1.00 0.00 0.00 179.01 180.12 1l6i h ILE 502 N 1.18 1.17 -0.45 3.13 2.04 -0.75 -1.77 117.51 122.06 1l6i h ILE 502 Ca 0.40 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.74 1l6i h ILE 502 Cb 0.08 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 35.96 1l6i h ILE 502 CO -0.15 0.23 -0.10 0.50 0.00 0.00 0.00 178.15 178.63 1l6i h LYS 503 N 1.25 0.87 -0.06 2.37 1.63 -0.41 -1.97 116.57 120.25 1l6i h LYS 503 Ca 0.39 -0.33 -0.09 0.00 -0.85 0.00 0.00 60.65 59.77 1l6i h LYS 503 Cb -0.00 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 1l6i h LYS 503 CO -0.12 0.97 -0.37 1.96 -3.45 0.00 0.00 179.45 178.44 1l6i h GLN 504 N 0.71 0.12 -0.04 1.90 1.08 -1.06 -1.74 115.11 116.09 1l6i h GLN 504 Ca 0.12 -0.05 -0.13 0.00 -1.45 0.00 0.00 58.65 57.14 1l6i h GLN 504 Cb 0.64 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.05 1l6i h GLN 504 CO 0.04 0.47 -0.57 0.00 -0.95 0.00 0.00 178.83 177.82 1l6i h ALA 505 N 1.53 0.97 -0.28 3.87 0.00 -0.78 -1.66 119.26 122.92 1l6i h ALA 505 Ca 0.01 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.30 1l6i h ALA 505 Cb 0.70 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1l6i h ALA 505 CO 0.05 0.71 -0.25 -0.91 0.00 0.00 0.00 179.25 178.86 1l6i h ASN 506 N 0.08 0.54 0.16 0.00 2.35 -0.84 -2.17 115.58 115.71 1l6i h ASN 506 Ca -0.00 -0.19 -0.22 0.00 -0.55 0.00 0.00 56.30 55.34 1l6i h ASN 506 Cb 1.04 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1l6i h ASN 506 CO 0.08 0.78 -0.84 0.11 -1.65 0.00 0.00 177.43 175.91 1l6i h LYS 507 N 0.47 0.53 -0.47 0.81 1.57 -0.72 -1.98 116.57 116.79 1l6i h LYS 507 Ca 0.07 -0.49 -0.04 0.00 -1.87 0.00 0.00 60.65 58.32 1l6i h LYS 507 Cb 0.68 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 1l6i h LYS 507 CO 0.05 1.12 0.15 0.28 -0.57 0.00 0.00 179.45 180.48 1l6i h VAL 508 N 0.34 1.23 -0.05 0.50 2.07 -1.17 -0.05 116.25 119.12 1l6i h VAL 508 Ca -0.06 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1l6i h VAL 508 Cb 1.46 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1l6i h VAL 508 CO 0.15 0.27 -0.19 0.03 0.02 0.00 0.00 177.57 177.85 1l6i h ARG 509 N 0.63 0.08 -0.20 1.57 3.08 -1.33 -2.44 114.38 115.78 1l6i h ARG 509 Ca 0.15 -0.02 -0.18 0.00 0.07 0.00 0.00 59.98 60.00 1l6i h ARG 509 Cb 0.27 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1l6i h ARG 509 CO -0.00 0.28 -0.57 1.25 -1.07 0.00 0.00 179.97 179.85 1l6i h LEU 510 N 0.08 0.85 -0.64 3.04 5.85 -0.64 -2.96 115.31 120.89 1l6i h LEU 510 Ca 0.01 -0.58 0.13 0.00 0.84 0.00 0.00 57.88 58.29 1l6i h LEU 510 Cb 0.39 -0.25 -0.11 0.00 0.37 0.00 0.00 40.66 41.07 1l6i h LEU 510 CO 0.03 1.28 0.02 0.00 -0.34 0.00 0.00 178.44 179.43 1l6i h ALA 511 N 0.59 0.65 -0.85 1.25 0.00 -0.89 0.14 119.26 120.15 1l6i h ALA 511 Ca -0.01 0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1l6i h ALA 511 Cb 1.19 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 19.26 1l6i h ALA 511 CO 0.12 -0.39 0.56 0.93 0.00 0.00 0.00 179.25 180.47 1l6i h GLU 512 N 0.13 1.07 -0.32 0.00 5.08 -1.30 0.88 114.58 120.13 1l6i h GLU 512 Ca 0.34 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.58 1l6i h GLU 512 Cb 0.55 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1l6i h GLU 512 CO -0.53 0.71 -0.01 0.35 -1.00 0.00 0.00 179.01 178.53 1l6i h PHE 513 N 1.11 0.62 -0.60 4.33 3.57 -1.09 -1.77 116.94 123.10 1l6i h PHE 513 Ca 0.32 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.64 1l6i h PHE 513 Cb -0.06 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 1l6i h PHE 513 CO -0.00 0.69 0.10 0.28 -2.23 0.00 0.00 178.31 177.15 1l6i h VAL 514 N 0.36 1.26 -0.24 1.41 2.07 -0.21 -0.41 116.25 120.49 1l6i h VAL 514 Ca 0.09 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.61 1l6i h VAL 514 Cb 0.45 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1l6i h VAL 514 CO 0.02 0.37 0.16 0.50 0.02 0.00 0.00 177.57 178.64 1l6i h LYS 515 N 0.91 0.32 -0.11 1.57 1.63 -0.64 0.10 116.57 120.35 1l6i h LYS 515 Ca 0.18 -0.02 -0.14 0.00 -0.85 0.00 0.00 60.65 59.82 1l6i h LYS 515 Cb 0.43 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.98 1l6i h LYS 515 CO 0.01 0.22 -0.54 -0.39 -3.45 0.00 0.00 179.45 175.30 1l6i h VAL 516 N 0.33 1.35 0.00 2.00 -1.51 -0.82 -1.41 116.25 116.19 1l6i h VAL 516 Ca 0.09 -1.82 0.00 0.00 -1.23 0.00 0.00 66.70 63.74 1l6i h VAL 516 Cb -0.03 1.87 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 1l6i h VAL 516 CO -0.02 0.54 -0.15 0.03 -1.23 0.00 0.00 177.57 176.74 1l6i h ARG 517 N 0.24 0.00 0.00 5.19 2.47 -0.64 -3.40 114.38 118.24 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 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.34 1l6i h ARG 517 CO 0.09 0.00 -0.48 0.25 0.56 0.00 0.00 179.97 180.39 1l6i n THR 518 N -2.58 0.00 0.00 2.04 -2.24 0.32 -4.95 114.28 106.87 1l6i n THR 518 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1l6i n THR 518 Cb 0.48 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 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 1.19 2.83 3.76 3.38 0.00 -0.53 -5.04 105.19 110.78 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 -1.57 2.85 -0.33 -0.61 1.01 -1.26 -4.91 121.20 116.37 1l6i s ILE 520 Ca 0.00 0.81 -0.10 0.00 0.00 0.00 0.00 60.65 61.36 1l6i s ILE 520 Cb 0.00 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.96 1l6i s ILE 520 CO 0.00 0.18 0.17 -0.70 0.00 0.00 0.00 174.94 174.59 1l6i s GLU 521 N -1.34 3.18 -0.03 2.79 2.12 -1.26 -3.67 118.70 120.49 1l6i s GLU 521 Ca 0.51 -0.83 0.01 0.00 0.36 0.00 0.00 54.97 55.02 1l6i s GLU 521 Cb -0.39 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.35 1l6i s GLU 521 CO 0.49 -0.50 -0.01 0.96 -0.54 0.00 0.00 175.26 175.65 1l6i s ILE 522 N 1.60 4.13 -0.46 -3.70 -4.36 -1.26 -5.07 121.20 112.09 1l6i s ILE 522 Ca 0.04 -0.52 -0.29 0.00 -0.26 0.00 0.00 60.65 59.62 1l6i s ILE 522 Cb -0.18 -2.81 0.03 0.00 1.25 0.00 0.00 42.46 40.75 1l6i s ILE 522 CO 0.06 0.45 1.18 0.21 0.24 0.00 0.00 174.94 177.09 1l6i s ASN 523 N -1.34 6.60 0.00 4.36 2.47 -1.26 -4.91 114.94 120.86 1l6i s ASN 523 Ca 0.17 0.57 0.16 0.00 0.42 0.00 0.00 52.86 54.18 1l6i s ASN 523 Cb -0.11 -2.55 0.88 0.00 -1.45 0.00 0.00 41.25 38.02 1l6i s ASN 523 CO 0.08 -1.27 1.39 -2.65 -3.72 0.00 0.00 177.10 170.93 1l6i n PRO 524 N 7.83 0.39 0.03 0.43 -0.02 -1.26 -0.56 135.00 141.83 1l6i n PRO 524 Ca 0.13 0.06 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 1l6i n PRO 524 Cb 0.49 -1.50 0.08 0.00 -0.02 0.00 0.00 33.50 32.54 1l6i n PRO 524 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1l6i n GLN 525 N -1.11 0.24 -1.14 -0.52 1.13 -1.26 -4.89 117.38 109.83 1l6i n GLN 525 Ca 0.10 0.02 -0.30 0.00 -1.94 0.00 0.00 57.00 54.87 1l6i n GLN 525 Cb 0.08 -1.60 0.13 0.00 0.11 0.00 0.00 30.24 28.96 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 -3.16 1.75 -0.16 -1.58 0.00 0.27 -4.95 121.76 113.93 1l6i s ALA 526 Ca 0.05 0.15 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1l6i s ALA 526 Cb 0.15 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.98 1l6i s ALA 526 CO 0.77 -2.22 1.37 0.42 0.00 0.00 0.00 175.76 176.10 1l6i s ILE 527 N -2.87 4.09 -0.50 0.00 1.01 0.05 -4.82 121.20 118.16 1l6i s ILE 527 Ca 0.63 1.30 -0.25 0.00 0.00 0.00 0.00 60.65 62.33 1l6i s ILE 527 Cb -0.18 -3.88 0.03 0.00 0.01 0.00 0.00 42.46 38.44 1l6i s ILE 527 CO 0.57 -0.16 0.94 -0.36 0.00 0.00 0.00 174.94 175.93 1l6i s PHE 528 N 3.80 2.85 -0.45 3.97 0.40 -1.26 -0.30 117.98 127.00 1l6i s PHE 528 Ca 0.60 0.22 -0.16 0.00 -0.60 0.00 0.00 56.93 56.99 1l6i s PHE 528 Cb -0.24 -4.04 0.05 0.00 0.51 0.00 0.00 43.02 39.30 1l6i s PHE 528 CO 0.19 -1.23 0.37 0.34 0.70 0.00 0.00 175.22 175.59 1l6i s ASP 529 N 2.53 6.14 -0.17 1.36 -1.08 0.12 -0.21 116.67 125.35 1l6i s ASP 529 Ca 0.35 -1.09 -0.01 0.00 -0.52 0.00 0.00 52.55 51.28 1l6i s ASP 529 Cb -0.11 -2.18 -0.00 0.00 -1.46 0.00 0.00 42.92 39.17 1l6i s ASP 529 CO 0.23 -0.57 -0.12 -0.63 0.52 0.00 0.00 175.17 174.60 1l6i s ILE 530 N 1.73 2.84 -0.25 4.11 1.01 0.22 -1.57 121.20 129.30 1l6i s ILE 530 Ca 0.05 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.03 1l6i s ILE 530 Cb -0.21 -2.23 0.06 0.00 0.01 0.00 0.00 42.46 40.09 1l6i s ILE 530 CO 0.09 0.49 -0.08 -1.58 0.00 0.00 0.00 174.94 173.86 1l6i s GLN 531 N 1.00 1.92 -0.07 2.79 0.74 -0.39 -1.41 119.66 124.22 1l6i s GLN 531 Ca -0.01 -1.19 0.00 0.00 0.05 0.00 0.00 55.36 54.20 1l6i s GLN 531 Cb -0.15 -2.75 0.02 0.00 1.10 0.00 0.00 33.01 31.24 1l6i s GLN 531 CO -0.02 -0.60 -0.05 0.96 -0.55 0.00 0.00 175.29 175.03 1l6i s ILE 532 N 1.24 0.70 0.00 -2.34 -4.36 -1.26 -2.30 121.20 112.88 1l6i s ILE 532 Ca -0.07 -0.14 0.00 0.00 -0.26 0.00 0.00 60.65 60.18 1l6i s ILE 532 Cb -0.19 -0.75 0.00 0.00 1.25 0.00 0.00 42.46 42.76 1l6i s ILE 532 CO -0.06 0.29 0.00 2.29 0.24 0.00 0.00 174.94 177.71 1l6i n LYS 533 N 4.61 0.00 -1.33 0.37 2.85 -0.59 -4.96 118.16 119.11 1l6i n LYS 533 Ca -0.16 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.74 1l6i n LYS 533 Cb 0.50 0.00 0.08 0.00 -0.65 0.00 0.00 35.03 34.96 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 -0.93 0.44 -2.54 -1.58 1.74 -1.26 -4.18 116.66 108.35 1l6i n ARG 534 Ca 0.00 0.20 -0.43 0.00 -0.77 0.00 0.00 57.85 56.85 1l6i n ARG 534 Cb 0.00 -2.07 -0.02 0.00 -1.02 0.00 0.00 32.46 29.35 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 -1.96 3.68 -0.14 0.55 1.98 -0.07 -4.86 118.68 117.85 1l6i s LEU 535 Ca 0.71 0.66 -0.08 0.00 -2.89 0.00 0.00 54.13 52.53 1l6i s LEU 535 Cb -0.35 -3.55 0.05 0.00 0.66 0.00 0.00 46.19 43.00 1l6i s LEU 535 CO 0.53 -1.23 0.34 -2.28 -1.89 0.00 0.00 176.35 171.82 1l6i s HIS 536 N 4.55 -0.49 0.28 5.38 2.46 -1.26 -4.69 115.29 121.53 1l6i s HIS 536 Ca 0.51 1.08 0.12 0.00 0.47 0.00 0.00 55.06 57.23 1l6i s HIS 536 Cb -0.10 0.17 0.92 0.00 -0.13 0.00 0.00 32.58 33.45 1l6i s HIS 536 CO 0.29 -0.29 1.24 0.39 -2.47 0.00 0.00 174.74 173.90 1l6i n GLU 537 N 4.20 -0.05 0.27 2.88 1.02 -1.26 0.22 120.64 127.91 1l6i n GLU 537 Ca -0.24 1.12 0.18 0.00 -0.02 0.00 0.00 57.16 58.20 1l6i n GLU 537 Cb 0.54 -1.93 0.78 0.00 -0.02 0.00 0.00 31.44 30.81 1l6i n GLU 537 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 