#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dra s GLN 3 N 0.00 0.38 -0.34 1.20 -2.07 -1.26 -5.12 119.66 112.44 3dra s GLN 3 Ca 0.00 0.48 -0.18 0.00 -1.82 0.00 0.00 55.36 53.84 3dra s GLN 3 Cb 0.00 0.16 -0.01 0.00 -1.09 0.00 0.00 33.01 32.07 3dra s GLN 3 CO 0.00 -0.06 0.50 -1.17 -1.32 0.00 0.00 175.29 173.24 3dra s LEU 4 N 0.31 4.33 -1.44 2.60 2.96 -1.26 -4.97 118.68 121.22 3dra s LEU 4 Ca -0.01 -0.00 -0.14 0.00 -0.22 0.00 0.00 54.13 53.75 3dra s LEU 4 Cb -0.03 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 44.13 3dra s LEU 4 CO -0.01 -0.45 2.16 0.18 -1.32 0.00 0.00 176.35 176.91 3dra n LEU 5 N 5.70 6.63 -0.29 -0.68 4.77 -1.26 -4.81 117.00 127.07 3dra n LEU 5 Ca -0.05 -4.13 0.10 0.00 -0.03 0.00 0.00 56.01 51.90 3dra n LEU 5 Cb 0.49 -1.67 0.26 0.00 -2.33 0.00 0.00 43.42 40.17 3dra n LEU 5 CO 0.44 1.00 1.00 0.40 -1.33 0.00 0.00 177.39 178.90 3dra h ILE 6 N 4.18 0.48 -0.59 -0.08 1.08 -1.95 -1.38 117.51 119.25 3dra h ILE 6 Ca 0.55 -0.12 -0.05 0.00 -0.39 0.00 0.00 64.86 64.85 3dra h ILE 6 Cb 0.67 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.50 3dra h ILE 6 CO 1.83 0.06 0.18 0.78 -0.69 0.00 0.00 178.15 180.31 3dra h ASN 7 N 0.35 0.87 -0.61 1.72 2.35 -1.99 0.21 115.58 118.49 3dra h ASN 7 Ca 0.50 -0.21 -0.06 0.00 -0.55 0.00 0.00 56.30 55.99 3dra h ASN 7 Cb 0.92 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 3dra h ASN 7 CO -0.53 0.86 0.17 0.11 -1.65 0.00 0.00 177.43 176.39 3dra h LYS 8 N 0.84 0.99 -0.29 0.81 1.79 -1.68 -1.40 116.57 117.64 3dra h LYS 8 Ca 0.19 -0.21 -0.12 0.00 -2.18 0.00 0.00 60.65 58.33 3dra h LYS 8 Cb 0.30 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.80 3dra h LYS 8 CO -0.00 0.87 -0.33 0.45 -1.08 0.00 0.00 179.45 179.35 3dra h HIS 9 N 0.95 0.72 -0.33 -1.35 3.86 -0.92 -0.04 115.15 118.05 3dra h HIS 9 Ca 0.21 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3dra h HIS 9 Cb 0.31 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 3dra h HIS 9 CO 0.02 0.87 0.21 1.49 0.86 0.00 0.00 177.93 181.39 3dra h GLU 10 N 0.53 0.44 -0.64 2.45 4.81 -0.66 -0.98 114.58 120.53 3dra h GLU 10 Ca 0.06 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 3dra h GLU 10 Cb 0.82 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 3dra h GLU 10 CO 0.07 0.31 0.41 -0.22 -0.73 0.00 0.00 179.01 178.85 3dra h LYS 11 N 0.44 0.82 0.18 1.92 3.64 -0.98 -1.22 116.57 121.36 3dra h LYS 11 Ca 0.12 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 3dra h LYS 11 Cb -0.03 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 3dra h LYS 11 CO -0.02 0.54 -0.09 0.35 -2.27 0.00 0.00 179.45 177.96 3dra h PHE 12 N 0.84 -0.23 -0.97 1.91 3.57 -0.67 -0.45 116.94 120.95 3dra h PHE 12 Ca 0.24 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.74 3dra h PHE 12 Cb -0.07 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 3dra h PHE 12 CO -0.03 -0.05 0.64 0.74 -2.23 0.00 0.00 178.31 177.38 3dra h PHE 13 N -0.36 1.22 -0.22 0.41 0.04 -1.05 -2.15 116.94 114.83 3dra h PHE 13 Ca -0.02 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 3dra h PHE 13 Cb 0.28 -0.41 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 3dra h PHE 13 CO -0.03 0.77 -0.30 -0.91 -0.60 0.00 0.00 178.31 177.24 3dra h ASN 14 N 1.32 0.45 -0.09 2.17 -0.26 -1.05 -1.92 115.58 116.18 3dra h ASN 14 Ca 0.35 -0.16 -0.00 0.00 -0.56 0.00 0.00 56.30 55.93 3dra h ASN 14 Cb -0.15 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 36.99 3dra h ASN 14 CO -0.08 0.73 0.05 -0.09 -1.06 0.00 0.00 177.43 176.99 3dra h ARG 15 N 0.38 0.13 -0.96 0.81 2.43 -0.64 -2.16 114.38 114.38 3dra h ARG 15 Ca 0.05 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 3dra h ARG 15 Cb 0.72 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.18 3dra h ARG 15 CO 0.06 0.14 0.61 0.00 -1.51 0.00 0.00 179.97 179.27 3dra h LEU 17 N 1.13 0.00 -0.17 0.00 3.38 -1.17 -2.51 115.31 115.96 3dra h LEU 17 Ca 0.41 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.17 3dra h LEU 17 Cb 0.14 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3dra h LEU 17 CO -0.16 0.37 -0.69 0.40 0.09 0.00 0.00 178.44 178.45 3dra h ILE 18 N 0.00 1.29 -1.01 1.22 2.04 -0.67 -3.48 117.51 116.90 3dra h ILE 18 Ca -0.00 -1.89 0.22 0.00 1.00 0.00 0.00 64.86 64.19 3dra h ILE 18 Cb 0.75 1.94 -0.32 0.00 -0.74 0.00 0.00 36.82 38.45 3dra h ILE 18 CO 0.05 0.60 0.95 -0.83 0.00 0.00 0.00 178.15 178.92 3dra s GLY 19 N -4.05 0.34 0.25 5.37 0.00 -0.13 -5.11 107.32 103.98 3dra s GLY 19 Ca -0.11 3.44 -0.03 0.00 0.00 0.00 0.00 44.72 48.02 3dra s GLY 19 CO 0.89 1.72 0.47 1.08 0.00 0.00 0.00 173.10 177.26 3dra s LEU 20 N -0.28 4.14 1.22 0.66 1.43 -1.25 -4.02 118.68 120.58 3dra s LEU 20 Ca 0.08 0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 53.58 3dra s LEU 20 Cb -0.04 -3.33 0.30 0.00 0.03 0.00 0.00 46.19 43.15 3dra s LEU 20 CO -0.15 -0.12 1.01 -2.16 0.23 0.00 0.00 176.35 175.16 3dra s PRO 21 N -3.46 -1.39 0.58 1.29 0.04 -1.26 -4.83 135.00 125.97 3dra s PRO 21 Ca 0.41 0.62 0.39 0.00 0.04 0.00 0.00 61.00 62.45 3dra s PRO 21 Cb -0.11 -1.52 2.00 0.00 0.04 0.00 0.00 34.50 34.92 3dra s PRO 21 CO 0.30 -3.98 2.17 0.66 0.04 0.00 0.00 177.00 176.19 3dra h SER 22 N -2.80 0.00 0.94 6.66 4.64 -2.06 -1.82 113.55 119.11 3dra h SER 22 Ca -0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 3dra h SER 22 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 3dra h SER 22 CO 0.46 0.00 -0.05 0.35 -0.87 0.00 0.00 176.83 176.73 3dra n THR 23 N -2.92 0.00 -0.00 2.95 -2.24 -1.26 -4.15 114.28 106.66 3dra n THR 23 Ca -0.02 -0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.78 3dra n THR 23 Cb 0.11 -0.43 0.37 0.00 -2.10 0.00 0.00 70.33 68.29 3dra n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dra h ALA 24 N 3.01 1.58 -0.11 6.98 0.00 -1.65 -2.94 119.26 126.14 3dra h ALA 24 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3dra h ALA 24 Cb 0.50 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3dra h ALA 24 CO 0.00 0.34 0.03 0.37 0.00 0.00 0.00 179.25 179.99 3dra h GLN 25 N 0.54 0.08 0.00 0.00 4.15 -1.82 -1.80 115.11 116.27 3dra h GLN 25 Ca 0.14 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.55 3dra h GLN 25 Cb 0.08 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.75 3dra h GLN 25 CO -0.02 0.05 0.15 -1.13 -1.93 0.00 0.00 178.83 175.96 3dra n SER 26 N -5.07 0.35 -1.51 -0.69 3.41 -1.11 -1.10 113.62 107.90 3dra n SER 26 Ca -0.05 0.60 -0.01 0.00 -0.26 0.00 0.00 58.87 59.15 3dra n SER 26 Cb 0.05 -0.60 0.09 0.00 -0.26 0.00 0.00 64.21 63.49 3dra n SER 26 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dra n GLU 27 N -1.99 1.43 0.00 4.33 1.02 -0.71 -4.94 120.64 119.78 3dra n GLU 27 Ca -0.01 -3.06 0.00 0.00 -0.02 0.00 0.00 57.16 54.07 3dra n GLU 27 Cb 0.17 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 3dra n GLU 27 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dra n ASP 28 N -0.43 0.05 -0.95 1.62 2.03 -0.26 -3.12 116.55 115.49 3dra n ASP 28 Ca 0.17 -0.26 0.08 0.00 0.52 0.00 0.00 54.79 55.29 3dra n ASP 28 Cb 0.91 -0.03 0.23 0.00 -0.72 0.00 0.00 41.12 41.52 3dra n ASP 28 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3dra n SER 29 N -0.13 3.62 -0.11 1.67 3.41 -1.26 -4.63 113.62 116.19 3dra n SER 29 Ca 0.00 -2.33 0.05 0.00 -0.26 0.00 0.00 58.87 56.32 3dra n SER 29 Cb 0.01 -0.40 0.07 0.00 -0.26 0.00 0.00 64.21 63.63 3dra n SER 29 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3dra n ASN 30 N 0.49 1.68 -0.27 4.04 5.15 -1.18 -4.73 115.26 120.44 3dra n ASN 30 Ca 0.18 -2.43 0.03 0.00 -0.60 0.00 0.00 54.58 51.76 3dra n ASN 30 Cb 0.65 -0.24 0.17 0.00 -0.53 0.00 0.00 39.78 39.83 3dra n ASN 30 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 3dra h LYS 31 N 0.00 0.62 -0.50 1.20 1.63 -1.82 -2.12 116.57 115.57 3dra h LYS 31 Ca 0.00 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.68 3dra h LYS 31 Cb 0.92 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.39 3dra h LYS 31 CO 0.00 0.41 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.30 3dra h LEU 32 N 0.64 0.85 -0.71 5.20 3.38 -1.89 -0.79 115.31 121.97 3dra h LEU 32 Ca 0.39 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3dra h LEU 32 Cb 0.46 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3dra h LEU 32 CO -0.30 0.93 0.28 0.00 0.09 0.00 0.00 178.44 179.44 3dra h ALA 33 N 1.16 0.93 -0.59 1.53 0.00 -1.76 -1.68 119.26 118.85 3dra h ALA 33 Ca 0.15 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3dra h ALA 33 Cb 0.53 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3dra h ALA 33 CO 0.03 0.56 0.02 0.82 0.00 0.00 0.00 179.25 180.68 3dra h ILE 34 N 1.03 1.26 -0.48 0.00 2.04 -0.76 -1.22 117.51 119.39 3dra h ILE 34 Ca 0.24 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.99 3dra h ILE 34 Cb 0.22 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 3dra h ILE 34 CO -0.02 0.40 0.31 0.40 0.00 0.00 0.00 178.15 179.24 3dra h ILE 35 N 0.92 1.13 0.10 -0.67 2.04 -1.08 -1.70 117.51 118.25 3dra h ILE 35 Ca 0.17 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.80 3dra h ILE 35 Cb 0.53 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 3dra h ILE 35 CO 0.03 0.13 -0.33 0.22 0.00 0.00 0.00 178.15 178.20 3dra h TYR 36 N 0.64 -0.89 -0.96 1.37 3.20 -0.99 0.18 116.97 119.52 3dra h TYR 36 Ca 0.17 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.14 3dra h TYR 36 Cb -0.06 0.38 -0.07 0.00 1.54 0.00 0.00 36.73 38.53 3dra h TYR 36 CO -0.04 -0.43 0.62 0.74 -1.64 0.00 0.00 178.16 177.41 3dra h PHE 37 N -0.54 1.13 -0.05 -3.82 0.04 -1.01 0.14 116.94 112.83 3dra h PHE 37 Ca 0.04 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.79 3dra h PHE 37 Cb 0.58 -0.37 0.00 0.00 2.20 0.00 0.00 35.95 38.36 3dra h PHE 37 CO -0.30 0.57 -0.13 0.00 -0.60 0.00 0.00 178.31 177.85 3dra h LEU 39 N -0.35 0.57 -0.72 0.00 3.38 -0.84 -1.80 115.31 115.55 3dra h LEU 39 Ca -0.00 -0.49 -0.13 0.00 0.09 0.00 0.00 57.88 57.35 3dra h LEU 39 Cb 0.74 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3dra h LEU 39 CO 0.03 0.94 -0.44 0.45 0.09 0.00 0.00 178.44 179.51 3dra h HIS 40 N 0.20 0.53 -0.77 1.13 3.86 -0.84 -1.30 115.15 117.96 3dra h HIS 40 Ca 0.03 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.06 3dra h HIS 40 Cb 0.79 -0.11 -0.04 0.00 1.06 0.00 0.00 27.41 29.11 3dra h HIS 40 CO 0.08 0.81 0.42 0.78 0.86 0.00 0.00 177.93 180.89 3dra h GLY 41 N 1.14 1.16 1.00 2.45 0.00 -1.12 0.37 103.07 108.07 3dra h GLY 41 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3dra h GLY 41 CO 0.08 0.50 0.16 1.41 0.00 0.00 0.00 176.54 178.69 3dra h LEU 42 N 1.07 0.27 -0.84 3.11 3.38 -1.02 -2.40 115.31 118.88 3dra h LEU 42 Ca 0.27 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.26 3dra h LEU 42 Cb 0.03 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 3dra h LEU 42 CO -0.04 0.20 0.54 -0.61 0.09 0.00 0.00 178.44 178.62 3dra h GLN 43 N 0.32 1.04 -0.74 1.13 4.15 -0.93 0.21 115.11 120.29 3dra h GLN 43 Ca 0.09 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.49 3dra h GLN 43 Cb -0.04 -0.23 -0.05 0.00 0.21 0.00 0.00 27.48 27.37 3dra h GLN 43 CO -0.02 0.69 0.45 1.25 -1.93 0.00 0.00 178.83 179.27 3dra h LEU 44 N 1.07 0.73 -0.97 -2.39 5.85 -0.69 -1.07 115.31 117.84 3dra h LEU 44 Ca 0.33 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.06 3dra h LEU 44 Cb -0.02 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.87 3dra h LEU 44 CO -0.11 0.49 0.00 2.30 -0.34 0.00 0.00 178.44 180.78 3dra n ILE 45 N -4.67 0.34 -3.39 4.05 -5.35 -0.93 -1.43 119.36 107.98 3dra n ILE 45 Ca 0.09 -0.35 -0.19 0.00 -0.27 0.00 0.00 62.75 62.03 3dra n ILE 45 Cb 0.12 0.18 0.07 0.00 -1.74 0.00 0.00 39.64 38.27 3dra n ILE 45 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dra n GLN 46 N 0.26 -6.59 -0.56 6.28 6.02 -0.40 -4.93 117.38 117.45 3dra n GLN 46 Ca 0.10 0.71 0.05 0.00 -0.01 0.00 0.00 57.00 57.84 3dra n GLN 46 Cb 0.23 -5.37 0.08 0.00 1.02 0.00 0.00 30.24 26.20 3dra n GLN 46 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3dra n LYS 47 N -4.22 0.68 -2.78 -1.09 4.76 0.01 -4.99 118.16 110.52 3dra n LYS 47 Ca -0.04 -2.08 -0.43 0.00 -2.87 0.00 0.00 58.31 52.90 3dra n LYS 47 Cb 0.57 -0.92 -0.04 0.00 -1.84 0.00 0.00 35.03 32.80 3dra n LYS 47 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3dra s PHE 48 N -1.47 2.77 -0.11 2.13 5.36 -1.17 -4.81 117.98 120.67 3dra s PHE 48 Ca 0.23 0.12 0.22 0.00 -0.96 0.00 0.00 56.93 56.54 3dra s PHE 48 Cb 0.22 -4.15 0.45 0.00 -0.34 0.00 0.00 43.02 39.20 3dra s PHE 48 CO -0.03 -1.37 1.16 1.04 -1.46 0.00 0.00 175.22 174.55 3dra n GLN 49 N 7.63 0.88 -2.07 10.12 6.02 -1.26 -4.96 117.38 133.73 3dra n GLN 49 Ca 0.04 -2.70 -0.40 0.00 -0.01 0.00 0.00 57.00 53.92 3dra n GLN 49 Cb 0.48 -0.77 -0.01 0.00 1.02 0.00 0.00 30.24 30.96 3dra n GLN 49 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3dra s PHE 50 N -1.66 2.91 0.86 1.08 0.40 -1.26 -5.01 117.98 115.30 3dra s PHE 50 Ca 0.33 1.40 -0.11 0.00 -0.60 0.00 0.00 56.93 57.95 3dra s PHE 50 Cb 0.37 -3.68 0.10 0.00 0.51 0.00 0.00 43.02 40.32 3dra s PHE 50 CO -0.11 -2.01 1.09 0.95 0.70 0.00 0.00 175.22 175.84 3dra s THR 51 N -1.21 2.84 0.30 0.64 -4.23 -1.26 -4.81 115.64 107.91 3dra s THR 51 Ca 0.53 0.27 0.02 0.00 -1.18 0.00 0.00 61.69 61.34 3dra s THR 51 Cb -0.39 -2.84 0.29 0.00 1.34 0.00 0.00 72.50 70.90 3dra s THR 51 CO 0.51 -0.35 1.87 0.78 -0.54 0.00 0.00 174.62 176.88 3dra h ASN 52 N -1.37 0.89 -0.44 3.99 2.35 -2.00 -1.33 115.58 117.68 3dra h ASN 52 Ca -0.48 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.26 3dra h ASN 52 Cb 1.28 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.48 3dra h ASN 52 CO 0.56 0.51 0.13 -0.61 -1.65 0.00 0.00 177.43 176.37 3dra h GLN 53 N 0.97 0.68 -0.69 0.81 4.15 -2.00 -2.53 115.11 116.50 3dra h GLN 53 Ca 0.45 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 59.71 3dra h GLN 53 Cb 0.42 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.98 3dra h GLN 53 CO -0.21 0.66 0.38 0.93 -1.93 0.00 0.00 178.83 178.66 3dra h GLU 54 N 0.56 0.97 -0.54 1.69 5.08 -1.78 -0.36 114.58 120.21 3dra h GLU 54 Ca 0.14 -0.11 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3dra h GLU 54 Cb 0.27 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 3dra h GLU 54 CO -0.00 0.72 0.24 -0.07 -1.00 0.00 0.00 179.01 178.90 3dra h LEU 55 N 0.95 0.32 -0.40 1.33 3.38 -1.11 0.10 115.31 119.88 3dra h LEU 55 Ca 0.24 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.13 3dra h LEU 55 Cb 0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3dra h LEU 55 CO -0.04 0.21 -0.24 0.40 0.09 0.00 0.00 178.44 178.86 3dra h ILE 56 N 0.47 1.28 -0.36 1.22 2.04 -1.29 -2.10 117.51 118.77 3dra h ILE 56 Ca 0.25 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.71 3dra h ILE 56 Cb 0.21 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 3dra h ILE 56 CO -0.20 0.47 0.22 0.22 0.00 0.00 0.00 178.15 178.85 3dra h TYR 57 N 0.67 0.48 -0.00 1.37 3.20 -0.66 -1.09 116.97 120.94 3dra h TYR 57 Ca 0.08 -0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.75 3dra h TYR 57 Cb 0.81 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 3dra h TYR 57 CO 0.06 0.35 -0.86 1.88 -1.64 0.00 0.00 178.16 177.94 3dra h TYR 58 N 0.47 0.31 -0.03 -3.82 0.05 -0.98 -2.07 116.97 110.91 3dra h TYR 58 Ca 0.13 -0.17 -0.17 0.00 0.05 0.00 0.00 58.73 58.57 3dra h TYR 58 Cb 0.01 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 3dra h TYR 58 CO -0.04 0.97 -0.73 0.07 -1.05 0.00 0.00 178.16 177.39 3dra h ARG 59 N 0.12 0.20 -0.55 4.88 0.11 -1.24 -1.97 114.38 115.93 3dra h ARG 59 Ca -0.04 -0.17 -0.01 0.00 0.10 0.00 0.00 59.98 59.86 3dra h ARG 59 Cb 1.49 0.04 -0.03 0.00 1.11 0.00 0.00 29.97 32.58 3dra h ARG 59 CO 0.13 0.84 0.32 -0.91 0.10 0.00 0.00 179.97 180.45 3dra h ASN 60 N 0.13 0.66 -0.23 0.08 2.35 -1.14 -1.75 115.58 115.67 3dra h ASN 60 Ca -0.02 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 3dra h ASN 60 Cb 1.29 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.48 3dra h ASN 60 CO 0.11 0.52 0.10 0.15 -1.65 0.00 0.00 177.43 176.67 3dra h PHE 61 N 0.76 0.35 -0.09 1.19 3.57 -0.99 0.12 116.94 121.84 3dra h PHE 61 Ca 0.20 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.68 3dra h PHE 61 Cb -0.00 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 3dra h PHE 61 CO 0.00 0.36 0.04 0.82 -2.23 0.00 0.00 178.31 177.30 3dra h ILE 62 N 0.24 0.99 0.20 1.41 1.08 -1.13 0.19 117.51 120.48 3dra h ILE 62 Ca 0.08 -0.03 -0.01 0.00 -0.39 0.00 0.00 64.86 64.51 3dra h ILE 62 Cb 0.15 0.90 0.00 0.00 -3.07 0.00 0.00 36.82 34.80 3dra h ILE 62 CO -0.01 0.02 -0.10 0.40 -0.69 0.00 0.00 178.15 177.77 3dra h ILE 63 N 0.09 0.89 -0.46 -0.67 1.08 -1.26 -0.92 117.51 116.26 3dra h ILE 63 Ca 0.04 -0.64 -0.07 0.00 -0.39 0.00 0.00 64.86 63.81 3dra h ILE 63 Cb 0.01 1.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 3dra h ILE 63 CO -0.03 0.14 0.02 0.78 -0.69 0.00 0.00 178.15 178.37 3dra h ASN 64 N -0.60 0.71 0.59 1.72 2.35 -0.74 -2.43 115.58 117.18 3dra h ASN 64 Ca -0.03 -0.16 -0.18 0.00 -0.55 0.00 0.00 56.30 55.38 3dra h ASN 64 Cb 0.44 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 3dra h ASN 64 CO 0.05 0.77 -1.55 0.00 -1.65 0.00 0.00 177.43 175.05 3dra n GLN 65 N -4.23 0.63 -0.00 0.81 1.13 0.05 -4.64 117.38 111.12 3dra n GLN 65 Ca 0.03 0.18 0.01 0.00 -1.94 0.00 0.00 57.00 55.27 3dra n GLN 65 Cb 0.28 -1.76 -0.01 0.00 0.11 0.00 0.00 30.24 28.85 3dra n GLN 65 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 3dra n PHE 66 N -2.84 0.00 -2.81 1.08 3.72 -0.35 -4.52 117.46 111.74 3dra n PHE 66 Ca -0.12 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.87 3dra n PHE 66 Cb 0.86 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 39.32 3dra n PHE 66 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 3dra s MET 67 N -2.02 4.59 -0.20 -1.08 1.75 -0.92 -0.28 119.30 121.15 3dra s MET 67 Ca -0.00 1.31 -0.07 0.00 -1.25 0.00 0.00 55.69 55.68 3dra s MET 67 Cb 0.01 -3.40 -0.04 0.00 2.84 0.00 0.00 34.83 34.24 3dra s MET 67 CO 0.06 0.14 0.05 0.42 -0.65 0.00 0.00 175.02 175.05 3dra s ILE 68 N 0.33 4.52 -0.05 10.11 1.01 0.92 -4.91 121.20 133.13 3dra s ILE 68 Ca 0.46 -0.12 -0.02 0.00 0.00 0.00 0.00 60.65 60.97 3dra s ILE 68 Cb -0.22 -3.05 0.03 0.00 0.01 0.00 0.00 42.46 39.24 3dra s ILE 68 CO 0.27 0.43 0.08 -0.70 0.00 0.00 0.00 174.94 175.02 3dra s GLU 69 N 0.73 -0.03 0.00 2.79 2.12 -1.26 -1.56 118.70 121.49 3dra s GLU 69 Ca 0.03 0.36 0.00 0.00 0.36 0.00 0.00 54.97 55.72 3dra s GLU 69 Cb -0.14 -0.36 0.00 0.00 0.26 0.00 0.00 34.13 33.89 3dra s GLU 69 CO 0.02 -0.27 0.00 0.27 -0.54 0.00 0.00 175.26 174.74 3dra n ASN 70 N 4.90 0.17 0.28 -1.70 0.23 -0.74 -5.02 115.26 113.37 3dra n ASN 70 Ca -0.12 -0.42 0.17 0.00 -0.53 0.00 0.00 54.58 53.67 3dra n ASN 70 Cb 0.50 0.00 0.69 0.00 -2.08 0.00 0.00 39.78 38.89 3dra n ASN 70 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 3dra h ASN 71 N 0.00 0.00 0.00 0.53 2.35 -2.04 -3.32 115.58 113.10 3dra h ASN 71 Ca 0.00 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.39 3dra h ASN 71 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 3dra h ASN 71 CO 0.00 0.02 -2.30 0.00 -1.65 0.00 0.00 177.43 173.50 3dra n GLN 72 N -3.13 0.54 -4.16 0.81 6.02 -1.26 -5.07 117.38 111.12 3dra n GLN 72 Ca 0.00 0.17 -0.10 0.00 -0.01 0.00 0.00 57.00 57.06 3dra n GLN 72 Cb 0.31 -1.41 -0.10 0.00 1.02 0.00 0.00 30.24 30.06 3dra n GLN 72 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3dra s ILE 73 N -2.44 0.66 -0.02 5.09 -4.36 -1.25 -4.68 121.20 114.19 3dra s ILE 73 Ca -0.32 -1.92 0.08 0.00 -0.26 0.00 0.00 60.65 58.23 3dra s ILE 73 Cb 0.10 -1.66 -0.02 0.00 1.25 0.00 0.00 42.46 42.13 3dra s ILE 73 CO 0.48 -0.88 -0.26 -0.63 0.24 0.00 0.00 174.94 173.89 3dra s ILE 74 N -3.63 2.04 0.21 8.37 1.01 -1.04 -1.80 121.20 126.38 3dra s ILE 74 Ca 0.11 -1.10 -0.07 0.00 0.00 0.00 0.00 60.65 59.59 3dra s ILE 74 Cb 0.05 -1.70 0.03 0.00 0.01 0.00 0.00 42.46 40.85 3dra s ILE 74 CO -0.05 0.58 0.41 -0.24 0.00 0.00 0.00 174.94 175.64 3dra n SER 75 N 2.51 -1.19 -4.19 3.58 2.88 -0.60 -4.40 113.62 112.22 3dra n SER 75 Ca -0.16 -1.88 -0.23 0.00 -1.33 0.00 0.00 58.87 55.26 3dra n SER 75 Cb 0.51 2.00 -0.14 0.00 -0.75 0.00 0.00 64.21 65.83 3dra n SER 75 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3dra s PHE 76 N -5.14 1.53 0.49 0.66 0.08 -1.26 -0.06 117.98 114.29 3dra s PHE 76 Ca 0.09 -0.34 -0.13 0.00 0.12 0.00 0.00 56.93 56.68 3dra s PHE 76 Cb -0.02 -0.93 -0.06 0.00 -0.57 0.00 0.00 43.02 41.43 3dra s PHE 76 CO 0.07 0.04 0.91 -0.98 -0.10 0.00 0.00 175.22 175.16 3dra s ARG 77 N -0.91 3.80 0.19 0.44 1.70 0.62 -2.00 118.95 122.79 3dra s ARG 77 Ca 0.05 0.71 0.06 0.00 -0.47 0.00 0.00 55.73 56.08 3dra s ARG 77 Cb -0.08 -2.23 0.07 0.00 -0.57 0.00 0.00 34.95 32.15 3dra s ARG 77 CO 0.01 -0.24 1.44 0.66 -1.08 0.00 0.00 175.30 176.09 3dra h SER 78 N 0.77 0.12 -3.25 -2.89 4.64 -1.89 -3.45 113.55 107.60 3dra h SER 78 Ca -0.46 -0.09 -0.45 0.00 -0.47 0.00 0.00 61.79 60.31 3dra h SER 78 Cb 1.19 -0.04 -0.39 0.00 -0.31 0.00 0.00 62.40 62.85 3dra h SER 78 CO 0.62 0.88 -0.76 -0.89 -0.87 0.00 0.00 176.83 175.81 3dra s THR 79 N -3.25 0.36 0.36 2.95 2.01 -1.26 -4.31 115.64 112.49 3dra s THR 79 Ca -0.02 -0.03 0.05 0.00 0.31 0.00 0.00 61.69 62.00 3dra s THR 79 Cb 0.11 -0.63 0.20 0.00 0.01 0.00 0.00 72.50 72.19 3dra s THR 79 CO 0.80 0.12 1.94 1.12 -0.69 0.00 0.00 174.62 177.91 3dra h HIS 80 N 8.32 0.58 0.00 4.92 -0.00 -1.87 -2.49 115.15 124.60 3dra h HIS 80 Ca -0.18 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.16 3dra h HIS 80 Cb 1.12 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 28.36 3dra h HIS 80 CO 0.41 0.48 0.00 2.48 -0.00 0.00 0.00 177.93 181.30 3dra n TYR 81 N -4.35 0.00 0.56 6.12 4.11 -1.26 -1.87 117.16 120.47 3dra n TYR 81 Ca 0.03 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.99 3dra n TYR 81 Cb 0.17 -0.44 0.32 0.00 -0.00 0.00 0.00 39.34 39.40 3dra n TYR 81 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.86 178.05 3dra n PHE 82 N -1.44 0.00 0.33 -3.48 3.72 -0.94 -2.15 117.46 113.51 3dra n PHE 82 Ca 0.06 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.61 3dra n PHE 82 Cb 0.21 -0.42 0.62 0.00 -0.94 0.00 0.00 39.48 38.96 3dra n PHE 82 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3dra h GLN 83 N 0.00 0.00 -0.42 -1.08 3.07 -1.59 -2.70 115.11 112.40 3dra h GLN 83 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3dra h GLN 83 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.76 3dra h GLN 83 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 178.83 180.55 3dra n LYS 84 N -2.63 1.57 0.00 0.06 5.02 -0.91 -4.65 118.16 116.62 3dra n LYS 84 Ca 0.01 -0.66 0.00 0.00 -2.02 0.00 0.00 58.31 55.64 3dra n LYS 84 Cb 0.23 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 3dra n LYS 84 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3dra n THR 85 N 0.05 0.00 -3.65 -0.18 -2.24 -1.02 -5.16 114.28 102.08 3dra n THR 85 Ca 0.06 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 3dra n THR 85 Cb 0.25 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.49 3dra n THR 85 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3dra n ASN 86 N 0.00 -1.42 0.10 3.42 0.23 -1.26 -5.03 115.26 111.30 3dra n ASN 86 Ca 0.00 -2.17 0.04 0.00 -0.53 0.00 0.00 54.58 51.92 3dra n ASN 86 Cb 0.00 2.42 0.45 0.00 -2.08 0.00 0.00 39.78 40.57 3dra n ASN 86 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 3dra h GLN 87 N 0.00 0.32 -0.43 -3.83 4.15 -1.97 -0.95 115.11 112.40 3dra h GLN 87 Ca -0.22 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.06 3dra h GLN 87 Cb 0.85 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.47 3dra h GLN 87 CO 0.29 0.30 -0.12 0.87 -1.93 0.00 0.00 178.83 178.24 3dra h LYS 88 N 0.32 0.77 -0.17 1.69 1.57 -1.96 -3.27 116.57 115.52 3dra h LYS 88 Ca 0.08 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3dra h LYS 88 Cb 0.13 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3dra h LYS 88 CO -0.00 0.86 0.00 0.66 -0.57 0.00 0.00 179.45 180.40 3dra n TYR 89 N -4.16 0.24 -3.34 -1.35 4.01 -1.00 -4.16 117.16 107.40 3dra n TYR 89 Ca 0.01 -0.52 -0.43 0.00 -0.16 0.00 0.00 57.90 56.80 3dra n TYR 89 Cb 0.37 -0.05 -0.01 0.00 -0.31 0.00 0.00 39.34 39.34 3dra n TYR 89 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3dra n ASP 90 N -0.05 5.43 -4.77 7.72 2.03 -0.40 -4.83 116.55 121.69 3dra n ASP 90 Ca 0.06 -3.10 -0.39 0.00 0.52 0.00 0.00 54.79 51.88 3dra n ASP 90 Cb 0.36 -1.32 -0.06 0.00 -0.72 0.00 0.00 41.12 39.38 3dra n ASP 90 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3dra s PRO 92 N -1.22 3.87 -0.05 0.00 0.04 -1.25 -4.54 135.00 131.84 3dra s PRO 92 Ca 0.38 1.01 -0.02 0.00 0.04 0.00 0.00 61.00 62.42 3dra s PRO 92 Cb -0.24 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.21 3dra s PRO 92 CO 0.28 -0.34 0.03 1.21 0.04 0.00 0.00 177.00 178.22 3dra s ASN 93 N -2.95 1.24 0.09 6.66 3.84 -0.85 -2.97 114.94 120.00 3dra s ASN 93 Ca 0.60 0.01 -0.21 0.00 0.21 0.00 0.00 52.86 53.47 3dra s ASN 93 Cb -0.11 -0.26 -0.10 0.00 -0.55 0.00 0.00 41.25 40.23 3dra s ASN 93 CO 0.31 -0.22 1.67 0.25 -2.79 0.00 0.00 177.10 176.32 3dra h LEU 94 N 8.29 0.19 -1.09 3.21 6.46 -1.34 -2.17 115.31 128.87 3dra h LEU 