#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f9i s LEU 2 N 0.00 1.44 -0.03 4.03 2.01 -1.26 -5.02 118.68 119.86 2f9i s LEU 2 Ca 0.00 0.87 -0.24 0.00 0.01 0.00 0.00 54.13 54.77 2f9i s LEU 2 Cb 0.00 -2.91 -0.18 0.00 0.01 0.00 0.00 46.19 43.11 2f9i s LEU 2 CO 0.00 -3.33 1.12 -2.24 1.01 0.00 0.00 176.35 172.91 2f9i h ASP 3 N -2.04 -0.15 0.13 2.29 2.03 -2.01 -3.27 116.42 113.41 2f9i h ASP 3 Ca -0.50 -0.37 0.00 0.00 -0.73 0.00 0.00 57.03 55.43 2f9i h ASP 3 Cb 1.31 0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.85 2f9i h ASP 3 CO 0.49 0.34 0.00 2.22 -1.03 0.00 0.00 179.24 181.26 2f9i n PHE 4 N -4.94 0.00 1.26 4.15 1.16 -1.26 -1.02 117.46 116.81 2f9i n PHE 4 Ca -0.08 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.62 2f9i n PHE 4 Cb 0.26 -0.48 0.36 0.00 -1.61 0.00 0.00 39.48 38.01 2f9i n PHE 4 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2f9i n GLU 5 N -1.48 1.93 -0.26 3.97 1.02 -1.23 -4.42 120.64 120.16 2f9i n GLU 5 Ca 0.01 -1.35 0.00 0.00 -0.02 0.00 0.00 57.16 55.80 2f9i n GLU 5 Cb 0.05 -1.47 0.12 0.00 -0.02 0.00 0.00 31.44 30.12 2f9i n GLU 5 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2f9i h LYS 6 N 3.20 0.74 -0.74 3.49 1.79 -1.21 -1.81 116.57 122.03 2f9i h LYS 6 Ca 0.00 -0.04 0.17 0.00 -2.18 0.00 0.00 60.65 58.59 2f9i h LYS 6 Cb 0.68 -0.17 -0.12 0.00 -1.58 0.00 0.00 32.23 31.04 2f9i h LYS 6 CO 0.00 0.49 0.10 -1.35 -1.08 0.00 0.00 179.45 177.61 2f9i h PRO 7 N 0.77 0.17 0.00 3.15 0.11 -1.82 0.92 132.00 135.30 2f9i h PRO 7 Ca 0.34 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.42 2f9i h PRO 7 Cb 0.23 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 2f9i h PRO 7 CO -0.20 0.11 -0.09 -0.07 -0.21 0.00 0.00 178.00 177.55 2f9i h LEU 8 N 0.18 0.00 0.16 2.35 3.38 -1.67 0.17 115.31 119.88 2f9i h LEU 8 Ca 0.42 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 58.10 2f9i h LEU 8 Cb 0.74 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.50 2f9i h LEU 8 CO -0.59 0.09 -1.30 -0.26 0.09 0.00 0.00 178.44 176.47 2f9i h PHE 9 N 0.00 0.62 -0.13 1.13 0.04 -0.40 -1.43 116.94 116.76 2f9i h PHE 9 Ca -0.00 -0.45 -0.03 0.00 2.80 0.00 0.00 57.97 60.29 2f9i h PHE 9 Cb 0.51 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.63 2f9i h PHE 9 CO 0.00 1.35 -0.03 1.05 -0.60 0.00 0.00 178.31 180.08 2f9i h GLU 10 N 0.10 0.26 -0.65 1.51 9.09 -0.58 -2.70 114.58 121.61 2f9i h GLU 10 Ca -0.16 -0.10 -0.06 0.00 0.05 0.00 0.00 59.36 59.08 2f9i h GLU 10 Cb 2.02 -0.01 -0.03 0.00 -1.65 0.00 0.00 28.75 29.08 2f9i h GLU 10 CO 0.22 0.55 0.15 -0.84 0.05 0.00 0.00 179.01 179.15 2f9i h ILE 11 N -0.05 1.26 0.00 -1.06 -0.00 -1.05 -2.66 117.51 113.95 2f9i h ILE 11 Ca 0.03 -0.95 0.00 0.00 -0.00 0.00 0.00 64.86 63.95 2f9i h ILE 11 Cb 0.46 0.62 0.00 0.00 -0.00 0.00 0.00 36.82 37.90 2f9i h ILE 11 CO 0.01 0.36 0.00 0.54 -0.00 0.00 0.00 178.15 179.06 2f9i n ARG 12 N -4.29 0.10 0.03 0.16 1.74 -0.54 -2.38 116.66 111.48 2f9i n ARG 12 Ca 0.04 0.35 -0.02 0.00 -0.77 0.00 0.00 57.85 57.45 2f9i n ARG 12 Cb 0.25 -1.70 -0.09 0.00 -1.02 0.00 0.00 32.46 29.90 2f9i n ARG 12 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2f9i h ASN 13 N 0.00 0.00 -0.95 0.55 4.21 -1.14 -3.31 115.58 114.93 2f9i h ASN 13 Ca 0.00 0.00 -0.62 0.00 1.21 0.00 0.00 56.30 56.89 2f9i h ASN 13 Cb 0.30 0.00 -0.28 0.00 -1.12 0.00 0.00 38.32 37.22 2f9i h ASN 13 CO 0.00 0.69 0.80 2.29 -1.29 0.00 0.00 177.43 179.92 2f9i n LYS 14 N -2.96 2.53 0.00 0.81 -0.00 -1.00 -3.55 118.16 113.99 2f9i n LYS 14 Ca -0.10 -3.09 0.00 0.00 -0.00 0.00 0.00 58.31 55.12 2f9i n LYS 14 Cb 0.89 -2.21 0.00 0.00 -0.00 0.00 0.00 35.03 33.71 2f9i n LYS 14 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2f9i n ILE 15 N -0.86 0.00 0.00 0.58 5.41 -1.24 -5.14 119.36 118.10 2f9i n ILE 15 Ca 0.60 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.35 2f9i n ILE 15 Cb 0.84 -0.24 0.00 0.00 -0.71 0.00 0.00 39.64 39.53 2f9i n ILE 15 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2f9i n GLU 16 N -1.39 0.00 0.00 0.38 0.00 -1.23 -5.15 120.64 113.25 2f9i n GLU 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2f9i n GLU 16 Cb 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 31.44 30.87 2f9i n GLU 16 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2f9i n ASP 34 N 0.54 0.00 0.10 -1.84 2.03 -1.26 -5.08 116.55 111.04 2f9i n ASP 34 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 2f9i n ASP 34 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2f9i n ASP 34 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 2f9i h MET 35 N 0.00 -0.28 -0.37 -0.67 1.85 -2.06 -1.18 114.93 112.22 2f9i h MET 35 Ca 0.00 0.02 0.03 0.00 -0.61 0.00 0.00 59.70 59.14 2f9i h MET 35 Cb 0.00 0.06 -0.03 0.00 0.43 0.00 0.00 31.60 32.06 2f9i h MET 35 CO 0.00 0.09 0.18 -0.07 -0.40 0.00 0.00 176.91 176.71 2f9i h LEU 36 N -0.76 0.25 -0.50 3.39 3.38 -1.99 -1.58 115.31 117.49 2f9i h LEU 36 Ca -0.03 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.06 2f9i h LEU 36 Cb 0.51 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.13 2f9i h LEU 36 CO 0.05 0.19 -0.18 -0.33 0.09 0.00 0.00 178.44 178.26 2f9i h GLU 37 N 0.36 -0.06 -0.19 1.13 5.08 -1.94 0.18 114.58 119.14 2f9i h GLU 37 Ca 0.16 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2f9i h GLU 37 Cb 0.07 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2f9i h GLU 37 CO -0.12 -0.04 -0.12 0.00 -1.00 0.00 0.00 179.01 177.73 2f9i h ALA 38 N 1.35 1.44 -0.04 3.43 0.00 -0.99 -2.60 119.26 121.86 2f9i h ALA 38 Ca 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2f9i h ALA 38 Cb 0.43 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2f9i h ALA 38 CO -0.54 0.39 -0.03 0.77 0.00 0.00 0.00 179.25 179.84 2f9i h SER 39 N 0.29 0.09 -0.67 0.00 0.02 -0.16 -1.86 113.55 111.26 2f9i h SER 39 Ca 0.06 -0.46 0.13 0.00 -0.84 0.00 0.00 61.79 60.68 2f9i h SER 39 Cb 0.40 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 62.82 2f9i h SER 39 CO 0.02 0.53 0.20 0.25 -1.14 0.00 0.00 176.83 176.70 2f9i h LEU 40 N -0.34 0.12 -0.75 5.07 5.85 -0.65 0.53 115.31 125.14 2f9i h LEU 40 Ca 0.01 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 2f9i h LEU 40 Cb 0.50 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2f9i h LEU 40 CO 0.01 0.05 0.27 -0.08 -0.34 0.00 0.00 178.44 178.34 2f9i h GLU 41 N 0.34 1.14 -0.62 1.25 4.81 -1.48 -1.69 114.58 118.32 2f9i h GLU 41 Ca 0.36 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 2f9i h GLU 41 Cb 0.55 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 2f9i h GLU 41 CO -0.41 0.95 0.18 -0.09 -0.73 0.00 0.00 179.01 178.90 2f9i h ARG 42 N 1.09 0.98 -0.15 1.92 9.65 -0.92 -2.53 114.38 124.42 2f9i h ARG 42 Ca 0.25 -0.22 -0.14 0.00 -1.10 0.00 0.00 59.98 58.77 2f9i h ARG 42 Cb 0.26 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 2f9i h ARG 42 CO -0.01 0.88 -0.50 1.49 2.80 0.00 0.00 179.97 184.63 2f9i h GLU 43 N 0.90 0.40 0.05 0.20 4.57 0.06 -0.67 114.58 120.09 2f9i h GLU 43 Ca 0.20 -0.23 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2f9i h GLU 43 Cb 0.32 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 2f9i h GLU 43 CO -0.00 0.81 -0.02 1.15 -1.18 0.00 0.00 179.01 179.76 2f9i h THR 44 N 0.32 1.04 -0.70 0.32 2.02 -1.25 -0.79 112.91 113.86 2f9i h THR 44 Ca 0.01 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.84 2f9i h THR 44 Cb 0.99 1.25 -0.03 0.00 -1.74 0.00 0.00 68.15 68.62 2f9i h THR 44 CO 0.09 0.08 0.24 0.50 0.37 0.00 0.00 175.52 176.80 2f9i h LYS 45 N -0.20 1.07 0.48 6.66 3.64 -1.33 -1.29 116.57 125.58 2f9i h LYS 45 Ca -0.01 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.14 2f9i h LYS 45 Cb 0.18 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2f9i h LYS 45 CO 0.01 0.89 -0.23 0.87 -2.27 0.00 0.00 179.45 178.73 2f9i h LYS 46 N 1.03 -0.62 -0.45 1.90 1.79 -1.01 -0.89 116.57 118.32 2f9i h LYS 46 Ca 0.23 0.04 0.05 0.00 -2.18 0.00 0.00 60.65 58.80 2f9i h LYS 46 Cb 0.26 0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 31.00 2f9i h LYS 46 CO -0.01 -0.39 0.18 0.82 -1.08 0.00 0.00 179.45 178.97 2f9i h ILE 47 N -0.67 0.89 -0.01 1.86 2.04 -1.01 -2.38 117.51 118.23 2f9i h ILE 47 Ca -0.07 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2f9i h ILE 47 Cb 0.51 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2f9i h ILE 47 CO 0.11 0.07 -0.03 -1.22 0.00 0.00 0.00 178.15 177.08 2f9i n TYR 48 N -4.97 0.00 0.65 1.37 4.01 -0.50 -2.54 117.16 115.18 2f9i n TYR 48 Ca 0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.85 2f9i n TYR 48 Cb 0.15 -0.06 0.01 0.00 -0.31 0.00 0.00 39.34 39.14 2f9i n TYR 48 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2f9i n THR 49 N -0.67 0.00 -2.55 -0.72 -1.04 -0.35 -4.57 114.28 104.39 2f9i n THR 49 Ca 0.20 -0.37 -0.09 0.00 -2.04 0.00 0.00 64.05 61.75 2f9i n THR 49 Cb 0.23 1.20 0.04 0.00 -1.82 0.00 0.00 70.33 69.97 2f9i n THR 49 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2f9i n ASN 50 N 0.02 2.77 -4.76 8.00 3.02 -0.92 -5.06 115.26 118.32 2f9i n ASN 50 Ca 0.07 -2.64 -0.41 0.00 -0.03 0.00 0.00 54.58 51.57 2f9i n ASN 50 Cb 0.32 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 39.04 2f9i n ASN 50 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2f9i s LEU 51 N -3.73 4.37 0.37 3.41 1.43 -1.17 -4.96 118.68 118.40 2f9i s LEU 51 Ca 0.36 2.82 -0.05 0.00 -1.03 0.00 0.00 54.13 56.22 2f9i s LEU 51 Cb 0.35 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.88 2f9i s LEU 51 CO -0.01 -0.74 0.66 -0.54 0.23 0.00 0.00 176.35 175.95 2f9i s LYS 52 N -1.25 3.62 0.25 1.70 1.02 -1.26 -4.93 119.74 118.89 2f9i s LYS 52 Ca 0.55 0.10 -0.10 0.00 0.02 0.00 0.00 55.97 56.54 2f9i s LYS 52 Cb -0.43 -2.53 0.38 0.00 -0.52 0.00 0.00 37.83 34.73 2f9i s LYS 52 CO 0.52 0.05 1.60 -1.35 -0.92 0.00 0.00 175.35 175.24 2f9i h PRO 53 N 1.07 0.01 0.00 -1.68 0.11 -1.98 0.11 132.00 129.64 2f9i h PRO 53 Ca -0.48 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 2f9i h PRO 53 Cb 1.20 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2f9i h PRO 53 CO 0.64 0.01 -0.28 2.35 -0.21 0.00 0.00 178.00 180.51 2f9i h TRP 54 N 0.01 0.00 -0.17 0.65 2.91 -1.95 -1.83 115.95 115.57 2f9i h TRP 54 Ca 0.41 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.40 2f9i h TRP 54 Cb 0.64 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.29 2f9i h TRP 54 CO -0.61 0.28 -0.01 -0.44 -1.03 0.00 0.00 178.44 176.63 2f9i h ASP 55 N 0.00 0.30 -0.77 2.65 3.32 -1.20 -2.54 116.42 118.19 2f9i h