1l6i h TYR 538 N 0.00 0.00 0.00 -0.32 -0.00 -1.97 -2.86 116.97 111.82 1l6i h TYR 538 Ca 0.61 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 59.23 1l6i h TYR 538 Cb 1.53 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.24 1l6i h TYR 538 CO -0.13 0.00 -0.88 0.87 -0.00 0.00 0.00 178.16 178.02 1l6i h LYS 539 N 0.00 0.00 -1.76 0.10 1.57 -0.56 -2.65 116.57 113.26 1l6i h LYS 539 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1l6i h LYS 539 Cb 0.36 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.68 1l6i h LYS 539 CO 0.00 0.32 -0.24 0.54 -0.57 0.00 0.00 179.45 179.50 1l6i n ARG 540 N -3.01 -1.48 -0.32 3.15 1.74 -1.08 -3.73 116.66 111.93 1l6i n ARG 540 Ca -0.03 0.39 0.35 0.00 -0.77 0.00 0.00 57.85 57.80 1l6i n ARG 540 Cb 0.74 -4.24 0.74 0.00 -1.02 0.00 0.00 32.46 28.67 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 -0.34 0.00 0.00 5.56 7.50 -1.87 0.32 115.11 126.28 1l6i h GLN 541 Ca -0.21 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.91 1l6i h GLN 541 Cb 1.15 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.68 1l6i h GLN 541 CO 0.24 0.00 -0.12 1.12 -1.50 0.00 0.00 178.83 178.57 1l6i h HIS 542 N 0.00 0.00 -0.09 2.96 2.07 -1.93 -2.55 115.15 115.61 1l6i h HIS 542 Ca 0.56 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.96 1l6i h HIS 542 Cb 2.36 0.00 0.01 0.00 2.57 0.00 0.00 27.41 32.34 1l6i h HIS 542 CO 0.00 0.12 -0.42 1.25 -3.07 0.00 0.00 177.93 175.81 1l6i h LEU 543 N 0.00 0.53 -0.85 6.12 5.85 -0.74 -2.29 115.31 123.93 1l6i h LEU 543 Ca -0.00 -0.64 0.11 0.00 0.84 0.00 0.00 57.88 58.19 1l6i h LEU 543 Cb 0.94 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.74 1l6i h LEU 543 CO 0.02 1.08 0.48 -1.13 -0.34 0.00 0.00 178.44 178.55 1l6i h ASN 544 N 0.01 0.67 -0.19 1.25 -0.00 -1.50 -1.24 115.58 114.58 1l6i h ASN 544 Ca -0.03 0.06 -0.05 0.00 -0.00 0.00 0.00 56.30 56.28 1l6i h ASN 544 Cb 1.07 -0.07 -0.02 0.00 -0.00 0.00 0.00 38.32 39.30 1l6i h ASN 544 CO 0.09 0.36 -0.03 0.25 -0.00 0.00 0.00 177.43 178.10 1l6i h LEU 545 N 0.78 0.46 -0.43 0.34 5.85 -1.32 -1.09 115.31 119.90 1l6i h LEU 545 Ca 0.42 -0.09 -0.18 0.00 0.84 0.00 0.00 57.88 58.87 1l6i h LEU 545 Cb 0.44 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 1l6i h LEU 545 CO -0.27 0.55 -0.63 -0.07 -0.34 0.00 0.00 178.44 177.67 1l6i h LEU 546 N 0.47 0.62 -1.37 2.25 3.38 -0.69 -1.07 115.31 118.91 1l6i h LEU 546 Ca 0.10 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1l6i h LEU 546 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1l6i h LEU 546 CO 0.01 1.10 -0.28 -0.74 0.09 0.00 0.00 178.44 178.62 1l6i h HIS 547 N 0.40 0.00 0.04 1.13 2.76 -0.76 -2.80 115.15 115.92 1l6i h HIS 547 Ca -0.01 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.94 1l6i h HIS 547 Cb 1.20 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.15 1l6i h HIS 547 CO 0.05 0.28 -1.00 0.82 -1.30 0.00 0.00 177.93 176.78 1l6i h ILE 548 N 0.00 1.55 -0.17 6.26 2.04 -0.52 -2.52 117.51 124.15 1l6i h ILE 548 Ca -0.00 -2.93 -0.03 0.00 1.00 0.00 0.00 64.86 62.90 1l6i h ILE 548 Cb 0.62 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 1l6i h ILE 548 CO 0.04 0.85 -0.01 -0.07 0.00 0.00 0.00 178.15 178.96 1l6i h LEU 549 N 0.07 0.31 -0.20 1.44 3.38 -1.05 -0.95 115.31 118.31 1l6i h LEU 549 Ca -0.06 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 57.64 1l6i h LEU 549 Cb 1.69 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.29 1l6i h LEU 549 CO 0.15 0.55 -0.46 0.00 0.09 0.00 0.00 178.44 178.77 1l6i h ALA 550 N 0.77 -0.65 -0.96 1.53 0.00 -1.47 0.50 119.26 118.99 1l6i h ALA 550 Ca 0.05 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.11 1l6i h ALA 550 Cb 0.40 0.89 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 1l6i h ALA 550 CO 0.01 -0.96 0.57 -0.07 0.00 0.00 0.00 179.25 178.79 1l6i h LEU 551 N -0.48 0.76 -0.59 0.00 3.38 -1.44 0.20 115.31 117.13 1l6i h LEU 551 Ca 0.08 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 1l6i h LEU 551 Cb 0.63 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1l6i h LEU 551 CO -0.46 0.33 -0.02 0.22 0.09 0.00 0.00 178.44 178.61 1l6i h TYR 552 N 0.80 1.16 -0.10 1.13 3.20 0.48 -1.67 116.97 121.97 1l6i h TYR 552 Ca 0.52 -0.21 -0.10 0.00 3.14 0.00 0.00 58.73 62.08 1l6i h TYR 552 Cb 0.69 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.66 1l6i h TYR 552 CO -0.03 1.03 -0.34 -0.22 -1.64 0.00 0.00 178.16 176.97 1l6i h LYS 553 N 0.96 0.40 -0.70 1.82 3.64 0.57 -1.80 116.57 121.46 1l6i h LYS 553 Ca 0.17 -0.30 0.15 0.00 -1.27 0.00 0.00 60.65 59.40 1l6i h LYS 553 Cb 0.58 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 32.35 1l6i h LYS 553 CO 0.03 0.93 0.13 1.49 -2.27 0.00 0.00 179.45 179.76 1l6i h GLU 554 N -0.04 0.22 0.00 1.90 4.81 -0.48 0.16 114.58 121.16 1l6i h GLU 554 Ca -0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1l6i h GLU 554 Cb 0.96 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1l6i h GLU 554 CO 0.07 0.15 -0.06 -0.84 -0.73 0.00 0.00 179.01 177.60 1l6i h ILE 555 N 0.23 0.00 -0.03 2.32 3.07 -1.24 -3.06 117.51 118.80 1l6i h ILE 555 Ca 0.39 -0.69 -0.25 0.00 1.55 0.00 0.00 64.86 65.86 1l6i h ILE 555 Cb 0.65 1.66 0.02 0.00 -0.27 0.00 0.00 36.82 38.88 1l6i h ILE 555 CO -0.51 0.00 -0.97 0.03 -1.05 0.00 0.00 178.15 175.65 1l6i h ARG 556 N 0.00 0.71 -0.99 0.16 3.08 -0.22 -3.36 114.38 113.75 1l6i h ARG 556 Ca 0.00 -0.72 -0.57 0.00 0.07 0.00 0.00 59.98 58.76 1l6i h ARG 556 Cb 0.84 0.20 -0.30 0.00 0.08 0.00 0.00 29.97 30.79 1l6i h ARG 556 CO 0.00 1.30 0.71 0.39 -1.07 0.00 0.00 179.97 181.31 1l6i n GLU 557 N -3.90 2.39 0.00 0.04 1.02 0.42 -4.72 120.64 115.89 1l6i n GLU 557 Ca -0.10 -3.11 0.00 0.00 -0.02 0.00 0.00 57.16 53.93 1l6i n GLU 557 Cb 0.84 -2.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 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 -1.08 0.00 0.05 1.62 2.85 -1.18 -4.99 115.26 112.53 1l6i n ASN 558 Ca 0.61 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 55.10 1l6i n ASN 558 Cb 1.35 0.00 0.11 0.00 1.24 0.00 0.00 39.78 42.48 1l6i n ASN 558 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1l6i n PRO 559 N 0.00 0.03 -0.08 1.20 -0.04 -1.26 0.39 135.00 135.24 1l6i n PRO 559 Ca 0.00 0.41 0.01 0.00 -0.04 0.00 0.00 63.50 63.88 1l6i n PRO 559 Cb 0.00 -1.77 0.05 0.00 -0.04 0.00 0.00 33.50 31.73 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 -1.55 1.34 -2.58 0.54 3.00 -1.26 -4.91 117.38 111.96 1l6i n GLN 560 Ca -0.00 -0.38 -0.40 0.00 -0.01 0.00 0.00 57.00 56.21 1l6i n GLN 560 Cb 0.19 -1.29 -0.05 0.00 0.00 0.00 0.00 30.24 29.09 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 -1.61 3.38 -0.76 -1.58 0.00 0.16 -4.97 121.76 116.38 1l6i s ALA 561 Ca 0.07 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.84 1l6i s ALA 561 Cb 0.04 -3.29 0.26 0.00 0.00 0.00 0.00 23.12 20.13 1l6i s ALA 561 CO 0.03 -0.04 0.92 -3.47 0.00 0.00 0.00 175.76 173.21 1l6i n ASP 562 N 1.49 4.41 -4.37 0.00 2.03 -1.26 -5.02 116.55 113.82 1l6i n ASP 562 Ca -0.01 -3.42 -0.31 0.00 0.52 0.00 0.00 54.79 51.57 1l6i n ASP 562 Cb 0.46 -0.84 -0.15 0.00 -0.72 0.00 0.00 41.12 39.88 1l6i n ASP 562 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1l6i s ARG 563 N -2.47 2.16 0.48 -0.67 1.81 -1.26 -5.08 118.95 113.91 1l6i s ARG 563 Ca 0.37 -0.90 -0.21 0.00 -1.72 0.00 0.00 55.73 53.26 1l6i s ARG 563 Cb 0.11 -2.13 -0.08 0.00 -0.45 0.00 0.00 34.95 32.40 1l6i s ARG 563 CO 0.01 0.57 1.07 0.54 -0.68 0.00 0.00 175.30 176.81 1l6i s VAL 564 N -0.70 3.56 0.30 3.52 0.11 -1.26 -4.94 120.40 120.99 1l6i s VAL 564 Ca 0.11 1.04 -0.29 0.00 -2.93 0.00 0.00 61.98 59.91 1l6i s VAL 564 Cb -0.10 -3.46 -0.10 0.00 -1.53 0.00 0.00 36.38 31.19 1l6i s VAL 564 CO 0.00 -0.15 1.31 -2.84 -3.33 0.00 0.00 175.10 170.09 1l6i s PRO 565 N -3.04 4.37 0.17 1.54 0.02 -1.26 -4.94 135.00 131.86 1l6i s PRO 565 Ca 0.66 2.17 0.10 0.00 0.02 0.00 0.00 61.00 63.96 1l6i s PRO 565 Cb -0.20 -3.10 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1l6i s PRO 565 CO 0.25 -0.20 -0.23 1.03 -0.33 0.00 0.00 177.00 177.52 1l6i s ARG 566 N -1.31 1.40 -0.20 5.54 0.52 -0.75 -0.77 118.95 123.39 1l6i s ARG 566 Ca 0.51 -1.43 0.01 0.00 -0.52 0.00 0.00 55.73 54.30 1l6i s ARG 566 Cb -0.39 -1.70 0.03 0.00 0.52 0.00 0.00 34.95 33.41 1l6i s ARG 566 CO 0.48 0.37 -0.18 0.08 0.02 0.00 0.00 175.30 176.08 1l6i s VAL 567 N -1.59 2.07 -0.23 3.52 1.01 0.59 -2.55 120.40 123.21 1l6i s VAL 567 Ca 0.17 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 1l6i s VAL 567 Cb -0.08 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1l6i s VAL 567 CO 0.08 0.42 0.18 -0.36 0.00 0.00 0.00 175.10 175.42 1l6i s PHE 568 N 1.26 3.32 -0.06 5.22 0.40 0.12 0.10 117.98 128.34 1l6i s PHE 568 Ca 0.02 0.27 0.06 0.00 -0.60 0.00 0.00 56.93 56.68 1l6i s PHE 568 Cb -0.14 -2.29 -0.01 0.00 0.51 0.00 0.00 43.02 41.08 1l6i s PHE 568 CO -0.11 0.06 -0.25 -0.51 0.70 0.00 0.00 175.22 175.11 1l6i s LEU 569 N 1.07 2.07 -0.04 -0.37 1.43 -0.61 0.13 118.68 122.36 1l6i s LEU 569 Ca 0.09 -0.52 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1l6i s LEU 569 Cb -0.14 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 1l6i s LEU 569 CO 0.05 0.23 -0.19 -0.36 0.23 0.00 0.00 176.35 176.31 1l6i s PHE 570 N -0.08 1.82 -0.12 0.29 0.40 -0.29 -1.27 117.98 118.73 1l6i s PHE 570 Ca -0.06 -0.50 0.01 0.00 -0.60 0.00 0.00 56.93 55.78 1l6i s PHE 570 Cb -0.14 -1.21 0.02 0.00 0.51 0.00 0.00 43.02 42.19 1l6i s PHE 570 CO 0.05 -0.15 -0.15 0.20 0.70 0.00 0.00 175.22 175.86 1l6i s GLY 571 N -0.06 1.09 -0.23 4.36 0.00 -0.97 -1.28 107.32 110.22 1l6i s GLY 571 Ca -0.02 -0.81 -0.28 0.00 0.00 0.00 0.00 44.72 43.61 1l6i s GLY 571 CO 0.02 0.31 1.14 0.00 0.00 0.00 0.00 173.10 174.56 1l6i s ALA 572 N 1.13 -2.02 0.16 3.20 0.00 -1.26 -1.54 121.76 121.43 1l6i s ALA 572 Ca -0.03 1.73 0.09 0.00 0.00 0.00 0.00 51.96 53.74 1l6i s ALA 572 Cb -0.14 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 1l6i s ALA 572 CO -0.04 -0.25 -0.10 0.15 0.00 0.00 0.00 175.76 175.52 1l6i s LYS 573 N -0.59 2.05 -0.12 0.00 1.02 -1.26 -4.76 119.74 116.09 1l6i s LYS 573 Ca 0.03 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 1l6i s LYS 573 Cb -0.02 -2.18 -0.03 0.00 -0.52 0.00 0.00 37.83 35.08 1l6i s LYS 573 CO -0.05 0.45 -0.07 0.00 -0.92 0.00 0.00 175.35 174.77 1l6i s ALA 574 N -1.58 2.92 0.21 5.17 0.00 -1.26 -0.89 121.76 126.33 1l6i s ALA 574 Ca 0.24 -0.85 -0.30 0.00 0.00 0.00 0.00 51.96 51.04 1l6i s ALA 574 Cb -0.09 -1.38 -0.16 0.00 0.00 0.00 0.00 23.12 21.49 1l6i s ALA 574 CO 0.15 0.34 0.90 0.00 0.00 0.00 0.00 175.76 177.14 1l6i n ALA 575 N 3.10 -1.48 0.25 0.00 0.00 -1.26 -4.83 120.51 116.29 1l6i n ALA 575 Ca -0.18 0.44 0.09 0.00 0.00 0.00 0.00 53.44 53.79 1l6i n ALA 575 Cb 0.53 -1.87 0.63 0.00 0.00 0.00 0.00 19.45 18.73 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 2.11 0.00 -0.05 0.00 0.11 -1.98 0.39 132.00 132.58 1l6i h PRO 576 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1l6i h PRO 576 Cb 1.