#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3duf s PHE 5 N 0.00 2.98 0.09 4.78 5.36 -1.26 -5.11 117.98 124.82 3duf s PHE 5 Ca 0.00 -1.59 0.10 0.00 -0.96 0.00 0.00 56.93 54.48 3duf s PHE 5 Cb 0.00 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.64 3duf s PHE 5 CO 0.00 -0.75 -0.25 1.14 -1.46 0.00 0.00 175.22 173.90 3duf s GLN 6 N 1.31 1.63 0.63 10.12 0.00 -1.26 -5.14 119.66 126.95 3duf s GLN 6 Ca 0.02 -1.22 -0.10 0.00 -0.00 0.00 0.00 55.36 54.06 3duf s GLN 6 Cb -0.15 -1.97 -0.01 0.00 0.00 0.00 0.00 33.01 30.87 3duf s GLN 6 CO -0.07 0.48 1.01 -0.06 0.00 0.00 0.00 175.29 176.65 3duf s PHE 7 N -0.97 3.45 -0.90 9.60 0.40 -1.26 -4.91 117.98 123.39 3duf s PHE 7 Ca 0.14 1.04 -0.07 0.00 -0.60 0.00 0.00 56.93 57.44 3duf s PHE 7 Cb -0.10 -2.81 -0.06 0.00 0.51 0.00 0.00 43.02 40.56 3duf s PHE 7 CO 0.05 -0.86 2.08 -0.35 0.70 0.00 0.00 175.22 176.84 3duf n PRO 8 N -2.77 2.02 0.07 0.24 -0.04 -1.26 -4.58 135.00 128.68 3duf n PRO 8 Ca 0.05 -1.47 -0.13 0.00 -0.04 0.00 0.00 63.50 61.91 3duf n PRO 8 Cb 0.56 -2.48 -0.09 0.00 -0.04 0.00 0.00 33.50 31.45 3duf n PRO 8 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3duf h PHE 9 N 6.45 -0.19 -0.94 0.54 0.04 -1.99 -0.76 116.94 120.08 3duf h PHE 9 Ca 0.48 -0.00 0.14 0.00 2.80 0.00 0.00 57.97 61.39 3duf h PHE 9 Cb 0.19 0.06 -0.09 0.00 2.20 0.00 0.00 35.95 38.31 3duf h PHE 9 CO 1.91 0.19 0.56 0.00 -0.60 0.00 0.00 178.31 180.37 3duf h ALA 10 N 0.11 1.45 -0.34 2.45 0.00 -2.02 -0.03 119.26 120.88 3duf h ALA 10 Ca -0.02 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3duf h ALA 10 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3duf h ALA 10 CO 0.03 0.06 -0.25 1.49 0.00 0.00 0.00 179.25 180.58 3duf h GLU 11 N 0.82 0.77 -0.71 0.00 4.81 -1.92 -3.09 114.58 115.26 3duf h GLU 11 Ca 0.50 -0.37 0.16 0.00 -0.13 0.00 0.00 59.36 59.51 3duf h GLU 11 Cb 0.62 -0.00 -0.12 0.00 0.63 0.00 0.00 28.75 29.88 3duf h GLU 11 CO -0.32 1.00 0.02 0.37 -0.73 0.00 0.00 179.01 179.35 3duf h GLN 12 N 0.55 0.12 -0.19 1.92 4.15 0.55 0.32 115.11 122.51 3duf h GLN 12 Ca 0.06 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.40 3duf h GLN 12 Cb 0.82 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 3duf h GLN 12 CO 0.07 0.08 -0.21 -0.07 -1.93 0.00 0.00 178.83 176.76 3duf h LEU 13 N 0.12 0.34 -0.22 -2.39 3.38 -1.43 -2.81 115.31 112.30 3duf h LEU 13 Ca 0.38 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 3duf h LEU 13 Cb 0.66 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3duf h LEU 13 CO -0.61 0.56 -0.27 -0.08 0.09 0.00 0.00 178.44 178.13 3duf h GLU 14 N 0.31 0.57 -0.21 1.13 4.57 -0.45 -2.70 114.58 117.80 3duf h GLU 14 Ca 0.05 -0.32 -0.06 0.00 -1.18 0.00 0.00 59.36 57.85 3duf h GLU 14 Cb 0.55 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 3duf h GLU 14 CO 0.04 0.92 -0.13 0.87 -1.18 0.00 0.00 179.01 179.53 3duf h LYS 15 N 0.26 0.35 0.03 1.92 1.79 -0.56 -2.78 116.57 117.57 3duf h LYS 15 Ca 0.03 -0.09 -0.21 0.00 -2.18 0.00 0.00 60.65 58.19 3duf h LYS 15 Cb 0.84 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.44 3duf h LYS 15 CO 0.07 0.48 -0.96 -0.39 -1.08 0.00 0.00 179.45 177.57 3duf h VAL 16 N 0.33 1.54 -0.99 0.50 -1.51 -1.52 -3.25 116.25 111.34 3duf h VAL 16 Ca 0.06 -2.85 0.03 0.00 -1.23 0.00 0.00 66.70 62.72 3duf h VAL 16 Cb 0.43 2.62 -0.06 0.00 -2.13 0.00 0.00 31.29 32.16 3duf h VAL 16 CO 0.03 0.83 0.65 0.00 -1.23 0.00 0.00 177.57 177.84 3duf h ALA 17 N 0.91 1.30 0.00 5.19 0.00 -1.21 -2.20 119.26 123.25 3duf h ALA 17 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3duf h ALA 17 Cb 1.64 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3duf h ALA 17 CO 0.15 0.56 0.00 0.39 0.00 0.00 0.00 179.25 180.34 3duf n GLU 18 N -4.44 0.02 0.00 0.00 1.02 -1.11 -2.35 120.64 113.77 3duf n GLU 18 Ca 0.13 0.22 0.14 0.00 -0.02 0.00 0.00 57.16 57.62 3duf n GLU 18 Cb 0.08 -1.50 0.50 0.00 -0.02 0.00 0.00 31.44 30.50 3duf n GLU 18 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3duf n GLN 19 N -1.48 1.31 -3.39 3.49 1.13 -0.83 -4.44 117.38 113.18 3duf n GLN 19 Ca 0.04 -0.73 -0.26 0.00 -1.94 0.00 0.00 57.00 54.12 3duf n GLN 19 Cb 0.18 -1.48 -0.09 0.00 0.11 0.00 0.00 30.24 28.96 3duf n GLN 19 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 3duf n PHE 20 N -0.21 1.14 -2.33 1.08 3.72 -0.99 -5.02 117.46 114.85 3duf n PHE 20 Ca 0.17 -3.78 -0.28 0.00 -0.05 0.00 0.00 57.45 53.50 3duf n PHE 20 Cb 0.34 -0.33 0.01 0.00 -0.94 0.00 0.00 39.48 38.56 3duf n PHE 20 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3duf s PRO 21 N -1.35 3.42 -0.39 -1.08 0.04 -1.26 -4.87 135.00 129.51 3duf s PRO 21 Ca 0.35 0.34 -0.29 0.00 0.04 0.00 0.00 61.00 61.44 3duf s PRO 21 Cb 0.11 -2.25 0.02 0.00 0.04 0.00 0.00 34.50 32.42 3duf s PRO 21 CO -0.11 -0.44 1.13 0.99 0.04 0.00 0.00 177.00 178.61 3duf s THR 22 N -2.95 4.33 0.02 1.26 2.01 -1.26 -4.34 115.64 114.71 3duf s THR 22 Ca 0.51 1.46 -0.30 0.00 0.31 0.00 0.00 61.69 63.67 3duf s THR 22 Cb -0.11 -4.47 -0.05 0.00 0.01 0.00 0.00 72.50 67.88 3duf s THR 22 CO 0.48 -0.72 1.21 0.12 -0.69 0.00 0.00 174.62 175.01 3duf s PHE 23 N 4.12 3.32 0.10 4.92 5.36 0.15 -4.90 117.98 131.06 3duf s PHE 23 Ca 0.48 1.25 -0.05 0.00 -0.96 0.00 0.00 56.93 57.65 3duf s PHE 23 Cb -0.10 -3.43 -0.02 0.00 -0.34 0.00 0.00 43.02 39.13 3duf s PHE 23 CO 0.24 -1.33 0.11 -1.14 -1.46 0.00 0.00 175.22 171.64 3duf s GLN 24 N 1.54 0.86 0.16 10.12 0.74 -1.26 -1.53 119.66 130.29 3duf s GLN 24 Ca 0.58 -1.20 0.00 0.00 0.05 0.00 0.00 55.36 54.79 3duf s GLN 24 Cb -0.28 0.29 0.00 0.00 1.10 0.00 0.00 33.01 34.12 3duf s GLN 24 CO 0.27 -0.25 0.00 -0.89 -0.55 0.00 0.00 175.29 173.86 3duf n ILE 25 N -0.05 0.14 -4.06 -2.34 5.41 -1.26 -4.68 119.36 112.52 3duf n ILE 25 Ca -0.11 0.05 -0.32 0.00 1.00 0.00 0.00 62.75 63.37 3duf n ILE 