94 Ca -0.18 -0.11 -0.03 0.00 -0.12 0.00 0.00 57.88 57.45 3dra h LEU 94 Cb 1.12 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.97 3dra h LEU 94 CO 0.22 0.25 0.28 0.77 -0.62 0.00 0.00 178.44 179.34 3dra h SER 95 N 0.13 0.84 -0.52 1.25 4.64 -1.95 -1.74 113.55 116.19 3dra h SER 95 Ca 0.05 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 3dra h SER 95 Cb 0.10 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.95 3dra h SER 95 CO -0.01 0.73 0.31 0.28 -0.87 0.00 0.00 176.83 177.27 3dra h SER 96 N 0.92 0.66 -0.41 4.97 0.02 -1.80 -1.54 113.55 116.36 3dra h SER 96 Ca 0.22 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.08 3dra h SER 96 Cb 0.14 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3dra h SER 96 CO -0.02 0.53 0.05 0.74 -1.14 0.00 0.00 176.83 176.99 3dra h THR 97 N 0.75 1.25 0.62 -2.27 2.02 -0.68 0.92 112.91 115.52 3dra h THR 97 Ca 0.19 -0.90 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 3dra h THR 97 Cb 0.01 1.03 0.01 0.00 -1.74 0.00 0.00 68.15 67.46 3dra h THR 97 CO -0.03 0.31 -0.30 0.25 0.37 0.00 0.00 175.52 176.12 3dra h LEU 98 N 0.54 -0.71 -1.36 2.58 7.12 -1.04 -1.60 115.31 120.85 3dra h LEU 98 Ca 0.12 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 58.15 3dra h LEU 98 Cb 0.39 0.18 -0.03 0.00 -0.53 0.00 0.00 40.66 40.68 3dra h LEU 98 CO 0.01 -0.50 0.27 -0.26 -0.13 0.00 0.00 178.44 177.83 3dra h PHE 99 N -0.84 0.69 -0.48 1.25 0.04 -1.24 -1.17 116.94 115.20 3dra h PHE 99 Ca -0.09 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.69 3dra h PHE 99 Cb 0.64 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 3dra h PHE 99 CO -0.03 0.49 0.30 0.00 -0.60 0.00 0.00 178.31 178.47 3dra h ALA 100 N 1.59 0.61 -0.60 2.45 0.00 -0.66 -1.53 119.26 121.13 3dra h ALA 100 Ca 0.18 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3dra h ALA 100 Cb 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3dra h ALA 100 CO -0.03 0.01 0.12 -0.07 0.00 0.00 0.00 179.25 179.28 3dra h LEU 101 N 0.60 0.93 -1.11 0.00 3.38 -0.54 -0.39 115.31 118.19 3dra h LEU 101 Ca 0.19 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.94 3dra h LEU 101 Cb -0.02 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 3dra h LEU 101 CO -0.07 0.94 0.60 1.88 0.09 0.00 0.00 178.44 181.89 3dra h TYR 102 N 0.88 1.12 -0.33 1.13 0.05 -0.96 -1.41 116.97 117.45 3dra h TYR 102 Ca 0.18 0.03 -0.13 0.00 0.05 0.00 0.00 58.73 58.86 3dra h TYR 102 Cb 0.39 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.75 3dra h TYR 102 CO 0.03 0.67 -0.31 -0.91 -1.05 0.00 0.00 178.16 176.59 3dra h ASN 103 N 1.17 0.84 -0.77 3.88 2.35 -0.76 -2.22 115.58 120.07 3dra h ASN 103 Ca 0.36 -0.46 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 3dra h ASN 103 Cb -0.03 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.07 3dra h ASN 103 CO -0.10 1.13 0.45 -0.07 -1.65 0.00 0.00 177.43 177.19 3dra h LEU 104 N 0.56 0.94 -0.03 1.61 3.38 -0.81 -1.27 115.31 119.70 3dra h LEU 104 Ca 0.05 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dra h LEU 104 Cb 0.89 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3dra h LEU 104 CO 0.08 0.74 0.01 0.25 0.09 0.00 0.00 178.44 179.61 3dra h LEU 105 N 1.06 0.01 -1.29 1.67 5.85 -1.22 0.87 115.31 122.27 3dra h LEU 105 Ca 0.27 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 3dra h LEU 105 Cb -0.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 3dra h LEU 105 CO -0.05 0.01 -0.35 -0.29 -0.34 0.00 0.00 178.44 177.42 3dra h ILE 106 N 0.02 1.18 -0.25 4.05 2.10 -1.17 -1.97 117.51 121.48 3dra h ILE 106 Ca 0.01 -1.23 0.00 0.00 1.08 0.00 0.00 64.86 64.72 3dra h ILE 106 Cb 0.00 1.68 0.00 0.00 -1.09 0.00 0.00 36.82 37.41 3dra h ILE 106 CO -0.01 0.35 0.00 0.18 -1.08 0.00 0.00 178.15 177.58 3dra n LEU 107 N -4.02 2.00 -2.56 2.19 4.77 -0.50 -4.91 117.00 113.97 3dra n LEU 107 Ca -0.02 -1.01 -0.21 0.00 -0.03 0.00 0.00 56.01 54.74 3dra n LEU 107 Cb 0.40 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 3dra n LEU 107 CO 0.38 0.38 -0.16 0.29 -1.33 0.00 0.00 177.39 176.95 3dra n LYS 108 N 0.28 -2.86 -2.29 3.23 5.02 -0.74 -4.73 118.16 116.07 3dra n LYS 108 Ca 0.10 0.95 -0.42 0.00 -2.02 0.00 0.00 58.31 56.92 3dra n LYS 108 Cb 0.38 -5.66 -0.03 0.00 -0.02 0.00 0.00 35.03 29.71 3dra n LYS 108 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3dra s SER 109 N -2.33 6.94 -1.43 4.39 0.15 0.25 -4.93 113.70 116.75 3dra s SER 109 Ca 0.11 2.12 -0.12 0.00 0.70 0.00 0.00 55.95 58.77 3dra s SER 109 Cb -0.05 -2.57 0.06 0.00 -1.71 0.00 0.00 66.02 61.75 3dra s SER 109 CO 0.14 -0.60 2.24 -0.81 1.20 0.00 0.00 173.24 175.41 3dra n PRO 110 N 4.44 3.27 0.02 5.44 -0.04 -1.26 -4.65 135.00 142.22 3dra n PRO 110 Ca 0.11 -2.85 0.07 0.00 -0.04 0.00 0.00 63.50 60.79 3dra n PRO 110 Cb 0.44 -3.09 0.29 0.00 -0.04 0.00 0.00 33.50 31.10 3dra n PRO 110 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3dra n TYR 111 N 4.92 0.13 0.26 0.54 0.18 -1.26 -1.26 117.16 120.68 3dra n TYR 111 Ca 0.53 0.05 0.15 0.00 1.88 0.00 0.00 57.90 60.51 3dra n TYR 111 Cb 0.35 -0.59 0.74 0.00 -0.38 0.00 0.00 39.34 39.46 3dra n TYR 111 CO 0.00 0.00 0.00 1.12 -2.08 0.00 0.00 176.86 175.90 3dra h HIS 112 N 0.00 0.00 -0.02 -3.48 2.07 -1.87 0.17 115.15 112.02 3dra h HIS 112 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3dra h HIS 112 Cb 0.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.20 3dra h HIS 112 CO 0.00 0.00 -0.16 0.25 -3.07 0.00 0.00 177.93 174.95 3dra n THR 113 N -2.54 0.00 0.00 6.12 -2.24 -0.39 -4.30 114.28 110.93 3dra n THR 113 Ca -0.01 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3dra n THR 113 Cb 0.11 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 3dra n THR 113 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3dra n ILE 114 N 0.38 0.00 -3.94 2.28 5.41 -0.62 -5.01 119.36 117.85 3dra n ILE 114 Ca 0.14 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.54 3dra n ILE 114 Cb 0.46 0.10 -0.14 0.00 -0.71 0.00 0.00 39.64 39.35 3dra n ILE 114 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3dra s ILE 115 N -1.25 2.81 -0.24 1.39 1.01 0.49 -5.07 121.20 120.34 3dra s ILE 115 Ca 0.00 -1.46 -0.29 0.00 0.00 0.00 0.00 60.65 58.90 3dra s ILE 115 Cb 0.00 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3dra s ILE 115 CO 0.00 -0.11 1.63 0.21 0.00 0.00 0.00 174.94 176.67 3dra s ASN 116 N 1.23 6.32 0.40 3.58 3.84 -1.26 -4.72 114.94 124.33 3dra s ASN 116 Ca -0.06 1.55 0.20 0.00 0.21 0.00 0.00 52.86 54.76 3dra s ASN 116 Cb -0.20 -2.53 0.79 0.00 -0.55 0.00 0.00 41.25 38.76 3dra s ASN 116 CO -0.02 -1.32 1.78 0.08 -2.79 0.00 0.00 177.10 174.83 3dra h ARG 117 N 10.97 0.00 -0.78 0.43 0.11 -1.96 -1.85 114.38 121.31 3dra h ARG 117 Ca -0.33 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.75 3dra h ARG 117 Cb 1.15 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.19 3dra h ARG 117 CO 1.01 0.32 0.48 -0.22 0.10 0.00 0.00 179.97 181.66 3dra h LYS 118 N 0.00 1.04 -0.01 0.08 3.64 -1.98 0.55 116.57 119.90 3dra h LYS 118 Ca -0.00 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 59.14 3dra h LYS 118 Cb 0.81 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 3dra h LYS 118 CO 0.04 0.72 -0.69 0.87 -2.27 0.00 0.00 179.45 178.12 3dra h LYS 119 N 1.07 0.03 -0.11 1.90 1.57 -1.64 -0.78 116.57 118.61 3dra h LYS 119 Ca 0.28 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 3dra h LYS 119 Cb -0.06 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 3dra h LYS 119 CO -0.05 0.71 -0.10 0.82 -0.57 0.00 0.00 179.45 180.26 3dra h ILE 120 N 0.02 1.35 -0.44 1.86 1.08 -1.11 -2.43 117.51 117.85 3dra h ILE 120 Ca -0.01 -1.24 -0.03 0.00 -0.39 0.00 0.00 64.86 63.18 3dra h ILE 120 Cb 1.23 1.93 -0.02 0.00 -3.07 0.00 0.00 36.82 36.89 3dra h ILE 120 CO 0.09 0.36 0.13 0.24 -0.69 0.00 0.00 178.15 178.28 3dra h MET 121 N -0.13 0.64 -0.71 2.37 2.86 -0.85 -1.04 114.93 118.07 3dra h MET 121 Ca 0.02 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.51 3dra h MET 121 Cb 0.62 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 3dra h MET 121 CO 0.03 0.56 0.28 -0.97 1.06 0.00 0.00 176.91 177.87 3dra h ASN 122 N 0.63 0.99 -0.04 1.22 -1.24 -1.10 0.99 115.58 117.02 3dra h ASN 122 Ca 0.15 -0.17 0.03 0.00 0.71 0.00 0.00 56.30 57.01 3dra h ASN 122 Cb 0.20 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.96 3dra h ASN 122 CO -0.01 0.89 -0.12 0.15 -1.29 0.00 0.00 177.43 177.06 3dra h PHE 123 N 1.02 -0.29 -0.29 0.67 3.57 -0.90 -1.73 116.94 118.99 3dra h PHE 123 Ca 0.24 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.76 3dra h PHE 123 Cb 0.21 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 3dra h PHE 123 CO 0.02 -0.18 0.16 -0.07 -2.23 0.00 0.00 178.31 176.01 3dra h LEU 124 N -0.18 0.26 -0.64 0.59 3.38 -0.85 -2.23 115.31 115.65 3dra h LEU 124 Ca 0.06 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.15 3dra h LEU 124 Cb 0.25 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.86 3dra h LEU 124 CO -0.15 0.19 0.15 0.00 0.09 0.00 0.00 178.44 178.72 3dra h LYS 126 N 0.27 0.00 -0.00 0.00 1.57 -0.73 -1.72 116.57 115.96 3dra h LYS 126 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 3dra h LYS 126 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3dra h LYS 126 CO -0.42 0.00 -0.46 0.00 -0.57 0.00 0.00 179.45 177.99 3dra s GLN 128 N -2.94 4.30 0.08 0.00 0.74 -0.65 -0.83 119.66 120.36 3dra s GLN 128 Ca 0.13 0.75 -0.31 0.00 0.05 0.00 0.00 55.36 55.97 3dra s GLN 128 Cb 0.18 -3.53 -0.07 0.00 1.10 0.00 0.00 33.01 30.68 3dra s GLN 128 CO 0.68 -0.14 1.46 0.08 -0.55 0.00 0.00 175.29 176.81 3dra s VAL 129 N 1.53 3.31 -0.13 1.34 1.01 0.23 -4.92 120.40 122.77 3dra s VAL 129 Ca 0.33 0.86 0.18 0.00 0.00 0.00 0.00 61.98 63.34 3dra s VAL 129 Cb -0.16 -3.55 -0.13 0.00 0.00 0.00 0.00 36.38 32.54 3dra s VAL 129 CO 0.13 0.03 0.82 0.29 0.00 0.00 0.00 175.10 176.38 3dra n LYS 130 N 4.65 0.62 -3.88 2.72 4.76 -1.26 -0.79 118.16 124.98 3dra n LYS 130 Ca 0.13 0.20 -0.09 0.00 -2.87 0.00 0.00 58.31 55.67 3dra n LYS 130 Cb 0.42 -1.80 -0.06 0.00 -1.84 0.00 0.00 35.03 31.75 3dra n LYS 130 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3dra s ASP 131 N -5.70 -0.00 0.00 4.39 1.01 -1.26 -4.82 116.67 110.29 3dra s ASP 131 Ca -0.03 -0.73 0.00 0.00 0.71 0.00 0.00 52.55 52.50 3dra s ASP 131 Cb 0.09 0.44 0.00 0.00 1.01 0.00 0.00 42.92 44.45 3dra s ASP 131 CO 0.81 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 175.93 3dra n GLY 132 N -0.20 -1.80 0.25 0.21 0.00 -1.26 -3.74 105.19 98.64 3dra n GLY 132 Ca -0.10 -1.77 0.13 0.00 0.00 0.00 0.00 46.02 44.27 3dra n GLY 132 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3dra h ILE 133 N 0.00 0.38 -0.71 -0.61 6.09 -2.02 -2.32 117.51 118.31 3dra h ILE 133 Ca 0.00 -0.84 0.00 0.00 -1.37 0.00 0.00 64.86 62.65 3dra h ILE 133 Cb 0.00 1.62 0.00 0.00 0.47 0.00 0.00 36.82 38.91 3dra h ILE 133 CO 0.00 0.14 0.00 0.59 -3.07 0.00 0.00 178.15 175.81 3dra n ASN 134 N -3.33 4.18 -4.61 2.19 3.02 -1.26 -4.99 115.26 110.46 3dra n ASN 134 Ca -0.00 -2.12 -0.60 0.00 -0.03 0.00 0.00 54.58 51.83 3dra n ASN 134 Cb 0.36 -0.51 -0.08 0.00 -0.61 0.00 0.00 39.78 38.94 3dra n ASN 134 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3dra n LYS 135 N 1.50 0.40 0.00 3.52 4.81 -0.88 -1.86 118.16 125.65 3dra n LYS 135 Ca 0.25 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 3dra n LYS 135 Cb 0.70 -1.70 0.00 0.00 0.02 0.00 0.00 35.03 34.04 3dra n LYS 135 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dra n GLY 136 N 2.74 3.13 3.80 3.14 0.00 0.03 -4.39 105.19 113.63 3dra n GLY 136 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 3dra n GLY 136 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dra s GLY 137 N -2.93 1.64 -0.04 -0.02 0.00 -0.78 -4.01 107.32 101.18 3dra s GLY 137 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 44.72 43.95 3dra s GLY 137 CO 0.00 -0.14 -0.23 -1.36 0.00 0.00 0.00 173.10 171.37 3dra s PHE 138 N -3.43 2.15 0.38 1.90 0.08 -1.26 -0.60 117.98 117.21 3dra s PHE 138 Ca 0.68 -0.57 -0.09 0.00 0.12 0.00 0.00 56.93 57.08 3dra s PHE 138 Cb -0.10 -1.41 -0.06 0.00 -0.57 0.00 0.00 43.02 40.88 3dra s PHE 138 CO 0.53 -0.15 0.72 0.14 -0.10 0.00 0.00 175.22 176.37 3dra s VAL 139 N -0.23 4.85 -0.51 -0.44 -7.23 -0.01 -3.20 120.40 113.63 3dra s VAL 139 Ca 0.00 0.46 0.24 0.00 -1.81 0.00 0.00 61.98 60.87 3dra s VAL 139 Cb -0.12 -3.74 0.33 0.00 0.56 0.00 0.00 36.38 33.41 3dra s VAL 139 CO 0.02 -0.50 1.66 1.55 -0.31 0.00 0.00 175.10 177.52 3dra h PRO 140 N 1.28 0.00 -3.44 4.82 0.13 -1.79 -3.45 132.00 129.55 3dra h PRO 140 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 