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.49 1l6i h PRO 576 CO 0.62 0.11 0.00 0.41 -0.21 0.00 0.00 178.00 178.94 1l6i n GLY 577 N -1.09 -0.01 3.30 -0.55 0.00 -1.26 -4.69 105.19 100.89 1l6i n GLY 577 Ca -0.03 -0.42 -0.44 0.00 0.00 0.00 0.00 46.02 45.14 1l6i n GLY 577 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1l6i n TYR 578 N 0.12 4.54 -0.11 1.61 4.19 0.13 -4.92 117.16 122.72 1l6i n TYR 578 Ca 0.19 -3.39 0.10 0.00 3.31 0.00 0.00 57.90 58.10 1l6i n TYR 578 Cb 0.33 -1.91 0.45 0.00 0.49 0.00 0.00 39.34 38.70 1l6i n TYR 578 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1l6i h TYR 579 N 6.61 0.54 0.68 2.98 0.05 -1.83 -2.51 116.97 123.48 1l6i h TYR 579 Ca 0.27 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 59.03 1l6i h TYR 579 Cb 0.81 -0.18 0.01 0.00 1.01 0.00 0.00 36.73 38.38 1l6i h TYR 579 CO 1.00 0.27 -0.32 1.25 -1.05 0.00 0.00 178.16 179.30 1l6i h LEU 580 N 0.52 -0.77 -1.79 3.88 5.85 -1.95 -2.35 115.31 118.70 1l6i h LEU 580 Ca 0.28 -0.01 0.16 0.00 0.84 0.00 0.00 57.88 59.16 1l6i h LEU 580 Cb 0.42 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 1l6i h LEU 580 CO -0.08 -0.46 0.47 0.00 -0.34 0.00 0.00 178.44 178.03 1l6i h ALA 581 N -0.84 2.35 0.00 1.25 0.00 -1.90 0.32 119.26 120.44 1l6i h ALA 581 Ca -0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1l6i h ALA 581 Cb 0.73 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1l6i h ALA 581 CO 0.15 -0.54 -0.31 0.87 0.00 0.00 0.00 179.25 179.42 1l6i h LYS 582 N 0.20 0.00 0.00 0.00 1.57 -1.28 -2.75 116.57 114.32 1l6i h LYS 582 Ca 0.33 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.93 1l6i h LYS 582 Cb 1.02 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 1l6i h LYS 582 CO -0.06 0.31 -0.88 -0.97 -0.57 0.00 0.00 179.45 177.28 1l6i h ASN 583 N 0.00 0.00 -0.17 0.86 -0.00 0.17 -2.92 115.58 113.53 1l6i h ASN 583 Ca -0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 56.30 56.09 1l6i h ASN 583 Cb 0.80 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.12 1l6i h ASN 583 CO 0.04 0.88 -0.70 0.40 -0.00 0.00 0.00 177.43 178.05 1l6i h ILE 584 N 0.00 1.28 -0.55 2.57 2.04 -1.26 -2.60 117.51 119.00 1l6i h ILE 584 Ca -0.01 -1.90 0.09 0.00 1.00 0.00 0.00 64.86 64.04 1l6i h ILE 584 Cb 1.59 1.87 -0.07 0.00 -0.74 0.00 0.00 36.82 39.46 1l6i h ILE 584 CO 0.11 0.61 0.15 0.40 0.00 0.00 0.00 178.15 179.42 1l6i h ILE 585 N 0.57 0.72 -0.31 -0.67 2.04 -1.44 -2.19 117.51 116.23 1l6i h ILE 585 Ca -0.03 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1l6i h ILE 585 Cb 1.32 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 1l6i h ILE 585 CO 0.15 0.05 0.06 0.15 0.00 0.00 0.00 178.15 178.56 1l6i h PHE 586 N 0.30 0.10 -0.46 1.37 3.57 -1.42 -1.32 116.94 119.07 1l6i h PHE 586 Ca 0.28 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1l6i h PHE 586 Cb 0.37 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1l6i h PHE 586 CO -0.21 0.02 0.29 0.00 -2.23 0.00 0.00 178.31 176.18 1l6i h ALA 587 N 1.23 0.59 0.33 2.41 0.00 -1.22 -0.69 119.26 121.91 1l6i h ALA 587 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1l6i h ALA 587 Cb 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1l6i h ALA 587 CO -0.20 0.06 -0.16 0.82 0.00 0.00 0.00 179.25 179.78 1l6i h ILE 588 N 0.62 0.69 -0.94 0.00 2.04 -1.23 0.26 117.51 118.95 1l6i h ILE 588 Ca 0.17 -0.09 0.11 0.00 1.00 0.00 0.00 64.86 66.05 1l6i h ILE 588 Cb -0.03 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1l6i h ILE 588 CO -0.03 0.02 0.60 0.78 0.00 0.00 0.00 178.15 179.52 1l6i h ASN 589 N -0.48 0.84 -0.09 1.72 2.35 -1.05 -0.53 115.58 118.34 1l6i h ASN 589 Ca -0.04 0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 1l6i h ASN 589 Cb 0.37 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1l6i h ASN 589 CO 0.07 0.47 -0.32 0.11 -1.65 0.00 0.00 177.43 176.12 1l6i h LYS 590 N 0.92 0.37 -0.03 0.81 1.79 -0.81 -1.54 116.57 118.07 1l6i h LYS 590 Ca 0.45 -0.28 -0.04 0.00 -2.18 0.00 0.00 60.65 58.60 1l6i h LYS 590 Cb 0.46 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 1l6i h LYS 590 CO -0.21 0.91 -0.17 0.28 -1.08 0.00 0.00 179.45 179.18 1l6i h VAL 591 N -0.10 1.14 -0.11 0.50 2.07 -0.73 -2.27 116.25 116.74 1l6i h VAL 591 Ca -0.02 -0.66 -0.21 0.00 0.82 0.00 0.00 66.70 66.63 1l6i h VAL 591 Cb 0.95 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1l6i h VAL 591 CO 0.07 0.19 -0.78 0.00 0.02 0.00 0.00 177.57 177.07 1l6i h ALA 592 N 1.78 0.41 -0.19 1.67 0.00 -0.88 -1.58 119.26 120.49 1l6i h ALA 592 Ca 0.01 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 1l6i h ALA 592 Cb 0.33 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1l6i h ALA 592 CO 0.02 0.72 -0.14 -0.44 0.00 0.00 0.00 179.25 179.42 1l6i h ASP 593 N 0.43 0.29 0.45 0.00 3.32 -0.69 -0.69 116.42 119.52 1l6i h ASP 593 Ca -0.05 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1l6i h ASP 593 Cb 1.39 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1l6i h ASP 593 CO 0.15 0.45 -0.21 0.58 -1.72 0.00 0.00 179.24 178.49 1l6i h VAL 594 N 0.28 0.22 -0.43 -1.35 2.07 -1.32 -3.00 116.25 112.73 1l6i h VAL 594 Ca 0.06 -0.58 0.06 0.00 0.82 0.00 0.00 66.70 67.05 1l6i h VAL 594 Cb 0.42 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1l6i h VAL 594 CO 0.02 0.05 0.29 0.40 0.02 0.00 0.00 177.57 178.35 1l6i h ILE 595 N -1.08 0.96 0.00 4.57 2.04 -1.24 -1.52 117.51 121.25 1l6i h ILE 595 Ca -0.06 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1l6i h ILE 595 Cb 0.54 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1l6i h ILE 595 CO 0.10 0.06 -0.04 0.78 0.00 0.00 0.00 178.15 179.05 1l6i h ASN 596 N 0.33 0.00 -0.22 1.72 2.35 -1.15 -3.26 115.58 115.35 1l6i h ASN 596 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1l6i h ASN 596 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1l6i h ASN 596 CO -0.04 0.04 0.00 0.59 -1.65 0.00 0.00 177.43 176.37 1l6i n ASN 597 N -3.12 2.93 -4.49 5.81 3.02 -0.60 -4.95 115.26 113.86 1l6i n ASN 597 Ca 0.03 -2.36 -0.43 0.00 -0.03 0.00 0.00 54.58 51.79 1l6i n ASN 597 Cb 0.48 -0.28 -0.09 0.00 -0.61 0.00 0.00 39.78 39.28 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 -1.41 6.21 0.63 6.41 -1.08 -1.04 -4.95 116.67 121.43 1l6i s ASP 598 Ca 0.24 -0.58 0.35 0.00 -0.52 0.00 0.00 52.55 52.04 1l6i s ASP 598 Cb 0.17 -2.23 1.99 0.00 -1.46 0.00 0.00 42.92 41.39 1l6i s ASP 598 CO 0.10 -0.56 2.22 1.55 0.52 0.00 0.00 175.17 178.99 1l6i h PRO 599 N 8.70 0.00 0.00 4.34 0.13 -1.92 0.39 132.00 143.64 1l6i h PRO 599 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1l6i h PRO 599 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1l6i h PRO 599 CO 0.79 0.00 0.00 -0.11 -0.23 0.00 0.00 178.00 178.45 1l6i n LEU 600 N -3.41 0.72 -0.10 1.56 7.94 -1.26 -3.64 117.00 118.81 1l6i n LEU 600 Ca -0.02 0.65 -0.24 0.00 -1.11 0.00 0.00 56.01 55.29 1l6i n LEU 600 Cb 0.18 -0.51 -0.12 0.00 0.53 0.00 0.00 43.42 43.50 1l6i n LEU 600 CO 0.23 -0.47 -1.03 0.52 -1.11 0.00 0.00 177.39 175.52 1l6i n VAL 601 N -2.26 1.57 0.00 1.96 0.31 0.14 -4.96 118.33 115.09 1l6i n VAL 601 Ca 0.03 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1l6i n VAL 601 Cb 0.28 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 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 1.64 3.22 1.45 2.92 0.00 -1.14 -1.19 105.19 112.09 1l6i n GLY 602 Ca -0.42 0.05 -0.02 0.00 0.00 0.00 0.00 46.02 45.63 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 4.12 3.62 0.02 1.61 9.92 -1.26 -4.11 116.55 130.47 1l6i n ASP 603 Ca 0.00 -2.68 0.11 0.00 -0.53 0.00 0.00 54.79 51.69 1l6i n ASP 603 Cb 0.00 -0.64 -0.01 0.00 -0.64 0.00 0.00 41.12 39.83 1l6i n ASP 603 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1l6i n LYS 604 N 0.07 0.28 -3.65 -1.24 5.02 -0.33 -4.66 118.16 113.65 1l6i n LYS 604 Ca 0.23 -0.02 -0.03 0.00 -2.02 0.00 0.00 58.31 56.47 1l6i n LYS 604 Cb 0.93 -1.58 -0.05 0.00 -0.02 0.00 0.00 35.03 34.32 1l6i n LYS 604 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1l6i s LEU 605 N -3.86 -1.04 0.02 -0.35 0.20 -1.25 -1.81 118.68 110.59 1l6i s LEU 605 Ca 0.03 1.49 0.00 0.00 0.69 0.00 0.00 54.13 56.35 1l6i s LEU 605 Cb 0.15 2.19 -0.02 0.00 -0.43 0.00 0.00 46.19 48.08 1l6i s LEU 605 CO 0.82 -0.22 -0.04 -0.54 -0.29 0.00 0.00 176.35 176.08 1l6i s LYS 606 N 2.65 0.31 -0.18 1.98 -0.14 -1.06 -4.74 119.74 118.57 1l6i s LYS 606 Ca -0.06 -0.54 -0.01 0.00 -1.36 0.00 0.00 55.97 54.00 1l6i s LYS 606 Cb -0.11 -0.01 0.00 0.00 -1.68 0.00 0.00 37.83 36.04 1l6i s LYS 606 CO -0.18 -0.02 -0.13 0.08 -0.76 0.00 0.00 175.35 174.34 1l6i s VAL 607 N -1.18 2.73 -0.19 3.17 1.01 -1.26 0.14 120.40 124.82 1l6i s VAL 607 Ca -0.12 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1l6i s VAL 607 Cb -0.08 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.14 1l6i s VAL 607 CO -0.01 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.74 1l6i s VAL 608 N 1.16 1.93 -0.53 2.92 1.01 0.34 -4.96 120.40 122.27 1l6i s VAL 608 Ca 0.01 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 1l6i s VAL 608 Cb -0.14 -1.86 0.12 0.00 0.00 0.00 0.00 36.38 34.50 1l6i s VAL 608 CO -0.05 0.35 0.50 0.12 0.00 0.00 0.00 175.10 176.02 1l6i s PHE 609 N 1.30 3.24 -0.09 5.22 2.19 -1.26 -1.13 117.98 127.44 1l6i s PHE 