25 Cb 0.62 -0.69 -0.06 0.00 -0.71 0.00 0.00 39.64 38.80 3duf n ILE 25 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3duf s LEU 26 N -6.29 3.91 0.00 1.39 1.43 -1.26 -0.82 118.68 117.04 3duf s LEU 26 Ca 0.00 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3duf s LEU 26 Cb 0.00 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.78 3duf s LEU 26 CO 0.00 0.22 0.00 -0.46 0.23 0.00 0.00 176.35 176.34 3duf n ASN 27 N 0.78 0.60 -0.33 2.29 6.94 -0.98 -4.90 115.26 119.66 3duf n ASN 27 Ca -0.10 -0.90 0.04 0.00 -0.02 0.00 0.00 54.58 53.60 3duf n ASN 27 Cb 0.52 0.00 0.19 0.00 -2.36 0.00 0.00 39.78 38.13 3duf n ASN 27 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 3duf h GLU 28 N 0.00 0.93 -0.70 -3.83 5.08 -1.93 -1.77 114.58 112.36 3duf h GLU 28 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3duf h GLU 28 Cb 0.00 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.04 3duf h GLU 28 CO 0.00 0.61 0.00 0.39 -1.00 0.00 0.00 179.01 179.01 3duf n GLU 29 N -4.64 1.83 -3.08 2.33 4.71 -1.26 -4.28 120.64 116.26 3duf n GLU 29 Ca 0.15 -0.76 -0.21 0.00 -0.01 0.00 0.00 57.16 56.33 3duf n GLU 29 Cb 0.27 -1.54 0.04 0.00 -1.01 0.00 0.00 31.44 29.20 3duf n GLU 29 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3duf n GLY 30 N 0.34 -0.45 3.60 0.62 0.00 -0.66 -4.83 105.19 103.79 3duf n GLY 30 Ca 0.07 0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3duf n GLY 30 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3duf s GLU 31 N -5.75 3.53 -0.01 1.61 2.02 -1.26 -4.30 118.70 114.55 3duf s GLU 31 Ca 0.34 -0.43 -0.30 0.00 0.02 0.00 0.00 54.97 54.59 3duf s GLU 31 Cb -0.15 -2.96 -0.06 0.00 0.10 0.00 0.00 34.13 31.07 3duf s GLU 31 CO 0.42 0.40 1.47 0.08 0.02 0.00 0.00 175.26 177.65 3duf s VAL 32 N -0.04 3.61 -0.06 2.63 1.01 -1.26 -2.31 120.40 123.98 3duf s VAL 32 Ca 0.03 0.96 0.08 0.00 0.00 0.00 0.00 61.98 63.06 3duf s VAL 32 Cb -0.13 -3.62 0.13 0.00 0.00 0.00 0.00 36.38 32.76 3duf s VAL 32 CO 0.02 -0.02 1.04 1.33 0.00 0.00 0.00 175.10 177.47 3duf n VAL 33 N 4.83 1.29 -2.81 2.92 0.24 0.00 -4.82 118.33 119.98 3duf n VAL 33 Ca 0.14 -1.45 -0.07 0.00 -2.04 0.00 0.00 64.34 60.92 3duf n VAL 33 Cb 0.43 0.20 0.01 0.00 -1.47 0.00 0.00 33.84 33.01 3duf n VAL 33 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3duf n ASN 34 N -0.86 -3.08 -0.13 -1.34 2.85 -1.24 -4.97 115.26 106.49 3duf n ASN 34 Ca 0.07 -2.96 -0.11 0.00 -0.11 0.00 0.00 54.58 51.46 3duf n ASN 34 Cb 0.46 1.58 0.01 0.00 1.24 0.00 0.00 39.78 43.07 3duf n ASN 34 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3duf h GLU 35 N 4.80 0.92 -0.01 1.20 4.39 -1.91 -3.21 114.58 120.77 3duf h GLU 35 Ca 0.03 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.30 3duf h GLU 35 Cb 1.08 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.71 3duf h GLU 35 CO 0.11 1.09 0.25 1.49 -1.16 0.00 0.00 179.01 180.78 3duf h GLU 36 N 0.78 0.00 -0.26 2.33 4.81 -2.01 -1.76 114.58 118.47 3duf h GLU 36 Ca 0.09 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 3duf h GLU 36 Cb 0.86 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.14 3duf h GLU 36 CO 0.08 0.00 -0.34 0.00 -0.73 0.00 0.00 179.01 178.01 3duf n ALA 37 N -1.96 4.17 -2.49 2.92 0.00 -1.21 -5.04 120.51 116.90 3duf n ALA 37 Ca -0.02 -3.32 -0.42 0.00 0.00 0.00 0.00 53.44 49.69 3duf n ALA 37 Cb 0.30 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 3duf n ALA 37 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3duf s MET 38 N -3.31 4.52 -0.58 0.00 0.00 -0.67 -4.97 119.30 114.29 3duf s MET 38 Ca 0.43 1.60 -0.28 0.00 0.00 0.00 0.00 55.69 57.44 3duf s MET 38 Cb 0.39 -3.39 0.03 0.00 0.00 0.00 0.00 34.83 31.86 3duf s MET 38 CO -0.03 -0.11 1.27 -2.14 0.00 0.00 0.00 175.02 174.01 3duf s PRO 39 N 0.83 3.43 -0.47 4.11 0.02 -1.26 -4.95 135.00 136.72 3duf s PRO 39 Ca 0.54 0.28 -0.26 0.00 0.02 0.00 0.00 61.00 61.58 3duf s PRO 39 Cb -0.26 -4.06 -0.06 0.00 0.02 0.00 0.00 34.50 30.15 3duf s PRO 39 CO 0.29 -1.79 2.31 -1.83 -0.33 0.00 0.00 177.00 175.65 3duf s GLU 40 N 5.17 2.32 -0.04 5.54 1.03 -1.26 -4.92 118.70 126.54 3duf s GLU 40 Ca 0.45 1.40 0.05 0.00 0.03 0.00 0.00 54.97 56.90 3duf s GLU 40 Cb -0.08 -4.53 -0.01 0.00 -0.80 0.00 0.00 34.13 28.71 3duf s GLU 40 CO 0.25 -3.03 -0.19 -0.51 -1.33 0.00 0.00 175.26 170.44 3duf s LEU 41 N 11.22 1.98 1.25 1.83 1.43 -1.26 -5.14 118.68 130.00 3duf s LEU 41 Ca 0.94 -0.38 -0.15 0.00 -1.03 0.00 0.00 54.13 53.51 3duf s LEU 41 Cb -0.19 -1.06 0.32 0.00 0.03 0.00 0.00 46.19 45.30 3duf s LEU 41 CO 0.27 0.20 0.99 -1.54 0.23 0.00 0.00 176.35 176.49 3duf n SER 42 N 2.95 -2.31 0.21 2.29 3.41 -1.26 -4.85 113.62 114.07 3duf n SER 42 Ca -0.17 -0.33 0.11 0.00 -0.26 0.00 0.00 58.87 58.22 3duf n SER 42 Cb 0.53 -1.20 0.25 0.00 -0.26 0.00 0.00 64.21 63.52 3duf n SER 42 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3duf h ASP 43 N -2.93 0.00 0.09 4.04 3.32 -2.00 -3.10 116.42 115.84 3duf h ASP 43 Ca -0.60 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.22 3duf h ASP 43 Cb 1.34 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.90 3duf h ASP 43 CO 0.46 0.12 -0.85 -0.08 -1.72 0.00 0.00 179.24 177.17 3duf h GLU 44 N 0.00 0.59 -0.16 3.56 4.22 -2.00 -3.02 114.58 117.77 3duf h GLU 44 Ca -0.00 -0.54 -0.11 0.00 0.08 0.00 0.00 59.36 58.79 3duf h GLU 44 Cb 0.98 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 3duf h GLU 44 CO 0.02 1.16 -0.37 1.96 -2.18 0.00 0.00 179.01 179.60 3duf h GLN 45 N 0.38 0.34 -0.47 1.92 4.20 -1.91 -2.16 115.11 117.41 3duf h GLN 45 Ca -0.07 -0.15 -0.11 0.00 0.06 0.00 0.00 58.65 58.38 3duf h GLN 45 Cb 1.47 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.23 3duf h GLN 45 CO 0.16 0.67 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.76 3duf h LEU 46 N 0.29 0.89 -0.52 1.46 3.38 -1.52 -0.86 