ASP 55 Ca -0.00 -0.32 0.05 0.00 0.02 0.00 0.00 57.03 56.78 2f9i h ASP 55 Cb 0.68 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 2f9i h ASP 55 CO 0.04 0.55 0.48 0.03 -1.72 0.00 0.00 179.24 178.61 2f9i h ARG 56 N 0.05 0.87 -0.78 3.56 3.08 -1.02 -1.94 114.38 118.21 2f9i h ARG 56 Ca 0.05 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.09 2f9i h ARG 56 Cb 0.39 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2f9i h ARG 56 CO 0.01 0.58 0.48 0.28 -1.07 0.00 0.00 179.97 180.25 2f9i h VAL 57 N 0.90 1.06 -0.22 2.04 2.07 -1.25 -0.08 116.25 120.77 2f9i h VAL 57 Ca 0.33 -0.31 -0.12 0.00 0.82 0.00 0.00 66.70 67.41 2f9i h VAL 57 Cb 0.10 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2f9i h VAL 57 CO -0.15 0.17 -0.37 1.56 0.02 0.00 0.00 177.57 178.80 2f9i h GLN 58 N 0.91 0.49 -0.38 1.57 4.20 -1.01 -1.96 115.11 118.93 2f9i h GLN 58 Ca 0.33 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 2f9i h GLN 58 Cb 0.10 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 2f9i h GLN 58 CO -0.15 0.79 0.04 0.82 -0.67 0.00 0.00 178.83 179.66 2f9i h ILE 59 N 0.41 1.25 -0.57 2.54 2.04 -0.72 -2.79 117.51 119.68 2f9i h ILE 59 Ca 0.04 -0.92 0.07 0.00 1.00 0.00 0.00 64.86 65.05 2f9i h ILE 59 Cb 0.84 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 2f9i h ILE 59 CO 0.07 0.31 0.38 0.00 0.00 0.00 0.00 178.15 178.91 2f9i h ALA 60 N 0.90 1.88 -0.15 1.87 0.00 -0.80 -2.71 119.26 120.24 2f9i h ALA 60 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2f9i h ALA 60 Cb 0.41 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2f9i h ALA 60 CO 0.01 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.82 2f9i n ARG 61 N -4.47 1.73 -1.98 0.00 1.74 -0.76 -4.52 116.66 108.40 2f9i n ARG 61 Ca 0.08 -1.09 -0.40 0.00 -0.77 0.00 0.00 57.85 55.67 2f9i n ARG 61 Cb 0.26 -1.40 -0.01 0.00 -1.02 0.00 0.00 32.46 30.29 2f9i n ARG 61 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2f9i s LEU 62 N -1.60 4.32 0.28 0.55 1.43 -1.02 -4.90 118.68 117.74 2f9i s LEU 62 Ca 0.33 2.82 0.01 0.00 -1.03 0.00 0.00 54.13 56.26 2f9i s LEU 62 Cb 0.18 -3.73 0.58 0.00 0.03 0.00 0.00 46.19 43.24 2f9i s LEU 62 CO 0.27 -0.76 1.81 -0.61 0.23 0.00 0.00 176.35 177.28 2f9i h GLN 63 N 3.02 0.85 -0.20 1.70 5.75 -1.92 -1.47 115.11 122.85 2f9i h GLN 63 Ca -0.50 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 57.95 2f9i h GLN 63 Cb 1.24 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 29.60 2f9i h GLN 63 CO 0.64 0.56 0.00 -0.85 -2.65 0.00 0.00 178.83 176.53 2f9i n GLU 64 N -4.70 1.71 -1.67 1.69 0.00 -1.26 -4.85 120.64 111.57 2f9i n GLU 64 Ca 0.19 -1.08 -0.55 0.00 0.00 0.00 0.00 57.16 55.72 2f9i n GLU 64 Cb 0.40 -1.36 -0.07 0.00 0.00 0.00 0.00 31.44 30.42 2f9i n GLU 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2f9i n ARG 65 N 0.32 1.27 -1.73 3.44 3.00 -0.56 -4.61 116.66 117.80 2f9i n ARG 65 Ca 0.15 0.46 -0.39 0.00 -0.00 0.00 0.00 57.85 58.08 2f9i n ARG 65 Cb 0.31 -2.15 0.04 0.00 0.00 0.00 0.00 32.46 30.66 2f9i n ARG 65 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2f9i n PRO 66 N 4.59 1.60 -3.23 -0.14 -0.02 -1.26 -5.01 135.00 131.53 2f9i n PRO 66 Ca 0.23 0.59 -0.21 0.00 -2.02 0.00 0.00 63.50 62.10 2f9i n PRO 66 Cb 0.17 -2.51 0.04 0.00 -0.02 0.00 0.00 33.50 31.17 2f9i n PRO 66 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2f9i s THR 67 N -1.31 2.11 0.17 3.45 -4.23 -1.26 -4.87 115.64 109.70 2f9i s THR 67 Ca 0.72 -1.11 -0.13 0.00 -1.18 0.00 0.00 61.69 59.98 2f9i s THR 67 Cb -0.42 -2.22 0.06 0.00 1.34 0.00 0.00 72.50 71.25 2f9i s THR 67 CO 0.49 0.00 1.77 0.74 -0.54 0.00 0.00 174.62 177.08 2f9i h THR 68 N 0.35 1.19 0.00 3.99 2.02 -1.95 -2.09 112.91 116.42 2f9i h THR 68 Ca -0.32 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.36 2f9i h THR 68 Cb 1.29 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2f9i h THR 68 CO 0.45 0.21 0.00 -0.07 0.37 0.00 0.00 175.52 176.48 2f9i h LEU 69 N 0.72 0.00 -0.15 2.58 3.38 -1.95 -2.08 115.31 117.81 2f9i h LEU 69 Ca 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 2f9i h LEU 69 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2f9i h LEU 69 CO -0.03 0.00 -0.09 0.44 0.09 0.00 0.00 178.44 178.85 2f9i h ASP 70 N 0.00 0.34 0.04 -0.43 3.32 -1.76 -3.36 116.42 114.57 2f9i h ASP 70 Ca 0.00 -0.43 -0.27 0.00 0.02 0.00 0.00 57.03 56.35 2f9i h ASP 70 Cb 0.50 -0.09 0.02 0.00 0.22 0.00 0.00 39.33 39.97 2f9i h ASP 70 CO 0.00 0.70 -1.06 1.88 -1.72 0.00 0.00 179.24 179.04 2f9i h TYR 71 N -0.02 1.01 -0.62 4.55 0.05 -1.22 -3.39 116.97 117.33 2f9i h TYR 71 Ca 0.03 -0.56 0.12 0.00 0.05 0.00 0.00 58.73 58.37 2f9i h TYR 71 Cb 0.58 -0.11 -0.12 0.00 1.01 0.00 0.00 36.73 38.09 2f9i h TYR 71 CO 0.07 1.40 -0.19 0.82 -1.05 0.00 0.00 178.16 179.20 2f9i h ILE 72 N 0.37 0.32 -0.19 -2.88 2.04 -1.53 -1.72 117.51 113.92 2f9i h ILE 72 Ca -0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2f9i h ILE 72 Cb 1.72 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 2f9i h ILE 72 CO 0.21 0.00 0.13 -0.65 0.00 0.00 0.00 178.15 177.84 2f9i h PRO 73 N -0.04 0.10 0.00 2.37 0.11 -1.78 0.25 132.00 133.01 2f9i h PRO 73 Ca 0.29 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.36 2f9i h PRO 73 Cb 0.49 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 2f9i h PRO 73 CO -0.66 0.07 -0.17 1.88 -0.21 0.00 0.00 178.00 178.91 2f9i h TYR 74 N 0.10 0.00 0.00 0.65 0.05 -1.56 -3.39 116.97 112.83 2f9i h TYR 74 Ca 0.09 0.00 -0.38 0.00 0.05 0.00 0.00 58.73 58.49 2f9i h TYR 74 Cb 0.21 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.89 2f9i h TYR 74 CO -0.00 0.17 -2.32 -0.89 -1.05 0.00 0.00 178.16 174.06 2f9i n ILE 75 N -3.15 1.31 -4.16 -2.88 5.41 -0.28 -4.84 119.36 110.77 2f9i n ILE 75 Ca 0.03 -0.40 -0.29 0.00 1.00 0.00 0.00 62.75 63.09 2f9i n ILE 75 Cb 0.59 -1.62 -0.08 0.00 -0.71 0.00 0.00 39.64 37.82 2f9i n ILE 75 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2f9i s PHE 76 N -2.45 2.92 0.02 1.39 0.08 0.71 -4.73 117.98 115.93 2f9i s PHE 76 Ca -0.32 -0.07 0.02 0.00 0.12 0.00 0.00 56.93 56.67 2f9i s PHE 76 Cb 0.11 -1.48 -0.04 0.00 -0.57 0.00 0.00 43.02 41.04 2f9i s PHE 76 CO 0.46 0.48 0.03 -0.51 -0.10 0.00 0.00 175.22 175.59 2f9i s ASP 77 N -2.51 5.29 -1.46 1.36 1.01 0.17 -4.56 116.67 115.96 2f9i s ASP 77 Ca 0.26 -0.00 -0.10 0.00 0.71 0.00 0.00 52.55 53.42 2f9i s ASP 77 Cb -0.11 -1.40 0.05 0.00 1.01 0.00 0.00 42.92 42.47 2f9i s ASP 77 CO 0.18 0.25 0.85 -1.20 0.21 0.00 0.00 175.17 175.46 2f9i n SER 78 N 1.08 -5.28 -4.71 0.27 7.64 -1.26 -0.60 113.62 110.75 2f9i n SER 78 Ca -0.13 -0.54 -0.42 0.00 1.01 0.00 0.00 58.87 58.79 2f9i n SER 78 Cb 0.52 -4.24 -0.03 0.00 -1.01 0.00 0.00 64.21 59.46 2f9i n SER 78 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2f9i s PHE 79 N -3.21 2.71 -0.22 1.43 5.36 -1.26 -4.44 117.98 118.36 2f9i s PHE 79 Ca 0.52 0.40 0.01 0.00 -0.96 0.00 0.00 56.93 56.90 2f9i s PHE 79 Cb -0.25 -4.00 0.03 0.00 -0.34 0.00 0.00 43.02 38.46 2f9i s PHE 79 CO 0.64 -3.87 -0.14 1.41 -1.46 0.00 0.00 175.22 171.80 2f9i s MET 80 N 1.85 2.73 0.26 10.12 -2.45 0.18 -4.97 119.30 127.02 2f9i s MET 80 Ca 0.73 -1.02 -0.29 0.00 -1.25 0.00 0.00 55.69 53.86 2f9i s MET 80 Cb -0.43 -2.75 -0.09 0.00 1.25 0.00 0.00 34.83 32.80 2f9i s MET 80 CO 0.32 -0.36 1.20 -2.00 1.05 0.00 0.00 175.02 175.24 2f9i s GLU 81 N 1.24 4.50 0.01 4.11 2.12 -1.26 -1.53 118.70 127.89 2f9i s GLU 81 Ca -0.00 1.96 0.06 0.00 0.36 0.00 0.00 54.97 57.35 2f9i s GLU 81 Cb -0.16 -3.17 -0.02 0.00 0.26 0.00 0.00 34.13 31.04 2f9i s GLU 81 CO -0.09 -0.02 -0.20 -0.51 -0.54 0.00 0.00 175.26 173.91 2f9i s LEU 82 N -1.10 2.09 0.12 2.70 1.43 -0.07 -4.94 118.68 118.91 2f9i s LEU 82 Ca 0.49 -0.42 0.08 0.00 -1.03 0.00 0.00 54.13 53.25 2f9i s LEU 82 Cb -0.35 -0.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2f9i s LEU 82 CO 0.43 0.21 -0.15 -1.00 0.23 0.00 0.00 176.35 176.06 2f9i s HIS 83 N -0.60 2.60 0.00 0.29 3.76 -1.26 -4.21 115.29 115.87 2f9i s HIS 83 Ca 0.07 -0.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 2f9i s HIS 83 Cb -0.08 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.25 2f9i s HIS 83 CO 0.00 0.41 0.00 0.41 -0.85 0.00 0.00 174.74 174.71 2f9i n GLY 84 N 0.70 0.98 0.67 -2.22 0.00 -1.26 -4.88 105.19 99.18 2f9i n GLY 84 Ca -0.15 -1.73 0.08 0.00 0.00 0.00 0.00 46.02 44.23 2f9i n GLY 84 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2f9i n ASP 85 N -0.46 2.39 -2.09 1.61 5.75 -1.25 -4.58 116.55 117.92 2f9i n ASP 85 Ca 0.00 -1.70 -0.19 0.00 -0.01 0.00 0.00 54.79 52.90 2f9i n ASP 85 Cb 0.00 0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.06 2f9i n ASP 85 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2f9i n ARG 86 N 0.93 -1.66 0.00 0.11 5.12 -1.26 -4.75 116.66 115.15 2f9i n ARG 86 Ca 0.10 0.99 0.00 0.00 -1.93 0.00 0.00 57.85 57.01 2f9i n ARG 86 Cb 0.42 -5.53 0.00 0.00 -1.16 0.00 0.00 32.46 26.18 2f9i n ARG 86 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2f9i n ASN 87 N -1.66 0.00 0.00 0.55 5.15 -1.26 -5.08 115.26 112.96 2f9i n ASN 87 Ca -0.21 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.77 2f9i n ASN 87 Cb 0.65 0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.91 2f9i n ASN 87 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 2f9i n PHE 88 N -1.64 -1.23 -3.55 1.20 7.35 -1.26 -5.17 117.46 113.17 2f9i n PHE 88 Ca 0.00 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.57 2f9i n PHE 88 Cb 0.00 0.44 -0.05 0.00 0.35 0.00 0.00 39.48 40.22 2f9i n PHE 88 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 2f9i s ARG 89 N -1.88 0.75 -0.37 -4.13 3.52 -1.26 -5.08 118.95 110.50 2f9i s ARG 89 Ca 0.00 0.06 -0.22 0.00 -0.13 0.00 0.00 55.73 55.44 2f9i s ARG 89 Cb 0.00 0.35 0.01 0.00 -1.56 0.00 0.00 34.95 33.75 2f9i s ARG 89 CO 0.00 -0.26 0.73 0.34 -0.81 0.00 0.00 175.30 175.30 2f9i s ASP 90 N -1.46 6.49 -0.25 -2.12 2.15 -1.26 -3.83 116.67 116.39 2f9i s ASP 90 Ca -0.02 0.23 -0.29 0.00 0.43 0.00 0.00 52.55 52.90 2f9i s ASP 90 Cb -0.00 -2.37 0.01 0.00 -0.30 0.00 0.00 42.92 40.26 2f9i s ASP 90 CO 0.01 -0.70 1.04 -0.62 -0.17 0.00 0.00 175.17 174.73 2f9i s ASP 91 N 1.85 7.05 0.54 -0.34 -1.08 -1.26 -4.92 116.67 118.51 2f9i s ASP 91 Ca 0.28 1.30 0.28 0.00 -0.52 0.00 0.00 52.55 53.89 2f9i s ASP 91 Cb -0.14 -2.54 1.54 0.00 -1.46 0.00 0.00 42.92 40.33 2f9i s ASP 91 CO 0.17 -0.71 2.12 -0.65 0.52 0.00 0.00 175.17 176.62 2f9i h PRO 92 N 7.59 0.00 0.00 4.34 0.11 -1.91 -2.91 132.00 139.22 2f9i h PRO 92 