609 Ca 0.01 -1.21 -0.30 0.00 0.33 0.00 0.00 56.93 55.76 1l6i s PHE 609 Cb -0.15 -3.72 -0.02 0.00 -1.31 0.00 0.00 43.02 37.82 1l6i s PHE 609 CO -0.10 -1.00 1.12 -0.51 1.83 0.00 0.00 175.22 176.56 1l6i s LEU 610 N 1.67 4.25 0.34 6.12 2.01 -0.40 -4.98 118.68 127.68 1l6i s LEU 610 Ca 0.04 1.68 -0.27 0.00 0.01 0.00 0.00 54.13 55.58 1l6i s LEU 610 Cb -0.29 -3.56 -0.09 0.00 0.01 0.00 0.00 46.19 42.26 1l6i s LEU 610 CO 0.04 -0.55 1.15 -2.16 1.01 0.00 0.00 176.35 175.84 1l6i s PRO 611 N 2.28 4.37 -0.67 1.29 0.04 -1.26 -4.06 135.00 136.98 1l6i s PRO 611 Ca 0.52 1.85 -0.04 0.00 0.04 0.00 0.00 61.00 63.37 1l6i s PRO 611 Cb -0.22 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.38 1l6i s PRO 611 CO 0.19 -0.05 0.59 -3.47 0.04 0.00 0.00 177.00 174.30 1l6i n ASP 612 N 0.65 -4.05 -4.25 6.66 2.03 -1.24 -4.95 116.55 111.40 1l6i n ASP 612 Ca 0.01 -0.27 -0.56 0.00 0.52 0.00 0.00 54.79 54.49 1l6i n ASP 612 Cb 0.45 -2.76 -0.08 0.00 -0.72 0.00 0.00 41.12 38.01 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 -3.68 0.70 -3.91 -0.67 9.36 -1.26 -4.89 117.16 112.82 1l6i n TYR 613 Ca -0.01 1.00 -0.09 0.00 3.32 0.00 0.00 57.90 62.13 1l6i n TYR 613 Cb 0.53 -1.98 -0.02 0.00 -0.63 0.00 0.00 39.34 37.25 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 0.51 -0.65 0.00 2.07 -1.94 -1.97 116.25 116.35 1l6i h VAL 615 Ca -0.26 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1l6i h VAL 615 Cb 1.25 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1l6i h VAL 615 CO 0.33 0.04 0.32 0.28 0.02 0.00 0.00 177.57 178.56 1l6i h SER 616 N 0.22 0.84 -0.65 0.57 0.02 -1.98 0.84 113.55 113.41 1l6i h SER 616 Ca 0.38 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 1l6i h SER 616 Cb 0.65 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1l6i h SER 616 CO -0.52 0.73 0.36 0.00 -1.14 0.00 0.00 176.83 176.27 1l6i h ALA 617 N 1.14 0.83 -0.04 3.77 0.00 -1.87 -2.40 119.26 120.70 1l6i h ALA 617 Ca 0.22 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1l6i h ALA 617 Cb 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1l6i h ALA 617 CO -0.03 0.35 -0.09 0.00 0.00 0.00 0.00 179.25 179.48 1l6i h ALA 618 N 1.17 1.78 0.00 0.00 0.00 -0.57 -0.22 119.26 121.42 1l6i h ALA 618 Ca 0.23 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1l6i h ALA 618 Cb 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1l6i h ALA 618 CO -0.04 0.17 -0.39 0.93 0.00 0.00 0.00 179.25 179.92 1l6i h GLU 619 N 0.05 0.00 0.15 0.00 5.08 -0.35 -1.04 114.58 118.47 1l6i h GLU 619 Ca 0.01 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.06 1l6i h GLU 619 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1l6i h GLU 619 CO 0.01 0.39 -1.52 0.87 -1.00 0.00 0.00 179.01 177.77 1l6i h LYS 620 N 0.00 0.32 0.04 2.33 1.79 -0.93 -3.40 116.57 116.72 1l6i h LYS 620 Ca -0.00 -0.55 -0.19 0.00 -2.18 0.00 0.00 60.65 57.73 1l6i h LYS 620 Cb 0.76 0.20 0.02 0.00 -1.58 0.00 0.00 32.23 31.63 1l6i h LYS 620 CO 0.05 1.21 -0.77 -0.07 -1.08 0.00 0.00 179.45 178.79 1l6i h LEU 621 N 0.09 0.61 -0.39 2.94 3.38 -1.06 -3.37 115.31 117.50 1l6i h LEU 621 Ca -0.25 -0.80 0.03 0.00 0.09 0.00 0.00 57.88 56.95 1l6i h LEU 621 Cb 2.05 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.58 1l6i h LEU 621 CO 0.19 1.34 0.20 0.40 0.09 0.00 0.00 178.44 180.65 1l6i h ILE 622 N -0.05 0.98 0.00 1.22 2.04 -1.40 -1.71 117.51 118.59 1l6i h ILE 622 Ca -0.11 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1l6i h ILE 622 Cb 1.49 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1l6i h ILE 622 CO 0.15 0.07 0.00 -0.65 0.00 0.00 0.00 178.15 177.72 1l6i h PRO 623 N 0.40 0.00 -0.00 2.37 0.11 -1.77 -2.70 132.00 130.42 1l6i h PRO 623 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1l6i h PRO 623 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1l6i h PRO 623 CO -0.12 0.00 -0.89 0.00 -0.21 0.00 0.00 178.00 176.78 1l6i n ALA 624 N -1.86 4.51 -1.77 -0.75 0.00 -0.66 -4.81 120.51 115.17 1l6i n ALA 624 Ca -0.00 -0.56 -0.39 0.00 0.00 0.00 0.00 53.44 52.49 1l6i n ALA 624 Cb 0.14 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 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 -2.98 3.22 -0.19 0.00 0.00 -1.02 -4.76 121.76 116.03 1l6i s ALA 625 Ca 0.09 1.13 -0.03 0.00 0.00 0.00 0.00 51.96 53.15 1l6i s ALA 625 Cb 0.16 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 1l6i s ALA 625 CO 0.83 -0.72 -0.20 -0.25 0.00 0.00 0.00 175.76 175.42 1l6i n ASP 626 N 0.11 2.07 -4.48 0.00 8.00 0.70 -3.97 116.55 118.99 1l6i n ASP 626 Ca 0.04 0.05 -0.34 0.00 0.71 0.00 0.00 54.79 55.24 1l6i n ASP 626 Cb 0.45 -0.41 -0.12 0.00 -0.02 0.00 0.00 41.12 41.02 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 -2.36 3.96 -0.27 0.53 -1.09 -0.27 0.11 121.20 121.81 1l6i s ILE 627 Ca -0.26 -0.32 -0.07 0.00 -2.23 0.00 0.00 60.65 57.77 1l6i s ILE 627 Cb 0.08 -2.77 -0.01 0.00 -1.58 0.00 0.00 42.46 38.18 1l6i s ILE 627 CO 0.39 0.46 0.08 -0.55 -1.23 0.00 0.00 174.94 174.08 1l6i s SER 628 N 0.69 5.15 -0.40 3.58 0.15 -0.87 0.73 113.70 122.74 1l6i s SER 628 Ca -0.01 -0.42 -0.23 0.00 0.70 0.00 0.00 55.95 55.99 1l6i s SER 628 Cb -0.14 -1.91 0.02 0.00 -1.71 0.00 0.00 66.02 62.27 1l6i s SER 628 CO 0.02 -0.11 0.78 -1.61 1.20 0.00 0.00 173.24 173.53 1l6i s GLU 629 N 1.57 3.60 -0.46 5.44 0.41 -0.50 -1.48 118.70 127.28 1l6i s GLU 629 Ca 0.05 0.12 0.08 0.00 -0.41 0.00 0.00 54.97 54.81 1l6i s GLU 629 Cb -0.16 -3.87 0.28 0.00 -1.78 0.00 0.00 34.13 28.60 1l6i s GLU 629 CO 0.03 -0.97 0.66 1.04 -0.49 0.00 0.00 175.26 175.54 1l6i n GLN 630 N 6.56 1.46 -0.94 1.61 1.13 -0.81 -4.71 117.38 121.68 1l6i n GLN 630 Ca 0.03 -3.77 -0.10 0.00 -1.94 0.00 0.00 57.00 51.22 1l6i n GLN 630 Cb 0.48 -1.67 0.20 0.00 0.11 0.00 0.00 30.24 29.36 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 0.86 2.76 -2.15 5.09 -5.35 -1.26 -2.26 119.36 117.05 1l6i n ILE 631 Ca 0.25 -2.50 -0.36 0.00 -0.27 0.00 0.00 62.75 59.87 1l6i n ILE 631 Cb 0.51 -0.37 0.01 0.00 -1.74 0.00 0.00 39.64 38.06 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 -2.16 5.61 0.13 7.28 1.04 -1.24 -4.63 113.70 119.73 1l6i s SER 632 Ca 0.48 2.30 -0.35 0.00 0.48 0.00 0.00 55.95 58.87 1l6i s SER 632 Cb 0.43 -2.59 -0.16 0.00 0.10 0.00 0.00 66.02 63.80 1l6i s SER 632 CO 0.03 -1.30 1.38 0.41 0.98 0.00 0.00 173.24 174.74 1l6i n THR 633 N -1.22 0.21 -1.64 2.02 -1.04 -1.00 -4.67 114.28 106.94 1l6i n THR 633 Ca 0.11 -0.05 -0.52 0.00 -2.04 0.00 0.00 64.05 61.55 1l6i n THR 633 Cb 0.50 -1.06 -0.06 0.00 -1.82 0.00 0.00 70.33 67.88 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 2.56 -0.30 0.00 2.41 0.00 -1.26 -1.43 120.51 122.49 1l6i n ALA 634 Ca 0.17 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.07 1l6i n ALA 634 Cb 0.23 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 3.18 2.31 0.10 0.00 0.00 -1.26 -4.69 105.19 104.84 1l6i n GLY 635 Ca 0.20 0.00 -0.11 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 -1.60 0.74 -3.37 1.61 4.76 -0.51 -4.86 118.16 114.93 1l6i n LYS 636 Ca 0.00 0.01 -0.41 0.00 -2.87 0.00 0.00 58.31 55.04 1l6i n LYS 636 Cb 0.00 -1.51 -0.09 0.00 -1.84 0.00 0.00 35.03 31.59 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 -2.49 3.55 0.06 1.97 2.56 -1.26 -4.75 118.70 118.35 1l6i s GLU 637 Ca -0.14 -0.39 -0.18 0.00 0.00 0.00 0.00 54.97 54.27 1l6i s GLU 637 Cb 0.06 -3.81 -0.13 0.00 2.00 0.00 0.00 34.13 32.25 1l6i s GLU 637 CO 0.78 -0.56 1.34 0.00 -0.56 0.00 0.00 175.26 176.25 1l6i h ALA 638 N 8.48 0.29 -1.47 6.30 0.00 -1.89 -2.86 119.26 128.10 1l6i h ALA 638 Ca -0.29 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1l6i h ALA 638 Cb 1.14 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1l6i h ALA 638 CO 0.71 0.29 0.00 0.45 0.00 0.00 0.00 179.25 180.71 1l6i n SER 639 N -4.37 0.00 0.00 0.00 2.88 -1.26 -4.11 113.62 106.76 1l6i n SER 639 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1l6i n SER 639 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 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 1.99 2.55 0.00 0.46 0.00 -1.26 -0.56 105.19 108.36 1l6i n GLY 640 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 1.42 0.00 -0.34 2.61 -2.24 -1.26 -4.73 114.28 109.74 1l6i n THR 641 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1l6i n THR 641 Cb 0.00 -0.53 0.22 0.00 -2.10 0.00 0.00 70.33 67.92 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 1.52 0.71 3.38 0.00 -1.96 -1.54 103.07 105.19 1l6i h GLY 642 Ca 0.00 -0.38 0.09 0.00 0.00 0.00 0.00 47.33 47.04 1l6i h GLY 642 CO 0.00 0.12 0.60 3.45 0.00 0.00 0.00 176.54 180.71 1l6i h ASN 643 N 0.90 0.87 -0.06 0.19 7.08 -1.94 -0.88 115.58 121.73 1l6i h ASN 643 Ca 0.47 0.02 -0.03 0.00 -3.08 0.00 0.00 56.30 53.68 1l6i h ASN 643 Cb 0.48 -0.16 -0.00 0.00 -2.08 0.00 0.00 38.32 36.56 1l6i h ASN 643 CO -0.27 0.52 -0.07 0.24 -2.08 0.00 0.00 177.43 175.77 1l6i h MET 644 N 0.97 0.16 -0.92 4.14 2.86 -1.61 -2.19 114.93 118.33 1l6i h MET 644 Ca 0.42 -0.08 0.16 0.00 -2.06 0.00 0.00 59.70 58.14 1l6i h MET 644 Cb 0.35 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.93 1l6i h MET 644 CO -0.18 0.60 0.59 0.87 1.06 0.00 0.00 176.91 179.85 1l6i h LYS 645 N -0.28 0.67 0.03 1.72 1.57 -0.66 -2.40 116.57 117.21 1l6i h LYS 645 Ca 0.01 -0.04 -0.24 0.00 -1.87 0.00 0.00 60.65 58.51 1l6i h LYS 645 Cb 0.58 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.74 1l6i h LYS 645 CO 0.02 0.44 -1.01 -0.07 -0.57 0.00 0.00 179.45 178.26 1l6i h LEU 646 N 0.69 0.55 -0.57 2.94 3.38 -1.05 -2.89 115.31 118.36 1l6i h LEU 646 Ca 0.48 -0.47 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 1l6i h LEU 646 Cb 0.80 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1l6i h LEU 646 CO -0.23 1.28 -0.18 0.00 0.09 0.00 0.00 178.44 179.40 1l6i h ALA 647 N 0.67 0.76 -0.07 1.53 0.00 -0.98 -1.61 119.26 119.57 1l6i h ALA 647 Ca -0.10 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1l6i h ALA 647 Cb 1.67 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1l6i h ALA 647 CO 0.18 0.66 -0.43 -0.07 0.00 0.00 0.00 179.25 179.59 1l6i h LEU 648 N 0.84 0.17 -1.40 0.00 3.38 -1.44 -2.39 115.31 114.47 1l6i h LEU 648 