115.31 118.43 3duf h LEU 46 Ca 0.03 -0.30 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 3duf h LEU 46 Cb 0.79 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3duf h LEU 46 CO 0.06 1.04 -0.26 0.11 0.09 0.00 0.00 178.44 179.48 3duf h LYS 47 N 0.79 0.93 -0.80 1.13 1.57 -1.39 -1.98 116.57 116.81 3duf h LYS 47 Ca 0.12 -0.41 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 3duf h LYS 47 Cb 0.68 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 3duf h LYS 47 CO 0.05 1.07 0.34 1.49 -0.57 0.00 0.00 179.45 181.83 3duf h GLU 48 N 0.79 1.18 -0.46 3.15 4.57 -1.16 0.17 114.58 122.83 3duf h GLU 48 Ca 0.09 -0.20 -0.05 0.00 -1.18 0.00 0.00 59.36 58.02 3duf h GLU 48 Cb 0.83 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.20 3duf h GLU 48 CO 0.07 0.94 0.09 1.25 -1.18 0.00 0.00 179.01 180.18 3duf h LEU 49 N 1.16 0.71 -0.54 1.64 5.85 -0.90 -1.13 115.31 122.10 3duf h LEU 49 Ca 0.27 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.61 3duf h LEU 49 Cb 0.19 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 3duf h LEU 49 CO -0.03 0.78 -0.21 -0.03 -0.34 0.00 0.00 178.44 178.61 3duf h MET 50 N 0.61 0.95 -0.76 1.25 4.05 -1.03 -2.46 114.93 117.54 3duf h MET 50 Ca 0.14 -0.40 -0.01 0.00 -0.28 0.00 0.00 59.70 59.16 3duf h MET 50 Cb 0.36 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.09 3duf h MET 50 CO 0.01 1.06 0.45 -0.09 0.23 0.00 0.00 176.91 178.57 3duf h ARG 51 N 0.82 1.04 -0.16 0.39 2.43 -0.45 -2.13 114.38 116.31 3duf h ARG 51 Ca 0.11 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 3duf h ARG 51 Cb 0.78 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 3duf h ARG 51 CO 0.06 0.74 -0.40 0.00 -1.51 0.00 0.00 179.97 178.87 3duf h ARG 52 N 1.04 0.36 -0.15 0.20 3.08 -1.07 -2.34 114.38 115.50 3duf h ARG 52 Ca 0.27 -0.17 -0.18 0.00 0.07 0.00 0.00 59.98 59.97 3duf h ARG 52 Cb -0.02 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 3duf h ARG 52 CO -0.05 0.71 -0.64 0.52 -1.07 0.00 0.00 179.97 179.43 3duf h MET 53 N 0.30 0.57 -0.10 0.04 2.86 -1.13 -2.23 114.93 115.24 3duf h MET 53 Ca 0.03 -0.41 -0.20 0.00 -2.06 0.00 0.00 59.70 57.07 3duf h MET 53 Cb 0.84 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.56 3duf h MET 53 CO 0.07 1.03 -0.75 0.28 1.06 0.00 0.00 176.91 178.60 3duf h VAL 54 N 0.41 1.35 -0.59 -2.22 2.07 -1.38 -2.64 116.25 113.25 3duf h VAL 54 Ca -0.01 -2.10 -0.07 0.00 0.82 0.00 0.00 66.70 65.34 3duf h VAL 54 Cb 1.22 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 3duf h VAL 54 CO 0.12 0.64 0.11 0.22 0.02 0.00 0.00 177.57 178.68 3duf h TYR 55 N 0.35 1.02 0.00 1.57 5.03 -1.40 -2.56 116.97 120.99 3duf h TYR 55 Ca -0.04 -0.14 -0.09 0.00 2.58 0.00 0.00 58.73 61.05 3duf h TYR 55 Cb 1.34 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 39.33 3duf h TYR 55 CO 0.06 0.88 -0.41 1.15 -1.32 0.00 0.00 178.16 178.52 3duf h THR 56 N 0.87 1.01 0.00 1.81 2.02 -1.39 -0.57 112.91 116.66 3duf h THR 56 Ca 0.18 -1.57 -0.03 0.00 0.77 0.00 0.00 66.41 65.77 3duf h THR 56 Cb 0.40 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.73 3duf h THR 56 CO 0.01 0.40 -0.13 -0.09 0.37 0.00 0.00 175.52 176.08 3duf h ARG 57 N 0.00 0.00 0.00 6.66 9.65 -1.15 -2.03 114.38 127.50 3duf h ARG 57 Ca -0.00 0.00 -0.27 0.00 -1.10 0.00 0.00 59.98 58.61 3duf h ARG 57 Cb 0.89 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.42 3duf h ARG 57 CO 0.05 0.13 -1.60 0.82 2.80 0.00 0.00 179.97 182.18 3duf h ILE 58 N 0.00 0.87 -0.41 1.20 2.04 -1.01 -3.13 117.51 117.07 3duf h ILE 58 Ca -0.00 -2.66 -0.07 0.00 1.00 0.00 0.00 64.86 63.13 3duf h ILE 58 Cb 0.77 2.40 -0.02 0.00 -0.74 0.00 0.00 36.82 39.23 3duf h ILE 58 CO 0.02 0.50 -0.02 0.25 0.00 0.00 0.00 178.15 178.90 3duf h LEU 59 N 0.00 0.64 -0.33 1.44 5.85 -0.83 -0.54 115.31 121.54 3duf h LEU 59 Ca -0.24 -0.15 -0.17 0.00 0.84 0.00 0.00 57.88 58.16 3duf h LEU 59 Cb 1.93 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.79 3duf h LEU 59 CO 0.08 0.72 -0.46 -0.78 -0.34 0.00 0.00 178.44 177.66 3duf h ASP 60 N 0.63 0.98 -0.28 1.25 3.58 -1.46 -1.07 116.42 120.04 3duf h ASP 60 Ca 0.13 -0.50 -0.17 0.00 0.42 0.00 0.00 57.03 56.91 3duf h ASP 60 Cb 0.42 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.19 3duf h ASP 60 CO 0.02 1.29 -0.47 1.56 -2.88 0.00 0.00 179.24 178.75 3duf h GLN 61 N 0.69 0.82 -0.13 0.28 4.20 -1.44 -2.23 115.11 117.31 3duf h GLN 61 Ca 0.04 -0.50 -0.04 0.00 0.06 0.00 0.00 58.65 58.20 3duf h GLN 61 Cb 1.06 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.89 3duf h GLN 61 CO 0.11 1.14 -0.08 0.00 -0.67 0.00 0.00 178.83 179.33 3duf h ARG 62 N 0.59 0.29 -0.69 1.46 2.47 -1.14 -2.82 114.38 114.53 3duf h ARG 62 Ca 0.02 -0.13 0.12 0.00 -1.26 0.00 0.00 59.98 58.73 3duf h ARG 62 Cb 1.08 -0.01 -0.08 0.00 -1.65 0.00 0.00 29.97 29.31 3duf h ARG 62 CO 0.11 0.63 0.28 0.77 0.56 0.00 0.00 179.97 182.32 3duf h SER 63 N -0.06 0.28 -0.54 7.04 0.02 -1.20 0.50 113.55 119.59 3duf h SER 63 Ca 0.03 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3duf h SER 63 Cb 0.55 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 3duf h SER 63 CO 0.02 0.14 0.34 0.40 -1.14 0.00 0.00 176.83 176.60 3duf h ILE 64 N 0.45 1.10 -0.31 3.27 2.04 -1.37 0.34 117.51 123.05 3duf h ILE 64 Ca 0.36 -0.24 -0.08 0.00 1.00 0.00 0.00 64.86 65.91 3duf h ILE 64 Cb 0.49 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3duf h ILE 64 CO -0.35 0.13 -0.11 0.28 0.00 0.00 0.00 178.15 178.10 3duf h SER 65 N 0.69 0.63 -0.76 1.72 0.02 -0.90 -1.72 113.55 113.22 3duf h SER 65 Ca 0.21 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 3duf h SER 65 Cb -0.04 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 3duf h SER 65 CO -0.07 0.87 0.50 -0.07 -1.14 0.00 0.00 176.83 176.93 3duf h LEU 66 N 0.38 0.82 -0.63 5.07 3.38 0.25 -1.87 115.31 