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 2f9i h PRO 92 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2f9i h PRO 92 CO 0.99 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 178.86 2f9i n ALA 93 N -2.30 2.22 -3.96 -0.75 0.00 -1.25 -4.66 120.51 109.82 2f9i n ALA 93 Ca -0.02 -0.04 -0.28 0.00 0.00 0.00 0.00 53.44 53.09 2f9i n ALA 93 Cb 0.19 -1.45 -0.17 0.00 0.00 0.00 0.00 19.45 18.02 2f9i n ALA 93 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2f9i s MET 94 N -3.08 1.90 0.33 0.00 -2.45 -1.10 -0.80 119.30 114.09 2f9i s MET 94 Ca 0.11 -0.42 0.09 0.00 -1.25 0.00 0.00 55.69 54.22 2f9i s MET 94 Cb 0.14 -1.87 -0.05 0.00 1.25 0.00 0.00 34.83 34.31 2f9i s MET 94 CO 0.54 -0.26 0.06 0.96 1.05 0.00 0.00 175.02 177.37 2f9i s ILE 95 N 1.60 2.91 0.13 10.11 -5.25 0.12 -4.67 121.20 126.14 2f9i s ILE 95 Ca 0.05 -1.85 -0.25 0.00 -0.99 0.00 0.00 60.65 57.61 2f9i s ILE 95 Cb -0.13 -2.87 0.08 0.00 2.95 0.00 0.00 42.46 42.49 2f9i s ILE 95 CO -0.09 -0.22 1.09 -0.83 -1.79 0.00 0.00 174.94 173.09 2f9i s GLY 96 N -3.76 -0.06 0.00 6.27 0.00 -1.26 -1.17 107.32 107.34 2f9i s GLY 96 Ca 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 45.02 2f9i s GLY 96 CO 0.21 2.02 0.00 0.61 0.00 0.00 0.00 173.10 175.94 2f9i n GLY 97 N -0.65 -1.21 3.26 0.20 0.00 -0.21 -0.89 105.19 105.70 2f9i n GLY 97 Ca -0.03 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 2f9i n GLY 97 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2f9i s ILE 98 N -3.00 1.57 0.00 -0.61 -4.36 -0.58 -1.20 121.20 113.02 2f9i s ILE 98 Ca 0.00 -1.55 0.00 0.00 -0.26 0.00 0.00 60.65 58.84 2f9i s ILE 98 Cb 0.00 -1.48 0.00 0.00 1.25 0.00 0.00 42.46 42.23 2f9i s ILE 98 CO 0.00 -0.15 0.00 0.61 0.24 0.00 0.00 174.94 175.64 2f9i n GLY 99 N 1.00 1.60 3.17 6.27 0.00 -0.65 0.48 105.19 117.05 2f9i n GLY 99 Ca -0.19 -0.71 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 2f9i n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f9i s PHE 100 N -3.00 1.66 -0.42 1.61 0.08 0.23 -1.03 117.98 117.11 2f9i s PHE 100 Ca 0.00 -0.36 -0.07 0.00 0.12 0.00 0.00 56.93 56.61 2f9i s PHE 100 Cb 0.00 -1.09 0.09 0.00 -0.57 0.00 0.00 43.02 41.46 2f9i s PHE 100 CO 0.00 -0.07 0.26 -1.17 -0.10 0.00 0.00 175.22 174.14 2f9i s LEU 101 N -0.29 5.24 -1.52 -0.37 2.96 0.45 0.42 118.68 125.57 2f9i s LEU 101 Ca 0.04 -1.71 -0.08 0.00 -0.22 0.00 0.00 54.13 52.16 2f9i s LEU 101 Cb -0.08 -1.94 0.06 0.00 0.50 0.00 0.00 46.19 44.73 2f9i s LEU 101 CO 0.00 -0.56 0.61 0.59 -1.32 0.00 0.00 176.35 175.66 2f9i n ASN 102 N 4.83 -1.83 0.00 3.68 3.02 -1.26 -1.42 115.26 122.28 2f9i n ASN 102 Ca -0.08 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 2f9i n ASN 102 Cb 0.42 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.55 2f9i n ASN 102 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f9i n GLY 103 N -1.75 1.16 3.66 7.41 0.00 -1.26 -5.03 105.19 109.37 2f9i n GLY 103 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2f9i n GLY 103 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2f9i s ARG 104 N -0.20 4.10 0.18 1.61 3.52 -0.51 -5.03 118.95 122.62 2f9i s ARG 104 Ca 0.00 -0.05 -0.32 0.00 -0.13 0.00 0.00 55.73 55.24 2f9i s ARG 104 Cb 0.00 -3.55 -0.11 0.00 -1.56 0.00 0.00 34.95 29.73 2f9i s ARG 104 CO 0.00 -0.02 1.62 0.00 -0.81 0.00 0.00 175.30 176.09 2f9i s ALA 105 N 1.29 3.84 0.06 6.12 0.00 -1.26 -0.41 121.76 131.39 2f9i s ALA 105 Ca 0.13 1.45 -0.02 0.00 0.00 0.00 0.00 51.96 53.52 2f9i s ALA 105 Cb -0.14 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 2f9i s ALA 105 CO 0.07 -0.83 0.00 0.14 0.00 0.00 0.00 175.76 175.14 2f9i s VAL 106 N 1.15 0.20 -0.05 0.00 -7.23 -0.20 -4.20 120.40 110.07 2f9i s VAL 106 Ca 0.72 -1.75 0.02 0.00 -1.81 0.00 0.00 61.98 59.16 2f9i s VAL 106 Cb -0.46 -1.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 2f9i s VAL 106 CO 0.31 -0.92 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.22 2f9i s THR 107 N -3.92 3.58 -0.03 5.32 2.01 -0.78 -1.64 115.64 120.18 2f9i s THR 107 Ca 0.08 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.55 2f9i s THR 107 Cb 0.08 -2.47 0.00 0.00 0.01 0.00 0.00 72.50 70.12 2f9i s THR 107 CO -0.09 0.57 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.61 2f9i s VAL 108 N -0.82 0.94 0.03 3.82 1.01 -0.34 -1.36 120.40 123.68 2f9i s VAL 108 Ca 0.13 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.67 2f9i s VAL 108 Cb -0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 2f9i s VAL 108 CO 0.02 0.29 -0.06 -0.63 0.00 0.00 0.00 175.10 174.72 2f9i s ILE 109 N 0.14 0.36 0.00 2.22 1.01 -0.36 -1.04 121.20 123.53 2f9i s ILE 109 Ca -0.03 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.58 2f9i s ILE 109 Cb -0.09 -0.51 0.00 0.00 0.01 0.00 0.00 42.46 41.87 2f9i s ILE 109 CO 0.01 -0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.10 2f9i n GLY 110 N 1.46 0.51 3.76 6.18 0.00 -0.32 -0.59 105.19 116.19 2f9i n GLY 110 Ca -0.23 -0.83 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 2f9i n GLY 110 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2f9i s GLN 111 N -2.00 4.59 -0.27 1.61 1.11 -0.90 -0.71 119.66 123.09 2f9i s GLN 111 Ca 0.00 1.71 0.03 0.00 0.01 0.00 0.00 55.36 57.11 2f9i s GLN 111 Cb 0.00 -3.09 0.06 0.00 -1.01 0.00 0.00 33.01 28.97 2f9i s GLN 111 CO 0.00 0.19 -0.09 -1.14 0.01 0.00 0.00 175.29 174.26 2f9i s GLN 112 N -1.60 2.23 0.23 2.91 2.00 0.02 -4.36 119.66 121.09 2f9i s GLN 112 Ca 0.46 -1.37 0.01 0.00 -2.00 0.00 0.00 55.36 52.47 2f9i s GLN 112 Cb -0.29 -2.94 0.24 0.00 0.80 0.00 0.00 33.01 30.82 2f9i s GLN 112 CO 0.38 -0.59 1.58 0.00 -0.50 0.00 0.00 175.29 176.15 2f9i h ARG 113 N 7.79 0.41 0.00 1.67 3.08 -1.86 -3.25 114.38 122.21 2f9i h ARG 113 Ca -0.19 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2f9i h ARG 113 Cb 1.04 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2f9i h ARG 113 CO 0.47 0.82 0.00 0.41 -1.07 0.00 0.00 179.97 180.60 2f9i n GLY 114 N 0.10 1.75 0.08 0.04 0.00 -1.26 -3.99 105.19 101.90 2f9i n GLY 114 Ca -0.02 -1.18 -0.06 0.00 0.00 0.00 0.00 46.02 44.76 2f9i n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f9i h LYS 115 N 0.00 0.00 0.00 1.61 1.57 -1.88 -3.43 116.57 114.43 2f9i h LYS 115 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2f9i h LYS 115 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2f9i h LYS 115 CO 0.00 0.66 0.00 -0.40 -0.57 0.00 0.00 179.45 179.14 2f9i n ASP 116 N -3.15 0.63 -0.00 0.86 5.68 -1.26 -4.78 116.55 114.52 2f9i n ASP 116 Ca -0.08 -0.53 -0.13 0.00 -0.50 0.00 0.00 54.79 53.55 2f9i n ASP 116 Cb 0.96 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.84 2f9i n ASP 116 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2f9i h THR 117 N 0.53 1.33 -0.69 2.12 2.02 -1.99 -0.52 112.91 115.72 2f9i h THR 117 Ca 0.00 -1.06 -0.05 0.00 0.77 0.00 0.00 66.41 66.07 2f9i h THR 117 Cb 0.00 2.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 2f9i h THR 117 CO 0.00 0.27 0.24 0.07 0.37 0.00 0.00 175.52 176.47 2f9i h LYS 118 N -0.48 1.04 -0.21 6.66 2.10 -2.00 -1.27 116.57 122.42 2f9i h LYS 118 Ca -0.00 -0.20 -0.06 0.00 -2.00 0.00 0.00 60.65 58.39 2f9i h LYS 118 Cb 0.46 -0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 31.61 2f9i h LYS 118 CO 0.00 0.87 -0.14 0.22 -2.00 0.00 0.00 179.45 178.40 2f9i h ASP 119 N 1.01 0.33 -0.56 7.07 3.58 -1.94 -2.60 116.42 123.31 2f9i h ASP 119 Ca 0.23 -0.08 -0.05 0.00 0.42 0.00 0.00 57.03 57.55 2f9i h ASP 119 Cb 0.25 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2f9i h ASP 119 CO -0.01 0.50 0.16 0.78 -2.88 0.00 0.00 179.24 177.78 2f9i h ASN 120 N 0.32 0.83 -0.38 2.28 2.35 0.13 0.53 115.58 121.65 2f9i h ASN 120 Ca 0.06 -0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 55.51 2f9i h ASN 120 Cb 0.45 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 2f9i h ASN 120 CO 0.03 0.83 -0.10 0.40 -1.65 0.00 0.00 177.43 176.94 2f9i h ILE 121 N 0.79 1.28 -0.56 2.81 2.04 -1.40 0.11 117.51 122.58 2f9i h ILE 121 Ca 0.18 -1.19 0.05 0.00 1.00 0.00 0.00 64.86 64.90 2f9i h ILE 121 Cb 0.31 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 2f9i h ILE 121 CO -0.00 0.39 0.29 0.22 0.00 0.00 0.00 178.15 179.06 2f9i h TYR 122 N 0.53 0.54 -0.10 1.37 3.20 -1.15 -2.39 116.97 118.97 2f9i h TYR 122 Ca 0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2f9i h TYR 122 Cb 0.62 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.73 2f9i h TYR 122 CO 0.05 0.27 0.00 0.54 -1.64 0.00 0.00 178.16 177.38 2f9i n ARG 123 N -4.85 1.47 -3.71 1.82 5.12 0.15 -4.66 116.66 112.00 2f9i n ARG 123 Ca 0.06 -0.70 -0.28 0.00 -1.93 0.00 0.00 57.85 54.99 2f9i n ARG 123 Cb 0.14 -1.36 -0.00 0.00 -1.16 0.00 0.00 32.46 30.08 2f9i n ARG 123 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2f9i n ASN 124 N -0.08 -3.90 -2.14 0.55 4.05 -0.28 -1.41 115.26 112.06 2f9i n ASN 124 Ca 0.15 -0.64 -0.20 0.00 0.45 0.00 0.00 54.58 54.34 2f9i n ASN 124 Cb 0.24 -3.19 -0.04 0.00 1.23 0.00 0.00 39.78 38.02 2f9i n ASN 124 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2f9i n PHE 125 N -4.23 -0.70 -1.20 1.20 3.72 0.21 -0.92 117.46 115.54 2f9i n PHE 125 Ca 0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.35 2f9i n PHE 125 Cb 0.52 -3.75 -0.03 0.00 -0.94 0.00 0.00 39.48 35.28 2f9i n PHE 125 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2f9i n GLY 126 N -0.80 0.90 3.36 1.37 0.00 -0.50 -4.62 105.19 104.89 2f9i n GLY 126 Ca -0.23 -0.53 -0.45 0.00 0.00 0.00 0.00 46.02 44.81 2f9i n GLY 126 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2f9i s MET 127 N -2.36 3.01 0.46 1.61 -1.94 -0.10 -4.51 119.30 115.47 2f9i s MET 127 Ca 0.00 -1.44 -0.22 0.00 -1.71 0.00 0.00 55.69 52.32 2f9i s MET 127 Cb 0.00 -4.22 -0.08 0.00 2.01 0.00 0.00 34.83 32.54 2f9i s MET 127 CO 0.00 -1.26 1.11 0.00 -0.01 0.00 0.00 175.02 174.86 2f9i s ALA 128 N 1.92 2.94 0.51 3.03 0.00 -1.26 -4.35 121.76 124.55 2f9i s ALA 128 Ca 0.06 0.81 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 2f9i s ALA 128 Cb -0.26 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.54 2f9i s ALA 128 CO 0.06 -0.51 0.75 -1.01 0.00 0.00 0.00 175.76 175.04 2f9i s HIS 129 N -1.67 3.06 0.32 0.00 3.76 -1.26 -1.11 115.29 118.39 2f9i s HIS 129 Ca 0.64 0.17 0.07 0.00 -0.15 0.00 0.00 55.06 55.79 2f9i s HIS 129 Cb -0.24 -2.56 0.74 0.00 1.11 0.00 0.00 32.58 31.63 2f9i s HIS 129 CO 0.29 -0.65 1.81 -1.00 -0.85 0.00 0.00 174.74 174.35 2f9i h PRO 130 N 0.18 0.75 -0.54 8.40 0.13 -1.87 0.68 132.00 139.72 2f9i h PRO 130 