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1l6i h LEU 648 Cb 0.74 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1l6i h LEU 648 CO 0.06 0.58 0.00 0.59 0.09 0.00 0.00 178.44 179.76 1l6i n ASN 649 N -4.01 2.04 0.00 -0.43 3.02 -1.10 -4.46 115.26 110.32 1l6i n ASN 649 Ca -0.02 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.48 1l6i n ASN 649 Cb 0.48 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 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 0.95 0.64 3.87 7.41 0.00 -0.90 -4.88 105.19 112.28 1l6i n GLY 650 Ca 0.12 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 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 3.33 -0.02 4.61 0.00 -0.62 -4.81 121.76 122.25 1l6i s ALA 651 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.81 1l6i s ALA 651 Cb 0.00 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.35 1l6i s ALA 651 CO 0.00 0.04 0.09 -0.51 0.00 0.00 0.00 175.76 175.38 1l6i s LEU 652 N -3.71 3.96 -0.09 0.00 1.43 0.12 -4.40 118.68 115.99 1l6i s LEU 652 Ca 0.52 0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 53.66 1l6i s LEU 652 Cb -0.10 -2.26 -0.05 0.00 0.03 0.00 0.00 46.19 43.81 1l6i s LEU 652 CO 0.29 0.29 0.40 -0.89 0.23 0.00 0.00 176.35 176.67 1l6i s THR 653 N -1.17 5.17 -0.47 5.49 2.01 -1.26 -2.04 115.64 123.36 1l6i s THR 653 Ca 0.22 0.80 -0.14 0.00 0.31 0.00 0.00 61.69 62.88 1l6i s THR 653 Cb -0.12 -3.73 0.09 0.00 0.01 0.00 0.00 72.50 68.75 1l6i s THR 653 CO 0.13 0.44 0.38 -0.69 -0.69 0.00 0.00 174.62 174.19 1l6i s VAL 654 N -0.05 4.92 0.21 3.82 1.01 -0.55 0.06 120.40 129.83 1l6i s VAL 654 Ca 0.23 -1.29 -0.13 0.00 0.00 0.00 0.00 61.98 60.79 1l6i s VAL 654 Cb -0.15 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1l6i s VAL 654 CO 0.10 -0.64 0.43 -0.83 0.00 0.00 0.00 175.10 174.16 1l6i s GLY 655 N 2.71 0.36 0.64 4.51 0.00 -0.83 -1.93 107.32 112.78 1l6i s GLY 655 Ca 0.04 -0.71 -0.09 0.00 0.00 0.00 0.00 44.72 43.95 1l6i s GLY 655 CO 0.04 -0.60 1.00 -0.51 0.00 0.00 0.00 173.10 173.04 1l6i s THR 656 N -3.97 3.77 -1.12 0.90 -4.23 -0.96 -0.48 115.64 109.55 1l6i s THR 656 Ca 0.17 0.35 -0.17 0.00 -1.18 0.00 0.00 61.69 60.86 1l6i s THR 656 Cb 0.00 -3.54 0.13 0.00 1.34 0.00 0.00 72.50 70.44 1l6i s THR 656 CO 0.03 -0.64 1.38 -0.76 -0.54 0.00 0.00 174.62 174.09 1l6i s LEU 657 N -5.18 4.74 0.10 4.79 1.43 -1.26 -4.69 118.68 118.61 1l6i s LEU 657 Ca 0.56 -2.49 -0.13 0.00 -1.03 0.00 0.00 54.13 51.04 1l6i s LEU 657 Cb -0.11 -2.44 0.02 0.00 0.03 0.00 0.00 46.19 43.69 1l6i s LEU 657 CO 0.49 -0.97 0.31 -0.62 0.23 0.00 0.00 176.35 175.80 1l6i s ASP 658 N 3.47 -0.10 0.00 2.29 2.15 -1.26 -4.62 116.67 118.61 1l6i s ASP 658 Ca 0.41 -0.42 0.00 0.00 0.43 0.00 0.00 52.55 52.98 1l6i s ASP 658 Cb -0.02 0.41 0.00 0.00 -0.30 0.00 0.00 42.92 43.01 1l6i s ASP 658 CO -0.03 -0.78 0.00 0.61 -0.17 0.00 0.00 175.17 174.80 1l6i n GLY 659 N -0.07 1.99 0.12 2.66 0.00 -1.08 -0.55 105.19 108.25 1l6i n GLY 659 Ca -0.16 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 5.71 2.97 -0.25 4.61 0.00 0.28 -3.19 120.51 130.63 1l6i n ALA 660 Ca 0.00 -0.31 0.02 0.00 0.00 0.00 0.00 53.44 53.16 1l6i n ALA 660 Cb 0.00 -1.25 0.15 0.00 0.00 0.00 0.00 19.45 18.36 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 0.58 0.45 -0.55 0.00 2.35 -1.05 -1.39 115.58 115.96 1l6i h ASN 661 Ca 0.00 0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 1l6i h ASN 661 Cb 0.44 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1l6i h ASN 661 CO 0.00 0.24 0.08 1.62 -1.65 0.00 0.00 177.43 177.72 1l6i h VAL 662 N 0.59 1.25 -0.07 2.81 3.04 -1.53 0.27 116.25 122.61 1l6i h VAL 662 Ca 0.37 -0.99 -0.06 0.00 -1.01 0.00 0.00 66.70 65.02 1l6i h VAL 662 Cb 0.43 0.71 -0.01 0.00 -2.01 0.00 0.00 31.29 30.41 1l6i h VAL 662 CO -0.30 0.36 -0.22 -0.33 -1.01 0.00 0.00 177.57 176.08 1l6i h GLU 663 N 0.90 0.11 0.08 4.17 5.08 -1.63 -1.22 114.58 122.07 1l6i h GLU 663 Ca 0.18 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.29 1l6i h GLU 663 Cb 0.42 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.67 1l6i h GLU 663 CO 0.01 0.33 -0.92 0.82 -1.00 0.00 0.00 179.01 178.25 1l6i h ILE 664 N 0.10 1.38 -0.62 3.13 2.04 -0.32 -1.90 117.51 121.33 1l6i h ILE 664 Ca 0.02 -2.33 -0.02 0.00 1.00 0.00 0.00 64.86 63.53 1l6i h ILE 664 Cb 0.44 2.75 -0.03 0.00 -0.74 0.00 0.00 36.82 39.25 1l6i h ILE 664 CO 0.03 0.69 0.30 0.00 0.00 0.00 0.00 178.15 179.17 1l6i h ALA 665 N 0.26 0.80 0.00 1.87 0.00 -0.34 0.32 119.26 122.16 1l6i h ALA 665 Ca -0.14 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1l6i h ALA 665 Cb 1.63 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1l6i h ALA 665 CO 0.18 0.36 -0.45 1.05 0.00 0.00 0.00 179.25 180.39 1l6i h GLU 666 N 0.85 0.00 -0.04 0.00 4.11 -1.22 0.91 114.58 119.19 1l6i h GLU 666 Ca 0.21 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.54 1l6i h GLU 666 Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1l6i h GLU 666 CO -0.03 0.45 -0.35 0.87 0.07 0.00 0.00 179.01 180.02 1l6i h LYS 667 N 0.00 0.32 0.00 1.06 1.79 -0.87 -3.35 116.57 115.52 1l6i h LYS 667 Ca -0.00 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1l6i h LYS 667 Cb 0.83 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1l6i h LYS 667 CO 0.06 0.95 -0.39 -0.39 -1.08 0.00 0.00 179.45 178.59 1l6i h VAL 668 N -0.22 0.00 0.00 0.50 -1.51 -0.11 -3.47 116.25 111.44 1l6i h VAL 668 Ca -0.03 -0.89 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 1l6i h VAL 668 Cb 1.03 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.88 1l6i h VAL 668 CO 0.07 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.02 1l6i n GLY 669 N 1.17 0.48 0.28 5.19 0.00 0.29 -4.61 105.19 108.00 1l6i n GLY 669 Ca 0.03 -1.44 0.14 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.61 114.58 117.78 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 0.05 0.00 -0.85 0.07 0.00 0.00 179.01 178.28 1l6i n GLU 671 N -3.80 0.24 -0.18 1.06 0.00 -1.26 -3.56 120.64 113.13 1l6i n GLU 671 Ca -0.02 0.32 0.06 0.00 0.00 0.00 0.00 57.16 57.52 1l6i n GLU 671 Cb 0.15 -1.85 0.14 0.00 0.00 0.00 0.00 31.44 29.88 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 -2.27 2.86 -4.02 -1.84 3.02 -0.24 -4.94 115.26 107.82 1l6i n ASN 672 Ca 0.04 -2.43 -0.08 0.00 -0.03 0.00 0.00 54.58 52.08 1l6i n ASN 672 Cb 0.33 -0.29 -0.10 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.76 0.18 -0.85 2.41 2.07 -1.23 -4.62 121.20 117.40 1l6i s ILE 673 Ca 0.24 -1.52 0.01 0.00 -1.41 0.00 0.00 60.65 57.97 1l6i s ILE 673 Cb 0.17 -1.26 0.27 0.00 0.13 0.00 0.00 42.46 41.77 1l6i s ILE 673 CO 0.08 -0.84 1.05 0.49 -1.91 0.00 0.00 174.94 173.82 1l6i n PHE 674 N 0.35 3.15 -2.32 3.50 3.01 0.11 -4.90 117.46 120.36 1l6i n PHE 674 Ca -0.16 -3.51 -0.36 0.00 1.01 0.00 0.00 57.45 54.43 1l6i n PHE 674 Cb 0.60 -0.91 -0.01 0.00 -0.01 0.00 0.00 39.48 39.15 1l6i n PHE 674 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1l6i s ILE 675 N -2.48 3.26 0.23 4.37 -1.09 -1.26 -1.96 121.20 122.27 1l6i s ILE 675 Ca 0.35 0.90 -0.22 0.00 -2.23 0.00 0.00 60.65 59.44 1l6i s ILE 675 Cb 0.08 -3.43 0.05 0.00 -1.58 0.00 0.00 42.46 37.58 1l6i s ILE 675 CO 0.02 -0.06 0.85 0.72 -1.23 0.00 0.00 174.94 175.24 1l6i s PHE 676 N -1.65 -0.10 0.00 3.97 -0.71 0.36 -4.89 117.98 114.96 1l6i s PHE 676 Ca 0.65 -0.32 0.00 0.00 -1.04 0.00 0.00 56.93 56.23 1l6i s PHE 676 Cb -0.25 0.70 0.00 0.00 -1.21 0.00 0.00 43.02 42.25 1l6i s PHE 676 CO 0.30 -1.09 0.00 0.41 -1.34 0.00 0.00 175.22 173.51 1l6i n GLY 677 N -0.49 -2.22 3.82 1.99 0.00 -1.26 -4.15 105.19 102.87 1l6i n GLY 677 Ca -0.05 -1.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.30 3.35 1.02 1.61 3.76 -1.26 -4.96 115.29 118.52 1l6i s HIS 678 Ca 0.00 1.61 -0.15 0.00 -0.15 0.00 0.00 55.06 56.36 1l6i s HIS 678 Cb 0.00 -2.84 0.20 0.00 1.11 0.00 0.00 32.58 31.05 1l6i s HIS 678 CO 0.00 -0.07 1.17 0.95 -0.85 0.00 0.00 174.74 175.94 1l6i s THR 679 N -2.11 1.87 0.07 1.30 -4.23 -1.26 -4.46 115.64 106.82 1l6i s THR 679 Ca 0.60 0.00 -0.27 0.00 -1.18 0.00 0.00 61.69 60.84 1l6i s THR 679 Cb -0.10 -2.71 -0.17 0.00 1.34 0.00 0.00 72.50 70.86 1l6i s THR 679 CO 0.14 0.00 1.62 0.58 -0.54 0.00 0.00 174.62 176.43 1l6i h VAL 680 N -1.91 0.72 -0.79 2.29 2.07 -1.83 0.10 116.25 116.90 1l6i h VAL 680 Ca -0.48 -0.11 0.12 0.00 0.82 0.00 0.00 66.70 67.06 1l6i h VAL 680 Cb 1.30 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1l6i h VAL 680 CO 0.47 0.02 0.52 -0.33 0.02 0.00 0.00 177.57 178.27 1l6i h GLU 681 N -0.45 0.58 0.00 1.57 3.07 -1.94 -1.67 114.58 115.73 1l6i h GLU 681 Ca -0.04 -0.03 -0.20 0.00 -0.50 0.00 0.00 59.36 58.59 1l6i h GLU 681 Cb 0.34 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 28.09 1l6i h GLU 681 CO 0.07 0.38 -1.05 1.96 -1.40 0.00 0.00 179.01 178.97 1l6i h GLN 682 N 0.59 0.00 0.04 2.33 4.20 -1.81 -2.44 115.11 118.02 1l6i h GLN 682 Ca 0.38 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.09 1l6i h GLN 682 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1l6i h GLN 682 CO -0.14 0.75 -0.02 0.28 -0.67 0.00 0.00 178.83 179.03 1l6i h VAL 683 N 0.00 1.04 -0.77 -0.54 2.07 -0.16 -2.27 116.25 115.62 1l6i h VAL 683 Ca -0.07 -0.26 0.09 0.00 0.82 0.00 0.00 66.70 67.29 1l6i h VAL 683 Cb 1.72 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 32.62 1l6i h VAL 683 CO 0.10 0.07 0.41 0.11 0.02 0.00 0.00 177.57 178.28 1l6i h LYS 684 N -0.17 0.67 -0.77 1.57 1.57 -1.36 -1.76 116.57 116.32 1l6i h LYS 684 Ca -0.01 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1l6i h LYS 684 Cb 0.15 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1l6i h LYS 684 CO 0.01 0.45 0.30 0.00 -0.57 0.00 0.00 179.45 179.63 1l6i h ALA 685 N 1.44 1.00 -0.31 3.86 0.00 -1.41 -0.16 119.26 123.68 1l6i h ALA 685 Ca 0.37 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 1l6i h ALA 685 Cb 0.37 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1l6i h ALA 685 CO -0.26 0.63 -0.44 0.82 0.00 0.00 0.00 179.25 180.00 1l6i h ILE 686 N 1.11 1.28 -0.76 0.00 2.04 -0.82 -0.40 117.51 119.98 1l6i h ILE 686 Ca 0.25 -1.63 -0.05 0.00 1.00 0.00 0.00 64.86 64.44 1l6i h ILE 686 Cb 0.23 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1l6i h ILE 686 CO -0.02 0.53 0.27 -0.07 0.00 0.00 0.00 178.15 178.86 1l6i h LEU 687 N 0.63 1.07 -0.41 1.44 3.38 -1.25 -1.98 115.31 118.20 1l6i h LEU 687 Ca 0.04 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 1l6i h LEU 687 Cb 1.