122.71 3duf h LEU 66 Ca 0.07 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 3duf h LEU 66 Cb 0.62 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3duf h LEU 66 CO 0.04 0.58 -0.38 -1.13 0.09 0.00 0.00 178.44 177.63 3duf h ASN 67 N 0.96 0.68 0.70 -0.43 -0.73 -0.72 -1.06 115.58 114.98 3duf h ASN 67 Ca 0.29 -0.30 -0.10 0.00 1.87 0.00 0.00 56.30 58.07 3duf h ASN 67 Cb -0.01 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 38.38 3duf h ASN 67 CO -0.08 0.99 -0.47 0.03 -0.37 0.00 0.00 177.43 177.53 3duf h ARG 68 N 0.53 0.00 0.00 6.67 3.08 -0.67 -2.26 114.38 121.73 3duf h ARG 68 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3duf h ARG 68 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 3duf h ARG 68 CO 0.08 0.47 0.00 1.04 -1.07 0.00 0.00 179.97 180.49 3duf n GLN 69 N -3.70 0.56 -1.22 0.04 6.02 -0.76 -4.87 117.38 113.44 3duf n GLN 69 Ca -0.01 0.03 -0.02 0.00 -0.01 0.00 0.00 57.00 56.99 3duf n GLN 69 Cb 0.54 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.29 3duf n GLN 69 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3duf n GLY 70 N 0.81 0.49 1.00 1.08 0.00 -0.85 -4.93 105.19 102.79 3duf n GLY 70 Ca 0.15 -0.97 0.09 0.00 0.00 0.00 0.00 46.02 45.29 3duf n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3duf n ARG 71 N -2.64 2.84 -3.74 1.61 1.74 -0.42 -4.94 116.66 111.10 3duf n ARG 71 Ca -0.02 -2.37 -0.13 0.00 -0.77 0.00 0.00 57.85 54.56 3duf n ARG 71 Cb 0.14 -1.43 -0.08 0.00 -1.02 0.00 0.00 32.46 30.07 3duf n ARG 71 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3duf s LEU 72 N -1.05 0.75 0.00 0.55 1.43 -1.21 -4.85 118.68 114.30 3duf s LEU 72 Ca 0.36 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.53 3duf s LEU 72 Cb 0.19 1.38 0.00 0.00 0.03 0.00 0.00 46.19 47.79 3duf s LEU 72 CO 0.24 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 176.94 3duf n GLY 73 N 1.10 0.54 3.65 -3.19 0.00 -1.22 -4.65 105.19 101.42 3duf n GLY 73 Ca -0.21 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.32 3duf n GLY 73 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3duf n PHE 74 N 0.00 2.03 -3.72 1.61 7.35 -0.86 -4.87 117.46 119.01 3duf n PHE 74 Ca 0.00 0.36 -0.12 0.00 -0.76 0.00 0.00 57.45 56.93 3duf n PHE 74 Cb 0.00 -2.49 -0.10 0.00 0.35 0.00 0.00 39.48 37.24 3duf n PHE 74 CO 0.00 0.00 0.00 -0.47 -0.76 0.00 0.00 176.76 175.53 3duf s TYR 75 N 1.45 -0.52 -0.28 -5.13 5.04 -1.26 -4.58 117.35 112.06 3duf s TYR 75 Ca 0.84 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.68 3duf s TYR 75 Cb -0.80 0.20 0.05 0.00 0.35 0.00 0.00 41.96 41.77 3duf s TYR 75 CO 0.45 -0.27 -0.05 0.00 -1.34 0.00 0.00 175.55 174.34 3duf s ALA 76 N 0.64 2.70 0.37 3.97 0.00 -1.26 -1.99 121.76 126.19 3duf s ALA 76 Ca -0.03 -1.72 -0.25 0.00 0.00 0.00 0.00 51.96 49.95 3duf s ALA 76 Cb -0.05 -1.76 -0.13 0.00 0.00 0.00 0.00 23.12 21.18 3duf s ALA 76 CO -0.04 -1.18 0.86 -2.30 0.00 0.00 0.00 175.76 173.10 3duf n PRO 77 N 4.56 1.07 0.00 0.00 -0.02 -1.26 -4.86 135.00 134.48 3duf n PRO 77 Ca -0.14 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 3duf n PRO 77 Cb 0.43 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 3duf n PRO 77 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3duf n THR 78 N -0.34 0.00 -1.63 3.45 -2.24 -1.26 -4.95 114.28 107.31 3duf n THR 78 Ca 0.10 -0.47 -0.50 0.00 -2.27 0.00 0.00 64.05 60.91 3duf n THR 78 Cb 0.36 1.05 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 3duf n THR 78 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3duf n ALA 79 N -0.23 0.76 0.00 6.98 0.00 -1.26 -1.49 120.51 125.28 3duf n ALA 79 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3duf n ALA 79 Cb 0.01 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 16.98 3duf n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3duf n GLY 80 N 4.97 2.06 1.03 0.00 0.00 -1.26 0.06 105.19 112.04 3duf n GLY 80 Ca 0.28 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.38 3duf n GLY 80 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3duf n GLN 81 N -0.98 3.20 -0.29 1.61 6.02 -0.55 -4.22 117.38 122.16 3duf n GLN 81 Ca 0.00 -2.60 0.07 0.00 -0.01 0.00 0.00 57.00 54.46 3duf n GLN 81 Cb 0.00 -1.68 0.23 0.00 1.02 0.00 0.00 30.24 29.81 3duf n GLN 81 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3duf h GLU 82 N 2.59 0.58 -0.15 -1.09 3.07 -1.91 -0.14 114.58 117.53 3duf h GLU 82 Ca 0.00 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.76 3duf h GLU 82 Cb 1.22 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 29.00 3duf h GLU 82 CO 0.16 0.38 -0.15 0.00 -1.40 0.00 0.00 179.01 178.01 3duf h ALA 83 N 1.56 0.22 -0.87 3.43 0.00 -1.85 0.79 119.26 122.53 3duf h ALA 83 Ca 0.46 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 55.12 3duf h ALA 83 Cb 0.67 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 3duf h ALA 83 CO -0.37 0.10 0.54 1.03 0.00 0.00 0.00 179.25 180.55 3duf h SER 84 N -0.01 0.85 0.00 0.00 0.87 -1.43 -2.30 113.55 111.53 3duf h SER 84 Ca 0.02 0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.46 3duf h SER 84 Cb 0.67 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 3duf h SER 84 CO 0.04 0.54 -0.80 1.56 -0.53 0.00 0.00 176.83 177.63 3duf h GLN 85 N 0.98 0.00 -0.04 2.24 4.20 -0.91 -3.33 115.11 118.24 3duf h GLN 85 Ca 0.38 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.91 3duf h GLN 85 Cb 0.19 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.98 3duf h GLN 85 CO -0.18 0.91 -0.71 0.82 -0.67 0.00 0.00 178.83 179.00 3duf h ILE 86 N -1.00 1.36 -0.57 2.54 5.03 0.51 -3.19 117.51 122.20 3duf h ILE 86 Ca -0.21 -2.06 -0.04 0.00 -0.12 0.00 0.00 64.86 62.43 3duf h ILE 86 Cb 1.13 2.40 -0.02 0.00 -3.03 0.00 0.00 36.82 37.29 3duf h ILE 86 CO -0.13 0.62 0.18 0.00 -0.68 0.00 0.00 178.15 178.14 3duf h ALA 