3dra h PRO 140 Cb 1.19 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.21 3dra h PRO 140 CO 0.64 0.00 -0.07 -0.08 -0.23 0.00 0.00 178.00 178.26 3dra s THR 141 N -3.19 0.05 0.12 1.56 -1.32 -1.20 -0.95 115.64 110.70 3dra s THR 141 Ca 0.08 -0.84 0.06 0.00 -1.21 0.00 0.00 61.69 59.77 3dra s THR 141 Cb 0.07 -1.51 -0.04 0.00 -1.51 0.00 0.00 72.50 69.51 3dra s THR 141 CO 0.65 -0.22 -0.13 -0.76 -2.21 0.00 0.00 174.62 171.95 3dra s LEU 142 N -2.87 2.41 0.03 9.08 1.43 -1.16 -2.12 118.68 125.48 3dra s LEU 142 Ca 0.09 -0.82 0.05 0.00 -1.03 0.00 0.00 54.13 52.42 3dra s LEU 142 Cb 0.01 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.70 3dra s LEU 142 CO -0.05 -0.17 -0.14 -0.72 0.23 0.00 0.00 176.35 175.50 3dra s TYR 143 N -2.22 1.27 -0.04 0.29 -0.85 -0.46 -3.90 117.35 111.44 3dra s TYR 143 Ca 0.09 -0.33 -0.29 0.00 -0.52 0.00 0.00 57.07 56.02 3dra s TYR 143 Cb -0.04 -0.77 -0.03 0.00 0.38 0.00 0.00 41.96 41.50 3dra s TYR 143 CO 0.03 0.03 0.94 -0.47 -1.52 0.00 0.00 175.55 174.55 3dra s TYR 144 N -0.73 3.61 -0.48 -3.49 5.04 -1.26 -0.44 117.35 119.60 3dra s TYR 144 Ca 0.03 1.60 -0.13 0.00 -2.44 0.00 0.00 57.07 56.13 3dra s TYR 144 Cb -0.07 -3.09 0.10 0.00 0.35 0.00 0.00 41.96 39.25 3dra s TYR 144 CO 0.01 -0.05 0.38 1.21 -1.34 0.00 0.00 175.55 175.77 3dra s ASN 145 N 1.00 5.93 0.27 4.32 2.47 0.31 -4.74 114.94 124.51 3dra s ASN 145 Ca 0.49 -1.66 -0.02 0.00 0.42 0.00 0.00 52.86 52.09 3dra s ASN 145 Cb -0.20 -2.10 0.38 0.00 -1.45 0.00 0.00 41.25 37.87 3dra s ASN 145 CO 0.24 -0.70 1.83 -0.08 -3.72 0.00 0.00 177.10 174.67 3dra h GLU 146 N 8.64 0.89 -0.79 0.43 4.81 -1.95 -0.23 114.58 126.38 3dra h GLU 146 Ca -0.26 -0.17 0.16 0.00 -0.13 0.00 0.00 59.36 58.96 3dra h GLU 146 Cb 1.09 -0.14 -0.10 0.00 0.63 0.00 0.00 28.75 30.23 3dra h GLU 146 CO 0.90 0.77 0.32 1.49 -0.73 0.00 0.00 179.01 181.76 3dra h GLU 147 N 0.86 0.43 -0.01 1.92 4.81 -1.95 -2.79 114.58 117.85 3dra h GLU 147 Ca 0.19 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3dra h GLU 147 Cb 0.26 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3dra h GLU 147 CO -0.01 0.28 -0.10 0.09 -0.73 0.00 0.00 179.01 178.55 3dra n ASN 148 N -5.01 1.66 -2.51 1.04 3.02 -1.06 -5.00 115.26 107.40 3dra n ASN 148 Ca 0.16 -1.33 -0.16 0.00 -0.03 0.00 0.00 54.58 53.22 3dra n ASN 148 Cb 0.46 0.21 0.05 0.00 -0.61 0.00 0.00 39.78 39.88 3dra n ASN 148 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dra n GLY 149 N 0.77 -0.08 3.29 7.41 0.00 -0.12 -5.00 105.19 111.46 3dra n GLY 149 Ca 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 3dra n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dra s ASP 150 N -3.14 0.10 -0.02 1.61 -1.08 -1.10 -4.99 116.67 108.05 3dra s ASP 150 Ca 0.36 -0.93 -0.14 0.00 -0.52 0.00 0.00 52.55 51.32 3dra s ASP 150 Cb -0.16 0.40 -0.05 0.00 -1.46 0.00 0.00 42.92 41.65 3dra s ASP 150 CO 0.45 -0.85 0.39 -0.31 0.52 0.00 0.00 175.17 175.37 3dra s TYR 151 N -3.98 3.71 0.26 -5.34 2.02 -1.26 -0.53 117.35 112.23 3dra s TYR 151 Ca 0.18 0.96 0.09 0.00 -0.37 0.00 0.00 57.07 57.93 3dra s TYR 151 Cb 0.04 -2.28 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 3dra s TYR 151 CO -0.00 0.62 0.03 0.15 -1.57 0.00 0.00 175.55 174.77 3dra s LYS 152 N -0.95 2.40 0.19 -0.62 1.02 0.41 -4.90 119.74 117.29 3dra s LYS 152 Ca 0.23 -1.35 -0.14 0.00 0.02 0.00 0.00 55.97 54.73 3dra s LYS 152 Cb -0.16 -2.23 -0.07 0.00 -0.52 0.00 0.00 37.83 34.84 3dra s LYS 152 CO 0.12 0.37 0.60 -0.65 -0.92 0.00 0.00 175.35 174.87 3dra s GLN 153 N -3.68 3.99 -0.11 1.68 -0.21 -1.26 -1.35 119.66 118.72 3dra s GLN 153 Ca 0.31 0.52 -0.10 0.00 0.02 0.00 0.00 55.36 56.12 3dra s GLN 153 Cb -0.07 -2.81 0.03 0.00 1.00 0.00 0.00 33.01 31.16 3dra s GLN 153 CO 0.21 0.40 0.29 -0.47 -2.12 0.00 0.00 175.29 173.59 3dra s TYR 154 N -1.60 -0.32 0.00 0.91 5.04 -0.90 -4.88 117.35 115.60 3dra s TYR 154 Ca 0.42 0.78 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 3dra s TYR 154 Cb -0.14 0.11 0.00 0.00 0.35 0.00 0.00 41.96 42.28 3dra s TYR 154 CO 0.20 -0.16 0.00 0.41 -1.34 0.00 0.00 175.55 174.66 3dra n GLY 155 N 3.01 1.97 3.70 8.97 0.00 -1.26 -3.25 105.19 118.33 3dra n GLY 155 Ca -0.14 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 3dra n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dra s GLU 156 N -2.74 4.43 0.23 1.61 0.41 -1.26 -4.71 118.70 116.66 3dra s GLU 156 Ca 0.00 1.62 -0.30 0.00 -0.41 0.00 0.00 54.97 55.88 3dra s GLU 156 Cb 0.00 -3.47 -0.09 0.00 -1.78 0.00 0.00 34.13 28.79 3dra s GLU 156 CO 0.00 -0.29 1.28 -1.25 -0.49 0.00 0.00 175.26 174.52 3dra s PRO 157 N 1.57 4.41 0.21 0.39 0.04 -1.26 -4.48 135.00 135.88 3dra s PRO 157 Ca 0.55 2.05 -0.16 0.00 0.04 0.00 0.00 61.00 63.48 3dra s PRO 157 Cb -0.25 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.14 3dra s PRO 157 CO 0.25 -0.19 0.51 0.16 0.04 0.00 0.00 177.00 177.78 3dra s ASP 158 N 0.05 -0.19 0.42 6.66 1.47 -1.19 -4.91 116.67 118.98 3dra s ASP 158 Ca 0.54 -0.64 0.11 0.00 1.18 0.00 0.00 52.55 53.74 3dra s ASP 158 Cb -0.36 0.58 0.96 0.00 -0.34 0.00 0.00 42.92 43.76 3dra s ASP 158 CO 0.41 -1.09 2.01 -0.07 0.68 0.00 0.00 175.17 177.11 3dra h LEU 159 N 2.22 0.41 -0.38 2.11 3.38 -1.89 -1.73 115.31 119.44 3dra h LEU 159 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3dra h LEU 159 Cb 1.25 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3dra h LEU 159 CO 0.36 0.27 0.25 0.03 0.09 0.00 0.00 178.44 179.45 3dra h ARG 160 N 0.47 0.50 -0.38 1.13 3.08 -1.93 -1.86 114.38 115.39 3dra h ARG 160 Ca 0.23 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 3dra h ARG 160 Cb 0.29 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3dra h ARG 160 CO -0.06 0.33 -0.23 0.28 -1.07 0.00 0.00 179.97 179.22 3dra h VAL 161 N 0.52 1.27 -0.45 2.04 2.07 -1.66 -2.01 116.25 118.03 3dra h VAL 161 Ca 0.14 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.33 3dra h VAL 161 Cb -0.06 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3dra h VAL 161 CO -0.03 0.45 0.28 0.00 0.02 0.00 0.00 177.57 178.29 3dra h TYR 163 N 0.58 0.68 -0.34 0.00 3.20 -1.17 -1.03 116.97 118.89 3dra h TYR 163 Ca 0.17 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 3dra h TYR 163 Cb -0.03 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 3dra h TYR 163 CO -0.06 0.56 -0.13 0.52 -1.64 0.00 0.00 178.16 177.41 3dra h MET 164 N 0.61 0.59 -0.41 1.82 2.86 -1.03 -1.18 114.93 118.18 3dra h MET 164 Ca 0.16 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3dra h MET 164 Cb 0.14 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 3dra h MET 164 CO -0.02 0.70 0.23 0.00 1.06 0.00 0.00 176.91 178.88 3dra h ALA 165 N 1.33 0.52 -0.74 6.32 0.00 -0.36 -0.76 119.26 125.58 3dra h ALA 165 Ca 0.10 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3dra h ALA 165 Cb 0.53 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3dra h ALA 165 CO 0.03 0.04 0.36 -0.07 0.00 0.00 0.00 179.25 179.61 3dra h LEU 166 N 0.53 0.96 -0.13 0.00 3.38 -0.88 -1.15 115.31 118.02 3dra h LEU 166 Ca 0.14 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3dra h LEU 166 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3dra h LEU 166 CO -0.02 0.81 0.06 -0.07 0.09 0.00 0.00 178.44 179.31 3dra h LEU 167 N 1.05 0.18 -0.57 1.67 3.38 -0.95 -0.03 115.31 120.04 3dra h LEU 167 Ca 0.26 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.12 3dra h LEU 167 Cb 0.11 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3dra h LEU 167 CO -0.03 0.28 0.32 0.40 0.09 0.00 0.00 178.44 179.49 3dra h ILE 168 N 0.08 1.00 -0.66 1.22 2.04 -0.94 0.23 117.51 120.48 3dra h ILE 168 Ca 0.05 -0.21 0.05 0.00 1.00 0.00 0.00 64.86 65.75 3dra h ILE 168 Cb 0.15 0.33 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 3dra h ILE 168 CO -0.00 0.11 0.37 -0.09 0.00 0.00 0.00 178.15 178.54 3dra h ARG 169 N 0.61 0.68 -0.67 2.37 2.43 -1.09 -0.87 114.38 117.85 3dra h ARG 169 Ca 0.25 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 3dra h ARG 169 Cb 0.11 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3dra h ARG 169 CO -0.14 0.45 0.29 1.25 -1.51 0.00 0.00 179.97 180.31 3dra h HIS 170 N 0.70 0.99 0.00 2.20 2.76 -0.06 -2.16 115.15 119.58 3dra h HIS 170 Ca 0.29 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 3dra h HIS 170 Cb 0.14 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.80 3dra h HIS 170 CO -0.07 0.76 0.00 1.28 -1.30 0.00 0.00 177.93 178.59 3dra n LEU 171 N -4.43 0.67 -0.76 0.26 4.77 0.73 -0.91 117.00 117.32 3dra n LEU 171 Ca 0.05 0.69 0.09 0.00 -0.03 0.00 0.00 56.01 56.80 3dra n LEU 171 Cb 0.15 -0.63 0.25 0.00 -2.33 0.00 0.00 43.42 40.87 3dra n LEU 171 CO 0.39 -0.64 0.70 0.23 -1.33 0.00 0.00 177.39 176.74 3dra n MET 172 N -2.26 1.97 -2.61 3.23 2.81 -0.43 -4.94 117.12 114.89 3dra n MET 172 Ca 0.01 -1.49 -0.18 0.00 -1.81 0.00 0.00 57.70 54.24 3dra n MET 172 Cb 0.20 -1.37 0.01 0.00 -0.71 0.00 0.00 33.22 31.34 3dra n MET 172 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3dra n LYS 173 N 0.70 -2.75 -3.06 0.03 4.76 -0.09 -4.96 118.16 112.78 3dra n LYS 173 Ca 0.16 0.78 -0.35 0.00 -2.87 0.00 0.00 58.31 56.02 3dra n LYS 173 Cb 0.38 -5.26 -0.06 0.00 -1.84 0.00 0.00 35.03 28.25 3dra n LYS 173 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3dra s TYR 174 N -2.96 3.59 0.00 2.13 4.12 -1.06 -5.06 117.35 118.12 3dra s TYR 174 Ca 0.13 1.41 0.07 0.00 0.02 0.00 0.00 57.07 58.69 3dra s TYR 174 Cb -0.06 -2.64 0.11 0.00 -1.52 0.00 0.00 41.96 37.85 3dra s TYR 174 CO 0.16 0.26 0.96 -0.25 0.02 0.00 0.00 175.55 176.71 3dra n ASP 175 N 0.46 0.18 0.00 2.29 9.92 -1.26 -4.58 116.55 123.55 3dra n ASP 175 Ca -0.00 -1.84 0.00 0.00 -0.53 0.00 0.00 54.79 52.42 3dra n ASP 175 Cb 0.51 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.84 3dra n ASP 175 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 3dra n THR 189 N 0.13 0.00 -3.92 -3.53 5.66 -1.26 -5.18 114.28 106.18 3dra n THR 189 Ca -0.01 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.90 3dra n THR 189 Cb 0.78 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.48 3dra n THR 189 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3dra s ASP 190 N 0.00 0.18 0.88 1.09 2.15 -1.26 -4.94 116.67 114.77 3dra s ASP 190 Ca 0.00 -0.59 -0.12 0.00 0.43 0.00 0.00 52.55 52.27 3dra s ASP 190 Cb 0.00 0.26 0.12 0.00 -0.30 0.00 0.00 42.92 43.00 3dra s ASP 190 CO 0.00 -0.58 1.10 0.27 -0.17 0.00 0.00 175.17 175.78 3dra s ILE 191 N -3.08 2.68 -0.68 4.11 -4.36 -1.26 -4.96 121.20 113.64 3dra s ILE 191 Ca -0.01 0.22 -0.24 0.00 -0.26 0.00 0.00 60.65 60.36 3dra s ILE 191 Cb 0.02 -2.78 0.06 0.00 1.25 0.00 0.00 42.46 41.00 3dra s ILE 191 CO -0.07 -0.29 1.07 -0.62 0.24 0.00 0.00 174.94 175.28 3dra s ASP 192 N -3.57 6.17 0.34 4.36 -1.08 -1.26 -4.89 116.67 116.75 3dra s ASP 192 Ca 0.63 -0.79 0.16 0.00 -0.52 0.00 0.00 52.55 52.04 3dra s ASP 192 Cb -0.17 -2.47 0.52 0.00 -1.46 0.00 0.00 42.92 39.34 3dra s ASP 192 CO 0.56 -1.58 1.66 -0.07 0.52 0.00 0.00 175.17 176.27 3dra h LEU 193 N 11.93 0.00 -0.08 -1.34 3.38 -1.97 -2.79 115.31 124.43 3dra h LEU 193 Ca -0.28 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 3dra h LEU 193 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3dra h LEU 193 CO 1.21 0.46 -0.26 0.40 0.09 0.00 0.00 178.44 180.34 3dra h ILE 194 N 0.00 1.41 -0.24 1.22 2.04 -2.00 -1.60 117.51 118.35 3dra h ILE 194 Ca -0.00 -1.62 -0.13 0.00 1.00 0.00 0.00 64.86 64.10 3dra h ILE 194 Cb 1.02 2.24 -0.01 0.00 -0.74 0.00 0.00 36.82 39.33 3dra h ILE 194 CO 0.06 0.47 -0.40 0.77 0.00 0.00 0.00 178.15 179.05 3dra h SER 195 N -0.15 0.60 -0.19 1.72 4.64 -1.93 -2.53 113.55 115.70 3dra h SER 195 Ca -0.01 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3dra h SER 195 Cb 0.89 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 3dra h SER 195 CO 0.06 0.93 0.12 0.25 -0.87 0.00 0.00 176.83 177.31 3dra h LEU 196 N 0.47 0.23 -0.72 5.97 5.85 -1.51 -0.56 115.31 125.04 3dra h LEU 196 Ca 0.04 -0.05 0.13 0.00 0.84 0.00 0.00 57.88 58.83 3dra h LEU 196 Cb 0.90 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.78 3dra h LEU 196 CO 0.08 0.22 0.29 -0.61 -0.34 0.00 0.00 178.44 178.08 3dra h GLN 197 N 0.23 0.45 -0.28 1.25 4.15 -1.15 -1.95 115.11 117.81 3dra h GLN 197 Ca 0.07 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.32 3dra h GLN 197 Cb 0.03 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3dra h GLN 197 CO -0.01 0.30 -0.40 0.37 -1.93 0.00 0.00 178.83 177.15 3dra h GLN 198 N 0.46 0.68 -0.55 1.69 5.75 -1.01 -1.29 115.11 120.83 3dra h GLN 198 Ca 0.39 -0.35 0.04 0.00 -0.15 0.00 0.00 58.65 58.57 3dra h GLN 198 Cb 0.54 