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1l6i h LEU 687 CO 0.10 0.97 0.04 0.00 0.09 0.00 0.00 178.44 179.65 1l6i h ALA 688 N 1.14 0.54 0.00 1.53 0.00 -0.86 -3.17 119.26 118.44 1l6i h ALA 688 Ca 0.25 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1l6i h ALA 688 Cb 0.26 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1l6i h ALA 688 CO -0.01 0.28 0.00 -0.22 0.00 0.00 0.00 179.25 179.30 1l6i h LYS 689 N 0.53 0.00 0.00 0.00 3.64 -1.04 -3.48 116.57 116.22 1l6i h LYS 689 Ca 0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1l6i h LYS 689 Cb 0.41 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1l6i h LYS 689 CO 0.01 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.60 1l6i n GLY 690 N 0.87 0.93 3.65 5.01 0.00 -0.78 -5.09 105.19 109.78 1l6i n GLY 690 Ca 0.03 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 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 3.34 -0.61 1.61 5.04 -1.00 -4.98 117.35 120.75 1l6i s TYR 691 Ca 0.00 1.05 -0.04 0.00 -2.44 0.00 0.00 57.07 55.64 1l6i s TYR 691 Cb 0.00 -2.94 0.16 0.00 0.35 0.00 0.00 41.96 39.53 1l6i s TYR 691 CO 0.00 -0.30 0.44 0.34 -1.34 0.00 0.00 175.55 174.70 1l6i s ASP 692 N 1.29 5.44 0.38 4.32 -1.08 -1.26 -4.99 116.67 120.77 1l6i s ASP 692 Ca 0.32 -2.69 0.11 0.00 -0.52 0.00 0.00 52.55 49.77 1l6i s ASP 692 Cb -0.16 -1.90 0.89 0.00 -1.46 0.00 0.00 42.92 40.29 1l6i s ASP 692 CO 0.09 -0.43 1.88 1.55 0.52 0.00 0.00 175.17 178.78 1l6i h PRO 693 N 7.31 0.59 -0.30 4.34 0.13 -1.89 -2.43 132.00 139.75 1l6i h PRO 693 Ca -0.03 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.96 1l6i h PRO 693 Cb 0.98 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 1l6i h PRO 693 CO 0.73 0.39 -0.25 0.28 -0.23 0.00 0.00 178.00 178.92 1l6i h VAL 694 N 0.61 1.27 -0.82 1.56 2.07 -1.91 -1.39 116.25 117.64 1l6i h VAL 694 Ca 0.43 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 1l6i h VAL 694 Cb 0.77 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 1l6i h VAL 694 CO -0.18 0.42 0.44 0.50 0.02 0.00 0.00 177.57 178.77 1l6i h LYS 695 N 0.51 1.14 -0.22 1.57 3.64 -1.87 0.12 116.57 121.45 1l6i h LYS 695 Ca 0.07 -0.13 -0.15 0.00 -1.27 0.00 0.00 60.65 59.17 1l6i h LYS 695 Cb 0.70 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1l6i h LYS 695 CO 0.05 0.84 -0.47 -1.49 -2.27 0.00 0.00 179.45 176.11 1l6i h TRP 696 N 1.14 0.71 -0.70 1.91 4.06 -1.54 -2.28 115.95 119.26 1l6i h TRP 696 Ca 0.29 -0.23 -0.02 0.00 2.06 0.00 0.00 58.89 60.98 1l6i h TRP 696 Cb 0.03 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 28.01 1l6i h TRP 696 CO 0.01 0.95 0.34 -0.09 -3.56 0.00 0.00 178.44 176.09 1l6i h ARG 697 N 0.47 1.01 -0.29 0.49 2.43 -0.21 -2.83 114.38 115.46 1l6i h ARG 697 Ca 0.03 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 58.92 1l6i h ARG 697 Cb 1.00 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1l6i h ARG 697 CO 0.09 0.79 -0.34 0.87 -1.51 0.00 0.00 179.97 179.87 1l6i h LYS 698 N 0.98 0.64 0.00 0.20 1.79 -0.74 -2.86 116.57 116.58 1l6i h LYS 698 Ca 0.24 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1l6i h LYS 698 Cb 0.11 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1l6i h LYS 698 CO -0.03 0.89 0.00 1.63 -1.08 0.00 0.00 179.45 180.86 1l6i n LYS 699 N -4.06 0.19 -3.88 3.15 4.76 -0.86 -4.60 118.16 112.86 1l6i n LYS 699 Ca -0.01 0.29 -0.35 0.00 -2.87 0.00 0.00 58.31 55.36 1l6i n LYS 699 Cb 0.49 -1.79 -0.14 0.00 -1.84 0.00 0.00 35.03 31.75 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 -4.18 4.64 0.19 4.39 -1.08 -1.08 -5.00 116.67 114.55 1l6i s ASP 700 Ca 0.08 -0.81 -0.12 0.00 -0.52 0.00 0.00 52.55 51.18 1l6i s ASP 700 Cb 0.11 -1.75 0.11 0.00 -1.46 0.00 0.00 42.92 39.93 1l6i s ASP 700 CO 0.48 -0.15 1.82 0.50 0.52 0.00 0.00 175.17 178.33 1l6i h LYS 701 N 8.10 0.89 -0.03 4.34 3.64 -1.82 0.28 116.57 131.96 1l6i h LYS 701 Ca -0.32 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 1l6i h LYS 701 Cb 1.11 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1l6i h LYS 701 CO 0.58 0.65 -0.11 0.28 -2.27 0.00 0.00 179.45 178.58 1l6i h VAL 702 N 0.88 1.47 -0.35 2.00 2.07 -1.94 -2.07 116.25 118.30 1l6i h VAL 702 Ca 0.23 -1.54 0.08 0.00 0.82 0.00 0.00 66.70 66.29 1l6i h VAL 702 Cb -0.00 2.41 -0.08 0.00 -1.52 0.00 0.00 31.29 32.09 1l6i h VAL 702 CO -0.04 0.42 -0.23 0.25 0.02 0.00 0.00 177.57 177.99 1l6i h LEU 703 N -0.44 -0.77 -0.92 2.57 5.85 -1.83 0.25 115.31 120.02 1l6i h LEU 703 Ca -0.00 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1l6i h LEU 703 Cb 0.74 0.39 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1l6i h LEU 703 CO 0.02 -0.26 0.47 -0.78 -0.34 0.00 0.00 178.44 177.55 1l6i h ASP 704 N -0.18 1.11 -0.02 1.25 3.58 -0.35 -1.77 116.42 120.04 1l6i h ASP 704 Ca 0.18 -0.11 -0.17 0.00 0.42 0.00 0.00 57.03 57.35 1l6i h ASP 704 Cb 0.46 -0.28 0.01 0.00 1.72 0.00 0.00 39.33 41.24 1l6i h ASP 704 CO -0.46 0.90 -0.65 0.00 -2.88 0.00 0.00 179.24 176.14 1l6i h ALA 705 N 1.28 0.11 -0.60 -0.78 0.00 -0.57 -2.57 119.26 116.13 1l6i h ALA 705 Ca 0.31 -0.58 0.09 0.00 0.00 0.00 0.00 54.91 54.73 1l6i h ALA 705 Cb 0.05 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1l6i h ALA 705 CO -0.05 0.41 0.23 0.28 0.00 0.00 0.00 179.25 180.12 1l6i h VAL 706 N 0.02 0.78 -0.41 0.00 2.07 -0.32 0.21 116.25 118.60 1l6i h VAL 706 Ca -0.08 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1l6i h VAL 706 Cb 1.34 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1l6i h VAL 706 CO 0.13 0.08 0.23 -0.07 0.02 0.00 0.00 177.57 177.96 1l6i h LEU 707 N 0.41 0.49 -1.32 2.57 3.38 -1.33 -2.30 115.31 117.20 1l6i h LEU 707 Ca 0.30 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.20 1l6i h LEU 707 Cb 0.36 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1l6i h LEU 707 CO -0.30 0.39 -0.24 0.11 0.09 0.00 0.00 178.44 178.50 1l6i h LYS 708 N 0.56 0.00 0.00 1.13 1.57 -0.19 -1.73 116.57 117.91 1l6i h LYS 708 Ca 0.15 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.83 1l6i h LYS 708 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1l6i h LYS 708 CO -0.03 0.24 -0.48 0.93 -0.57 0.00 0.00 179.45 179.54 1l6i h GLU 709 N 0.00 0.00 0.00 3.15 5.08 -0.70 0.26 114.58 122.38 1l6i h GLU 709 Ca -0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1l6i h GLU 709 Cb 0.65 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1l6i h GLU 709 CO 0.03 0.48 -0.71 -0.07 -1.00 0.00 0.00 179.01 177.74 1l6i h LEU 710 N 0.00 0.00 0.00 1.33 3.38 -1.32 -3.04 115.31 115.66 1l6i h LEU 710 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1l6i h LEU 710 Cb 0.90 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1l6i h LEU 710 CO 0.06 0.71 -0.15 -0.33 0.09 0.00 0.00 178.44 178.82 1l6i h GLU 711 N 0.00 0.00 -0.00 1.13 5.08 -0.85 -3.37 114.58 116.57 1l6i h GLU 711 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1l6i h GLU 711 Cb 1.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.77 1l6i h GLU 711 CO 0.09 0.06 -0.16 -1.13 -1.00 0.00 0.00 179.01 176.87 1l6i n SER 712 N -3.08 0.24 0.00 1.42 3.41 0.89 -4.69 113.62 111.80 1l6i n SER 712 Ca 0.03 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1l6i n SER 712 Cb 0.56 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 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 1.45 1.35 0.36 5.00 0.00 -1.26 -4.75 105.19 107.33 1l6i n GLY 713 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 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 3.24 0.68 -0.28 1.61 3.64 -1.87 0.69 116.57 124.28 1l6i h LYS 714 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1l6i h LYS 714 Cb 0.00 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1l6i h LYS 714 CO 0.00 0.45 0.00 0.66 -2.27 0.00 0.00 179.45 178.29 1l6i n TYR 715 N -4.77 0.36 -2.51 1.91 4.01 -1.26 -4.48 117.16 110.41 1l6i n TYR 715 Ca 0.24 -0.25 -0.11 0.00 -0.16 0.00 0.00 57.90 57.62 1l6i n TYR 715 Cb 0.62 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.68 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 1.03 2.96 -4.18 7.72 3.41 -0.98 -4.72 113.62 118.86 1l6i n SER 716 Ca 0.14 -2.83 -0.35 0.00 -0.26 0.00 0.00 58.87 55.58 1l6i n SER 716 Cb 0.48 -0.44 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.57 -0.66 0.00 4.04 2.03 -1.13 -0.65 116.55 119.61 1l6i n ASP 717 Ca 0.22 -1.23 0.00 0.00 0.52 0.00 0.00 54.79 54.30 1l6i n ASP 717 Cb 0.85 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 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 -2.37 2.64 3.59 0.27 0.00 0.20 -4.99 105.19 104.53 1l6i n GLY 718 Ca -0.25 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 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 0.41 5.37 0.01 1.61 -1.08 0.18 -4.48 116.67 118.69 1l6i s ASP 719 Ca 0.00 1.46 0.21 0.00 -0.52 0.00 0.00 52.55 53.69 1l6i s ASP 719 Cb 0.00 -2.51 0.89 0.00 -1.46 0.00 0.00 42.92 39.83 1l6i s ASP 719 CO 0.00 -2.09 1.67 0.29 0.52 0.00 0.00 175.17 175.55 1l6i n LYS 720 N 8.75 0.00 -0.18 4.34 5.02 -1.26 -3.34 118.16 131.49 1l6i n LYS 720 Ca 0.28 0.15 0.07 0.00 -2.02 0.00 0.00 58.31 56.79 1l6i n LYS 720 Cb 0.48 -1.51 0.17 0.00 -0.02 0.00 0.00 35.03 34.15 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 -1.52 0.48 -0.24 2.13 8.25 -1.26 -4.64 115.22 118.42 1l6i n HIS 721 Ca 0.05 -0.41 0.04 0.00 -0.26 0.00 0.00 57.72 57.14 1l6i n HIS 721 Cb 0.25 -0.02 0.17 0.00 1.12 0.00 0.00 29.99 31.51 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 2.60 0.99 -0.71 -1.41 0.00 -1.89 -3.10 119.26 115.72 1l6i h ALA 722 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 54.91 54.73 1l6i h ALA 722 Cb 0.76 0.10 -0.18 0.00 0.00 0.00 0.00 17.79 18.47 1l6i h ALA 722 CO 0.00 -0.22 0.31 1.19 0.00 0.00 0.00 179.25 180.53 1l6i n PHE 723 N -5.02 2.28 -0.05 0.00 3.72 -1.26 -4.81 117.46 112.32 1l6i n PHE 723 Ca 0.13 -1.48 -0.12 0.00 -0.05 