87 N 0.39 0.74 -0.05 1.87 0.00 -1.48 -1.88 119.26 118.85 3duf h ALA 87 Ca -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3duf h ALA 87 Cb 1.38 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3duf h ALA 87 CO 0.14 0.40 -0.08 0.66 0.00 0.00 0.00 179.25 180.37 3duf h SER 88 N 0.80 0.07 0.58 0.00 4.64 -1.66 -2.13 113.55 115.85 3duf h SER 88 Ca 0.18 -0.01 -0.23 0.00 -0.47 0.00 0.00 61.79 61.27 3duf h SER 88 Cb 0.28 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3duf h SER 88 CO -0.01 0.17 -1.02 -0.74 -0.87 0.00 0.00 176.83 174.36 3duf h HIS 89 N 0.08 0.40 -0.23 4.77 6.17 -1.47 -3.23 115.15 121.65 3duf h HIS 89 Ca 0.02 -0.25 0.05 0.00 0.71 0.00 0.00 60.37 60.90 3duf h HIS 89 Cb 0.20 -0.03 -0.01 0.00 2.52 0.00 0.00 27.41 30.08 3duf h HIS 89 CO 0.00 1.11 0.16 0.35 0.71 0.00 0.00 177.93 180.26 3duf h PHE 90 N 0.11 0.07 0.00 5.26 3.57 -0.65 0.53 116.94 125.84 3duf h PHE 90 Ca -0.08 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.43 3duf h PHE 90 Cb 1.69 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.41 3duf h PHE 90 CO 0.04 0.04 0.00 0.00 -2.23 0.00 0.00 178.31 176.16 3duf n ALA 91 N -2.56 2.11 -1.98 2.41 0.00 -1.17 -4.83 120.51 114.49 3duf n ALA 91 Ca 0.02 -0.10 -0.25 0.00 0.00 0.00 0.00 53.44 53.11 3duf n ALA 91 Cb 0.26 -1.35 0.11 0.00 0.00 0.00 0.00 19.45 18.47 3duf n ALA 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3duf s LEU 92 N -2.60 2.94 0.28 0.00 1.43 0.18 -4.83 118.68 116.07 3duf s LEU 92 Ca 0.20 -0.17 0.04 0.00 -1.03 0.00 0.00 54.13 53.17 3duf s LEU 92 Cb 0.14 -2.19 -0.06 0.00 0.03 0.00 0.00 46.19 44.12 3duf s LEU 92 CO 0.33 -1.94 0.03 -1.61 0.23 0.00 0.00 176.35 173.38 3duf s GLU 93 N -5.25 1.49 0.53 1.70 0.41 -1.26 -5.05 118.70 111.27 3duf s GLU 93 Ca 0.66 -1.79 0.23 0.00 -0.41 0.00 0.00 54.97 53.66 3duf s GLU 93 Cb -0.06 -0.73 1.44 0.00 -1.78 0.00 0.00 34.13 33.00 3duf s GLU 93 CO 0.45 -0.14 2.14 -0.22 -0.49 0.00 0.00 175.26 177.00 3duf h LYS 94 N 2.30 0.00 0.00 1.61 3.64 -1.98 -2.73 116.57 119.40 3duf h LYS 94 Ca -0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 3duf h LYS 94 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 3duf h LYS 94 CO 0.66 0.07 0.00 1.05 -2.27 0.00 0.00 179.45 178.96 3duf h GLU 95 N 0.00 0.00 -7.17 1.90 9.09 -1.96 -3.42 114.58 113.02 3duf h GLU 95 Ca -0.00 0.00 -0.47 0.00 0.05 0.00 0.00 59.36 58.93 3duf h GLU 95 Cb 0.15 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.27 3duf h GLU 95 CO 0.01 0.00 0.37 -0.51 0.05 0.00 0.00 179.01 178.93 3duf s ASP 96 N -4.99 6.34 -0.06 3.06 1.01 -1.03 -4.75 116.67 116.25 3duf s ASP 96 Ca 0.07 1.71 -0.02 0.00 0.71 0.00 0.00 52.55 55.02 3duf s ASP 96 Cb 0.10 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 3duf s ASP 96 CO 0.56 -0.78 0.05 0.12 0.21 0.00 0.00 175.17 175.34 3duf s PHE 97 N -2.44 3.27 -0.09 4.23 2.19 -0.03 -4.65 117.98 120.46 3duf s PHE 97 Ca 0.62 0.25 0.02 0.00 0.33 0.00 0.00 56.93 58.15 3duf s PHE 97 Cb -0.13 -1.79 0.01 0.00 -1.31 0.00 0.00 43.02 39.81 3duf s PHE 97 CO 0.30 0.54 -0.16 0.42 1.83 0.00 0.00 175.22 178.15 3duf s ILE 98 N -1.03 1.51 -0.44 3.12 1.01 -1.10 -0.35 121.20 123.92 3duf s ILE 98 Ca 0.17 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 60.14 3duf s ILE 98 Cb -0.12 -1.36 0.12 0.00 0.01 0.00 0.00 42.46 41.11 3duf s ILE 98 CO 0.07 0.44 0.22 -0.76 0.00 0.00 0.00 174.94 174.91 3duf s LEU 99 N 0.76 5.12 0.66 2.97 1.02 0.10 -2.52 118.68 126.80 3duf s LEU 99 Ca -0.11 -2.24 -0.07 0.00 0.02 0.00 0.00 54.13 51.73 3duf s LEU 99 Cb -0.16 -1.79 0.04 0.00 0.02 0.00 0.00 46.19 44.30 3duf s LEU 99 CO 0.02 -0.47 0.98 -2.16 0.02 0.00 0.00 176.35 174.74 3duf s PRO 100 N 0.84 2.53 0.00 1.29 0.04 -1.26 -2.89 135.00 135.55 3duf s PRO 100 Ca 0.11 -0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.05 3duf s PRO 100 Cb -0.22 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.12 3duf s PRO 100 CO -0.04 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.39 3duf n GLY 101 N -2.80 2.32 0.17 0.56 0.00 -1.26 -2.10 105.19 102.09 3duf n GLY 101 Ca 0.07 -2.09 -0.03 0.00 0.00 0.00 0.00 46.02 43.97 3duf n GLY 101 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3duf h TYR 102 N 0.05 0.19 -0.04 1.61 -0.00 -1.55 -3.15 116.97 114.08 3duf h TYR 102 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 58.73 58.66 3duf h TYR 102 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 36.73 36.69 3duf h TYR 102 CO 0.00 0.66 0.00 -2.13 -0.00 0.00 0.00 178.16 176.69 3duf n ARG 103 N -3.92 1.68 -1.29 0.10 0.63 -1.26 -4.34 116.66 108.26 3duf n ARG 103 Ca -0.02 -0.99 -0.30 0.00 -0.92 0.00 0.00 57.85 55.61 3duf n ARG 103 Cb 0.56 -1.47 0.12 0.00 0.45 0.00 0.00 32.46 32.13 3duf n ARG 103 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3duf n ASP 104 N 0.21 6.10 -0.20 6.15 8.00 -1.19 -4.63 116.55 130.98 3duf n ASP 104 Ca 0.19 -3.72 -0.07 0.00 0.71 0.00 0.00 54.79 51.89 3duf n ASP 104 Cb 0.35 -0.92 0.06 0.00 -0.02 0.00 0.00 41.12 40.59 3duf n ASP 104 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3duf h VAL 105 N 1.00 1.26 -0.78 2.53 2.07 -1.81 -2.98 116.25 117.55 3duf h VAL 105 Ca 0.62 -1.08 0.16 0.00 0.82 0.00 0.00 66.70 67.22 3duf h VAL 105 Cb 1.65 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.11 3duf h VAL 105 CO 1.40 0.40 0.52 -0.65 0.02 0.00 0.00 177.57 179.25 3duf h PRO 106 N 0.96 0.39 -0.44 1.57 0.11 -1.97 -1.89 132.00 130.73 3duf h PRO 106 Ca 0.18 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 3duf h PRO 106 Cb 0.49 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 3duf h PRO 106 CO 0.02 0.26 0.03 1.96 -0.21 0.00 0.00 178.00 180.06 3duf h GLN 107 N 0.40 0.76 0.00 1.05 7.50 -1.84 -2.97 115.11 120.02 3duf h GLN 107 Ca 0.39 -0.23 0.00 0.00 0.50 0.00 0.00 58.65 59.31 3duf h GLN 107 Cb 