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.06 3dra h GLN 198 CO -0.37 0.96 0.31 0.35 -2.65 0.00 0.00 178.83 177.44 3dra h PHE 199 N 0.56 0.58 0.13 3.99 3.57 -0.65 -0.52 116.94 124.60 3dra h PHE 199 Ca 0.05 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 3dra h PHE 199 Cb 0.94 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.50 3dra h PHE 199 CO 0.04 0.31 -0.06 0.82 -2.23 0.00 0.00 178.31 177.19 3dra h ILE 200 N 0.61 1.02 -0.17 1.41 2.04 -1.14 -3.14 117.51 118.13 3dra h ILE 200 Ca 0.23 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 3dra h ILE 200 Cb 0.08 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 3dra h ILE 200 CO -0.13 0.16 0.03 -0.07 0.00 0.00 0.00 178.15 178.14 3dra h LEU 201 N -0.51 0.21 -0.80 1.44 3.38 -1.13 0.15 115.31 118.06 3dra h LEU 201 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3dra h LEU 201 Cb 0.40 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3dra h LEU 201 CO 0.03 0.23 0.00 0.47 0.09 0.00 0.00 178.44 179.26 3dra n ASP 202 N -4.43 0.52 -1.22 -0.43 8.00 -0.22 -2.18 116.55 116.59 3dra n ASP 202 Ca -0.00 0.67 0.12 0.00 0.71 0.00 0.00 54.79 56.28 3dra n ASP 202 Cb 0.14 -0.76 0.26 0.00 -0.02 0.00 0.00 41.12 40.74 3dra n ASP 202 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3dra n ARG 203 N -2.11 2.60 -2.78 -1.24 5.12 0.04 -4.68 116.66 113.61 3dra n ARG 203 Ca 0.01 -2.45 -0.36 0.00 -1.93 0.00 0.00 57.85 53.12 3dra n ARG 203 Cb 0.15 -1.53 -0.06 0.00 -1.16 0.00 0.00 32.46 29.85 3dra n ARG 203 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 3dra s ILE 204 N -1.24 4.22 0.32 0.55 2.07 -0.93 -1.65 121.20 124.55 3dra s ILE 204 Ca 0.43 1.72 0.08 0.00 -1.41 0.00 0.00 60.65 61.47 3dra s ILE 204 Cb 0.24 -3.90 -0.04 0.00 0.13 0.00 0.00 42.46 38.88 3dra s ILE 204 CO 0.32 0.03 0.11 0.20 -1.91 0.00 0.00 174.94 173.69 3dra s ASN 205 N -1.74 4.67 0.42 4.50 0.02 0.23 -4.83 114.94 118.20 3dra s ASN 205 Ca 0.53 -0.74 0.09 0.00 -1.02 0.00 0.00 52.86 51.72 3dra s ASN 205 Cb -0.17 -0.77 0.91 0.00 0.02 0.00 0.00 41.25 41.25 3dra s ASN 205 CO 0.22 -0.24 2.03 0.40 0.02 0.00 0.00 177.10 179.53 3dra h ILE 206 N 1.61 1.04 0.00 0.60 2.04 -1.98 -0.42 117.51 120.40 3dra h ILE 206 Ca -0.44 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.24 3dra h ILE 206 Cb 1.25 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3dra h ILE 206 CO 0.63 0.09 0.00 -0.46 0.00 0.00 0.00 178.15 178.41 3dra n ASN 207 N -4.48 0.00 0.00 1.72 0.23 -1.26 -4.87 115.26 106.61 3dra n ASN 207 Ca 0.05 -0.06 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 3dra n ASN 207 Cb 0.16 -0.26 0.00 0.00 -2.08 0.00 0.00 39.78 37.60 3dra n ASN 207 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dra n GLY 208 N 0.45 3.03 3.91 4.83 0.00 -0.17 -4.45 105.19 112.80 3dra n GLY 208 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 3dra n GLY 208 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dra s GLY 209 N -2.70 1.64 0.18 -0.02 0.00 -1.26 -3.87 107.32 101.27 3dra s GLY 209 Ca 0.00 -0.72 0.07 0.00 0.00 0.00 0.00 44.72 44.07 3dra s GLY 209 CO 0.00 -0.31 0.01 -1.36 0.00 0.00 0.00 173.10 171.44 3dra s PHE 210 N -3.33 2.87 0.37 1.90 0.08 -1.26 -0.60 117.98 118.00 3dra s PHE 210 Ca 0.60 -0.13 0.04 0.00 0.12 0.00 0.00 56.93 57.56 3dra s PHE 210 Cb -0.11 -1.39 -0.06 0.00 -0.57 0.00 0.00 43.02 40.90 3dra s PHE 210 CO 0.47 0.52 0.05 -1.54 -0.10 0.00 0.00 175.22 174.63 3dra s SER 211 N -2.98 2.85 0.09 1.36 1.04 -0.66 -1.32 113.70 114.08 3dra s SER 211 Ca 0.28 -1.44 -0.24 0.00 0.48 0.00 0.00 55.95 55.03 3dra s SER 211 Cb -0.09 -0.01 -0.14 0.00 0.10 0.00 0.00 66.02 65.87 3dra s SER 211 CO 0.19 -0.64 1.72 -1.28 0.98 0.00 0.00 173.24 174.21 3dra h SER 212 N 1.95 -0.15 -2.70 7.02 0.87 -1.90 -3.46 113.55 115.19 3dra h SER 212 Ca -0.41 0.01 -0.54 0.00 -1.23 0.00 0.00 61.79 59.63 3dra h SER 212 Cb 1.25 0.05 -0.13 0.00 -0.44 0.00 0.00 62.40 63.13 3dra h SER 212 CO 0.70 -0.09 -0.57 0.42 -0.53 0.00 0.00 176.83 176.76 3dra s THR 213 N -6.17 1.15 0.00 2.23 -4.23 -1.26 -4.72 115.64 102.64 3dra s THR 213 Ca -0.14 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.07 3dra s THR 213 Cb 0.06 -2.65 -0.07 0.00 1.34 0.00 0.00 72.50 71.19 3dra s THR 213 CO 0.66 0.00 1.74 -0.63 -0.54 0.00 0.00 174.62 175.85 3dra s ILE 214 N -3.15 3.29 -1.49 2.99 1.01 -1.26 -2.39 121.20 120.19 3dra s ILE 214 Ca 0.30 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.40 3dra s ILE 214 Cb 0.07 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.24 3dra s ILE 214 CO 0.14 -0.03 0.00 0.23 0.00 0.00 0.00 174.94 175.28 3dra n MET 215 N 6.89 -1.19 -1.34 2.79 2.81 -1.26 -5.03 117.12 120.78 3dra n MET 215 Ca 0.18 0.89 -0.22 0.00 -1.81 0.00 0.00 57.70 56.74 3dra n MET 215 Cb 0.42 -5.18 0.15 0.00 -0.71 0.00 0.00 33.22 27.90 3dra n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3dra n ASP 216 N -0.83 -0.10 -4.72 7.83 -0.08 -1.00 -5.01 116.55 112.63 3dra n ASP 216 Ca -0.18 -1.32 -0.42 0.00 -1.51 0.00 0.00 54.79 51.37 3dra n ASP 216 Cb 0.59 -0.75 -0.03 0.00 2.34 0.00 0.00 41.12 43.27 3dra n ASP 216 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 3dra s GLU 217 N -5.11 4.43 0.37 -0.67 2.12 -1.26 -4.81 118.70 113.78 3dra s GLU 217 Ca 0.55 1.88 -0.27 0.00 0.36 0.00 0.00 54.97 57.48 3dra s GLU 217 Cb -0.02 -3.28 -0.11 0.00 0.26 0.00 0.00 34.13 30.98 3dra s GLU 217 CO 0.39 -0.22 1.35 0.43 -0.54 0.00 0.00 175.26 176.67 3dra n SER 218 N 3.33 3.06 -3.80 -1.70 7.64 -1.26 -4.48 113.62 116.40 3dra n SER 218 Ca 0.07 1.20 -0.13 0.00 1.01 0.00 0.00 58.87 61.02 3dra n SER 218 Cb 0.45 -1.53 -0.13 0.00 -1.01 0.00 0.00 64.21 61.98 3dra n SER 218 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3dra s HIS 219 N -1.12 -0.13 0.24 1.43 2.46 -0.43 -4.71 115.29 113.02 3dra s HIS 219 Ca 0.56 0.36 -0.06 0.00 0.47 0.00 0.00 55.06 56.38 3dra s HIS 219 Cb -0.53 -0.00 0.29 0.00 -0.13 0.00 0.00 32.58 32.21 3dra s HIS 219 CO 0.62 -0.09 1.87 1.25 -2.47 0.00 0.00 174.74 175.92 3dra h LEU 220 N 6.40 0.90 0.16 8.88 5.85 -0.97 -1.75 115.31 134.79 3dra h LEU 220 Ca -0.31 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.42 3dra h LEU 220 Cb 1.18 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 3dra h LEU 220 CO 0.43 0.61 -0.20 1.23 -0.34 0.00 0.00 178.44 180.18 3dra h GLY 221 N 1.05 -0.40 1.86 3.75 0.00 -1.94 -0.31 103.07 107.09 3dra h GLY 221 Ca 0.36 0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.88 3dra h GLY 221 CO -0.13 -0.19 -0.04 0.74 0.00 0.00 0.00 176.54 176.92 3dra h PHE 222 N -0.40 0.18 -0.29 5.60 0.04 -1.81 -2.25 116.94 118.01 3dra h PHE 222 Ca 0.01 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 3dra h PHE 222 Cb 0.40 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 3dra h PHE 222 CO -0.16 0.23 -0.03 1.15 -0.60 0.00 0.00 178.31 178.90 3dra h THR 223 N 0.18 1.27 -0.36 -1.55 2.02 -0.66 -0.30 112.91 113.51 3dra h THR 223 Ca 0.04 -1.01 0.04 0.00 0.77 0.00 0.00 66.41 66.25 3dra h THR 223 Cb 0.20 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 3dra h THR 223 CO 0.01 0.32 0.15 0.15 0.37 0.00 0.00 175.52 176.52 3dra h PHE 224 N 0.31 0.27 -0.56 3.16 3.57 -0.73 -1.18 116.94 121.78 3dra h PHE 224 Ca 0.08 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.63 3dra h PHE 224 Cb 0.48 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 3dra h PHE 224 CO 0.04 0.13 0.32 0.00 -2.23 0.00 0.00 178.31 176.57 3dra h ALA 226 N 1.27 0.46 -0.51 0.00 0.00 -0.77 -1.52 119.26 118.19 3dra h ALA 226 Ca 0.24 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3dra h ALA 226 Cb 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3dra h ALA 226 CO -0.13 0.04 0.18 0.82 0.00 0.00 0.00 179.25 180.16 3dra h ILE 227 N 0.43 1.22 -0.42 0.00 2.04 -0.96 0.95 117.51 120.77 3dra h ILE 227 Ca 0.12 -0.73 -0.10 0.00 1.00 0.00 0.00 64.86 65.16 3dra h ILE 227 Cb 0.14 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 3dra h ILE 227 CO -0.01 0.27 -0.13 0.00 0.00 0.00 0.00 178.15 178.28 3dra h ALA 228 N 1.03 0.98 -0.17 1.87 0.00 -1.06 -0.62 119.26 121.30 3dra h ALA 228 Ca 0.17 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3dra h ALA 228 Cb 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3dra h ALA 228 CO -0.01 0.61 -0.02 0.77 0.00 0.00 0.00 179.25 180.60 3dra h SER 229 N 0.70 0.31 -0.71 0.00 0.02 -1.12 -1.69 113.55 111.06 3dra h SER 229 Ca 0.11 -0.34 0.02 0.00 -0.84 0.00 0.00 61.79 60.75 3dra h SER 229 Cb 0.61 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 3dra h SER 229 CO 0.04 0.57 0.47 -0.07 -1.14 0.00 0.00 176.83 176.70 3dra h LEU 230 N 0.04 0.77 -0.49 5.07 3.38 -0.59 -0.93 115.31 122.56 3dra h LEU 230 Ca 0.05 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3dra h LEU 230 Cb 0.42 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3dra h LEU 230 CO 0.01 0.54 0.08 0.50 0.09 0.00 0.00 178.44 179.66 3dra h LYS 231 N 0.90 0.81 0.00 1.13 3.64 -0.90 -0.49 116.57 121.66 3dra h LYS 231 Ca 0.28 -0.22 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3dra h LYS 231 Cb 0.00 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3dra h LYS 231 CO -0.07 0.81 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.83 3dra h LEU 232 N 0.68 0.00 -1.46 5.20 3.38 -0.73 -2.08 115.31 120.31 3dra h LEU 232 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dra h LEU 232 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dra h LEU 232 CO 0.01 0.02 0.00 0.18 0.09 0.00 0.00 178.44 178.74 3dra n LEU 233 N -3.16 2.23 -2.27 1.67 4.77 -0.40 -4.96 117.00 114.87 3dra n LEU 233 Ca -0.01 -0.83 -0.15 0.00 -0.03 0.00 0.00 56.01 54.99 3dra n LEU 233 Cb 0.20 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.27 3dra n LEU 233 CO 0.25 0.41 0.07 0.59 -1.33 0.00 0.00 177.39 177.38 3dra n ASN 234 N 0.71 -4.71 -4.78 -1.43 3.02 -0.78 -5.01 115.26 102.29 3dra n ASN 234 Ca 0.17 -0.26 -0.39 0.00 -0.03 0.00 0.00 54.58 54.07 3dra n ASN 234 Cb 0.45 -3.45 -0.06 0.00 -0.61 0.00 0.00 39.78 36.10 3dra n ASN 234 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3dra s TYR 235 N -3.07 3.86 -0.68 3.10 5.04 -0.26 -4.98 117.35 120.37 3dra s TYR 235 Ca 0.28 1.69 -0.26 0.00 -2.44 0.00 0.00 57.07 56.34 3dra s TYR 235 Cb -0.12 -2.82 -0.00 0.00 0.35 0.00 0.00 41.96 39.36 3dra s TYR 235 CO 0.35 0.44 1.67 -1.25 -1.34 0.00 0.00 175.55 175.42 3dra s PRO 236 N -1.40 2.82 0.34 4.97 0.04 -1.26 -4.72 135.00 135.79 3dra s PRO 236 Ca 0.40 0.26 0.15 0.00 0.04 0.00 0.00 61.00 61.85 3dra s PRO 236 Cb -0.22 -4.38 0.58 0.00 0.04 0.00 0.00 34.50 30.51 3dra s PRO 236 CO 0.27 -2.57 1.70 -0.07 0.04 0.00 0.00 177.00 176.37 3dra h LEU 237 N 15.35 0.00 -1.35 -3.56 3.38 -1.93 -3.02 115.31 124.17 3dra h LEU 237 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3dra h LEU 237 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3dra h LEU 237 CO 1.24 0.46 0.03 -1.84 0.09 0.00 0.00 178.44 178.42 3dra n GLU 238 N -3.69 0.13 0.14 1.13 0.00 -1.26 -0.80 120.64 116.30 3dra n GLU 238 Ca -0.01 0.63 -0.01 0.00 0.00 0.00 0.00 57.16 57.78 3dra n GLU 238 Cb 0.53 -1.96 0.24 0.00 0.00 0.00 0.00 31.44 30.25 3dra n GLU 238 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 3dra h LYS 239 N 0.00 0.07 -4.09 3.44 1.57 -1.95 -3.38 116.57 112.23 3dra h LYS 239 Ca 0.00 -0.04 -0.69 0.00 -1.87 0.00 0.00 60.65 58.05 3dra h LYS 239 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3dra h LYS 239 CO 0.00 0.55 2.93 1.28 -0.57 0.00 0.00 179.45 183.64 3dra n LEU 240 N -3.95 6.16 -0.13 2.94 4.77 0.02 -4.71 117.00 122.10 3dra n LEU 240 Ca -0.02 -3.80 -0.11 0.00 -0.03 0.00 0.00 56.01 52.05 3dra n LEU 240 Cb 0.52 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.08 3dra n LEU 240 CO 0.41 0.74 0.73 0.50 -1.33 0.00 0.00 177.39 178.44 3dra h LYS 241 N 6.48 0.73 -0.09 3.23 3.64 -1.83 -2.82 116.57 125.91 3dra h LYS 241 Ca 0.54 -0.27 -0.04 0.00 -1.27 0.00 0.00 60.65 59.60 3dra h LYS 241 Cb 0.63 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3dra h LYS 241 CO 1.90 0.87 -0.15 0.66 -2.27 0.00 0.00 179.45 180.46 3dra h SER 242 N 0.53 0.13 -0.29 4.20 4.64 -1.92 -2.51 113.55 118.33 3dra h SER 242 Ca 0.10 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 3dra h SER 242 Cb 0.59 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 3dra h SER 242 CO 0.04 0.29 0.03 0.74 -0.87 0.00 0.00 176.83 177.06 3dra h THR 243 N 0.13 1.24 -0.73 2.95 2.02 -1.62 0.36 112.91 117.25 3dra h THR 243 Ca 0.03 -0.84 0.01 0.00 0.77 0.00 0.00 66.41 66.37 3dra h THR 243 Cb 0.35 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 3dra h THR 243 CO 0.02 0.27 0.48 0.50 0.37 0.00 0.00 175.52 177.17 3dra h LYS 244 N 