Ca -0.44 -0.05 0.13 0.00 -0.87 0.00 0.00 66.00 64.77 2f9i h PRO 130 Cb 1.27 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 2f9i h PRO 130 CO 0.56 0.50 0.38 1.05 -0.23 0.00 0.00 178.00 180.25 2f9i h GLU 131 N 0.77 0.18 -0.18 0.86 9.09 -1.90 0.02 114.58 123.42 2f9i h GLU 131 Ca 0.53 -0.01 -0.03 0.00 0.05 0.00 0.00 59.36 59.90 2f9i h GLU 131 Cb 0.81 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.86 2f9i h GLU 131 CO -0.30 0.12 0.00 0.78 0.05 0.00 0.00 179.01 179.65 2f9i h GLY 132 N 0.18 0.33 1.05 1.06 0.00 -1.17 -0.30 103.07 104.22 2f9i h GLY 132 Ca 0.26 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 2f9i h GLY 132 CO -0.04 0.22 0.25 -0.97 0.00 0.00 0.00 176.54 176.00 2f9i h TYR 133 N 0.06 1.17 -0.30 5.60 0.05 -1.19 -1.54 116.97 120.83 2f9i h TYR 133 Ca 0.05 -0.11 -0.09 0.00 0.05 0.00 0.00 58.73 58.63 2f9i h TYR 133 Cb 0.38 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2f9i h TYR 133 CO 0.03 0.92 -0.21 0.00 -1.05 0.00 0.00 178.16 177.85 2f9i h ARG 134 N 1.08 0.55 -0.25 4.88 3.08 -0.92 -1.08 114.38 121.72 2f9i h ARG 134 Ca 0.24 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 2f9i h ARG 134 Cb 0.28 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2f9i h ARG 134 CO -0.01 0.72 0.08 -0.22 -1.07 0.00 0.00 179.97 179.47 2f9i h LYS 135 N 0.49 0.39 -0.33 0.04 3.64 -0.89 -1.05 116.57 118.86 2f9i h LYS 135 Ca 0.08 -0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 2f9i h LYS 135 Cb 0.63 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.34 2f9i h LYS 135 CO 0.04 0.46 0.01 0.00 -2.27 0.00 0.00 179.45 177.69 2f9i h ALA 136 N 0.91 0.30 -0.69 5.00 0.00 -0.98 -1.06 119.26 122.73 2f9i h ALA 136 Ca 0.08 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2f9i h ALA 136 Cb 0.23 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2f9i h ALA 136 CO -0.00 -0.40 0.44 1.25 0.00 0.00 0.00 179.25 180.54 2f9i h LEU 137 N 0.10 0.75 -0.39 0.00 5.85 -1.04 -1.21 115.31 119.36 2f9i h LEU 137 Ca 0.16 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 2f9i h LEU 137 Cb 0.21 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2f9i h LEU 137 CO -0.26 0.53 0.24 -0.09 -0.34 0.00 0.00 178.44 178.51 2f9i h ARG 138 N 0.88 0.53 -0.34 1.25 2.43 -0.71 -0.11 114.38 118.33 2f9i h ARG 138 Ca 0.27 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 2f9i h ARG 138 Cb -0.03 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 2f9i h ARG 138 CO -0.09 0.40 -0.10 -0.07 -1.51 0.00 0.00 179.97 178.60 2f9i h LEU 139 N 0.52 0.56 -0.78 3.80 3.38 -0.89 -1.27 115.31 120.63 2f9i h LEU 139 Ca 0.14 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 2f9i h LEU 139 Cb 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2f9i h LEU 139 CO -0.03 0.70 -0.39 0.24 0.09 0.00 0.00 178.44 179.06 2f9i h MET 140 N 0.53 0.46 -0.07 1.13 2.86 -0.81 -1.70 114.93 117.34 2f9i h MET 140 Ca 0.10 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.39 2f9i h MET 140 Cb 0.50 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2f9i h MET 140 CO 0.03 0.78 -0.52 0.87 1.06 0.00 0.00 176.91 179.13 2f9i h LYS 141 N 0.39 0.19 -0.17 1.72 1.79 -0.61 -0.96 116.57 118.92 2f9i h LYS 141 Ca 0.04 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 2f9i h LYS 141 Cb 0.85 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.50 2f9i h LYS 141 CO 0.07 0.67 0.08 1.96 -1.08 0.00 0.00 179.45 181.14 2f9i h GLN 142 N 0.15 0.25 -0.48 3.15 1.08 -1.09 -1.08 115.11 117.09 2f9i h GLN 142 Ca 0.00 -0.04 0.04 0.00 -1.45 0.00 0.00 58.65 57.21 2f9i h GLN 142 Cb 0.97 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.31 2f9i h GLN 142 CO 0.08 0.30 0.24 0.00 -0.95 0.00 0.00 178.83 178.50 2f9i h ALA 143 N 0.93 0.61 -0.40 3.87 0.00 -1.07 -1.98 119.26 121.23 2f9i h ALA 143 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2f9i h ALA 143 Cb 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2f9i h ALA 143 CO -0.01 -0.12 0.20 1.49 0.00 0.00 0.00 179.25 180.82 2f9i h GLU 144 N 0.46 0.57 -0.90 0.00 4.81 -1.07 0.34 114.58 118.80 2f9i h GLU 144 Ca 0.21 -0.08 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 2f9i h GLU 144 Cb 0.13 -0.11 -0.08 0.00 0.63 0.00 0.00 28.75 29.32 2f9i h GLU 144 CO -0.16 0.49 0.53 -0.22 -0.73 0.00 0.00 179.01 178.92 2f9i h LYS 145 N 0.51 0.81 -0.59 1.92 3.64 -0.72 -2.21 116.57 119.94 2f9i h LYS 145 Ca 0.14 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2f9i h LYS 145 Cb 0.10 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2f9i h LYS 145 CO -0.02 0.54 0.00 1.19 -2.27 0.00 0.00 179.45 178.89 2f9i n PHE 146 N -4.72 0.79 -3.28 1.91 3.72 -0.79 -4.96 117.46 110.13 2f9i n PHE 146 Ca 0.17 -0.39 -0.23 0.00 -0.05 0.00 0.00 57.45 56.94 2f9i n PHE 146 Cb 0.34 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.93 2f9i n PHE 146 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2f9i n ASN 147 N 1.28 -6.11 -4.82 4.37 4.05 0.06 -5.00 115.26 109.07 2f9i n ASN 147 Ca 0.20 -0.40 -0.38 0.00 0.45 0.00 0.00 54.58 54.45 2f9i n ASN 147 Cb 0.52 -4.89 -0.06 0.00 1.23 0.00 0.00 39.78 36.57 2f9i n ASN 147 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2f9i s ARG 148 N -5.98 3.94 0.72 1.20 0.52 0.98 -5.00 118.95 115.34 2f9i s ARG 148 Ca 0.43 0.38 -0.15 0.00 -0.52 0.00 0.00 55.73 55.87 2f9i s ARG 148 Cb -0.19 -3.25 0.04 0.00 0.52 0.00 0.00 34.95 32.07 2f9i s ARG 148 CO 0.53 0.63 1.17 -2.14 0.02 0.00 0.00 175.30 175.51 2f9i s PRO 149 N -0.88 2.27 -0.10 3.54 0.02 -1.26 -4.43 135.00 134.16 2f9i s PRO 149 Ca 0.23 1.62 0.03 0.00 0.02 0.00 0.00 61.00 62.89 2f9i s PRO 149 Cb -0.16 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 2f9i s PRO 149 CO 0.12 -1.71 -0.19 0.42 -0.33 0.00 0.00 177.00 175.32 2f9i s ILE 150 N -2.16 2.54 -0.16 2.83 1.01 0.22 -1.87 121.20 123.60 2f9i s ILE 150 Ca 0.71 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 60.49 2f9i s ILE 150 Cb -0.26 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 2f9i s ILE 150 CO 0.45 0.55 -0.13 -0.36 0.00 0.00 0.00 174.94 175.46 2f9i s PHE 151 N 0.17 2.82 0.01 3.97 0.08 -0.46 -0.58 117.98 123.99 2f9i s PHE 151 Ca -0.11 -0.90 0.08 0.00 0.12 0.00 0.00 56.93 56.13 2f9i s PHE 151 Cb -0.16 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.36 2f9i s PHE 151 CO 0.06 -0.40 -0.24 0.95 -0.10 0.00 0.00 175.22 175.49 2f9i s THR 152 N 0.77 2.26 -0.30 0.64 -4.23 -0.40 -1.22 115.64 113.16 2f9i s THR 152 Ca -0.05 -1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 59.23 2f9i s THR 152 Cb -0.15 -1.85 0.03 0.00 1.34 0.00 0.00 72.50 71.88 2f9i s THR 152 CO 0.01 0.48 0.03 -0.36 -0.54 0.00 0.00 174.62 174.23 2f9i s PHE 153 N -0.73 3.20 -0.18 3.99 0.08 0.24 -1.22 117.98 123.36 2f9i s PHE 153 Ca 0.11 -1.53 -0.23 0.00 0.12 0.00 0.00 56.93 55.40 2f9i s PHE 153 Cb -0.10 -2.16 -0.02 0.00 -0.57 0.00 0.00 43.02 40.17 2f9i s PHE 153 CO 0.01 -0.73 0.73 0.42 -0.10 0.00 0.00 175.22 175.55 2f9i s ILE 154 N 1.35 4.95 -0.51 0.64 1.01 0.01 -2.12 121.20 126.52 2f9i s ILE 154 Ca -0.02 1.42 0.07 0.00 0.00 0.00 0.00 60.65 62.12 2f9i s ILE 154 Cb -0.19 -4.04 0.19 0.00 0.01 0.00 0.00 42.46 38.43 2f9i s ILE 154 CO -0.00 0.08 0.75 -0.67 0.00 0.00 0.00 174.94 175.09 2f9i n ASP 155 N 5.07 -3.39 -3.67 3.58 -0.08 -1.25 -0.99 116.55 115.81 2f9i n ASP 155 Ca 0.01 -2.90 -0.11 0.00 -1.51 0.00 0.00 54.79 50.29 2f9i n ASP 155 Cb 0.49 1.74 -0.09 0.00 2.34 0.00 0.00 41.12 45.61 2f9i n ASP 155 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2f9i s THR 156 N 0.86 -0.01 0.01 5.18 -1.32 -0.42 -4.59 115.64 115.35 2f9i s THR 156 Ca 0.30 0.03 0.32 0.00 -1.21 0.00 0.00 61.69 61.12 2f9i s THR 156 Cb 0.02 -0.82 0.35 0.00 -1.51 0.00 0.00 72.50 70.54 2f9i s THR 156 CO -0.06 0.01 1.95 0.07 -2.21 0.00 0.00 174.62 174.37 2f9i h LYS 157 N 6.31 0.00 0.00 7.08 2.10 -1.81 0.59 116.57 130.84 2f9i h LYS 157 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 2f9i h LYS 157 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2f9i h LYS 157 CO 0.19 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.05 2f9i n GLY 158 N -0.27 2.67 3.73 0.07 0.00 -1.26 -4.38 105.19 105.75 2f9i n GLY 158 Ca 0.00 -1.22 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 2f9i n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f9i s ALA 159 N -2.00 2.42 -0.04 4.61 0.00 -1.26 -4.27 121.76 121.21 2f9i s ALA 159 Ca 0.00 1.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.90 2f9i s ALA 159 Cb 0.00 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.50 2f9i s ALA 159 CO 0.00 -1.58 1.69 -0.47 0.00 0.00 0.00 175.76 175.40 2f9i s TYR 160 N -1.38 1.89 -1.23 0.00 5.04 -0.27 -4.88 117.35 116.53 2f9i s TYR 160 Ca 0.82 0.11 -0.14 0.00 -2.44 0.00 0.00 57.07 55.41 2f9i s TYR 160 Cb -0.38 -3.96 0.16 0.00 0.35 0.00 0.00 41.96 38.13 2f9i s TYR 160 CO 0.40 -4.08 1.49 -1.25 -1.34 0.00 0.00 175.55 170.78 2f9i s PRO 161 N 4.08 4.08 0.40 4.97 0.04 -1.26 -4.84 135.00 142.47 2f9i s PRO 161 Ca 0.75 -2.50 0.07 0.00 0.04 0.00 0.00 61.00 59.36 2f9i s PRO 161 Cb -0.35 -5.14 -0.08 0.00 0.04 0.00 0.00 34.50 28.98 2f9i s PRO 161 CO 0.31 -1.84 0.01 0.20 0.04 0.00 0.00 177.00 175.72 2f9i s GLY 162 N 3.04 2.47 0.02 0.56 0.00 -1.26 -5.06 107.32 107.09 2f9i s GLY 162 Ca 0.45 -2.28 -0.26 0.00 0.00 0.00 0.00 44.72 42.62 2f9i s GLY 162 CO 0.01 -2.07 1.28 1.70 0.00 0.00 0.00 173.10 174.02 2f9i h LYS 163 N 1.80 -0.52 -0.84 2.90 3.64 -2.00 -2.49 116.57 119.07 2f9i h LYS 163 Ca -0.44 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.97 2f9i h LYS 163 Cb 1.24 0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 33.14 2f9i h LYS 163 CO 0.80 -0.22 0.50 0.00 -2.27 0.00 0.00 179.45 178.26 2f9i h ALA 164 N -0.37 1.30 -0.80 5.00 0.00 -1.99 -1.75 119.26 120.65 2f9i h ALA 164 Ca -0.06 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2f9i h ALA 164 Cb 0.54 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2f9i h ALA 164 CO 0.09 0.60 0.53 0.00 0.00 0.00 0.00 179.25 180.46 2f9i h ALA 165 N 1.40 1.03 -0.32 0.00 0.00 -1.88 0.21 119.26 119.70 2f9i h ALA 165 Ca 0.30 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2f9i h ALA 165 Cb -0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2f9i h ALA 165 CO -0.06 0.40 -0.03 0.93 0.00 0.00 0.00 179.25 180.49 2f9i h GLU 166 N 1.06 0.59 -0.91 0.00 4.39 -1.07 -0.26 114.58 118.38 2f9i h GLU 166 Ca 0.30 -0.20 0.08 0.00 0.34 0.00 0.00 59.36 59.88 2f9i h GLU 166 Cb -0.08 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.46 2f9i h