0.92 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 28.37 3duf h GLN 107 CO -0.12 0.81 -0.04 0.44 -1.50 0.00 0.00 178.83 178.42 3duf n ILE 108 N -4.42 0.05 -0.00 2.54 -5.35 -0.77 -2.80 119.36 108.60 3duf n ILE 108 Ca 0.00 -0.03 -0.10 0.00 -0.27 0.00 0.00 62.75 62.35 3duf n ILE 108 Cb 0.28 -0.46 -0.08 0.00 -1.74 0.00 0.00 39.64 37.63 3duf n ILE 108 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3duf h ILE 109 N 0.00 1.05 0.00 7.28 1.08 -1.25 -2.37 117.51 123.30 3duf h ILE 109 Ca 0.00 -1.48 0.00 0.00 -0.39 0.00 0.00 64.86 62.99 3duf h ILE 109 Cb 0.52 1.87 0.00 0.00 -3.07 0.00 0.00 36.82 36.14 3duf h ILE 109 CO 0.00 0.31 0.00 0.79 -0.69 0.00 0.00 178.15 178.56 3duf n TRP 110 N -4.80 0.54 1.22 1.37 7.02 -1.14 -2.16 117.44 119.49 3duf n TRP 110 Ca -0.07 0.23 0.12 0.00 -1.02 0.00 0.00 57.50 56.76 3duf n TRP 110 Cb 0.29 -0.87 0.38 0.00 -2.42 0.00 0.00 31.31 28.69 3duf n TRP 110 CO 0.00 0.00 0.00 1.58 -2.02 0.00 0.00 177.69 177.25 3duf n HIS 111 N -2.01 0.12 0.00 -5.99 -0.00 -1.12 -4.90 115.22 101.32 3duf n HIS 111 Ca 0.02 -0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.14 3duf n HIS 111 Cb 0.16 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.03 3duf n HIS 111 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3duf n GLY 112 N 1.22 0.97 3.69 1.57 0.00 -0.92 -4.77 105.19 106.95 3duf n GLY 112 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3duf n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3duf s LEU 113 N 0.00 4.25 0.21 0.99 2.96 -0.89 -4.93 118.68 121.26 3duf s LEU 113 Ca 0.00 1.53 -0.32 0.00 -0.22 0.00 0.00 54.13 55.12 3duf s LEU 113 Cb 0.00 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 43.02 3duf s LEU 113 CO 0.00 -0.45 1.69 -2.84 -1.32 0.00 0.00 176.35 173.43 3duf s PRO 114 N 2.01 4.14 0.36 0.98 0.02 -1.26 -4.53 135.00 136.72 3duf s PRO 114 Ca 0.48 2.56 0.18 0.00 0.02 0.00 0.00 61.00 64.25 3duf s PRO 114 Cb -0.18 -3.08 1.23 0.00 0.02 0.00 0.00 34.50 32.49 3duf s PRO 114 CO 0.18 -0.72 1.62 1.25 -0.33 0.00 0.00 177.00 179.00 3duf h LEU 115 N 6.66 0.41 -2.06 -5.54 5.85 -1.94 0.16 115.31 118.86 3duf h LEU 115 Ca -0.43 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 3duf h LEU 115 Cb 1.20 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 3duf h LEU 115 CO 0.94 -0.29 -0.06 0.10 -0.34 0.00 0.00 178.44 178.79 3duf h TYR 116 N 0.16 0.00 0.00 1.25 -0.00 -1.90 -1.19 116.97 115.28 3duf h TYR 116 Ca 0.80 0.00 -0.13 0.00 -0.00 0.00 0.00 58.73 59.40 3duf h TYR 116 Cb 2.00 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 38.71 3duf h TYR 116 CO -0.01 0.06 -0.78 1.96 -0.00 0.00 0.00 178.16 179.38 3duf h GLN 117 N 0.00 0.00 -0.67 0.10 4.20 -1.00 -2.48 115.11 115.26 3duf h GLN 117 Ca -0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3duf h GLN 117 Cb 0.30 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 3duf h GLN 117 CO 0.01 0.49 0.14 0.00 -0.67 0.00 0.00 178.83 178.79 3duf h ALA 118 N 1.44 0.98 0.00 3.87 0.00 -1.14 -0.63 119.26 123.78 3duf h ALA 118 Ca -0.05 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 3duf h ALA 118 Cb 1.47 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 3duf h ALA 118 CO 0.07 0.65 -0.52 0.74 0.00 0.00 0.00 179.25 180.19 3duf h PHE 119 N 1.02 0.00 0.00 0.00 0.04 -1.43 -2.61 116.94 113.96 3duf h PHE 119 Ca 0.21 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.84 3duf h PHE 119 Cb 0.39 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3duf h PHE 119 CO 0.03 0.52 -0.68 -0.07 -0.60 0.00 0.00 178.31 177.51 3duf h LEU 120 N 0.00 0.00 -0.68 1.54 3.38 -0.94 -1.83 115.31 116.78 3duf h LEU 120 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 3duf h LEU 120 Cb 0.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3duf h LEU 120 CO 0.07 0.68 -0.49 0.15 0.09 0.00 0.00 178.44 178.94 3duf h PHE 121 N 0.00 0.50 -0.07 1.13 3.57 -0.90 0.15 116.94 121.33 3duf h PHE 121 Ca -0.01 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.31 3duf h PHE 121 Cb 1.27 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 3duf h PHE 121 CO 0.00 0.82 -0.02 1.03 -2.23 0.00 0.00 178.31 177.91 3duf h SER 122 N 0.33 0.13 -0.06 0.41 0.87 -1.22 -3.17 113.55 110.83 3duf h SER 122 Ca 0.02 -0.38 -0.09 0.00 -1.23 0.00 0.00 61.79 60.10 3duf h SER 122 Cb 0.99 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 3duf h SER 122 CO 0.09 0.48 -0.23 0.03 -0.53 0.00 0.00 176.83 176.67 3duf h ARG 123 N -0.22 0.47 0.00 2.24 3.08 -1.31 -2.27 114.38 116.38 3duf h ARG 123 Ca 0.02 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.90 3duf h ARG 123 Cb 0.43 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.45 3duf h ARG 123 CO 0.01 0.67 0.00 0.41 -1.07 0.00 0.00 179.97 179.99 3duf n GLY 124 N -0.43 0.79 2.75 0.04 0.00 -0.15 -4.75 105.19 103.44 3duf n GLY 124 Ca -0.00 -0.73 -0.21 0.00 0.00 0.00 0.00 46.02 45.07 3duf n GLY 124 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3duf s HIS 125 N -1.73 0.44 0.42 1.61 5.04 -0.14 -5.02 115.29 115.91 3duf s HIS 125 Ca 0.00 -0.02 0.25 0.00 -1.54 0.00 0.00 55.06 53.76 3duf s HIS 125 Cb 0.00 -0.65 1.30 0.00 0.04 0.00 0.00 32.58 33.26 3duf s HIS 125 CO 0.00 -0.26 1.68 0.27 -2.34 0.00 0.00 174.74 174.10 3duf h PHE 126 N 8.21 0.57 0.00 3.88 -5.15 -2.00 0.74 116.94 123.19 3duf h PHE 126 Ca -0.20 0.02 -0.02 0.00 -0.20 0.00 0.00 57.97 57.57 3duf h PHE 126 Cb 1.12 -0.15 -0.00 0.00 0.22 0.00 0.00 35.95 37.14 3duf h PHE 126 CO 0.48 -0.10 -0.09 1.25 -2.00 0.00 0.00 178.31 177.85 3duf h HIS 127 N 0.21 0.00 0.00 6.09 2.76 -1.96 -1.78 115.15 120.46 3duf h HIS 127 Ca 0.73 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.90 3duf h HIS 127 Cb 2.14 0.00 0.00 0.00 1.55 0.00 0.00 27.41 31.10 3duf h HIS 127 CO -0.00 0.09 0.00 0.78 -1.30 0.00 0.00 177.93 177.49 3duf