0.30 0.96 -0.31 6.66 3.64 -1.23 -0.58 116.57 126.00 3dra h LYS 244 Ca 0.09 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 3dra h LYS 244 Cb 0.37 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3dra h LYS 244 CO 0.01 0.63 -0.28 0.93 -2.27 0.00 0.00 179.45 178.47 3dra h GLU 245 N 0.99 0.63 -0.59 1.90 5.08 -1.30 -1.93 114.58 119.35 3dra h GLU 245 Ca 0.27 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3dra h GLU 245 Cb -0.11 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 3dra h GLU 245 CO -0.06 0.85 0.24 2.35 -1.00 0.00 0.00 179.01 181.39 3dra h TRP 246 N 0.54 0.91 -0.61 4.33 7.01 -0.45 -2.69 115.95 124.99 3dra h TRP 246 Ca 0.07 -0.07 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 3dra h TRP 246 Cb 0.77 -0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 27.52 3dra h TRP 246 CO 0.03 0.73 0.37 -0.07 -2.79 0.00 0.00 178.44 176.71 3dra h LEU 247 N 0.82 0.73 -1.58 0.65 3.38 -0.94 -2.48 115.31 115.89 3dra h LEU 247 Ca 0.20 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dra h LEU 247 Cb 0.20 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3dra h LEU 247 CO -0.02 0.57 -0.01 0.16 0.09 0.00 0.00 178.44 179.23 3dra h ILE 248 N 0.83 0.03 -0.00 1.22 -0.00 -1.10 -1.90 117.51 116.59 3dra h ILE 248 Ca 0.22 -0.49 0.00 0.00 -0.00 0.00 0.00 64.86 64.59 3dra h ILE 248 Cb -0.03 1.48 0.00 0.00 -0.00 0.00 0.00 36.82 38.27 3dra h ILE 248 CO -0.04 0.01 -0.01 1.41 -0.00 0.00 0.00 178.15 179.52 3dra n HIS 249 N -3.11 0.00 0.34 0.16 8.25 -0.94 -3.74 115.22 116.18 3dra n HIS 249 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.60 3dra n HIS 249 Cb 0.29 -0.07 0.35 0.00 1.12 0.00 0.00 29.99 31.68 3dra n HIS 249 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dra h ARG 250 N 0.28 0.00 -6.41 -0.41 2.47 -1.31 -3.44 114.38 105.56 3dra h ARG 250 Ca 0.00 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.18 3dra h ARG 250 Cb 0.14 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 3dra h ARG 250 CO 0.00 0.00 0.57 -1.14 0.56 0.00 0.00 179.97 179.96 3dra s GLN 251 N -3.29 4.43 -0.04 0.04 0.74 -1.25 -1.68 119.66 118.62 3dra s GLN 251 Ca 0.06 1.66 -0.25 0.00 0.05 0.00 0.00 55.36 56.88 3dra s GLN 251 Cb 0.08 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.71 3dra s GLN 251 CO 0.60 -0.28 0.78 0.08 -0.55 0.00 0.00 175.29 175.92 3dra s VAL 252 N 1.45 4.97 -0.01 1.34 1.01 0.40 -4.95 120.40 124.62 3dra s VAL 252 Ca 0.56 1.61 -0.16 0.00 0.00 0.00 0.00 61.98 64.00 3dra s VAL 252 Cb -0.26 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.03 3dra s VAL 252 CO 0.26 0.24 0.34 -0.62 0.00 0.00 0.00 175.10 175.32 3dra s ASP 253 N 0.77 -0.22 -0.47 3.32 2.15 -1.26 -1.10 116.67 119.85 3dra s ASP 253 Ca 0.41 0.10 0.07 0.00 0.43 0.00 0.00 52.55 53.56 3dra s ASP 253 Cb -0.19 0.34 0.24 0.00 -0.30 0.00 0.00 42.92 43.01 3dra s ASP 253 CO 0.21 -0.48 0.57 -1.22 -0.17 0.00 0.00 175.17 174.07 3dra n TYR 254 N 1.14 0.86 -1.70 -5.34 4.01 -1.26 -5.08 117.16 109.79 3dra n TYR 254 Ca -0.21 -3.74 -0.44 0.00 -0.16 0.00 0.00 57.90 53.36 3dra n TYR 254 Cb 0.57 -0.37 -0.02 0.00 -0.31 0.00 0.00 39.34 39.20 3dra n TYR 254 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3dra n PRO 255 N 1.39 2.27 0.29 -0.72 -0.04 -1.26 -4.75 135.00 132.17 3dra n PRO 255 Ca 0.24 0.81 0.15 0.00 -0.04 0.00 0.00 63.50 64.66 3dra n PRO 255 Cb 0.49 -2.51 0.88 0.00 -0.04 0.00 0.00 33.50 32.32 3dra n PRO 255 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3dra h GLU 256 N 4.45 0.00 0.00 0.54 4.81 -1.99 -1.37 114.58 121.01 3dra h GLU 256 Ca -0.46 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 3dra h GLU 256 Cb 1.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 3dra h GLU 256 CO 0.77 0.04 -0.06 -2.95 -0.73 0.00 0.00 179.01 176.08 3dra h ASN 257 N 0.00 0.00 0.00 1.04 7.08 -2.00 -3.15 115.58 118.55 3dra h ASN 257 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 3dra h ASN 257 Cb 0.11 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.35 3dra h ASN 257 CO 0.00 0.06 -0.71 0.18 -2.08 0.00 0.00 177.43 174.88 3dra n LEU 258 N -3.25 0.20 -3.73 6.14 4.77 -0.59 -4.81 117.00 115.74 3dra n LEU 258 Ca -0.01 -0.30 -0.28 0.00 -0.03 0.00 0.00 56.01 55.39 3dra n LEU 258 Cb 0.26 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.24 3dra n LEU 258 CO 0.27 0.05 -0.13 -0.31 -1.33 0.00 0.00 177.39 175.94 3dra s TYR 259 N -1.97 2.73 -0.08 -1.77 2.02 -0.78 -5.04 117.35 112.46 3dra s TYR 259 Ca 0.01 -3.00 -0.26 0.00 -0.37 0.00 0.00 57.07 53.44 3dra s TYR 259 Cb 0.05 -2.10 -0.22 0.00 -0.40 0.00 0.00 41.96 39.29 3dra s TYR 259 CO 0.28 -0.64 0.98 -1.00 -1.57 0.00 0.00 175.55 173.60 3dra h PRO 260 N 5.46 -0.02 -1.79 -1.71 0.14 -1.86 -3.41 132.00 128.82 3dra h PRO 260 Ca 0.19 0.00 0.02 0.00 0.14 0.00 0.00 66.00 66.36 3dra h PRO 260 Cb 0.81 0.00 -0.24 0.00 0.14 0.00 0.00 31.00 31.71 3dra h PRO 260 CO 0.60 0.69 0.27 -0.80 0.14 0.00 0.00 178.00 178.90 3dra s ASN 273 N -5.91 -0.63 0.18 1.44 0.01 -1.26 -5.09 114.94 103.67 3dra s ASN 273 Ca -0.17 1.16 -0.31 0.00 -0.71 0.00 0.00 52.86 52.84 3dra s ASN 273 Cb -0.01 1.20 -0.09 0.00 0.41 0.00 0.00 41.25 42.77 3dra s ASN 273 CO 0.65 -0.20 1.38 -0.47 -1.51 0.00 0.00 177.10 176.95 3dra s TYR 274 N 0.61 3.20 0.57 2.20 5.04 -1.26 -4.90 117.35 122.81 3dra s TYR 274 Ca -0.01 1.05 0.38 0.00 -2.44 0.00 0.00 57.07 56.05 3dra s TYR 274 Cb -0.05 -3.69 2.09 0.00 0.35 0.00 0.00 41.96 40.66 3dra s TYR 274 CO -0.07 -2.30 2.28 1.05 -1.34 0.00 0.00 175.55 175.17 3dra h GLU 275 N 5.90 0.00 -0.01 4.97 4.11 -2.06 -1.00 114.58 126.49 3dra h GLU 275 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 3dra h GLU 275 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3dra h GLU 275 CO 0.81 0.01 -0.03 0.66 0.07 0.00 0.00 179.01 180.54 3dra n TYR 276 N -3.34 0.00 -3.58 2.06 4.01 -1.26 -4.73 117.16 110.32 3dra n TYR 276 Ca -0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.31 3dra n TYR 276 Cb 0.11 -0.01 -0.10 0.00 -0.31 0.00 0.00 39.34 39.03 3dra n TYR 276 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3dra s TYR 277 N -2.06 3.32 -0.06 -0.72 2.02 -0.38 -4.40 117.35 115.07 3dra s TYR 277 Ca 0.36 -1.43 0.04 0.00 -0.37 0.00 0.00 57.07 55.67 3dra s TYR 277 Cb 0.21 -2.95 0.00 0.00 -0.40 0.00 0.00 41.96 38.82 3dra s TYR 277 CO 0.36 -0.83 -0.16 1.03 -1.57 0.00 0.00 175.55 174.37 3dra s ARG 278 N 1.46 1.88 0.39 -0.62 0.52 -1.26 -4.75 118.95 116.57 3dra s ARG 278 Ca 0.03 -0.57 0.13 0.00 -0.52 0.00 0.00 55.73 54.79 3dra s ARG 278 Cb -0.23 -1.57 0.95 0.00 0.52 0.00 0.00 34.95 34.61 3dra s ARG 278 CO 0.03 0.17 1.90 -0.97 0.02 0.00 0.00 175.30 176.45 3dra h ASN 279 N 6.51 0.51 0.55 0.23 -0.73 -1.99 -1.55 115.58 119.11 3dra h ASN 279 Ca -0.31 0.03 0.00 0.00 1.87 0.00 0.00 56.30 57.89 3dra h ASN 279 Cb 1.18 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 39.70 3dra h ASN 279 CO 0.48 0.26 0.00 0.00 -0.37 0.00 0.00 177.43 177.80 3dra n ILE 280 N -4.51 0.96 1.07 2.57 3.06 -1.26 -2.30 119.36 118.94 3dra n ILE 280 Ca 0.16 0.24 0.13 0.00 -2.50 0.00 0.00 62.75 60.78 3dra n ILE 280 Cb 0.50 -1.03 0.51 0.00 0.54 0.00 0.00 39.64 40.16 3dra n ILE 280 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3dra n ASP 281 N -1.66 0.21 -4.71 9.51 9.92 -0.58 -4.88 116.55 124.35 3dra n ASP 281 Ca 0.03 0.12 -0.42 0.00 -0.53 0.00 0.00 54.79 53.99 3dra n ASP 281 Cb 0.18 -0.21 -0.03 0.00 -0.64 0.00 0.00 41.12 40.42 3dra n ASP 281 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3dra s ILE 282 N -2.92 2.24 0.00 0.53 1.01 -0.97 -1.05 121.20 120.03 3dra s ILE 282 Ca 0.15 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.91 3dra s ILE 282 Cb 0.19 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.59 3dra s ILE 282 CO 0.57 0.01 0.00 0.61 0.00 0.00 0.00 174.94 176.13 3dra n GLY 283 N 3.99 3.24 3.65 6.18 0.00 -0.26 -4.55 105.19 117.44 3dra n GLY 283 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3dra n GLY 283 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dra s GLY 284 N -2.15 1.58 -0.00 -0.02 0.00 -0.22 -3.72 107.32 102.79 3dra s GLY 284 Ca 0.00 -0.70 0.07 0.00 0.00 0.00 0.00 44.72 44.09 3dra s GLY 284 CO 0.00 0.05 -0.23 -1.36 0.00 0.00 0.00 173.10 171.56 3dra s PHE 285 N -3.04 2.07 0.26 1.90 0.08 -1.26 -0.45 117.98 117.54 3dra s PHE 285 Ca 0.68 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 57.40 3dra s PHE 285 Cb -0.13 -1.31 -0.03 0.00 -0.57 0.00 0.00 43.02 40.97 3dra s PHE 285 CO 0.56 -0.00 0.31 0.54 -0.10 0.00 0.00 175.22 176.53 3dra s ASN 286 N -0.70 5.93 0.24 1.36 2.20 -0.68 -1.81 114.94 121.48 3dra s ASN 286 Ca 0.09 -0.11 0.23 0.00 -0.94 0.00 0.00 52.86 52.14 3dra s ASN 286 Cb -0.09 -1.57 0.25 0.00 -2.00 0.00 0.00 41.25 37.84 3dra s ASN 286 CO -0.00 -0.12 1.32 1.23 -2.94 0.00 0.00 177.10 176.59 3dra h GLY 287 N 1.26 0.00 -2.55 0.45 0.00 -1.90 -3.46 103.07 96.86 3dra h GLY 287 Ca -0.50 0.00 0.04 0.00 0.00 0.00 0.00 47.33 46.88 3dra h GLY 287 CO 0.60 0.00 0.26 1.09 0.00 0.00 0.00 176.54 178.49 3dra s ARG 288 N -3.25 1.46 0.33 4.80 1.70 -1.26 -0.32 118.95 122.42 3dra s ARG 288 Ca 0.04 -0.69 -0.28 0.00 -0.47 0.00 0.00 55.73 54.32 3dra s ARG 288 Cb 0.10 0.57 -0.12 0.00 -0.57 0.00 0.00 34.95 34.93 3dra s ARG 288 CO 0.73 -0.66 1.37 0.39 -1.08 0.00 0.00 175.30 176.05 3dra n GLU 289 N -0.41 2.28 -2.09 3.89 4.71 -1.26 -2.74 120.64 125.02 3dra n GLU 289 Ca -0.10 0.80 -0.18 0.00 -0.01 0.00 0.00 57.16 57.67 3dra n GLU 289 Cb 0.62 -2.44 -0.03 0.00 -1.01 0.00 0.00 31.44 28.58 3dra n GLU 289 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3dra n ASN 290 N 0.96 -5.27 -4.87 1.62 3.02 -1.26 -5.01 115.26 104.45 3dra n ASN 290 Ca 0.05 0.13 -0.27 0.00 -0.03 0.00 0.00 54.58 54.46 3dra n ASN 290 Cb 0.36 -4.35 -0.02 0.00 -0.61 0.00 0.00 39.78 35.16 3dra n ASN 290 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dra s LYS 291 N -4.48 2.25 0.56 3.52 1.02 -1.11 -4.83 119.74 116.67 3dra s LYS 291 Ca 0.00 -2.06 -0.15 0.00 0.02 0.00 0.00 55.97 53.78 3dra s LYS 291 Cb 0.00 -2.00 -0.06 0.00 -0.52 0.00 0.00 37.83 35.25 3dra s LYS 291 CO 0.00 -0.52 1.01 -0.51 -0.92 0.00 0.00 175.35 174.41 3dra s LEU 292 N -4.18 3.50 0.50 3.17 1.43 -1.26 -4.82 118.68 117.02 3dra s LEU 292 Ca 0.30 1.59 -0.22 0.00 -1.03 0.00 0.00 54.13 54.77 3dra s LEU 292 Cb -0.01 -4.50 -0.06 0.00 0.03 0.00 0.00 46.19 41.64 3dra s LEU 292 CO 0.18 -0.79 1.23 -0.44 0.23 0.00 0.00 176.35 176.76 3dra s SER 293 N -3.28 5.77 -0.07 2.29 0.01 -1.26 -4.38 113.70 112.79 3dra s SER 293 Ca 0.59 2.45 -0.03 0.00 1.31 0.00 0.00 55.95 60.27 3dra s SER 293 Cb -0.11 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.54 3dra s SER 293 CO 0.38 -1.20 0.14 -0.62 0.41 0.00 0.00 173.24 172.35 3dra s ASP 294 N -1.27 0.16 0.23 2.44 -1.08 -0.75 -4.81 116.67 111.59 3dra s ASP 294 Ca 0.68 0.28 -0.02 0.00 -0.52 0.00 0.00 52.55 52.97 3dra s ASP 294 Cb -0.32 0.18 0.50 0.00 -1.46 0.00 0.00 42.92 41.82 3dra s ASP 294 CO 0.38 -0.18 1.22 0.41 0.52 0.00 0.00 175.17 177.52 3dra n THR 295 N 4.53 -0.33 0.25 1.71 -1.04 0.14 -1.18 114.28 118.36 3dra n THR 295 Ca -0.20 1.74 0.09 0.00 -2.04 0.00 0.00 64.05 63.63 3dra n THR 295 Cb 0.51 -2.49 0.63 0.00 -1.82 0.00 0.00 70.33 67.16 3dra n THR 295 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dra h TYR 297 N 0.00 0.00 -0.81 0.00 0.05 -1.41 -1.10 116.97 113.70 3dra h TYR 297 Ca -0.00 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.79 3dra h TYR 297 Cb 0.20 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.90 3dra h TYR 297 CO 0.00 0.00 0.54 0.77 -1.05 0.00 0.00 178.16 178.42 3dra h SER 298 N 0.00 0.91 0.00 3.88 0.02 -1.50 -0.81 113.55 116.05 3dra h SER 298 Ca 0.00 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3dra h SER 298 Cb 0.27 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 3dra h SER 298 CO 0.00 0.65 -0.04 -0.25 -1.14 0.00 0.00 176.83 176.05 3dra h TRP 299 N 1.07 0.00 -0.60 3.45 2.91 -1.38 -2.71 115.95 118.69 3dra h TRP 299 Ca 0.30 0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.41 3dra h TRP 299 Cb -0.08 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.53 3dra h TRP 299 CO -0.00 0.72 0.40 -1.49 -1.03 0.00 0.00 178.44 177.04 3dra h TRP 300 N -1.00 0.50 0.11 2.65 -0.00 -1.36 0.44 115.95 117.28 3dra h TRP 300 Ca -0.01 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.89 3dra h TRP 300 Cb 0.72 -0.16 0.00 0.00 -0.00 0.00 0.00 29.16 29.72 3dra h TRP 300 CO 0.19 0.25 -0.05 0.00 -0.00 0.00 0.00 178.44 178.83 3dra h THR 302 N -1.01 1.06 -0.21 0.00 1.35 -1.35 -1.74 112.91 111.00 3dra h THR 302 Ca -0.02 -1.61 -0.13 0.00 -0.55 0.00 0.00 66.41 64.11 3dra h THR 302 Cb 0.29 