0.00 0.00 57.45 55.93 1l6i n PHE 723 Cb 0.39 -0.71 -0.06 0.00 -0.94 0.00 0.00 39.48 38.16 1l6i n PHE 723 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1l6i h ASP 724 N 1.70 0.26 -0.92 4.37 5.19 -1.86 0.11 116.42 125.26 1l6i h ASP 724 Ca 0.36 -0.32 0.23 0.00 -0.62 0.00 0.00 57.03 56.69 1l6i h ASP 724 Cb 2.32 -0.07 -0.17 0.00 0.18 0.00 0.00 39.33 41.59 1l6i h ASP 724 CO 0.76 0.51 -0.01 1.56 -3.12 0.00 0.00 179.24 178.94 1l6i h GLN 725 N -0.00 0.04 -0.12 3.56 4.20 -1.88 1.77 115.11 122.68 1l6i h GLN 725 Ca 0.04 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1l6i h GLN 725 Cb 0.38 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1l6i h GLN 725 CO 0.01 0.03 -0.04 1.98 -0.67 0.00 0.00 178.83 180.14 1l6i h MET 726 N 0.04 0.23 -0.40 1.46 4.05 -1.45 -2.85 114.93 116.01 1l6i h MET 726 Ca 0.53 -0.09 -0.00 0.00 -0.28 0.00 0.00 59.70 59.86 1l6i h MET 726 Cb 1.02 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.78 1l6i h MET 726 CO -0.86 0.54 0.25 -0.07 0.23 0.00 0.00 176.91 177.00 1l6i h LEU 727 N -0.10 0.47 -1.24 3.39 4.07 0.17 -2.93 115.31 119.15 1l6i h LEU 727 Ca 0.03 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1l6i h LEU 727 Cb 0.46 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 42.06 1l6i h LEU 727 CO 0.01 0.38 0.30 0.45 -1.08 0.00 0.00 178.44 178.50 1l6i h HIS 728 N 0.53 0.81 -0.16 1.13 3.86 0.25 -1.91 115.15 119.66 1l6i h HIS 728 Ca 0.14 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.28 1l6i h HIS 728 Cb -0.01 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 1l6i h HIS 728 CO -0.04 0.59 -0.14 0.66 0.86 0.00 0.00 177.93 179.86 1l6i h SER 729 N 0.83 0.24 -0.18 2.45 4.64 -1.31 0.86 113.55 121.08 1l6i h SER 729 Ca 0.21 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1l6i h SER 729 Cb 0.06 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1l6i h SER 729 CO -0.03 0.41 0.00 2.30 -0.87 0.00 0.00 176.83 178.64 1l6i n ILE 730 N -4.26 0.31 -2.31 0.95 -5.35 -1.06 -0.79 119.36 106.85 1l6i n ILE 730 Ca -0.01 -0.65 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 1l6i n ILE 730 Cb 0.28 1.09 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 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 0.97 4.11 0.31 3.28 0.00 -0.74 -4.39 105.19 108.73 1l6i n GLY 731 Ca 0.12 -2.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.03 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 1.10 0.03 1.61 1.63 -1.87 0.38 116.57 119.45 1l6i h LYS 732 Ca 0.00 -0.34 0.03 0.00 -0.85 0.00 0.00 60.65 59.49 1l6i h LYS 732 Cb 0.00 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.48 1l6i h LYS 732 CO 0.00 1.05 -0.26 1.96 -3.45 0.00 0.00 179.45 178.75 1l6i h GLN 733 N 1.01 -0.41 0.00 1.90 7.50 -1.93 -3.10 115.11 120.08 1l6i h GLN 733 Ca 0.18 0.03 -0.09 0.00 0.50 0.00 0.00 58.65 59.27 1l6i h GLN 733 Cb 0.54 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.15 1l6i h GLN 733 CO 0.03 -0.27 -1.00 0.78 -1.50 0.00 0.00 178.83 176.86 1l6i h GLY 734 N -0.42 0.00 0.00 3.46 0.00 0.79 -3.49 103.07 103.41 1l6i h GLY 734 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1l6i h GLY 734 CO -0.21 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.94 1l6i n GLY 735 N 1.27 0.90 3.55 4.60 0.00 0.13 -4.38 105.19 111.26 1l6i n GLY 735 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 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 -5.86 0.32 1.61 2.03 0.03 -4.67 116.55 110.01 1l6i n ASP 736 Ca 0.00 -0.78 0.20 0.00 0.52 0.00 0.00 54.79 54.73 1l6i n ASP 736 Cb 0.00 -3.51 1.10 0.00 -0.72 0.00 0.00 41.12 37.99 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 -0.97 0.00 -0.43 -0.67 0.11 -1.76 -1.35 132.00 126.92 1l6i h PRO 737 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1l6i h PRO 737 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1l6i h PRO 737 CO 0.41 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.86 1l6i n TYR 738 N -3.37 0.57 -3.56 0.65 4.01 -1.26 -4.98 117.16 109.21 1l6i n TYR 738 Ca -0.03 -0.36 -0.22 0.00 -0.16 0.00 0.00 57.90 57.13 1l6i n TYR 738 Cb 0.09 -0.01 0.08 0.00 -0.31 0.00 0.00 39.34 39.19 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 1.16 -3.57 -0.06 7.72 4.77 -0.51 -4.59 117.00 121.91 1l6i n LEU 739 Ca 0.17 -0.58 -0.08 0.00 -0.03 0.00 0.00 56.01 55.49 1l6i n LEU 739 Cb 0.52 -3.04 -0.01 0.00 -2.33 0.00 0.00 43.42 38.56 1l6i n LEU 739 CO 0.13 0.55 0.88 0.58 -1.33 0.00 0.00 177.39 178.21 1l6i h VAL 740 N -2.40 0.87 -0.05 4.08 2.07 -1.94 -2.69 116.25 116.18 1l6i h VAL 740 Ca -0.58 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1l6i h VAL 740 Cb 1.36 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1l6i h VAL 740 CO 0.55 0.02 0.03 0.24 0.02 0.00 0.00 177.57 178.42 1l6i h MET 741 N 0.13 0.07 0.00 1.57 2.86 -1.90 -2.55 114.93 115.10 1l6i h MET 741 Ca 0.12 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1l6i h MET 741 Cb 0.13 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.77 1l6i h MET 741 CO -0.17 0.15 -0.06 0.00 1.06 0.00 0.00 176.91 177.90 1l6i h ALA 742 N 0.92 1.26 0.00 6.32 0.00 -1.91 -2.54 119.26 123.31 1l6i h ALA 742 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1l6i h ALA 742 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1l6i h ALA 742 CO -0.00 0.07 -1.03 -0.25 0.00 0.00 0.00 179.25 178.04 1l6i n ASP 743 N -3.53 0.81 -0.20 0.00 8.00 -1.02 -4.73 116.55 115.89 1l6i n ASP 743 Ca -0.02 -0.75 -0.03 0.00 0.71 0.00 0.00 54.79 54.70 1l6i n ASP 743 Cb 0.17 0.98 0.08 0.00 -0.02 0.00 0.00 41.12 42.33 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 0.58 -0.19 1.24 3.57 -1.02 -2.70 116.94 118.43 1l6i h PHE 744 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1l6i h PHE 744 Cb 0.56 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1l6i h PHE 744 CO 0.00 0.28 0.08 0.00 -2.23 0.00 0.00 178.31 176.44 1l6i h ALA 745 N 1.31 0.24 -0.21 2.41 0.00 -1.85 -2.23 119.26 118.95 1l6i h ALA 745 Ca 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1l6i h ALA 745 Cb 0.16 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1l6i h ALA 745 CO -0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 179.25 178.88 1l6i h ALA 746 N 0.92 1.57 0.17 0.00 0.00 -1.85 -1.63 119.26 118.44 1l6i h ALA 746 Ca 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1l6i h ALA 746 Cb 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1l6i h ALA 746 CO -0.01 0.31 -0.08 -0.92 0.00 0.00 0.00 179.25 178.56 1l6i h TYR 747 N 0.30 -0.21 -0.43 0.00 3.20 -1.42 -1.73 116.97 116.68 1l6i h TYR 747 Ca 0.07 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.02 1l6i h TYR 747 Cb 0.25 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 1l6i h TYR 747 CO 0.01 0.18 0.30 0.28 -1.64 0.00 0.00 178.16 177.28 1l6i h VAL 748 N -0.65 0.89 -0.10 1.81 2.07 -1.07 -1.28 116.25 117.92 1l6i h VAL 748 Ca -0.02 -0.08 -0.24 0.00 0.82 0.00 0.00 66.70 67.18 1l6i h VAL 748 Cb 0.48 0.65 0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1l6i h VAL 748 CO 0.04 0.04 -0.87 -0.08 0.02 0.00 0.00 177.57 176.72 1l6i h GLU 749 N 0.22 0.77 -0.32 1.57 4.57 -1.03 -2.71 114.58 117.65 1l6i h GLU 749 Ca 0.20 -0.69 -0.14 0.00 -1.18 0.00 0.00 59.36 57.55 1l6i h GLU 749 Cb 0.50 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.24 1l6i h GLU 749 CO -0.04 1.28 -0.37 0.00 -1.18 0.00 0.00 179.01 178.71 1l6i h ALA 750 N 0.50 0.75 0.00 2.92 0.00 -0.97 -1.14 119.26 121.33 1l6i h ALA 750 Ca -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1l6i h ALA 750 Cb 1.51 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1l6i h ALA 750 CO 0.18 0.66 0.00 1.96 0.00 0.00 0.00 179.25 182.04 1l6i h GLN 751 N 0.61 0.00 0.02 0.00 1.08 -1.08 -2.31 115.11 113.43 1l6i h GLN 751 Ca 0.06 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.17 1l6i h GLN 751 Cb 0.91 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.35 1l6i h GLN 751 CO 0.08 0.00 -0.36 0.87 -0.95 0.00 0.00 178.83 178.47 1l6i h LYS 752 N 0.00 0.21 -0.26 1.46 1.57 -0.89 -3.15 116.57 115.51 1l6i h LYS 752 Ca 0.00 -0.25 0.04 0.00 -1.87 0.00 0.00 60.65 58.57 1l6i h LYS 752 Cb 0.14 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1l6i h LYS 752 CO 0.00 1.00 0.18 1.96 -0.57 0.00 0.00 179.45 182.02 1l6i h GLN 753 N -0.47 0.19 -0.35 3.15 4.20 -1.20 -2.36 115.11 118.26 1l6i h GLN 753 Ca -0.05 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.71 1l6i h GLN 753 Cb 1.14 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.80 1l6i h GLN 753 CO 0.07 0.13 -0.48 0.28 -0.67 0.00 0.00 178.83 178.16 1l6i h VAL 754 N 0.20 0.07 -0.87 -0.54 2.07 -1.39 -1.13 116.25 114.66 1l6i h VAL 754 Ca 0.11 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.79 1l6i h VAL 754 Cb 0.20 0.07 -0.10 0.00 -1.52 0.00 0.00 31.29 29.95 1l6i h VAL 754 CO -0.02 0.00 0.45 0.44 0.02 0.00 0.00 177.57 178.46 1l6i h ASP 755 N -0.39 0.54 -0.30 0.57 5.19 -1.46 -0.52 116.42 120.05 1l6i h ASP 755 Ca 0.10 0.09 -0.09 0.00 -0.62 0.00 0.00 57.03 56.51 1l6i h ASP 755 Cb 0.61 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.11 1l6i h ASP 755 CO -0.55 0.22 -0.14 0.58 -3.12 0.00 0.00 179.24 176.23 1l6i h VAL 756 N 0.63 1.26 0.00 -1.35 2.07 -1.26 -2.26 116.25 115.33 1l6i h VAL 756 Ca 0.48 -1.19 -0.19 0.00 0.82 0.00 0.00 66.70 66.62 1l6i h VAL 756 Cb 0.69 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 1l6i h VAL 756 CO -0.37 0.40 -0.89 0.25 0.02 0.00 0.00 177.57 176.98 1l6i h LEU 757 N 0.66 0.00 -1.10 2.57 5.85 -0.43 -3.14 115.31 119.72 1l6i h LEU 757 Ca 0.11 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1l6i h LEU 757 Cb 0.61 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1l6i h LEU 757 CO 0.04 0.89 -0.42 0.22 -0.34 0.00 0.00 178.44 178.83 1l6i h TYR 758 N 0.00 0.00 0.00 1.25 3.20 -0.64 -2.52 116.97 118.26 1l6i h TYR 758 Ca -0.01 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 1l6i h TYR 758 Cb 1.61 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.87 1l6i h TYR 758 CO 0.00 0.42 -0.48 0.00 -1.64 0.00 0.00 178.16 176.46 1l6i h ARG 759 N 0.00 0.00 -4.12 1.82 3.08 -1.37 -3.28 114.38 110.51 1l6i h