GLU 166 CO -0.08 0.74 0.57 0.93 -1.16 0.00 0.00 179.01 180.01 2f9i h GLU 167 N 0.38 0.97 -0.37 2.33 5.08 -0.95 -2.24 114.58 119.78 2f9i h GLU 167 Ca 0.09 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2f9i h GLU 167 Cb 0.49 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2f9i h GLU 167 CO 0.02 0.64 0.00 0.54 -1.00 0.00 0.00 179.01 179.21 2f9i n ARG 168 N -4.61 1.83 -2.04 2.33 1.74 0.03 -4.93 116.66 111.02 2f9i n ARG 168 Ca 0.14 -1.14 -0.01 0.00 -0.77 0.00 0.00 57.85 56.08 2f9i n ARG 168 Cb 0.22 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 2f9i n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f9i n GLY 169 N 0.90 0.43 0.37 -0.13 0.00 -0.84 -4.80 105.19 101.12 2f9i n GLY 169 Ca 0.11 -0.45 -0.05 0.00 0.00 0.00 0.00 46.02 45.62 2f9i n GLY 169 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2f9i h GLN 170 N -0.07 -0.13 -0.33 1.61 5.75 -1.23 0.25 115.11 120.95 2f9i h GLN 170 Ca -0.02 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 2f9i h GLN 170 Cb 1.01 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.56 2f9i h GLN 170 CO 0.02 -0.09 0.14 0.77 -2.65 0.00 0.00 178.83 177.02 2f9i h SER 171 N -0.14 0.19 -0.47 -0.69 0.02 -1.91 -2.52 113.55 108.02 2f9i h SER 171 Ca 0.24 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2f9i h SER 171 Cb 0.56 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 2f9i h SER 171 CO -0.76 0.15 0.31 -0.08 -1.14 0.00 0.00 176.83 175.30 2f9i h GLU 172 N 0.30 0.63 -0.61 3.45 4.22 -1.79 -0.29 114.58 120.49 2f9i h GLU 172 Ca 0.15 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 59.54 2f9i h GLU 172 Cb 0.09 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2f9i h GLU 172 CO -0.13 0.43 0.35 0.66 -2.18 0.00 0.00 179.01 178.14 2f9i h SER 173 N 0.64 0.73 -0.02 1.04 4.64 -0.66 0.21 113.55 120.14 2f9i h SER 173 Ca 0.17 -0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.41 2f9i h SER 173 Cb -0.06 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 2f9i h SER 173 CO -0.04 0.58 -0.13 0.40 -0.87 0.00 0.00 176.83 176.77 2f9i h ILE 174 N 0.84 1.52 -0.66 0.95 2.04 -1.29 -2.93 117.51 117.99 2f9i h ILE 174 Ca 0.22 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 64.36 2f9i h ILE 174 Cb -0.00 2.60 -0.03 0.00 -0.74 0.00 0.00 36.82 38.64 2f9i h ILE 174 CO -0.04 0.46 0.41 0.00 0.00 0.00 0.00 178.15 178.98 2f9i h ALA 175 N 0.33 0.84 -0.72 1.87 0.00 -0.81 -1.19 119.26 119.57 2f9i h ALA 175 Ca -0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2f9i h ALA 175 Cb 0.83 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2f9i h ALA 175 CO 0.03 0.31 0.44 1.15 0.00 0.00 0.00 179.25 181.17 2f9i h THR 176 N 0.90 1.20 -0.88 0.00 2.02 -0.69 -2.57 112.91 112.89 2f9i h THR 176 Ca 0.24 -0.45 0.03 0.00 0.77 0.00 0.00 66.41 67.01 2f9i h THR 176 Cb -0.04 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 66.51 2f9i h THR 176 CO -0.05 0.21 0.58 0.78 0.37 0.00 0.00 175.52 177.42 2f9i h ASN 177 N 0.98 0.95 -0.03 4.18 4.21 -1.18 -0.78 115.58 123.92 2f9i h ASN 177 Ca 0.26 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.76 2f9i h ASN 177 Cb -0.04 -0.22 -0.00 0.00 -1.12 0.00 0.00 38.32 36.94 2f9i h ASN 177 CO -0.05 0.65 0.02 -0.07 -1.29 0.00 0.00 177.43 176.69 2f9i h LEU 178 N 1.10 0.03 -0.40 1.61 3.38 -0.84 0.53 115.31 120.72 2f9i h LEU 178 Ca 0.35 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 58.12 2f9i h LEU 178 Cb 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2f9i h LEU 178 CO -0.10 0.04 -0.79 0.16 0.09 0.00 0.00 178.44 177.83 2f9i h ILE 179 N 0.02 1.46 -0.19 1.22 3.07 -1.34 -1.66 117.51 120.09 2f9i h ILE 179 Ca 0.01 -2.41 -0.20 0.00 1.55 0.00 0.00 64.86 63.80 2f9i h ILE 179 Cb 0.01 2.31 0.00 0.00 -0.27 0.00 0.00 36.82 38.88 2f9i h ILE 179 CO -0.00 0.71 -0.69 -0.33 -1.05 0.00 0.00 178.15 176.78 2f9i h GLU 180 N 0.13 0.76 -0.20 0.16 4.39 -1.12 -3.10 114.58 115.60 2f9i h GLU 180 Ca -0.03 -0.57 -0.11 0.00 0.34 0.00 0.00 59.36 58.99 2f9i h GLU 180 Cb 1.38 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 30.12 2f9i h GLU 180 CO 0.12 1.19 -0.35 0.52 -1.16 0.00 0.00 179.01 179.32 2f9i h MET 181 N 0.54 0.42 -0.77 2.33 2.86 -0.91 -3.00 114.93 116.40 2f9i h MET 181 Ca -0.03 -0.19 0.14 0.00 -2.06 0.00 0.00 59.70 57.57 2f9i h MET 181 Cb 1.31 -0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.86 2f9i h MET 181 CO 0.14 0.72 0.33 0.00 1.06 0.00 0.00 176.91 179.16 2f9i h ALA 182 N 1.27 1.10 -0.46 6.32 0.00 -1.22 -2.63 119.26 123.64 2f9i h ALA 182 Ca 0.04 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2f9i h ALA 182 Cb 0.79 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2f9i h ALA 182 CO 0.06 -0.18 0.00 -1.13 0.00 0.00 0.00 179.25 178.00 2f9i n SER 183 N -4.97 4.14 -4.69 0.00 3.41 -1.17 -4.52 113.62 105.81 2f9i n SER 183 Ca 0.15 -2.54 -0.44 0.00 -0.26 0.00 0.00 58.87 55.77 2f9i n SER 183 Cb 0.41 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 63.84 2f9i n SER 183 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2f9i n LEU 184 N 0.46 3.49 -1.04 1.04 4.77 -0.99 -4.86 117.00 119.87 2f9i n LEU 184 Ca 0.21 1.13 0.05 0.00 -0.03 0.00 0.00 56.01 57.37 2f9i n LEU 184 Cb 0.80 -1.48 0.20 0.00 -2.33 0.00 0.00 43.42 40.61 2f9i n LEU 184 CO 0.18 -0.25 0.61 0.29 -1.33 0.00 0.00 177.39 176.90 2f9i n LYS 185 N 2.39 2.62 -4.35 3.23 5.02 -1.26 -3.84 118.16 121.98 2f9i n LYS 185 Ca 0.12 -1.60 -0.21 0.00 -2.02 0.00 0.00 58.31 54.60 2f9i n LYS 185 Cb 0.33 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.56 2f9i n LYS 185 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2f9i s VAL 186 N -1.75 1.85 0.33 -0.18 -7.23 -1.26 -4.47 120.40 107.69 2f9i s VAL 186 Ca 0.28 -2.05 -0.29 0.00 -1.81 0.00 0.00 61.98 58.12 2f9i s VAL 186 Cb 0.19 -1.94 -0.11 0.00 0.56 0.00 0.00 36.38 35.08 2f9i s VAL 186 CO 0.13 -0.41 1.47 -2.84 -0.31 0.00 0.00 175.10 173.14 2f9i s PRO 187 N -3.12 4.17 -0.10 4.82 0.02 -1.26 -4.86 135.00 134.67 2f9i s PRO 187 Ca 0.19 2.48 0.02 0.00 0.02 0.00 0.00 61.00 63.70 2f9i s PRO 187 Cb -0.04 -3.02 0.02 0.00 0.02 0.00 0.00 34.50 31.48 2f9i s PRO 187 CO 0.07 -0.48 -0.14 0.08 -0.33 0.00 0.00 177.00 176.20 2f9i s VAL 188 N -0.74 1.42 -0.14 3.83 1.01 -1.26 -0.61 120.40 123.91 2f9i s VAL 188 Ca 0.55 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.94 2f9i s VAL 188 Cb -0.45 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 34.65 2f9i s VAL 188 CO 0.56 0.42 -0.13 -0.63 0.00 0.00 0.00 175.10 175.32 2f9i s ILE 189 N 1.01 1.47 0.06 2.22 1.01 0.26 -0.50 121.20 126.72 2f9i s ILE 189 Ca -0.07 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.05 2f9i s ILE 189 Cb -0.15 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 2f9i s ILE 189 CO -0.01 0.44 -0.00 0.00 0.00 0.00 0.00 174.94 175.36 2f9i s ALA 190 N 1.49 3.27 -0.03 9.38 0.00 -0.33 -1.27 121.76 134.28 2f9i s ALA 190 Ca 0.04 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 50.94 2f9i s ALA 190 Cb -0.13 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.79 2f9i s ALA 190 CO -0.10 0.68 -0.02 -1.50 0.00 0.00 0.00 175.76 174.82 2f9i s ILE 191 N -1.23 0.34 -0.30 0.00 2.07 -0.36 0.38 121.20 122.09 2f9i s ILE 191 Ca 0.24 -0.02 -0.23 0.00 -1.41 0.00 0.00 60.65 59.22 2f9i s ILE 191 Cb -0.12 -0.39 -0.00 0.00 0.13 0.00 0.00 42.46 42.08 2f9i s ILE 191 CO 0.15 0.17 0.79 -0.69 -1.91 0.00 0.00 174.94 173.45 2f9i s VAL 192 N 0.88 4.80 -0.57 4.00 1.01 0.16 -0.81 120.40 129.86 2f9i s VAL 192 Ca -0.10 1.19 0.11 0.00 0.00 0.00 0.00 61.98 63.18 2f9i s VAL 192 Cb -0.13 -4.14 -0.12 0.00 0.00 0.00 0.00 36.38 31.99 2f9i s VAL 192 CO -0.01 -0.24 0.50 2.30 0.00 0.00 0.00 175.10 177.65 2f9i n ILE 193 N 5.52 0.00 0.00 2.22 -5.35 -0.16 -1.83 119.36 119.76 2f9i n ILE 193 Ca 0.04 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 2f9i n ILE 193 Cb 0.48 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 2f9i n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2f9i n GLY 194 N 1.25 3.95 3.86 3.28 0.00 -1.16 -4.87 105.19 111.51 2f9i n GLY 194 Ca 0.02 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.27 2f9i n GLY 194 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2f9i s GLU 195 N 3.98 3.87 -0.83 1.61 2.02 -1.26 -2.74 118.70 125.34 2f9i s GLU 195 Ca 0.00 0.61 0.01 0.00 0.02 0.00 0.00 54.97 55.61 2f9i s GLU 195 Cb 0.00 -2.36 0.20 0.00 0.10 0.00 0.00 34.13 32.08 2f9i s GLU 195 CO 0.00 -0.03 0.69 0.41 0.02 0.00 0.00 175.26 176.35 2f9i n GLY 196 N -1.10 4.12 3.58 -1.39 0.00 0.10 -1.31 105.19 109.19 2f9i n GLY 196 Ca 0.03 -2.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.04 2f9i n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f9i s GLY 197 N -0.74 1.48 0.00 -0.02 0.00 0.20 -1.71 107.32 106.52 2f9i s GLY 197 Ca 0.27 -2.82 0.00 0.00 0.00 0.00 0.00 44.72 42.17 2f9i s GLY 197 CO -0.14 2.81 0.00 -1.26 0.00 0.00 0.00 173.10 174.51 2f9i n SER 198 N 9.03 0.00 -0.14 1.64 2.88 -0.28 -2.63 113.62 124.12 2f9i n SER 198 Ca 0.48 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 58.18 2f9i n SER 198 Cb 0.46 0.00 0.52 0.00 -0.75 0.00 0.00 64.21 64.44 2f9i n SER 198 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2f9i h GLY 199 N 0.00 0.63 2.00 0.46 0.00 -1.87 0.03 103.07 104.33 2f9i h GLY 199 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2f9i h GLY 199 CO 0.00 0.06 -0.06 -1.33 0.00 0.00 0.00 176.54 175.21 2f9i h GLY 200 N 0.38 0.00 0.64 4.60 0.00 -1.88 -0.44 103.07 106.37 2f9i h GLY 200 Ca 0.35 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.35 2f9i h GLY 200 CO -0.10 0.00 -1.75 0.00 0.00 0.00 0.00 176.54 174.68 2f9i h ALA 201 N 1.94 0.29 0.00 3.60 0.00 -0.77 -3.35 119.26 120.97 2f9i h ALA 201 Ca -0.00 -1.24 -0.02 0.00 0.00 0.00 0.00 54.91 53.64 2f9i h ALA 201 Cb 0.31 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2f9i h ALA 201 CO 0.01 1.08 -0.10 1.25 0.00 0.00 0.00 179.25 181.49 2f9i h LEU 202 N -0.08 0.00 -1.94 0.00 5.85 -1.05 -2.46 115.31 115.64 2f9i h LEU 202 Ca -0.37 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2f9i h LEU 202 Cb 1.94 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.97 2f9i h LEU 202 CO 0.09 0.10 0.05 1.23 -0.34 0.00 0.00 178.44 179.57 2f9i h GLY 203 N 1.38 0.00 -1.66 3.75 0.00 -1.22 -0.08 103.07 105.25 2f9i h GLY 203 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 2f9i h GLY 203 CO 0.01 0.00 -0.65 0.29 0.00 0.00 0.00 176.54 176.20 2f9i n ILE 204 N -2.56 0.74 0.00 2.60 -5.35 -0.94 -4.69 119.36 109.16 2f9i n ILE 