1.93 -0.01 0.00 -1.73 0.00 0.00 68.15 68.63 3dra h THR 302 CO 0.02 0.42 -0.41 1.23 -0.25 0.00 0.00 175.52 176.53 3dra h GLY 303 N 1.85 0.55 0.90 5.82 0.00 -1.07 -1.41 103.07 109.72 3dra h GLY 303 Ca -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 3dra h GLY 303 CO 0.06 0.50 0.05 1.76 0.00 0.00 0.00 176.54 178.90 3dra h SER 304 N 0.42 0.54 -0.56 0.19 0.02 -1.30 -1.51 113.55 111.34 3dra h SER 304 Ca 0.03 -0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 3dra h SER 304 Cb 0.90 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 3dra h SER 304 CO 0.08 0.67 0.14 -0.07 -1.14 0.00 0.00 176.83 176.51 3dra h LEU 305 N 0.39 0.85 -0.80 5.07 3.38 -1.18 -2.19 115.31 120.84 3dra h LEU 305 Ca 0.10 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3dra h LEU 305 Cb 0.36 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 3dra h LEU 305 CO 0.01 0.86 0.53 0.22 0.09 0.00 0.00 178.44 180.15 3dra h TYR 306 N 0.80 1.00 0.00 1.13 3.20 -1.17 -2.02 116.97 119.91 3dra h TYR 306 Ca 0.18 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 3dra h TYR 306 Cb 0.34 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 3dra h TYR 306 CO 0.02 0.63 -0.33 -0.91 -1.64 0.00 0.00 178.16 175.94 3dra h ASN 307 N 1.08 0.00 -0.01 -2.11 2.35 -0.80 -2.41 115.58 113.68 3dra h ASN 307 Ca 0.29 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.04 3dra h ASN 307 Cb -0.12 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 3dra h ASN 307 CO -0.06 0.33 -0.01 0.40 -1.65 0.00 0.00 177.43 176.43 3dra h ILE 308 N 0.00 1.40 -1.93 2.81 2.04 -1.05 -3.47 117.51 117.31 3dra h ILE 308 Ca -0.00 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 64.69 3dra h ILE 308 Cb 0.66 2.19 -0.22 0.00 -0.74 0.00 0.00 36.82 38.70 3dra h ILE 308 CO 0.04 0.31 0.08 -0.62 0.00 0.00 0.00 178.15 177.96 3dra s ASP 309 N -5.74 -0.88 0.55 1.72 -1.08 -0.79 -4.76 116.67 105.69 3dra s ASP 309 Ca -0.16 1.41 0.28 0.00 -0.52 0.00 0.00 52.55 53.55 3dra s ASP 309 Cb 0.02 1.36 1.45 0.00 -1.46 0.00 0.00 42.92 44.29 3dra s ASP 309 CO 0.68 -0.22 1.96 -0.37 0.52 0.00 0.00 175.17 177.74 3dra h VAL 310 N 4.99 0.61 0.00 1.11 -1.51 -1.76 -0.08 116.25 119.61 3dra h VAL 310 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 3dra h VAL 310 Cb 1.22 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.06 3dra h VAL 310 CO 0.17 0.00 0.00 0.78 -1.23 0.00 0.00 177.57 177.29 3dra h ASN 311 N 0.00 0.00 0.91 4.19 -0.26 -1.89 -3.32 115.58 115.21 3dra h ASN 311 Ca 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.01 3dra h ASN 311 Cb 1.16 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.42 3dra h ASN 311 CO -0.00 0.00 0.00 -0.26 -1.06 0.00 0.00 177.43 176.11 3dra h PHE 312 N 0.00 0.00 0.00 1.19 0.04 -1.23 -1.95 116.94 114.99 3dra h PHE 312 Ca 0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3dra h PHE 312 Cb 0.84 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.99 3dra h PHE 312 CO 0.00 0.00 -0.04 -0.84 -0.60 0.00 0.00 178.31 176.83 3dra h ILE 313 N 0.00 0.23 -0.00 -0.55 3.07 -1.74 -0.68 117.51 117.83 3dra h ILE 313 Ca 0.00 -0.27 0.00 0.00 1.55 0.00 0.00 64.86 66.14 3dra h ILE 313 Cb 0.45 1.21 0.00 0.00 -0.27 0.00 0.00 36.82 38.21 3dra h ILE 313 CO 0.00 0.04 0.00 0.29 -1.05 0.00 0.00 178.15 177.43 3dra n LYS 314 N -3.33 1.03 0.10 0.16 5.02 -0.73 -3.36 118.16 117.05 3dra n LYS 314 Ca -0.02 -0.05 0.12 0.00 -2.02 0.00 0.00 58.31 56.35 3dra n LYS 314 Cb 0.17 -1.49 0.28 0.00 -0.02 0.00 0.00 35.03 33.97 3dra n LYS 314 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3dra h LEU 315 N 0.12 0.00-10.52 -0.35 3.38 -1.29 -3.45 115.31 103.20 3dra h LEU 315 Ca 0.00 -0.07 -0.45 0.00 0.09 0.00 0.00 57.88 57.45 3dra h LEU 315 Cb 0.03 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.80 3dra h LEU 315 CO 0.00 0.04 -0.19 0.68 0.09 0.00 0.00 178.44 179.05 3dra s VAL 316 N -3.15 2.62 -0.67 1.22 -7.23 -1.21 -5.05 120.40 106.93 3dra s VAL 316 Ca 0.08 -1.01 -0.20 0.00 -1.81 0.00 0.00 61.98 59.04 3dra s VAL 316 Cb 0.12 -2.63 0.10 0.00 0.56 0.00 0.00 36.38 34.53 3dra s VAL 316 CO 0.66 0.00 0.84 -0.62 -0.31 0.00 0.00 175.10 175.67 3dra s ASP 317 N -4.48 6.27 0.47 4.85 -1.08 -1.26 -4.88 116.67 116.55 3dra s ASP 317 Ca 0.58 -1.45 0.27 0.00 -0.52 0.00 0.00 52.55 51.43 3dra s ASP 317 Cb -0.08 -2.35 0.96 0.00 -1.46 0.00 0.00 42.92 39.99 3dra s ASP 317 CO 0.35 -1.18 1.83 -0.07 0.52 0.00 0.00 175.17 176.63 3dra h LEU 318 N 10.34 0.00 -0.04 -1.34 3.38 -1.91 -1.05 115.31 124.69 3dra h LEU 318 Ca -0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3dra h LEU 318 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3dra h LEU 318 CO 1.11 0.13 -0.01 0.78 0.09 0.00 0.00 178.44 180.54 3dra h ASN 319 N 0.00 0.08 0.11 -0.43 2.35 -1.99 -1.08 115.58 114.62 3dra h ASN 319 Ca -0.00 -0.36 -0.10 0.00 -0.55 0.00 0.00 56.30 55.29 3dra h ASN 319 Cb 0.73 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 3dra h ASN 319 CO 0.02 0.42 -0.35 0.11 -1.65 0.00 0.00 177.43 175.98 3dra h LYS 320 N -0.26 0.33 -0.48 0.81 1.79 -1.87 -1.83 116.57 115.06 3dra h LYS 320 Ca 0.01 -0.14 -0.00 0.00 -2.18 0.00 0.00 60.65 58.34 3dra h LYS 320 Cb 0.38 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 3dra h LYS 320 CO 0.00 0.64 0.30 0.00 -1.08 0.00 0.00 179.45 179.31 3dra h ALA 321 N 1.35 0.61 -0.70 3.86 0.00 -1.11 -1.80 119.26 121.47 3dra h ALA 321 Ca 0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3dra h ALA 321 Cb 0.75 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3dra h ALA 321 CO 0.06 0.09 0.30 0.93 0.00 0.00 0.00 179.25 180.63 3dra h GLU 322 N 0.64 1.04 -0.56 0.00 5.08 -1.00 -2.66 114.58 117.11 3dra h GLU 322 Ca 0.17 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3dra h GLU 322 Cb -0.02 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 3dra h GLU 322 CO -0.03 0.84 0.37 0.22 -1.00 0.00 0.00 179.01 179.41 3dra h ASP 323 N 0.99 0.63 -0.21 1.42 3.58 -1.04 0.65 116.42 122.45 3dra h ASP 323 Ca 0.24 -0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.68 3dra h ASP 323 Cb 0.18 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 3dra h ASP 323 CO -0.02 0.45 0.11 0.22 -2.88 0.00 0.00 179.24 177.12 3dra h TYR 324 N 0.75 0.20 0.02 0.28 3.20 -1.21 0.02 116.97 120.22 3dra h TYR 324 Ca 0.21 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 3dra h TYR 324 Cb -0.07 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.14 3dra h TYR 324 CO -0.04 0.12 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.52 3dra h LEU 325 N 0.23 -0.02 -0.45 2.82 3.38 -1.24 -1.30 115.31 118.73 3dra h LEU 325 Ca 0.08 -0.39 -0.18 0.00 0.09 0.00 0.00 57.88 57.49 3dra h LEU 325 Cb 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3dra h LEU 325 CO -0.05 0.38 -0.68 -0.07 0.09 0.00 0.00 178.44 178.10 3dra h LEU 326 N -0.43 0.49 0.00 1.67 3.38 -0.86 0.19 115.31 119.74 3dra h LEU 326 Ca -0.00 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 3dra h LEU 326 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3dra h LEU 326 CO 0.00 1.03 -1.73 0.59 0.09 0.00 0.00 178.44 178.42 3dra n ASN 327 N -3.86 1.57 -0.11 -0.43 3.02 -0.01 -4.41 115.26 111.02 3dra n ASN 327 Ca -0.04 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.31 3dra n ASN 327 Cb 0.68 1.56 -0.09 0.00 -0.61 0.00 0.00 39.78 41.32 3dra n ASN 327 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dra n LYS 328 N -2.10 0.49 -0.00 3.52 4.76 -0.57 -4.82 118.16 119.43 3dra n LYS 328 Ca -0.06 0.17 0.07 0.00 -2.87 0.00 0.00 58.31 55.62 3dra n LYS 328 Cb 0.48 -1.34 -0.10 0.00 -1.84 0.00 0.00 35.03 32.23 3dra n LYS 328 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3dra n THR 329 N -3.62 0.00 -1.71 -0.18 -2.24 -0.71 -4.33 114.28 101.49 3dra n THR 329 Ca -0.40 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 60.67 3dra n THR 329 Cb 0.84 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.45 3dra n THR 329 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3dra n GLN 330 N -1.81 2.78 -3.05 -0.78 7.27 0.05 -1.68 117.38 120.16 3dra n GLN 330 Ca -0.01 1.00 -0.44 0.00 0.07 0.00 0.00 57.00 57.63 3dra n GLN 330 Cb 0.33 -2.86 -0.05 0.00 2.41 0.00 0.00 30.24 30.07 3dra n GLN 330 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 3dra s ASN 331 N 1.58 6.24 0.41 1.69 3.84 -0.15 -4.89 114.94 123.65 3dra s ASN 331 Ca 0.77 -0.89 0.20 0.00 0.21 0.00 0.00 52.86 53.16 3dra s ASN 331 Cb -0.50 -2.34 0.86 0.00 -0.55 0.00 0.00 41.25 38.72 3dra s ASN 331 CO 0.34 -1.06 1.82 1.56 -2.79 0.00 0.00 177.10 176.97 3dra h GLN 332 N 9.15 0.00 0.06 0.43 1.08 -1.90 0.29 115.11 124.23 3dra h GLN 332 Ca -0.28 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 56.72 3dra h GLN 332 Cb 1.09 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.51 3dra h GLN 332 CO 1.04 0.31 -1.06 -0.07 -0.95 0.00 0.00 178.83 178.09 3dra h LEU 333 N 0.00 0.21 0.00 1.46 4.07 -1.97 -3.40 115.31 115.67 3dra h LEU 333 Ca -0.00 -0.79 0.00 0.00 0.08 0.00 0.00 57.88 57.16 3dra h LEU 333 Cb 0.75 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.42 3dra h LEU 333 CO 0.04 1.45 -1.48 0.49 -1.08 0.00 0.00 178.44 177.86 3dra n PHE 334 N -4.20 0.13 0.00 1.13 3.72 -1.23 -5.10 117.46 111.90 3dra n PHE 334 Ca -0.23 0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 3dra n PHE 334 Cb 0.75 -0.41 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 3dra n PHE 334 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dra n GLY 335 N 1.33 -1.39 0.46 1.37 0.00 0.09 -4.55 105.19 102.51 3dra n GLY 335 Ca -0.01 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.49 3dra n GLY 335 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dra n GLY 336 N -1.67 -1.70 3.20 -0.02 0.00 -1.26 -4.50 105.19 99.24 3dra n GLY 336 Ca 0.00 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.35 3dra n GLY 336 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dra s PHE 337 N -1.72 1.81 0.51 1.61 0.08 -1.26 -0.98 117.98 118.02 3dra s PHE 337 Ca 0.00 -0.36 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 3dra s PHE 337 Cb 0.00 -1.17 -0.02 0.00 -0.57 0.00 0.00 43.02 41.26 3dra s PHE 337 CO 0.00 -0.05 0.80 0.20 -0.10 0.00 0.00 175.22 176.08 3dra s GLY 338 N -0.42 1.53 0.28 4.36 0.00 -0.67 -2.82 107.32 109.56 3dra s GLY 338 Ca 0.06 -0.59 0.01 0.00 0.00 0.00 0.00 44.72 44.20 3dra s GLY 338 CO -0.00 -0.40 1.74 -0.09 0.00 0.00 0.00 173.10 174.35 3dra h ARG 339 N 0.14 0.54 0.00 2.90 2.43 -1.82 -3.41 114.38 115.17 3dra h ARG 339 Ca -0.47 -0.03 -0.26 0.00 -0.81 0.00 0.00 59.98 58.41 3dra h ARG 339 Cb 1.22 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.59 3dra h ARG 339 CO 0.61 0.36 -0.14 -0.40 -1.51 0.00 0.00 179.97 178.89 3dra n ASP 340 N -4.92 -1.28 0.04 -3.80 5.68 -1.26 -0.69 116.55 110.33 3dra n ASP 340 Ca 0.19 -2.78 0.08 0.00 -0.50 0.00 0.00 54.79 51.78 3dra n ASP 340 Cb 0.52 2.38 0.34 0.00 -1.14 0.00 0.00 41.12 43.22 3dra n ASP 340 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 3dra n PRO 341 N -0.54 0.06 -0.06 0.11 -0.02 -1.26 -2.29 135.00 130.99 3dra n PRO 341 Ca 0.01 0.34 0.09 0.00 -2.02 0.00 0.00 63.50 61.92 3dra n PRO 341 Cb 0.55 -1.63 0.11 0.00 -0.02 0.00 0.00 33.50 32.52 3dra n PRO 341 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3dra n ASP 342 N -1.74 2.73 -4.78 2.55 8.00 -1.26 -4.96 116.55 117.09 3dra n ASP 342 Ca 0.02 -1.81 -0.33 0.00 0.71 0.00 0.00 54.79 53.39 3dra n ASP 342 Cb 0.16 -0.08 -0.07 0.00 -0.02 0.00 0.00 41.12 41.11 3dra n ASP 342 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3dra s SER 343 N -1.40 5.64 0.44 -2.24 0.01 -0.97 -5.09 113.70 110.08 3dra s SER 343 Ca 0.25 0.12 -0.22 0.00 1.31 0.00 0.00 55.95 57.41 3dra s SER 343 Cb 0.16 -1.60 -0.10 0.00 0.21 0.00 0.00 66.02 64.69 3dra s SER 343 CO 0.23 0.26 1.00 0.42 0.41 0.00 0.00 173.24 175.56 3dra s THR 344 N -1.21 4.04 0.69 1.44 -4.23 -1.26 -4.38 115.64 110.73 3dra s THR 344 Ca 0.23 1.35 -0.17 0.00 -1.18 0.00 0.00 61.69 61.93 3dra s THR 344 Cb -0.12 -3.59 0.01 0.00 1.34 0.00 0.00 72.50 70.14 3dra s THR 344 CO 0.15 -0.20 1.26 -2.16 -0.54 0.00 0.00 174.62 173.13 3dra s PRO 345 N -3.00 2.35 0.05 3.99 0.04 -1.26 -4.56 135.00 132.61 3dra s PRO 345 Ca 0.62 1.95 -0.04 0.00 0.04 0.00 0.00 61.00 63.58 3dra s PRO 345 Cb -0.15 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 3dra s PRO 345 CO 0.19 -1.73 0.05 0.16 0.04 0.00 0.00 177.00 175.71 3dra s ASP 346 N -1.63 0.31 0.24 6.66 -4.77 -1.13 -4.94 116.67 111.42 3dra s ASP 346 Ca 0.79 -0.76 -0.06 0.00 -3.30 0.00 0.00 52.55 49.23 3dra s ASP 346 Cb -0.34 0.23 0.29 0.00 -1.09 0.00 0.00 42.92 42.00 3dra s ASP 346 CO 0.42 -0.58 1.89 -0.65 