h GLY 128 N 1.17 0.00 -1.46 5.26 0.00 0.27 -2.65 103.07 105.66 3duf h GLY 128 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3duf h GLY 128 CO 0.01 0.00 -0.20 0.70 0.00 0.00 0.00 176.54 177.05 3duf n ASN 129 N -2.95 2.50 -4.55 0.19 3.02 -0.68 -4.49 115.26 108.29 3duf n ASN 129 Ca 0.01 -1.75 -0.41 0.00 -0.03 0.00 0.00 54.58 52.41 3duf n ASN 129 Cb 0.32 0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 39.67 3duf n ASN 129 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3duf s GLN 130 N -2.12 3.31 0.13 3.52 -0.21 -1.00 -4.81 119.66 118.48 3duf s GLN 130 Ca 0.23 -0.55 -0.30 0.00 0.02 0.00 0.00 55.36 54.75 3duf s GLN 130 Cb 0.18 -4.66 -0.07 0.00 1.00 0.00 0.00 33.01 29.46 3duf s GLN 130 CO 0.40 -2.22 1.26 0.42 -2.12 0.00 0.00 175.29 173.04 3duf s ILE 131 N 5.64 3.58 0.57 1.08 1.09 -1.26 -4.99 121.20 126.91 3duf s ILE 131 Ca 0.41 1.21 -0.18 0.00 -1.10 0.00 0.00 60.65 60.99 3duf s ILE 131 Cb -0.05 -3.78 -0.05 0.00 -1.06 0.00 0.00 42.46 37.53 3duf s ILE 131 CO 0.05 0.14 1.11 -2.16 -0.10 0.00 0.00 174.94 173.98 3duf s PRO 132 N 0.52 3.26 0.53 2.79 0.04 -1.26 -4.96 135.00 135.91 3duf s PRO 132 Ca 0.58 1.52 -0.22 0.00 0.04 0.00 0.00 61.00 62.92 3duf s PRO 132 Cb -0.33 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.15 3duf s PRO 132 CO 0.33 -0.91 1.37 0.39 0.04 0.00 0.00 177.00 178.22 3duf n GLU 133 N -1.57 1.80 0.00 4.56 1.02 -1.26 -2.50 120.64 122.68 3duf n GLU 133 Ca 0.11 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.91 3duf n GLU 133 Cb 0.51 -2.58 0.00 0.00 -0.02 0.00 0.00 31.44 29.35 3duf n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3duf n GLY 134 N 0.73 3.37 3.42 0.62 0.00 -1.26 -5.01 105.19 107.06 3duf n GLY 134 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 3duf n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3duf s VAL 135 N -2.54 5.24 -1.00 1.61 1.01 -1.04 -4.99 120.40 118.69 3duf s VAL 135 Ca 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 3duf s VAL 135 Cb 0.00 -4.03 0.11 0.00 0.00 0.00 0.00 36.38 32.47 3duf s VAL 135 CO 0.00 -0.45 1.27 0.20 0.00 0.00 0.00 175.10 176.12 3duf s ASN 136 N 2.16 6.66 0.09 3.32 0.01 -1.26 -4.81 114.94 121.11 3duf s ASN 136 Ca 0.04 -2.04 -0.21 0.00 -0.71 0.00 0.00 52.86 49.95 3duf s ASN 136 Cb -0.22 -2.45 0.05 0.00 0.41 0.00 0.00 41.25 39.04 3duf s ASN 136 CO 0.08 -1.13 0.50 0.68 -1.51 0.00 0.00 177.10 175.72 3duf s VAL 137 N 3.16 0.04 0.16 1.60 -7.23 -1.26 -2.73 120.40 114.14 3duf s VAL 137 Ca 0.38 -0.29 0.07 0.00 -1.81 0.00 0.00 61.98 60.33 3duf s VAL 137 Cb -0.03 -1.03 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 3duf s VAL 137 CO -0.08 -0.16 -0.02 -0.76 -0.31 0.00 0.00 175.10 173.78 3duf s LEU 138 N -2.36 3.28 1.03 1.32 1.43 -1.05 -4.95 118.68 117.38 3duf s LEU 138 Ca -0.02 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 3duf s LEU 138 Cb -0.00 -1.96 0.21 0.00 0.03 0.00 0.00 46.19 44.47 3duf s LEU 138 CO -0.07 0.11 1.07 -2.16 0.23 0.00 0.00 176.35 175.53 3duf s PRO 139 N -2.80 0.16 0.11 1.29 0.04 -1.26 -4.51 135.00 128.04 3duf s PRO 139 Ca 0.26 0.87 -0.34 0.00 0.04 0.00 0.00 61.00 61.84 3duf s PRO 139 Cb -0.10 -1.68 -0.13 0.00 0.04 0.00 0.00 34.50 32.63 3duf s PRO 139 CO 0.18 -3.01 1.63 -2.30 0.04 0.00 0.00 177.00 173.55 3duf n PRO 140 N -4.42 2.15 -3.14 0.56 -0.02 -1.26 -4.65 135.00 124.21 3duf n PRO 140 Ca 0.06 0.78 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 3duf n PRO 140 Cb 0.55 -2.56 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 3duf n PRO 140 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3duf s GLN 141 N 1.51 4.36 -0.10 -0.52 2.00 -0.89 -4.79 119.66 121.24 3duf s GLN 141 Ca 0.81 0.92 0.13 0.00 -2.00 0.00 0.00 55.36 55.22 3duf s GLN 141 Cb -0.68 -3.23 -0.18 0.00 0.80 0.00 0.00 33.01 29.71 3duf s GLN 141 CO 0.40 0.60 0.12 1.51 -0.50 0.00 0.00 175.29 177.43 3duf n ILE 142 N 1.62 0.64 -2.54 -2.34 0.13 -1.26 -1.43 119.36 114.19 3duf n ILE 142 Ca -0.08 -0.49 -0.43 0.00 -1.10 0.00 0.00 62.75 60.65 3duf n ILE 142 Cb 0.50 -0.41 -0.02 0.00 -0.84 0.00 0.00 39.64 38.87 3duf n ILE 142 CO 0.00 0.00 0.00 -0.63 2.80 0.00 0.00 176.55 178.72 3duf s ILE 143 N -2.52 4.07 -0.09 9.51 -1.09 -1.26 -4.95 121.20 124.88 3duf s ILE 143 Ca -0.06 1.05 -0.32 0.00 -2.23 0.00 0.00 60.65 59.09 3duf s ILE 143 Cb 0.05 -4.56 -0.10 0.00 -1.58 0.00 0.00 42.46 36.28 3duf s ILE 143 CO 0.56 -1.06 1.97 -0.38 -1.23 0.00 0.00 174.94 174.80 3duf n ILE 144 N 6.86 0.59 0.00 2.92 2.08 -1.26 -1.94 119.36 128.60 3duf n ILE 144 Ca 0.12 -0.17 0.00 0.00 0.56 0.00 0.00 62.75 63.26 3duf n ILE 144 Cb 0.49 -2.08 0.00 0.00 -0.75 0.00 0.00 39.64 37.30 3duf n ILE 144 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3duf n GLY 145 N 4.76 2.96 0.33 7.39 0.00 -1.26 -4.92 105.19 114.45 3duf n GLY 145 Ca 0.24 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.36 3duf n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3duf h ALA 146 N 0.00 1.97 0.00 4.61 0.00 -1.74 -0.72 119.26 123.37 3duf h ALA 146 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3duf h ALA 146 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3duf h ALA 146 CO 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.19 3duf n GLN 147 N -4.47 0.90 -0.07 0.00 0.00 -1.26 -3.06 117.38 109.41 3duf n GLN 147 Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 57.00 56.89 3duf n GLN 147 Cb 0.27 -1.45 -0.13 0.00 0.00 0.00 0.00 30.24 28.92 3duf n GLN 147 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3duf n TYR 148 N -0.95 0.49 0.14 2.61 4.02 -0.28 -3.18 117.16 120.02 3duf n TYR 148 Ca 0.20 0.12 0.01 0.00 -0.01 0.00 0.00 57.90 58.22 3duf n TYR 148 Cb 0.09 -1.07 0.11 0.00 -0.02 0.00 0.00 39.34 38.45 3duf n TYR 148 CO 0.00 0.00 0.00 -0.84 -1.01 0.00 0.00 176.86 175.01 3duf h ILE 149 N 0.02 