204 Ca -0.02 -1.41 0.00 0.00 -0.27 0.00 0.00 62.75 61.05 2f9i n ILE 204 Cb 0.10 0.44 0.00 0.00 -1.74 0.00 0.00 39.64 38.44 2f9i n ILE 204 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2f9i n GLY 205 N -0.24 0.99 3.54 3.28 0.00 -0.04 -4.84 105.19 107.88 2f9i n GLY 205 Ca 0.09 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2f9i n GLY 205 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f9i s ILE 206 N -0.56 4.32 0.27 -0.61 -1.09 -1.22 -4.93 121.20 117.38 2f9i s ILE 206 Ca 0.01 -1.80 0.11 0.00 -2.23 0.00 0.00 60.65 56.74 2f9i s ILE 206 Cb 0.00 -5.08 -0.05 0.00 -1.58 0.00 0.00 42.46 35.76 2f9i s ILE 206 CO 0.00 -1.88 -0.18 0.00 -1.23 0.00 0.00 174.94 171.66 2f9i s ALA 207 N 3.71 2.61 0.13 9.38 0.00 -1.26 -4.68 121.76 131.66 2f9i s ALA 207 Ca 0.48 -1.86 -0.13 0.00 0.00 0.00 0.00 51.96 50.46 2f9i s ALA 207 Cb 0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 2f9i s ALA 207 CO 0.01 0.21 1.53 -0.91 0.00 0.00 0.00 175.76 176.60 2f9i h ASN 208 N 2.30 0.84 -4.27 0.00 2.35 -1.16 -3.45 115.58 112.20 2f9i h ASN 208 Ca -0.40 -0.37 -0.42 0.00 -0.55 0.00 0.00 56.30 54.55 2f9i h ASN 208 Cb 1.25 -0.23 -0.26 0.00 0.05 0.00 0.00 38.32 39.13 2f9i h ASN 208 CO 0.62 1.02 -0.79 -0.54 -1.65 0.00 0.00 177.43 176.09 2f9i s LYS 209 N -4.75 0.88 -0.06 0.81 -0.14 -1.12 -4.96 119.74 110.40 2f9i s LYS 209 Ca -0.12 -0.62 0.03 0.00 -1.36 0.00 0.00 55.97 53.89 2f9i s LYS 209 Cb 0.11 -0.86 0.01 0.00 -1.68 0.00 0.00 37.83 35.41 2f9i s LYS 209 CO 0.83 0.22 -0.14 0.08 -0.76 0.00 0.00 175.35 175.58 2f9i s VAL 210 N -0.67 1.22 0.22 3.17 1.01 -1.26 -1.18 120.40 122.91 2f9i s VAL 210 Ca 0.02 -0.55 0.10 0.00 0.00 0.00 0.00 61.98 61.55 2f9i s VAL 210 Cb -0.07 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2f9i s VAL 210 CO 0.01 0.37 -0.11 -0.76 0.00 0.00 0.00 175.10 174.61 2f9i s LEU 211 N 0.51 2.90 -0.02 3.92 1.43 0.16 -0.39 118.68 127.19 2f9i s LEU 211 Ca -0.12 -0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 52.25 2f9i s LEU 211 Cb -0.15 -1.51 0.01 0.00 0.03 0.00 0.00 46.19 44.57 2f9i s LEU 211 CO 0.04 0.07 0.04 -0.04 0.23 0.00 0.00 176.35 176.69 2f9i s MET 212 N -3.15 0.02 0.47 1.70 -1.94 -0.99 -0.67 119.30 114.75 2f9i s MET 212 Ca 0.27 0.11 -0.24 0.00 -1.71 0.00 0.00 55.69 54.12 2f9i s MET 212 Cb -0.07 -0.07 -0.07 0.00 2.01 0.00 0.00 34.83 36.63 2f9i s MET 212 CO 0.16 -0.06 1.33 -0.51 -0.01 0.00 0.00 175.02 175.93 2f9i s LEU 213 N 0.39 4.03 0.54 -0.03 1.43 -0.76 -0.72 118.68 123.56 2f9i s LEU 213 Ca -0.03 2.71 0.24 0.00 -1.03 0.00 0.00 54.13 56.02 2f9i s LEU 213 Cb -0.04 -4.09 1.41 0.00 0.03 0.00 0.00 46.19 43.50 2f9i s LEU 213 CO -0.01 -1.19 2.05 1.05 0.23 0.00 0.00 176.35 178.48 2f9i h GLU 214 N 2.08 0.00 -0.02 1.70 4.11 -1.12 -0.96 114.58 120.36 2f9i h GLU 214 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 2f9i h GLU 214 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2f9i h GLU 214 CO 0.60 0.00 -0.15 0.09 0.07 0.00 0.00 179.01 179.62 2f9i n ASN 215 N -4.31 2.15 -4.83 3.06 3.02 -1.26 -4.23 115.26 108.86 2f9i n ASN 215 Ca 0.05 -1.62 -0.31 0.00 -0.03 0.00 0.00 54.58 52.67 2f9i n ASN 215 Cb 0.42 0.13 0.03 0.00 -0.61 0.00 0.00 39.78 39.76 2f9i n ASN 215 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2f9i s SER 216 N -2.18 5.66 0.27 6.41 0.01 -0.37 -4.04 113.70 119.46 2f9i s SER 216 Ca 0.28 1.59 0.11 0.00 1.31 0.00 0.00 55.95 59.24 2f9i s SER 216 Cb 0.20 -2.49 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 2f9i s SER 216 CO 0.40 -1.25 -0.18 0.42 0.41 0.00 0.00 173.24 173.04 2f9i s THR 217 N -3.00 2.30 -0.21 1.44 -4.23 -1.11 -3.21 115.64 107.63 2f9i s THR 217 Ca 0.58 -2.36 -0.04 0.00 -1.18 0.00 0.00 61.69 58.70 2f9i s THR 217 Cb -0.13 -2.26 0.11 0.00 1.34 0.00 0.00 72.50 71.55 2f9i s THR 217 CO 0.52 -0.43 0.29 -0.47 -0.54 0.00 0.00 174.62 173.99 2f9i s TYR 218 N -2.62 -0.52 0.01 3.99 6.04 -0.82 0.03 117.35 123.46 2f9i s TYR 218 Ca 0.28 0.57 0.00 0.00 0.04 0.00 0.00 57.07 57.97 2f9i s TYR 218 Cb -0.04 -0.16 -0.01 0.00 -1.04 0.00 0.00 41.96 40.71 2f9i s TYR 218 CO 0.13 -0.62 -0.02 0.45 -1.54 0.00 0.00 175.55 173.95 2f9i s SER 219 N 2.43 0.20 0.44 4.32 0.15 -0.69 -4.60 113.70 115.96 2f9i s SER 219 Ca 0.08 -0.29 0.29 0.00 0.70 0.00 0.00 55.95 56.74 2f9i s SER 219 Cb -0.15 0.05 1.12 0.00 -1.71 0.00 0.00 66.02 65.33 2f9i s SER 219 CO -0.13 -0.16 1.86 1.62 1.20 0.00 0.00 173.24 177.63 2f9i h VAL 220 N 4.85 0.00 -2.34 4.45 3.04 -1.95 -0.73 116.25 123.58 2f9i h VAL 220 Ca -0.29 -0.50 -0.06 0.00 -1.01 0.00 0.00 66.70 64.84 2f9i h VAL 220 Cb 1.21 1.43 -0.18 0.00 -2.01 0.00 0.00 31.29 31.74 2f9i h VAL 220 CO 0.45 0.00 0.11 -0.51 -1.01 0.00 0.00 177.57 176.62 2f9i s ILE 221 N -3.49 0.01 0.66 3.17 2.07 -1.26 -4.64 121.20 117.73 2f9i s ILE 221 Ca 0.03 -0.09 -0.17 0.00 -1.41 0.00 0.00 60.65 59.00 2f9i s ILE 221 Cb 0.09 -0.95 -0.00 0.00 0.13 0.00 0.00 42.46 41.72 2f9i s ILE 221 CO 0.52 -0.05 1.27 -0.94 -1.91 0.00 0.00 174.94 173.83 2f9i s SER 222 N -1.49 4.54 0.27 4.50 1.04 -1.26 -4.80 113.70 116.50 2f9i s SER 222 Ca -0.09 2.55 -0.01 0.00 0.48 0.00 0.00 55.95 58.88 2f9i s SER 222 Cb -0.01 -2.61 0.49 0.00 0.10 0.00 0.00 66.02 63.99 2f9i s SER 222 CO 0.05 -2.05 1.84 -0.65 0.98 0.00 0.00 173.24 173.42 2f9i h PRO 223 N 0.37 0.98 -0.44 4.02 0.11 -1.93 -0.55 132.00 134.55 2f9i h PRO 223 Ca -0.50 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2f9i h PRO 223 Cb 1.32 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2f9i h PRO 223 CO 0.52 0.65 0.28 0.93 -0.21 0.00 0.00 178.00 180.18 2f9i h GLU 224 N 1.01 0.60 -0.24 1.05 3.07 -1.85 -0.79 114.58 117.44 2f9i h GLU 224 Ca 0.47 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.27 2f9i h GLU 224 Cb 0.38 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 2f9i h GLU 224 CO -0.24 0.42 0.11 0.78 -1.40 0.00 0.00 179.01 178.68 2f9i h GLY 225 N 0.60 0.37 1.07 -3.84 0.00 -1.80 -0.99 103.07 98.48 2f9i h GLY 225 Ca 0.16 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2f9i h GLY 225 CO -0.03 0.17 0.46 0.00 0.00 0.00 0.00 176.54 177.14 2f9i h ALA 226 N 0.97 1.19 -0.32 3.60 0.00 -0.98 -2.30 119.26 121.41 2f9i h ALA 226 Ca 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2f9i h ALA 226 Cb 0.13 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2f9i h ALA 226 CO -0.01 0.65 0.11 0.00 0.00 0.00 0.00 179.25 180.00 2f9i h ALA 227 N 1.29 0.42 0.00 0.00 0.00 -0.92 0.10 119.26 120.17 2f9i h ALA 227 Ca 0.30 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2f9i h ALA 227 Cb 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2f9i h ALA 227 CO -0.05 0.05 -0.28 0.00 0.00 0.00 0.00 179.25 178.97 2f9i h ALA 228 N 0.95 1.50 0.04 0.00 0.00 -1.06 -1.95 119.26 118.74 2f9i h ALA 228 Ca 0.11 -0.26 -0.22 0.00 0.00 0.00 0.00 54.91 54.54 2f9i h ALA 228 Cb 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2f9i h ALA 228 CO -0.01 0.36 -1.17 -0.07 0.00 0.00 0.00 179.25 178.36 2f9i h LEU 229 N 0.00 0.12 0.25 0.00 3.38 -1.11 -2.86 115.31 115.09 2f9i h LEU 229 Ca -0.00 -0.70 -0.34 0.00 0.09 0.00 0.00 57.88 56.93 2f9i h LEU 229 Cb 0.51 -0.04 0.04 0.00 0.09 0.00 0.00 40.66 41.26 2f9i h LEU 229 CO 0.04 1.48 -1.51 -0.07 0.09 0.00 0.00 178.44 178.47 2f9i h LEU 230 N -0.75 0.83 -1.93 1.67 3.38 -0.88 -3.37 115.31 114.26 2f9i h LEU 230 Ca -0.29 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.75 2f9i h LEU 230 Cb 1.43 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2f9i h LEU 230 CO -0.09 1.72 0.00 0.79 0.09 0.00 0.00 178.44 180.95 2f9i n TRP 231 N -3.71 0.10 -1.34 1.13 8.01 -0.82 -4.98 117.44 115.82 2f9i n TRP 231 Ca -0.18 -0.21 -0.13 0.00 -1.31 0.00 0.00 57.50 55.68 2f9i n TRP 231 Cb 1.10 -0.02 -0.06 0.00 -2.01 0.00 0.00 31.31 30.33 2f9i n TRP 231 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2f9i n LYS 232 N 0.21 -1.56 -3.65 -0.99 4.01 -0.80 -4.91 118.16 110.46 2f9i n LYS 232 Ca 0.04 0.89 -0.27 0.00 -0.51 0.00 0.00 58.31 58.46 2f9i n LYS 232 Cb 0.23 -5.19 -0.16 0.00 -0.51 0.00 0.00 35.03 29.39 2f9i n LYS 232 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2f9i s ASP 233 N -2.31 2.78 0.20 4.39 -1.08 -0.97 -4.87 116.67 114.81 2f9i s ASP 233 Ca 0.00 -0.82 0.22 0.00 -0.52 0.00 0.00 52.55 51.42 2f9i s ASP 233 Cb 0.00 -0.41 0.90 0.00 -1.46 0.00 0.00 42.92 41.95 2f9i s ASP 233 CO 0.00 -0.35 1.66 -1.54 0.52 0.00 0.00 175.17 175.46 2f9i n SER 234 N 5.17 0.53 0.02 -0.34 3.41 -1.26 -1.92 113.62 119.22 2f9i n SER 234 Ca -0.07 0.63 0.09 0.00 -0.26 0.00 0.00 58.87 59.25 2f9i n SER 234 Cb 0.47 -0.74 0.37 0.00 -0.26 0.00 0.00 64.21 64.05 2f9i n SER 234 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2f9i n ASN 235 N -2.08 0.12 -1.53 4.04 4.13 -1.26 -2.72 115.26 115.96 2f9i n ASN 235 Ca 0.02 0.53 -0.06 0.00 1.68 0.00 0.00 54.58 56.75 2f9i n ASN 235 Cb 0.22 -0.55 0.16 0.00 -1.54 0.00 0.00 39.78 38.07 2f9i n ASN 235 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2f9i n LEU 236 N -1.63 4.54 -0.28 3.41 4.77 -0.81 -4.53 117.00 122.46 2f9i n LEU 236 Ca 0.04 -2.35 0.09 0.00 -0.03 0.00 0.00 56.01 53.75 2f9i n LEU 236 Cb 0.20 -0.66 0.24 0.00 -2.33 0.00 0.00 43.42 40.88 2f9i n LEU 236 CO 0.16 0.66 1.04 0.00 -1.33 0.00 0.00 177.39 177.92 2f9i h ALA 237 N 2.21 1.24 -0.13 -1.18 0.00 -1.73 -1.57 119.26 118.10 2f9i h ALA 237 Ca 0.20 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2f9i h ALA 237 Cb 1.76 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 2f9i h ALA 237 CO 0.48 -0.25 -0.02 -0.22 0.00 0.00 0.00 179.25 179.25 2f9i h LYS 238 N 0.45 0.02 -0.75 0.00 3.64 -1.89 0.31 116.57 118.35 2f9i h LYS 238 Ca 0.48 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.80 2f9i h LYS 238 Cb 0.81 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 2f9i h LYS 238 CO -0.46 0.01 0.23 0.82 -2.27 0.00 0.00 179.45 177.79 2f9i h ILE 239 N 0.02 1.26 -0.31 2.00 1.08 -1.81 -1.56 117.51 118.19 2f9i h ILE 239 Ca 0.06 -0.91 -0.00 0.00 -0.39 0.00 0.00 64.86 63.62 2f9i h ILE 239 Cb 0.09 0.44 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 2f9i h ILE 239 CO -0.12 0.36 0.18 0.00 -0.69 0.00 0.00 178.15 177.87 2f9i h ALA 240 N 1.14 0.40 -0.32 1.87 0.00 -0.62 0.10 119.26 121.83 2f9i h ALA 240 Ca 0.24 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2f9i h ALA 240 Cb 0.31 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2f9i h ALA 240 CO -0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 179.25 179.12 2f9i h ALA 241 N 1.05 0.25 -0.51 0.00 0.00 -0.16 -0.93 119.26 118.96 2f9i h ALA 241 Ca 0.11 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2f9i h ALA 241 Cb 0.04 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2f9i h ALA 241 CO -0.02 -0.43 -0.05 0.93 0.00 0.00 0.00 179.25 179.68 2f9i h GLU 242 N 0.05 0.90 -0.11 0.00 5.08 -1.02 -2.06 114.58 117.42 2f9i h GLU 242 Ca 0.16 -0.28 -0.16 0.00 -1.00 0.00 0.00 59.36 58.07 2f9i h GLU 242 Cb 0.22 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2f9i h GLU 242 CO -0.29 0.92 -0.62 1.15 -1.00 0.00 0.00 179.01 179.17 2f9i h THR 243 N 0.82 1.36 0.00 1.13 2.02 -0.42 -3.03 112.91 114.80 2f9i h THR 243 Ca 0.15 -1.96 -0.05 0.00 0.77 0.00 0.00 66.41 65.32 2f9i h THR 243 Cb 0.55 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 2f9i h THR 243 CO 0.03 0.59 -0.24 0.24 0.37 0.00 0.00 175.52 176.51 2f9i h MET 244 N 0.28 0.00 -4.91 6.66 2.86 -1.07 -3.49 114.93 115.27 2f9i h MET 244 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2f9i h MET 244 Cb 1.