0.70 0.00 0.00 175.17 176.96 3dra h PRO 347 N 3.33 1.15 0.17 2.11 0.11 -1.96 -1.33 132.00 135.58 3dra h PRO 347 Ca -0.33 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3dra h PRO 347 Cb 1.17 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3dra h PRO 347 CO 0.58 0.76 -0.08 1.98 -0.21 0.00 0.00 178.00 181.03 3dra h MET 348 N 1.19 -0.21 -0.22 1.05 4.05 -1.94 -0.05 114.93 118.78 3dra h MET 348 Ca 0.37 0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 59.75 3dra h MET 348 Cb -0.01 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 3dra h MET 348 CO -0.12 0.07 -0.09 0.45 0.23 0.00 0.00 176.91 177.46 3dra h HIS 349 N -0.50 0.37 -0.38 1.39 3.86 -1.82 -1.96 115.15 116.11 3dra h HIS 349 Ca -0.02 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.11 3dra h HIS 349 Cb 0.39 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.74 3dra h HIS 349 CO 0.02 0.44 0.09 0.77 0.86 0.00 0.00 177.93 180.11 3dra h SER 350 N 0.34 0.58 -0.36 2.45 0.02 -1.05 -0.93 113.55 114.60 3dra h SER 350 Ca 0.07 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 3dra h SER 350 Cb 0.37 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 3dra h SER 350 CO 0.02 0.67 -0.05 0.22 -1.14 0.00 0.00 176.83 176.55 3dra h TYR 351 N 0.47 0.74 0.00 3.45 3.20 -0.80 -2.66 116.97 121.37 3dra h TYR 351 Ca 0.12 -0.15 -0.10 0.00 3.14 0.00 0.00 58.73 61.74 3dra h TYR 351 Cb 0.32 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 3dra h TYR 351 CO 0.02 0.80 -0.50 -0.07 -1.64 0.00 0.00 178.16 176.77 3dra h LEU 352 N 0.46 0.00 -0.58 2.82 3.38 -1.28 -0.23 115.31 119.88 3dra h LEU 352 Ca 0.09 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 3dra h LEU 352 Cb 0.54 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 3dra h LEU 352 CO 0.03 0.50 0.26 0.00 0.09 0.00 0.00 178.44 179.32 3dra h ALA 353 N 1.50 0.75 -0.32 1.53 0.00 -1.09 -1.43 119.26 120.21 3dra h ALA 353 Ca -0.00 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 3dra h ALA 353 Cb 0.99 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3dra h ALA 353 CO 0.06 0.34 -0.45 -0.07 0.00 0.00 0.00 179.25 179.13 3dra h LEU 354 N 0.80 0.93 -0.85 0.00 3.38 -1.06 -1.73 115.31 116.77 3dra h LEU 354 Ca 0.20 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.74 3dra h LEU 354 Cb 0.15 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 3dra h LEU 354 CO -0.02 1.24 0.55 0.00 0.09 0.00 0.00 178.44 180.30 3dra h ALA 355 N 0.80 1.11 -0.13 1.53 0.00 -1.00 0.39 119.26 121.95 3dra h ALA 355 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dra h ALA 355 Cb 1.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3dra h ALA 355 CO 0.10 0.42 0.08 0.77 0.00 0.00 0.00 179.25 180.62 3dra h SER 356 N 1.10 0.17 -0.37 0.00 0.02 -1.00 -1.04 113.55 112.42 3dra h SER 356 Ca 0.33 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.15 3dra h SER 356 Cb -0.04 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 3dra h SER 356 CO -0.10 0.19 0.07 -0.07 -1.14 0.00 0.00 176.83 175.78 3dra h LEU 357 N 0.13 0.65 -0.46 5.07 3.38 -0.97 -1.21 115.31 121.90 3dra h LEU 357 Ca 0.05 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3dra h LEU 357 Cb 0.06 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3dra h LEU 357 CO -0.01 0.68 0.13 -1.28 0.09 0.00 0.00 178.44 178.05 3dra h SER 358 N 0.67 0.69 -0.92 -0.43 0.87 -0.80 -0.53 113.55 113.10 3dra h SER 358 Ca 0.15 -0.22 0.01 0.00 -1.23 0.00 0.00 61.79 60.50 3dra h SER 358 Cb 0.32 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 62.05 3dra h SER 358 CO 0.00 0.72 0.61 0.25 -0.53 0.00 0.00 176.83 177.89 3dra h LEU 359 N 0.62 1.04 0.08 2.23 5.85 -0.42 -2.38 115.31 122.33 3dra h LEU 359 Ca 0.15 -0.02 -0.26 0.00 0.84 0.00 0.00 57.88 58.58 3dra h LEU 359 Cb 0.29 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3dra h LEU 359 CO -0.00 0.75 -1.25 -0.50 -0.34 0.00 0.00 178.44 177.09 3dra h TRP 360 N 1.23 0.29 0.00 1.25 6.55 -1.04 -3.43 115.95 120.80 3dra h TRP 360 Ca 0.34 -0.21 -0.11 0.00 0.95 0.00 0.00 58.89 59.85 3dra h TRP 360 Cb -0.13 -0.01 -0.13 0.00 -0.86 0.00 0.00 29.16 28.03 3dra h TRP 360 CO -0.01 1.19 -0.15 -1.71 -1.05 0.00 0.00 178.44 176.71 3dra n ASN 361 N -3.42 -1.72 -0.19 -3.49 2.85 -0.23 -5.02 115.26 104.04 3dra n ASN 361 Ca -0.08 -2.22 0.02 0.00 -0.11 0.00 0.00 54.58 52.18 3dra n ASN 361 Cb 1.00 1.06 0.27 0.00 1.24 0.00 0.00 39.78 43.36 3dra n ASN 361 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 3dra h HIS 362 N 3.26 0.89 -0.45 1.20 2.07 -1.48 -2.86 115.15 117.77 3dra h HIS 362 Ca -0.22 0.02 -0.04 0.00 -2.85 0.00 0.00 60.37 57.28 3dra h HIS 362 Cb 1.16 -0.30 -0.02 0.00 2.57 0.00 0.00 27.41 30.82 3dra h HIS 362 CO -0.08 0.55 0.11 0.93 -3.07 0.00 0.00 177.93 176.37 3dra h GLU 363 N 0.95 0.72 -0.02 5.12 3.07 -1.89 -0.72 114.58 121.81 3dra h GLU 363 Ca 0.27 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 58.94 3dra h GLU 363 Cb -0.07 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 27.74 3dra h GLU 363 CO -0.06 0.71 -0.06 -0.22 -1.40 0.00 0.00 179.01 177.98 3dra h LYS 364 N 0.60 0.03 -0.24 2.33 3.64 -1.91 -2.97 116.57 118.04 3dra h LYS 364 Ca 0.14 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3dra h LYS 364 Cb 0.32 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3dra h LYS 364 CO 0.00 0.09 0.00 1.19 -2.27 0.00 0.00 179.45 178.46 3dra n PHE 365 N -4.45 0.31 -3.14 1.91 3.72 -1.04 -4.99 117.46 109.79 3dra n PHE 365 Ca -0.03 -0.29 -0.18 0.00 -0.05 0.00 0.00 57.45 56.91 3dra n PHE 365 Cb 0.15 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.72 3dra n PHE 365 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dra n ALA 366 N 0.70 -0.89 -2.77 4.37 0.00 -0.38 -4.99 120.51 116.55 3dra n ALA 366 Ca 0.11 0.28 -0.28 0.00 0.00 0.00 0.00 53.44 53.55 3dra n ALA 366 Cb 0.40 -3.84 -0.06 0.00 0.00 0.00 0.00 19.45 15.95 3dra n ALA 366 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dra s LEU 367 N -5.56 3.72 0.58 0.00 1.43 -0.57 -4.68 118.68 113.60 3dra s LEU 367 Ca 0.36 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 53.14 3dra s LEU 367 Cb -0.16 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 3dra s LEU 367 CO 0.45 0.11 1.22 -1.10 0.23 0.00 0.00 176.35 177.25 3dra s GLN 368 N -2.83 3.03 0.51 1.70 -1.52 -0.51 -4.57 119.66 115.46 3dra s GLN 368 Ca 0.30 1.86 -0.22 0.00 -1.95 0.00 0.00 55.36 55.35 3dra s GLN 368 Cb -0.11 -1.98 -0.06 0.00 -0.22 0.00 0.00 33.01 30.64 3dra s GLN 368 CO 0.22 -1.17 1.21 -1.21 -0.25 0.00 0.00 175.29 174.09 3dra s GLU 369 N -3.26 3.47 0.01 2.91 2.02 -1.26 -4.85 118.70 117.74 3dra s GLU 369 Ca 0.76 1.86 0.04 0.00 0.02 0.00 0.00 54.97 57.65 3dra s GLU 369 Cb -0.31 -2.26 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 3dra s GLU 369 CO 0.34 -0.81 -0.08 -1.50 0.02 0.00 0.00 175.26 173.23 3dra s ILE 370 N -1.53 3.54 -0.35 -1.63 1.10 -1.26 -0.92 121.20 120.16 3dra s ILE 370 Ca 0.68 -0.83 -0.16 0.00 -0.51 0.00 0.00 60.65 59.83 3dra s ILE 370 Cb -0.31 -2.54 -0.01 0.00 0.15 0.00 0.00 42.46 39.76 3dra s ILE 370 CO 0.36 0.38 0.41 0.21 -2.11 0.00 0.00 174.94 174.19 3dra s ASN 371 N -1.44 6.21 0.00 4.50 3.84 0.67 -4.67 114.94 124.06 3dra s ASN 371 Ca 0.17 -0.24 0.24 0.00 0.21 0.00 0.00 52.86 53.24 3dra s ASN 371 Cb -0.11 -2.22 1.01 0.00 -0.55 0.00 0.00 41.25 39.38 3dra s ASN 371 CO 0.07 -0.40 1.76 -2.65 -2.79 0.00 0.00 177.10 173.09 3dra n PRO 372 N 5.49 0.00 0.03 0.43 -0.02 -1.26 -0.33 135.00 139.35 3dra n PRO 372 Ca -0.08 0.09 -0.21 0.00 -2.02 0.00 0.00 63.50 61.29 3dra n PRO 372 Cb 0.49 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 32.32 3dra n PRO 372 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3dra h ILE 373 N 0.00 1.31 0.00 4.25 2.04 -1.93 -3.37 117.51 119.81 3dra h ILE 373 Ca 0.00 -2.48 0.00 0.00 1.00 0.00 0.00 64.86 63.38 3dra h ILE 373 Cb 0.41 2.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 3dra h ILE 373 CO 0.00 0.71 -1.14 0.18 0.00 0.00 0.00 178.15 177.90 3dra n LEU 374 N -4.04 0.63 -3.74 1.44 4.32 -1.20 -4.99 117.00 109.42 3dra n LEU 374 Ca -0.19 -0.17 -0.28 0.00 -0.02 0.00 0.00 56.01 55.36 3dra n LEU 374 Cb 0.86 -0.06 0.04 0.00 -1.62 0.00 0.00 43.42 42.64 3dra n LEU 374 CO 0.45 0.11 0.14 0.41 -1.22 0.00 0.00 177.39 177.28 3dra n THR 375 N -1.83 -2.24 -4.48 -5.08 -1.04 0.55 -5.03 114.28 95.14 3dra n THR 375 Ca 0.02 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.80 3dra n THR 375 Cb 0.42 -3.16 -0.11 0.00 -1.82 0.00 0.00 70.33 65.66 3dra n THR 375 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 3dra s ILE 376 N -3.28 1.49 0.60 12.58 -4.36 -1.20 -4.96 121.20 122.07 3dra s ILE 376 Ca 0.61 -2.04 -0.18 0.00 -0.26 0.00 0.00 60.65 58.79 3dra s ILE 376 Cb -0.30 -2.74 -0.03 0.00 1.25 0.00 0.00 42.46 40.64 3dra s ILE 376 CO 0.76 -0.09 1.18 0.42 0.24 0.00 0.00 174.94 177.45 3dra s THR 377 N -3.09 2.77 0.40 8.37 -4.23 -1.26 -0.23 115.64 118.36 3dra s THR 377 Ca 0.34 0.45 0.06 0.00 -1.18 0.00 0.00 61.69 61.37 3dra s THR 377 Cb 0.08 -3.13 0.26 0.00 1.34 0.00 0.00 72.50 71.05 3dra s THR 377 CO 0.15 -0.13 2.05 0.11 -0.54 0.00 0.00 174.62 176.26 3dra h LYS 378 N 0.73 0.59 -0.35 3.99 1.57 -1.30 -1.44 116.57 120.36 3dra h LYS 378 Ca -0.50 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.10 3dra h LYS 378 Cb 1.28 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 3dra h LYS 378 CO 0.55 0.40 -0.37 1.49 -0.57 0.00 0.00 179.45 180.94 3dra h GLU 379 N 0.60 0.82 -0.54 3.15 4.81 -1.91 -0.94 114.58 120.57 3dra h GLU 379 Ca 0.16 -0.42 -0.04 0.00 -0.13 0.00 0.00 59.36 58.93 3dra h GLU 379 Cb -0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3dra h GLU 379 CO -0.03 1.05 0.16 1.03 -0.73 0.00 0.00 179.01 180.49 3dra h SER 380 N 0.68 0.79 -0.96 1.04 0.87 -1.83 -1.93 113.55 112.20 3dra h SER 380 Ca 0.06 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 3dra h SER 380 Cb 0.93 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.64 3dra h SER 380 CO 0.09 0.79 0.62 0.22 -0.53 0.00 0.00 176.83 178.01 3dra h TYR 381 N 0.74 1.24 0.21 2.24 3.20 -1.17 -1.36 116.97 122.08 3dra h TYR 381 Ca 0.17 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3dra h TYR 381 Cb 0.29 -0.41 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 3dra h TYR 381 CO 0.02 0.80 -0.18 1.96 -1.64 0.00 0.00 178.16 179.11 3dra h GLN 382 N 1.32 -0.40 -0.82 1.82 1.08 -0.77 -0.89 115.11 116.44 3dra h GLN 382 Ca 0.35 0.03 0.20 0.00 -1.45 0.00 0.00 58.65 57.78 3dra h GLN 382 Cb -0.11 0.09 -0.14 0.00 -0.05 0.00 0.00 27.48 27.27 3dra h GLN 382 CO -0.07 -0.27 0.07 0.35 -0.95 0.00 0.00 178.83 177.96 3dra h PHE 383 N -0.41 0.06 -0.48 2.96 3.57 -1.00 -1.81 116.94 119.82 3dra h PHE 383 Ca -0.01 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3dra h PHE 383 Cb 0.38 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 3dra h PHE 383 CO -0.13 -0.26 0.20 0.35 -2.23 0.00 0.00 178.31 176.24 3dra h PHE 384 N 0.12 0.73 0.00 0.41 3.57 -0.27 0.71 116.94 122.21 3dra h PHE 384 Ca 0.48 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.85 3dra h PHE 384 Cb 0.89 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 3dra h PHE 384 CO -0.39 0.61 -0.36 -0.22 -2.23 0.00 0.00 178.31 175.71 3dra h LYS 385 N 0.64 0.00 0.01 1.11 3.64 -0.40 -2.70 116.57 118.86 3dra h LYS 385 Ca 0.16 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.17 3dra h LYS 385 Cb 0.18 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.93 3dra h LYS 385 CO -0.01 0.36 -2.35 0.39 -2.27 0.00 0.00 179.45 175.57 3dra n GLU 386 N -3.32 0.68 -0.05 1.90 1.02 -0.80 -4.71 120.64 115.37 3dra n GLU 386 Ca 0.01 0.09 0.01 0.00 -0.02 0.00 0.00 57.16 57.25 3dra n GLU 386 Cb 0.59 -1.55 -0.14 0.00 -0.02 0.00 0.00 31.44 30.31 3dra n GLU 386 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dra n GLU 387 N -3.00 0.82 -2.69 3.49 -0.58 0.24 -4.73 120.64 114.19 3dra n GLU 387 Ca -0.36 -0.10 -0.42 0.00 -0.42 0.00 0.00 57.16 55.86 3dra n GLU 387 Cb 1.08 -1.45 -0.03 0.00 -0.57 0.00 0.00 31.44 30.47 3dra n GLU 387 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3dra s ILE 388 N -2.91 4.14 -0.75 -3.67 -1.09 -1.02 -4.95 121.20 110.95 3dra s ILE 388 Ca -0.08 -0.66 -0.16 0.00 -2.23 0.00 0.00 60.65 57.52 3dra s ILE 388 Cb 0.09 -4.90 0.16 0.00 -1.58 0.00 0.00 42.46 36.23 3dra s ILE 388 CO 0.76 -1.74 0.78 -0.54 -1.23 0.00 0.00 174.94 172.97 3dra s LYS 389 N 4.43 3.38 0.00 2.79 -0.14 -1.26 -4.92 119.74 124.03 3dra s LYS 389 Ca 0.37 -1.96 0.27 0.00 -1.36 0.00 0.00 55.97 53.29 3dra s LYS 389 Cb -0.05 -4.47 0.93 0.00 -1.68 0.00 0.00 37.83 32.56 3dra s LYS 389 CO -0.02 -1.45 1.68 0.66 -0.76 0.00 0.00 175.35 175.46