ARG 759 Ca -0.00 0.00 -0.77 0.00 0.07 0.00 0.00 59.98 59.28 1l6i h ARG 759 Cb 0.80 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 30.63 1l6i h ARG 759 CO 0.06 0.48 0.97 -3.47 -1.07 0.00 0.00 179.97 176.94 1l6i n ASP 760 N -3.52 5.39 0.07 7.04 -0.08 -0.95 -4.89 116.55 119.61 1l6i n ASP 760 Ca -0.00 -3.02 0.21 0.00 -1.51 0.00 0.00 54.79 50.46 1l6i n ASP 760 Cb 0.59 -1.47 0.74 0.00 2.34 0.00 0.00 41.12 43.32 1l6i n ASP 760 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1l6i h GLN 761 N 6.80 0.00 -0.13 -0.67 1.08 -1.74 0.16 115.11 120.61 1l6i h GLN 761 Ca 0.26 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.25 1l6i h GLN 761 Cb 0.85 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.29 1l6i h GLN 761 CO 1.16 0.00 -0.74 1.49 -0.95 0.00 0.00 178.83 179.80 1l6i h GLU 762 N 0.00 0.64 -0.10 1.46 4.81 -1.90 -2.27 114.58 117.22 1l6i h GLU 762 Ca 0.21 -0.51 -0.24 0.00 -0.13 0.00 0.00 59.36 58.70 1l6i h GLU 762 Cb 1.12 0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.61 1l6i h GLU 762 CO -0.00 1.13 -0.87 0.00 -0.73 0.00 0.00 179.01 178.53 1l6i h ALA 763 N 0.73 0.26 0.27 2.92 0.00 -1.11 -2.42 119.26 119.91 1l6i h ALA 763 Ca -0.04 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1l6i h ALA 763 Cb 1.34 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 1l6i h ALA 763 CO 0.14 0.69 -0.52 2.35 0.00 0.00 0.00 179.25 181.92 1l6i h TRP 764 N 0.48 -1.47 -0.74 0.00 2.91 -0.91 -2.09 115.95 114.13 1l6i h TRP 764 Ca -0.08 0.03 0.01 0.00 1.13 0.00 0.00 58.89 59.98 1l6i h TRP 764 Cb 1.51 0.61 -0.04 0.00 -0.51 0.00 0.00 29.16 30.72 1l6i h TRP 764 CO 0.09 -0.63 0.49 1.15 -1.03 0.00 0.00 178.44 178.51 1l6i h THR 765 N -0.85 1.17 -0.28 2.65 2.02 -1.48 -1.24 112.91 114.90 1l6i h THR 765 Ca -0.03 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 66.85 1l6i h THR 765 Cb 0.80 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1l6i h THR 765 CO -0.20 0.18 0.10 0.03 0.37 0.00 0.00 175.52 176.00 1l6i h ARG 766 N 0.97 0.22 -0.58 6.66 3.08 -1.32 -1.34 114.38 122.08 1l6i h ARG 766 Ca 0.28 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 60.22 1l6i h ARG 766 Cb -0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1l6i h ARG 766 CO -0.07 0.15 0.00 0.00 -1.07 0.00 0.00 179.97 178.99 1l6i h ALA 767 N 1.17 0.78 -0.62 0.04 0.00 -0.59 -2.60 119.26 117.45 1l6i h ALA 767 Ca 0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1l6i h ALA 767 Cb 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1l6i h ALA 767 CO -0.12 0.61 0.38 0.00 0.00 0.00 0.00 179.25 180.12 1l6i h ALA 768 N 0.97 1.51 -0.19 0.00 0.00 -0.93 -1.30 119.26 119.32 1l6i h ALA 768 Ca 0.16 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1l6i h ALA 768 Cb 0.54 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1l6i h ALA 768 CO 0.03 0.44 -0.60 0.82 0.00 0.00 0.00 179.25 179.94 1l6i h ILE 769 N 0.85 1.30 -0.02 0.00 2.04 -1.14 -2.69 117.51 117.84 1l6i h ILE 769 Ca 0.22 -1.82 -0.05 0.00 1.00 0.00 0.00 64.86 64.22 1l6i h ILE 769 Cb -0.05 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1l6i h ILE 769 CO -0.04 0.57 -0.21 -0.07 0.00 0.00 0.00 178.15 178.40 1l6i h LEU 770 N 0.45 0.04 0.17 1.44 3.38 -1.20 0.83 115.31 120.42 1l6i h LEU 770 Ca -0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1l6i h LEU 770 Cb 1.22 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1l6i h LEU 770 CO 0.13 0.26 -0.09 0.78 0.09 0.00 0.00 178.44 179.60 1l6i h ASN 771 N 0.04 -0.23 -0.12 -0.43 -0.26 -0.93 0.15 115.58 113.81 1l6i h ASN 771 Ca 0.01 0.01 0.04 0.00 -0.56 0.00 0.00 56.30 55.79 1l6i h ASN 771 Cb 0.40 0.06 -0.04 0.00 -1.06 0.00 0.00 38.32 37.69 1l6i h ASN 771 CO 0.03 -0.15 -0.12 0.74 -1.06 0.00 0.00 177.43 176.87 1l6i h THR 772 N -0.25 0.68 -0.17 2.81 2.02 -1.02 -2.29 112.91 114.69 1l6i h THR 772 Ca -0.02 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 1l6i h THR 772 Cb 0.20 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1l6i h THR 772 CO 0.03 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 175.78 1l6i h ALA 773 N 0.93 1.47 -0.28 6.16 0.00 0.76 -3.11 119.26 125.20 1l6i h ALA 773 Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1l6i h ALA 773 Cb 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1l6i h ALA 773 CO -0.20 0.37 0.00 0.54 0.00 0.00 0.00 179.25 179.96 1l6i n ARG 774 N -4.26 2.47 -0.72 0.00 1.74 0.53 -2.82 116.66 113.59 1l6i n ARG 774 Ca -0.01 -2.20 0.08 0.00 -0.77 0.00 0.00 57.85 54.96 1l6i n ARG 774 Cb 0.28 -1.50 0.36 0.00 -1.02 0.00 0.00 32.46 30.57 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 3.35 0.00 2.00 0.00 0.00 -1.78 -1.76 103.07 104.89 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 0.38 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.92 1l6i h MET 777 N 0.00 0.00 -0.80 4.80 -0.00 -1.87 -3.12 114.93 113.93 1l6i h MET 777 Ca 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 59.70 59.76 1l6i h MET 777 Cb 0.66 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 32.22 1l6i h MET 777 CO -0.00 0.00 0.09 1.19 -0.00 0.00 0.00 176.91 178.19 1l6i n PHE 778 N -2.47 1.41 -2.45 -0.10 3.72 -0.66 -4.79 117.46 112.12 1l6i n PHE 778 Ca 0.00 -0.64 -0.32 0.00 -0.05 0.00 0.00 57.45 56.44 1l6i n PHE 778 Cb 0.16 -0.43 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 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 -0.45 6.56 0.31 4.37 0.15 -1.18 -1.54 113.70 121.93 1l6i s SER 779 Ca 0.34 1.65 0.23 0.00 0.70 0.00 0.00 55.95 58.86 1l6i s SER 779 Cb 0.26 -2.52 0.27 0.00 -1.71 0.00 0.00 66.02 62.32 1l6i s SER 779 CO 0.09 -0.63 1.41 0.77 1.20 0.00 0.00 173.24 176.09 1l6i h SER 780 N 1.09 0.00 -0.94 5.45 4.64 -1.48 -3.08 113.55 119.23 1l6i h SER 780 Ca -0.47 -0.02 0.09 0.00 -0.47 0.00 0.00 61.79 60.92 1l6i h SER 780 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 1l6i h SER 780 CO 0.61 0.01 0.60 0.44 -0.87 0.00 0.00 176.83 177.62 1l6i h ASP 781 N 0.00 0.89 0.01 4.97 3.32 -1.90 0.20 116.42 123.91 1l6i h ASP 781 Ca 0.00 0.02 -0.21 0.00 0.02 0.00 0.00 57.03 56.86 1l6i h ASP 781 Cb 0.95 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 40.34 1l6i h ASP 781 CO 0.00 0.54 -0.79 -0.09 -1.72 0.00 0.00 179.24 177.17 1l6i h ARG 782 N 0.99 0.65 -0.27 3.56 1.12 -1.86 -2.21 114.38 116.36 1l6i h ARG 782 Ca 0.43 -0.55 0.00 0.00 -1.11 0.00 0.00 59.98 58.75 1l6i h ARG 782 Cb 0.33 0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 30.40 1l6i h ARG 782 CO -0.18 1.17 0.18 0.77 -3.11 0.00 0.00 179.97 178.79 1l6i h SER 783 N 0.43 0.30 -0.82 -3.80 0.02 -1.34 -0.44 113.55 107.91 1l6i h SER 783 Ca -0.05 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 60.94 1l6i h SER 783 Cb 1.41 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.82 1l6i h SER 783 CO 0.15 0.22 0.51 0.40 -1.14 0.00 0.00 176.83 176.97 1l6i h ILE 784 N 0.36 1.07 -0.75 3.27 1.08 -0.85 0.33 117.51 122.03 1l6i h ILE 784 Ca 0.10 -0.33 0.02 0.00 -0.39 0.00 0.00 64.86 64.26 1l6i h ILE 784 Cb -0.04 0.03 -0.04 0.00 -3.07 0.00 0.00 36.82 33.70 1l6i h ILE 784 CO -0.03 0.17 0.48 0.03 -0.69 0.00 0.00 178.15 178.12 1l6i h ARG 785 N 0.96 0.94 -0.51 2.37 -0.00 -1.07 0.27 114.38 117.34 1l6i h ARG 785 Ca 0.35 -0.06 0.04 0.00 -0.50 0.00 0.00 59.98 59.81 1l6i h ARG 785 Cb 0.11 -0.21 -0.04 0.00 0.00 0.00 0.00 29.97 29.83 1l6i h ARG 785 CO -0.15 0.62 0.27 -0.44 0.00 0.00 0.00 179.97 180.28 1l6i h ASP 786 N 0.97 0.41 -0.04 7.04 5.19 0.25 -2.10 116.42 128.14 1l6i h ASP 786 Ca 0.29 0.02 -0.10 0.00 -0.62 0.00 0.00 57.03 56.61 1l6i h ASP 786 Cb -0.05 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.38 1l6i h ASP 786 CO -0.08 0.29 -0.28 1.88 -3.12 0.00 0.00 179.24 177.92 1l6i h TYR 787 N 0.54 0.55 0.15 4.55 0.05 0.10 -2.00 116.97 120.92 1l6i h TYR 787 Ca 0.22 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 1l6i h TYR 787 Cb 0.09 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.70 1l6i h TYR 787 CO -0.09 0.72 -0.07 1.96 -1.05 0.00 0.00 178.16 179.63 1l6i h GLN 788 N 0.42 -0.20 0.00 4.88 4.20 -0.27 0.18 115.11 124.33 1l6i h GLN 788 Ca 0.06 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1l6i h GLN 788 Cb 0.72 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1l6i h GLN 788 CO 0.05 -0.05 -0.00 0.00 -0.67 0.00 0.00 178.83 178.17 1l6i h ALA 789 N 0.52 -0.00 0.00 3.87 0.00 -1.35 0.07 119.26 122.37 1l6i h ALA 789 Ca -0.02 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1l6i h ALA 789 Cb 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1l6i h ALA 789 CO 0.03 -0.45 -0.49 0.00 0.00 0.00 0.00 179.25 178.34 1l6i h ARG 790 N -0.11 0.00 0.00 0.00 3.08 -1.46 -3.39 114.38 112.50 1l6i h ARG 790 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 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 0.00 0.32 0.00 -0.89 -1.07 0.00 0.00 179.97 178.33 1l6i n ILE 791 N -3.13 0.00 -0.07 2.04 5.41 -0.58 -4.74 119.36 118.29 1l6i n ILE 791 Ca 0.01 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.69 1l6i n ILE 791 Cb 0.68 -0.33 -0.01 0.00 -0.71 0.00 0.00 39.64 39.27 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 0.18 -0.35 1.39 6.55 -0.73 -3.10 115.95 119.90 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 -0.04 0.00 0.00 -0.86 0.00 0.00 29.16 28.26 1l6i h TRP 792 CO 0.00 0.08 0.00 1.04 -1.05 0.00 0.00 178.44 178.51 1l6i n GLN 793 N -5.03 3.45 -1.91 0.49 1.13 0.01 -4.70 117.38 110.82 1l6i n GLN 793 Ca -0.01 -2.93 -0.29 0.00 -1.94 0.00 0.00 57.00 51.83 1l6i n GLN 793 Cb 0.10 -1.95 0.08 0.00 0.11 0.00 0.00 30.24 28.57 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 -2.79 2.75 0.13 -1.58 0.00 -1.17 -4.95 121.76 114.14 1l6i s ALA 794 Ca 0.45 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 1l6i s ALA 794 Cb 0.36 -2.96 -0.06 0.00 0.00 0.00 0.00 23.12 20.45 1l6i s ALA 794 CO 0.11 -1.49 0.99 0.21 0.00 0.00 0.00 175.76 175.58 1l6i s LYS 795 N -5.50 4.69 0.00 0.00 2.47 -1.26 -4.99 119.74 115.15 1l6i s LYS 795 Ca 0.61 1.51 0.30 0.00 -1.56 0.00 0.00 55.97 56.83 1l6i s LYS 795 Cb -0.11 -3.35 1.43 0.00 -1.46 0.00 0.00 37.83 34.34 1l6i s LYS 795 CO 0.50 0.20 1.96 0.54 0.16 0.00 0.00 175.35 178.71