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.81 2f9i h MET 244 CO 0.10 0.24 -0.00 1.63 1.06 0.00 0.00 176.91 179.95 2f9i n LYS 245 N -3.26 -1.07 -0.17 1.72 5.02 -0.78 -4.98 118.16 114.64 2f9i n LYS 245 Ca 0.01 1.31 0.11 0.00 -2.02 0.00 0.00 58.31 57.72 2f9i n LYS 245 Cb 0.53 -4.95 0.19 0.00 -0.02 0.00 0.00 35.03 30.78 2f9i n LYS 245 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2f9i n ILE 246 N -1.62 0.49 -2.87 -0.18 -5.35 -1.24 -4.55 119.36 104.04 2f9i n ILE 246 Ca 0.00 -0.75 -0.28 0.00 -0.27 0.00 0.00 62.75 61.45 2f9i n ILE 246 Cb 0.50 0.99 -0.02 0.00 -1.74 0.00 0.00 39.64 39.37 2f9i n ILE 246 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2f9i s THR 247 N -1.42 4.89 0.17 7.28 -4.23 -1.26 -1.94 115.64 119.13 2f9i s THR 247 Ca 0.35 0.31 -0.16 0.00 -1.18 0.00 0.00 61.69 61.01 2f9i s THR 247 Cb 0.21 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 70.37 2f9i s THR 247 CO 0.29 -0.63 1.66 0.00 -0.54 0.00 0.00 174.62 175.41 2f9i h ALA 248 N 0.88 0.29 -0.66 3.99 0.00 -1.72 -0.64 119.26 121.40 2f9i h ALA 248 Ca -0.47 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2f9i h ALA 248 Cb 1.20 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 2f9i h ALA 248 CO 0.63 -0.45 0.34 0.45 0.00 0.00 0.00 179.25 180.22 2f9i h HIS 249 N 0.00 0.91 -0.07 0.00 3.86 -1.92 -1.26 115.15 116.68 2f9i h HIS 249 Ca 0.21 -0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.42 2f9i h HIS 249 Cb 0.32 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2f9i h HIS 249 CO -0.38 0.65 -0.08 -0.44 0.86 0.00 0.00 177.93 178.54 2f9i h ASP 250 N 0.93 -0.25 -0.32 2.45 3.32 -1.51 -1.66 116.42 119.37 2f9i h ASP 250 Ca 0.23 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.29 2f9i h ASP 250 Cb 0.06 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2f9i h ASP 250 CO -0.03 -0.12 0.09 0.40 -1.72 0.00 0.00 179.24 177.86 2f9i h ILE 251 N -0.11 1.19 -0.32 0.35 1.08 -0.70 -1.96 117.51 117.04 2f9i h ILE 251 Ca 0.06 -0.67 -0.16 0.00 -0.39 0.00 0.00 64.86 63.70 2f9i h ILE 251 Cb 0.19 0.79 -0.01 0.00 -3.07 0.00 0.00 36.82 34.72 2f9i h ILE 251 CO -0.14 0.24 -0.43 0.50 -0.69 0.00 0.00 178.15 177.63 2f9i h LYS 252 N 0.58 0.80 -0.39 2.37 3.64 -1.03 -2.71 116.57 119.83 2f9i h LYS 252 Ca 0.13 -0.44 0.06 0.00 -1.27 0.00 0.00 60.65 59.14 2f9i h LYS 252 Cb 0.24 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 2f9i h LYS 252 CO -0.00 1.07 0.26 0.37 -2.27 0.00 0.00 179.45 178.88 2f9i h GLN 253 N 0.64 0.25 -0.00 1.90 5.75 -0.57 -0.55 115.11 122.53 2f9i h GLN 253 Ca 0.04 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2f9i h GLN 253 Cb 1.00 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.50 2f9i h GLN 253 CO 0.10 0.16 -0.06 1.28 -2.65 0.00 0.00 178.83 177.66 2f9i n LEU 254 N -4.47 0.20 -0.09 -2.39 4.77 -0.92 -4.91 117.00 109.20 2f9i n LEU 254 Ca 0.05 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.18 2f9i n LEU 254 Cb 0.28 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 2f9i n LEU 254 CO 0.35 0.04 -0.01 0.61 -1.33 0.00 0.00 177.39 177.05 2f9i n GLY 255 N 1.29 0.50 0.10 -0.72 0.00 -0.22 -4.91 105.19 101.23 2f9i n GLY 255 Ca 0.14 -0.43 -0.00 0.00 0.00 0.00 0.00 46.02 45.73 2f9i n GLY 255 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2f9i h ILE 256 N 0.00 0.67 -2.04 -0.61 2.04 -1.71 -3.46 117.51 112.40 2f9i h ILE 256 Ca -0.02 -2.16 -0.61 0.00 1.00 0.00 0.00 64.86 63.07 2f9i h ILE 256 Cb 0.15 2.19 -0.13 0.00 -0.74 0.00 0.00 36.82 38.29 2f9i h ILE 256 CO 0.04 0.38 -0.70 0.27 0.00 0.00 0.00 178.15 178.14 2f9i s ILE 257 N -2.91 2.45 -0.13 -0.67 -4.36 -1.24 -4.83 121.20 109.52 2f9i s ILE 257 Ca -0.01 -2.22 0.20 0.00 -0.26 0.00 0.00 60.65 58.36 2f9i s ILE 257 Cb 0.08 -2.56 -0.18 0.00 1.25 0.00 0.00 42.46 41.05 2f9i s ILE 257 CO 0.80 -0.28 0.69 0.47 0.24 0.00 0.00 174.94 176.85 2f9i n ASP 258 N -0.77 0.46 -3.60 4.36 8.00 0.48 -4.68 116.55 120.80 2f9i n ASP 258 Ca -0.05 0.19 -0.07 0.00 0.71 0.00 0.00 54.79 55.57 2f9i n ASP 258 Cb 0.62 0.97 -0.05 0.00 -0.02 0.00 0.00 41.12 42.64 2f9i n ASP 258 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2f9i s ASP 259 N -5.19 -0.24 -0.15 -2.24 2.15 -1.23 -5.04 116.67 104.74 2f9i s ASP 259 Ca -0.05 0.25 -0.04 0.00 0.43 0.00 0.00 52.55 53.15 2f9i s ASP 259 Cb 0.10 0.20 -0.03 0.00 -0.30 0.00 0.00 42.92 42.89 2f9i s ASP 259 CO 0.84 -0.22 -0.03 -0.69 -0.17 0.00 0.00 175.17 174.90 2f9i s VAL 260 N -1.10 4.00 -0.20 1.11 1.01 -1.26 -2.34 120.40 121.62 2f9i s VAL 260 Ca 0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 2f9i s VAL 260 Cb -0.01 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 2f9i s VAL 260 CO -0.02 0.50 0.07 -0.63 0.00 0.00 0.00 175.10 175.02 2f9i s ILE 261 N 0.20 4.72 0.61 2.22 1.01 0.10 -4.91 121.20 125.15 2f9i s ILE 261 Ca -0.01 -0.05 -0.18 0.00 0.00 0.00 0.00 60.65 60.41 2f9i s ILE 261 Cb -0.14 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 2f9i s ILE 261 CO 0.03 0.43 1.18 -0.44 0.00 0.00 0.00 174.94 176.14 2f9i s SER 262 N 0.67 5.14 0.20 3.58 0.01 -1.26 -0.52 113.70 121.52 2f9i s SER 262 Ca 0.04 2.31 0.07 0.00 1.31 0.00 0.00 55.95 59.67 2f9i s SER 262 Cb -0.13 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.47 2f9i s SER 262 CO 0.02 -1.62 0.10 -1.61 0.41 0.00 0.00 173.24 170.53 2f9i s GLU 263 N -3.48 2.70 0.95 12.44 2.02 -1.26 -4.81 118.70 127.26 2f9i s GLU 263 Ca 0.75 -1.04 -0.12 0.00 0.02 0.00 0.00 54.97 54.58 2f9i s GLU 263 Cb -0.28 -2.49 0.07 0.00 0.10 0.00 0.00 34.13 31.53 2f9i s GLU 263 CO 0.34 0.44 0.58 -2.30 0.02 0.00 0.00 175.26 174.35 2f9i n PRO 264 N -0.54 -0.42 -1.69 0.39 -0.02 -1.26 -4.81 135.00 126.66 2f9i n PRO 264 Ca -0.08 -0.08 -0.45 0.00 -2.02 0.00 0.00 63.50 60.88 2f9i n PRO 264 Cb 0.56 -1.98 -0.04 0.00 -0.02 0.00 0.00 33.50 32.02 2f9i n PRO 264 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2f9i n LEU 265 N -2.11 3.60 0.00 2.45 7.94 -1.26 -1.29 117.00 126.33 2f9i n LEU 265 Ca 0.08 1.03 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 2f9i n LEU 265 Cb 0.53 -1.48 0.00 0.00 0.53 0.00 0.00 43.42 43.00 2f9i n LEU 265 CO 0.50 -0.03 0.00 0.61 -1.11 0.00 0.00 177.39 177.37 2f9i n GLY 266 N 3.91 3.33 0.00 -3.96 0.00 -1.26 -4.86 105.19 102.35 2f9i n GLY 266 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2f9i n GLY 266 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f9i n GLY 267 N -1.44 3.50 0.41 -0.02 0.00 -0.41 -4.86 105.19 102.37 2f9i n GLY 267 Ca 0.00 -1.85 0.33 0.00 0.00 0.00 0.00 46.02 44.49 2f9i n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f9i h ALA 268 N 0.00 2.45 0.00 4.61 0.00 -1.90 -0.32 119.26 124.10 2f9i h ALA 268 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2f9i h ALA 268 Cb 0.00 0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2f9i h ALA 268 CO 0.00 -1.09 0.00 -2.39 0.00 0.00 0.00 179.25 175.77 2f9i n HIS 269 N -4.85 0.80 0.16 0.00 1.44 -1.26 -2.69 115.22 108.82 2f9i n HIS 269 Ca 0.35 0.36 0.04 0.00 -2.01 0.00 0.00 57.72 56.46 2f9i n HIS 269 Cb 1.28 -1.07 0.18 0.00 0.12 0.00 0.00 29.99 30.50 2f9i n HIS 269 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 2f9i h LYS 270 N 0.00 0.00 -1.17 -1.40 1.79 -1.38 -3.40 116.57 111.00 2f9i h LYS 270 Ca 0.00 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 2f9i h LYS 270 Cb 0.21 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 30.65 2f9i h LYS 270 CO 0.00 0.44 -0.52 0.34 -1.08 0.00 0.00 179.45 178.63 2f9i s ASP 271 N -6.42 -1.06 0.13 0.86 -1.08 -1.09 -5.03 116.67 102.97 2f9i s ASP 271 Ca 0.02 -1.33 -0.19 0.00 -0.52 0.00 0.00 52.55 50.53 2f9i s ASP 271 Cb 0.09 1.67 -0.04 0.00 -1.46 0.00 0.00 42.92 43.17 2f9i s ASP 271 CO 0.71 -0.14 1.75 0.40 0.52 0.00 0.00 175.17 178.42 2f9i h ILE 272 N 4.98 0.97 -0.28 4.11 2.04 -1.78 -0.79 117.51 126.76 2f9i h ILE 272 Ca 0.06 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 65.90 2f9i h ILE 272 Cb 1.13 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2f9i h ILE 272 CO 0.09 0.03 0.07 -0.08 0.00 0.00 0.00 178.15 178.26 2f9i h GLU 273 N 0.19 0.18 -0.49 2.37 4.81 -1.95 0.30 114.58 119.98 2f9i h GLU 273 Ca 0.09 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2f9i h GLU 273 Cb 0.04 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2f9i h GLU 273 CO -0.08 0.12 0.27 0.37 -0.73 0.00 0.00 179.01 178.96 2f9i h GLN 274 N 0.18 0.68 -0.34 1.92 4.15 -1.92 -2.04 115.11 117.74 2f9i h GLN 274 Ca 0.13 -0.08 0.06 0.00 0.77 0.00 0.00 58.65 59.53 2f9i h GLN 274 Cb 0.13 -0.13 -0.06 0.00 0.21 0.00 0.00 27.48 27.62 2f9i h GLN 274 CO -0.16 0.53 -0.01 0.37 -1.93 0.00 0.00 178.83 177.63 2f9i h GLN 275 N 0.65 0.08 -0.89 1.69 5.75 -0.64 -2.21 115.11 119.54 2f9i h GLN 275 Ca 0.17 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.72 2f9i h GLN 275 Cb 0.04 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.52 2f9i h GLN 275 CO -0.03 0.06 0.56 0.00 -2.65 0.00 0.00 178.83 176.77 2f9i h ALA 276 N 1.30 1.21 -0.47 3.38 0.00 -0.19 -1.11 119.26 123.38 2f9i h ALA 276 Ca 0.17 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2f9i h ALA 276 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2f9i h ALA 276 CO -0.29 0.35 -0.04 -0.07 0.00 0.00 0.00 179.25 179.21 2f9i h LEU 277 N 1.05 0.78 -0.68 0.00 3.38 -1.06 0.10 115.31 118.88 2f9i h LEU 277 Ca 0.38 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 2f9i h LEU 277 Cb 0.11 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2f9i h LEU 277 CO -0.15 0.87 0.17 0.00 0.09 0.00 0.00 178.44 179.41 2f9i h ALA 278 N 1.21 0.89 -0.21 1.53 0.00 -0.75 -1.71 119.26 120.22 2f9i h ALA 278 Ca 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2f9i h ALA 278 Cb 0.50 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2f9i h ALA 278 CO 0.03 0.61 0.07 0.82 0.00 0.00 0.00 179.25 180.77 2f9i h ILE 279 N 1.01 1.19 -0.50 0.00 2.04 -0.67 -2.01 117.51 118.56 2f9i h ILE 279 Ca 0.21 -0.58 0.05 0.00 1.00 0.00 0.00 64.86 65.54 2f9i h ILE 279 Cb 0.36 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 2f9i h ILE 279 CO 0.00 0.18 0.24 0.50 0.00 0.00 0.00 178.15 179.07 2f9i h LYS 280 N 0.17 0.45 -0.49 2.37 3.64 -0.72 0.14 116.57 122.12 2f9i h LYS 280 Ca 0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2f9i h LYS 280 Cb 0.22 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2f9i h LYS 280 CO -0.00 0.30 0.32 1.03 -2.27 0.00 0.00 179.45 178.82 2f9i h SER 281 N 0.46 0.57 -0.74 4.20 0.87 -1.22 -1.14 113.55 116.55 2f9i h SER 281 Ca 0.23 -0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2f9i h SER 281 Cb 0.17 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 2f9i h SER 281 CO -0.18 0.43 0.43 0.00 -0.53 0.00 0.00 176.83 176.98 2f9i h ALA 282 N 1.17 0.94 -0.19 6.23 0.00 -0.73 -1.29 119.26 125.39 2f9i h ALA 282 Ca 0.18 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2f9i h ALA 282 Cb -0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 2f9i h ALA 282 CO -0.04 0.43 -0.05 0.74 0.00 0.00 0.00 179.25 180.34 2f9i h PHE 283 N 1.01 -0.10 -0.12 0.00 0.04 -0.26 0.34 116.94 117.86 2f9i h PHE 283 Ca 0.26 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.07 2f9i h PHE 283 Cb -0.01 0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 2f9i h PHE 283 CO -0.01 -0.08 -0.01 0.28 -0.60 0.00 0.00 178.31 177.89 2f9i h VAL 284 N -0.00 0.91 -0.06 -0.55 2.07 -0.97 0.13 116.25 117.77 2f9i h VAL 284 Ca 0.09 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 2f9i h VAL 284 Cb 0.14 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2f9i h VAL 284 CO -0.19 0.01 0.04 0.00 0.02 0.00 0.00 177.57 177.44 2f9i h ALA 285 N 1.10 0.08 -0.48 1.67 0.00 -0.98 0.23 119.26 120.88 2f9i h ALA 285 Ca 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2f9i h ALA 285 Cb 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2f9i h ALA 285 CO -0.10 -0.38 0.29 1.96 0.00 0.00 0.00 179.25 181.02 2f9i h GLN 286 N 0.02 0.65 -0.71 0.00 1.08 -0.75 -2.14 115.11 113.25 2f9i h GLN 286 Ca 0.02 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 2f9i h GLN 286 Cb 0.07 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 2f9i h GLN 286 CO -0.00 0.47 0.36 1.25 -0.95 0.00 0.00 178.83 179.96 2f9i h LEU 287 N 0.64 0.91 -1.04 1.46 5.85 -0.58 -2.80 115.31 119.74 2f9i h LEU 287 Ca 0.17 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 2f9i h LEU 287 Cb -0.01 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2f9i h LEU 287 CO -0.03 0.75 0.02 -0.78 -0.34 0.00 0.00 178.44 178.07 2f9i h ASP 288 N 1.01 0.67 0.05 1.25 1.82 -0.36 -1.08 116.42 119.78 2f9i h ASP 288 Ca 0.25 -0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 2f9i h ASP 288 Cb 0.08 -0.18 0.00 0.00 0.68 0.00 0.00 39.33 39.91 2f9i h ASP 288 CO -0.04 0.73 0.00 -1.54 -1.61 0.00 0.00 179.24 176.78 2f9i n SER 289 N -4.25 0.52 -0.51 2.28 3.41 -0.86 -1.73 113.62 112.49 2f9i n SER 289 Ca 0.02 0.73 0.09 0.00 -0.26 0.00 0.00 58.87 59.45 2f9i n SER 289 Cb 0.27 -0.81 0.03 0.00 -0.26 0.00 0.00 64.21 63.44 2f9i n SER 289 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2f9i n LEU 290 N -2.19 2.00 -0.33 1.04 4.77 -0.42 -4.73 117.00 117.13 2f9i n LEU 290 Ca -0.01 -0.86 0.15 0.00 -0.03 0.00 0.00 56.01 55.26 2f9i n LEU 290 Cb 0.05 0.00 0.37 0.00 -2.33 0.00 0.00 43.42 41.51 2f9i n LEU 290 CO 0.10 0.37 1.20 -0.08 -1.33 0.00 0.00 177.39 177.64 2f9i h GLU 291 N 2.52 0.65 0.00 3.23 4.57 -1.23 -2.15 114.58 122.17 2f9i h GLU 291 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2f9i h GLU 291 Cb 0.64 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2f9i h GLU 291 CO 0.00 0.43 -0.04 -1.13 -1.18 0.00 0.00 179.01 177.09 2f9i n SER 292 N -4.72 0.34 -4.74 1.04 3.41 -1.26 -4.88 113.62 102.82 2f9i n SER 292 Ca 0.23 0.48 -0.41 0.00 -0.26 0.00 0.00 58.87 58.92 2f9i n SER 292 Cb 0.63 -0.55 -0.05 0.00 -0.26 0.00 0.00 64.21 63.98 2f9i n SER 292 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2f9i s LEU 293 N -3.60 4.54 1.01 1.04 1.43 -0.81 -5.07 118.68 117.21 2f9i s LEU 293 Ca 0.12 1.78 -0.15 0.00 -1.03 0.00 0.00 54.13 54.86 2f9i s LEU 293 Cb 0.16 -3.53 0.19 0.00 0.03 0.00 0.00 46.19 43.04 2f9i s LEU 293 CO 0.57 0.02 1.15 -0.94 0.23 0.00 0.00 176.35 177.38 2f9i s SER 294 N -0.38 2.65 0.16 2.29 1.04 -1.26 -4.75 113.70 113.45 2f9i s SER 294 Ca 0.44 0.81 -0.18 0.00 0.48 0.00 0.00 55.95 57.50 2f9i s SER 294 Cb -0.24 -1.24 0.07 0.00 0.10 0.00 0.00 66.02 64.71 2f9i s SER 294 CO 0.29 -3.07 1.67 0.03 0.98 0.00 0.00 173.24 173.15 2f9i h ARG 295 N -1.86 -0.01 -0.41 4.02 3.08 -1.98 0.71 114.38 117.93 2f9i h ARG 295 Ca -0.49 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.48 2f9i h ARG 295 Cb 1.31 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 2f9i h ARG 295 CO 0.51 -0.01 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.89 2f9i h ASP 296 N -0.01 0.69 0.14 7.04 3.32 -1.94 -3.03 116.42 122.63 2f9i h ASP 296 Ca 0.17 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 2f9i h ASP 296 Cb 0.27 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2f9i h ASP 296 CO -0.37 0.80 -0.45 -0.33 -1.72 0.00 0.00 179.24 177.17 2f9i h GLU 297 N 0.65 0.38 -0.56 3.56 5.08 -1.73 -1.83 114.58 120.13 2f9i h GLU 297 Ca 0.12 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2f9i h GLU 297 Cb 0.51 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 2f9i h GLU 297 CO 0.03 0.76 0.17 0.82 -1.00 0.00 0.00 179.01 179.80 2f9i h ILE 298 N 0.31 1.22 -0.07 3.13 2.04 -0.76 0.65 117.51 124.03 2f9i h ILE 298 Ca 0.02 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 2f9i h ILE 298 Cb 0.92 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2f9i h ILE 298 CO 0.08 0.29 -0.08 0.00 0.00 0.00 0.00 178.15 178.43 2f9i h ALA 299 N 1.37 0.11 -0.71 1.87 0.00 -1.47 -2.88 119.26 117.56 2f9i h ALA 299 Ca 0.19 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2f9i h ALA 299 Cb 0.24 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2f9i h ALA 299 CO -0.01 -0.06 0.46 -0.97 0.00 0.00 0.00 179.25 178.67 2f9i h ASN 300 N -0.25 0.71 -0.96 0.00 -0.73 -1.13 -0.65 115.58 112.56 2f9i h ASN 300 Ca 0.01 -0.01 0.02 0.00 1.87 0.00 0.00 56.30 58.20 2f9i h ASN 300 Cb 0.61 -0.16 -0.05 0.00 0.27 0.00 0.00 38.32 38.98 2f9i h ASN 300 CO 0.02 0.48 0.64 -0.78 -0.37 0.00 0.00 177.43 177.42 2f9i h ASP 301 N 0.82 1.08 -0.04 1.15 3.58 -0.85 -1.08 116.42 121.08 2f9i h ASP 301 Ca 0.29 -0.02 -0.18 0.00 0.42 0.00 0.00 57.03 57.54 2f9i h ASP 301 Cb 0.11 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 2f9i h ASP 301 CO -0.08 0.76 -0.60 -0.09 -2.88 0.00 0.00 179.24 176.35 2f9i h ARG 302 N 1.27 0.65 0.05 0.28 2.43 -1.03 -2.10 114.38 115.92 2f9i h ARG 302 Ca 0.37 -0.44 0.02 0.00 -0.81 0.00 0.00 59.98 59.12 2f9i h ARG 302 Cb -0.08 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2f9i h ARG 302 CO -0.10 1.06 -0.18 0.35 -1.51 0.00 0.00 179.97 179.60 2f9i h PHE 303 N 0.49 -0.46 -0.76 2.20 3.57 -0.80 -2.62 116.94 118.55 2f9i h PHE 303 Ca -0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 2f9i h PHE 303 Cb 1.18 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 40.08 2f9i h PHE 303 CO 0.06 -0.26 0.46 0.93 -2.23 0.00 0.00 178.31 177.27 2f9i h GLU 304 N -0.31 1.03 0.27 1.11 4.39 -1.14 0.30 114.58 120.22 2f9i h GLU 304 Ca 0.04 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2f9i h GLU 304 Cb 0.36 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2f9i h GLU 304 CO -0.14 0.72 -0.28 -0.22 -1.16 0.00 0.00 179.01 177.93 2f9i h LYS 305 N 1.05 -0.57 0.17 2.33 3.64 -1.13 -2.98 116.57 119.08 2f9i h LYS 305 Ca 0.27 0.04 -0.30 0.00 -1.27 0.00 0.00 60.65 59.39 2f9i h LYS 305 Cb -0.05 0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2f9i h LYS 305 CO -0.05 -0.38 -1.40 0.74 -2.27 0.00 0.00 179.45 176.08 2f9i h PHE 306 N -0.59 0.64 -0.50 1.91 0.04 -1.34 -3.27 116.94 113.83 2f9i h PHE 306 Ca -0.01 -0.46 0.13 0.00 2.80 0.00 0.00 57.97 60.43 2f9i h PHE 306 Cb 0.55 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 2f9i h PHE 306 CO -0.19 1.41 0.36 -0.09 -0.60 0.00 0.00 178.31 179.19 2f9i h ARG 307 N 0.10 0.07 -0.58 1.51 9.65 -0.98 -2.52 114.38 121.62 2f9i h ARG 307 Ca -0.20 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.67 2f9i h ARG 307 Cb 2.05 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 30.61 2f9i h ARG 307 CO 0.21 0.05 0.00 0.09 2.80 0.00 0.00 179.97 183.12 2f9i n ASN 308 N -4.41 5.17 -4.68 -3.80 4.13 -1.13 -4.90 115.26 105.64 2f9i n ASN 308 Ca 0.09 -2.72 -0.38 0.00 1.68 0.00 0.00 54.58 53.25 2f9i n ASN 308 Cb 0.53 -0.62 -0.07 0.00 -1.54 0.00 0.00 39.78 38.07 2f9i n ASN 308 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2f9i s ILE 309 N -2.36 5.22 0.00 2.41 1.01 -0.95 -5.00 121.20 121.53 2f9i s ILE 309 Ca 0.52 0.67 0.00 0.00 0.00 0.00 0.00 60.65 61.84 2f9i s ILE 309 Cb 0.37 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 39.13 2f9i s ILE 309 CO 0.19 0.28 0.00 0.61 0.00 0.00 0.00 174.94 176.02 2f9i n GLY 310 N 3.83 4.68 3.17 6.18 0.00 -1.26 -5.09 105.19 116.70 2f9i n GLY 310 Ca -0.09 -1.18 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 2f9i n GLY 310 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f9i s SER 311 N 0.00 2.46 0.17 1.61 1.04 -1.26 -5.12 113.70 112.60 2f9i s SER 311 Ca 0.00 -0.41 -0.14 0.00 0.48 0.00 0.00 55.95 55.88 2f9i s SER 311 Cb 0.00 -0.72 0.02 0.00 0.10 0.00 0.00 66.02 65.41 2f9i s SER 311 CO 0.00 0.18 0.42 -0.72 0.98 0.00 0.00 173.24 174.10 2f9i s TYR 312 N 0.02 0.03 -0.19 5.02 -0.85 -1.26 -5.15 117.35 114.96 2f9i s TYR 312 Ca -0.05 -0.38 -0.03 0.00 -0.52 0.00 0.00 57.07 56.09 2f9i s TYR 312 Cb -0.13 0.23 -0.01 0.00 0.38 0.00 0.00 41.96 42.43 2f9i s TYR 312 CO 0.03 -0.81 -0.06 0.42 -1.52 0.00 0.00 175.55 173.61 2f9i s ILE 313 N -3.89 3.38 -2.00 -3.49 1.01 -1.26 -5.33 121.20 109.62 2f9i s ILE 313 Ca 0.10 -0.51 0.15 0.00 0.00 0.00 0.00 60.65 60.39 2f9i s ILE 313 Cb 0.01 -2.50 0.44 0.00 0.01 0.00 0.00 42.46 40.41 2f9i s ILE 313 CO -0.04 0.46 1.33 -0.62 0.00 0.00 0.00 174.94 176.07