1.07 -0.03 -0.72 3.07 -1.58 -3.13 117.51 116.21 3duf h ILE 149 Ca -0.50 -2.20 -0.23 0.00 1.55 0.00 0.00 64.86 63.48 3duf h ILE 149 Cb 2.00 2.32 0.01 0.00 -0.27 0.00 0.00 36.82 40.87 3duf h ILE 149 CO -0.00 0.55 -0.91 1.56 -1.05 0.00 0.00 178.15 178.30 3duf h GLN 150 N 0.00 0.51 -0.76 0.16 4.20 -1.71 -3.11 115.11 114.39 3duf h GLN 150 Ca -0.01 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.20 3duf h GLN 150 Cb 1.27 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 29.15 3duf h GLN 150 CO 0.07 1.14 0.49 0.00 -0.67 0.00 0.00 178.83 179.87 3duf h ALA 151 N 0.69 0.97 -0.64 3.87 0.00 -1.55 -0.35 119.26 122.24 3duf h ALA 151 Ca -0.08 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.80 3duf h ALA 151 Cb 1.54 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 3duf h ALA 151 CO 0.17 0.40 0.42 0.00 0.00 0.00 0.00 179.25 180.24 3duf h ALA 152 N 1.27 1.67 -0.15 0.00 0.00 -1.54 0.19 119.26 120.70 3duf h ALA 152 Ca 0.28 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3duf h ALA 152 Cb -0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 3duf h ALA 152 CO -0.06 0.26 -0.20 0.78 0.00 0.00 0.00 179.25 180.03 3duf h GLY 153 N 0.74 0.43 1.17 0.00 0.00 -1.18 -1.83 103.07 102.40 3duf h GLY 153 Ca 0.26 -0.46 -0.09 0.00 0.00 0.00 0.00 47.33 47.03 3duf h GLY 153 CO -0.07 0.42 0.02 -2.08 0.00 0.00 0.00 176.54 174.82 3duf h VAL 154 N 0.01 1.26 -0.59 4.60 2.07 -0.52 -0.88 116.25 122.20 3duf h VAL 154 Ca 0.02 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 3duf h VAL 154 Cb 0.76 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3duf h VAL 154 CO 0.05 0.40 0.34 0.00 0.02 0.00 0.00 177.57 178.38 3duf h ALA 155 N 1.09 0.76 -0.18 1.67 0.00 -0.63 -0.84 119.26 121.13 3duf h ALA 155 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3duf h ALA 155 Cb 0.51 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3duf h ALA 155 CO 0.02 0.26 -0.13 1.25 0.00 0.00 0.00 179.25 180.65 3duf h LEU 156 N 0.80 0.27 -0.39 0.00 5.85 -0.98 -2.01 115.31 118.85 3duf h LEU 156 Ca 0.21 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.84 3duf h LEU 156 Cb 0.01 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3duf h LEU 156 CO -0.04 0.43 0.11 1.23 -0.34 0.00 0.00 178.44 179.83 3duf h GLY 157 N 0.79 0.66 0.98 3.75 0.00 0.03 -2.11 103.07 107.17 3duf h GLY 157 Ca 0.05 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 3duf h GLY 157 CO 0.02 0.38 0.16 1.41 0.00 0.00 0.00 176.54 178.51 3duf h LEU 158 N 0.49 0.75 -0.97 3.11 3.38 -0.80 -2.53 115.31 118.73 3duf h LEU 158 Ca 0.12 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.91 3duf h LEU 158 Cb 0.29 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3duf h LEU 158 CO -0.00 0.76 0.64 0.50 0.09 0.00 0.00 178.44 180.43 3duf h LYS 159 N 0.71 1.23 0.00 1.13 3.64 -1.27 -2.01 116.57 120.00 3duf h LYS 159 Ca 0.17 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 3duf h LYS 159 Cb 0.28 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 3duf h LYS 159 CO -0.01 0.81 -0.18 0.52 -2.27 0.00 0.00 179.45 178.33 3duf h MET 160 N 1.27 0.00 -0.00 1.90 2.86 -1.10 -2.72 114.93 117.14 3duf h MET 160 Ca 0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.02 3duf h MET 160 Cb -0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3duf h MET 160 CO -0.11 0.18 -0.59 0.54 1.06 0.00 0.00 176.91 177.99 3duf n ARG 161 N -3.43 0.23 -1.06 1.72 1.74 -0.81 -4.95 116.66 110.09 3duf n ARG 161 Ca -0.00 -0.15 -0.02 0.00 -0.77 0.00 0.00 57.85 56.90 3duf n ARG 161 Cb 0.36 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.29 3duf n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3duf n GLY 162 N 1.47 0.54 3.80 -0.13 0.00 -0.88 -5.03 105.19 104.96 3duf n GLY 162 Ca 0.06 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 3duf n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3duf s LYS 163 N -1.78 3.19 -0.87 1.61 1.02 -1.06 -4.96 119.74 116.88 3duf s LYS 163 Ca 0.00 1.24 0.00 0.00 0.02 0.00 0.00 55.97 57.23 3duf s LYS 163 Cb 0.00 -2.01 0.34 0.00 -0.52 0.00 0.00 37.83 35.64 3duf s LYS 163 CO 0.00 -0.92 1.68 1.63 -0.92 0.00 0.00 175.35 176.82 3duf n LYS 164 N -2.16 4.33 -4.09 1.68 4.76 -1.26 -4.77 118.16 116.65 3duf n LYS 164 Ca 0.09 -4.43 -0.10 0.00 -2.87 0.00 0.00 58.31 51.00 3duf n LYS 164 Cb 0.53 -2.37 -0.09 0.00 -1.84 0.00 0.00 35.03 31.26 3duf n LYS 164 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3duf s ALA 165 N -4.08 0.56 0.44 7.82 0.00 -1.26 -5.00 121.76 120.24 3duf s ALA 165 Ca 0.44 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3duf s ALA 165 Cb 0.28 1.00 -0.02 0.00 0.00 0.00 0.00 23.12 24.38 3duf s ALA 165 CO -0.20 -0.59 0.10 0.14 0.00 0.00 0.00 175.76 175.20 3duf s VAL 166 N -4.05 0.74 -0.04 0.00 -7.23 -1.26 -4.88 120.40 103.68 3duf s VAL 166 Ca 0.25 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.48 3duf s VAL 166 Cb 0.05 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.70 3duf s VAL 166 CO 0.04 0.00 -0.21 0.00 -0.31 0.00 0.00 175.10 174.62 3duf s ALA 167 N -3.11 1.81 -0.05 1.32 0.00 -0.99 -0.85 121.76 119.89 3duf s ALA 167 Ca 0.19 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.31 3duf s ALA 167 Cb 0.02 -0.55 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 3duf s ALA 167 CO 0.12 0.37 -0.17 -1.50 0.00 0.00 0.00 175.76 174.57 3duf s ILE 168 N -0.18 1.44 0.14 0.00 2.07 0.53 -0.60 121.20 124.59 3duf s ILE 168 Ca -0.01 -0.70 0.07 0.00 -1.41 0.00 0.00 60.65 58.60 3duf s ILE 168 Cb -0.11 -1.25 -0.04 0.00 0.13 0.00 0.00 42.46 41.19 3duf s ILE 168 CO 0.02 0.42 -0.16 0.28 -1.91 0.00 0.00 174.94 173.58 3duf s THR 169 N 0.17 1.54 0.07 4.00 -1.32 -1.00 -0.72 115.64 118.37 3duf s THR 169 Ca -0.07 -1.78 0.06 0.00 -1.21 0.00 0.00 61.69 58.69 3duf s THR 169 Cb -0.13 -1.65 -0.03 0.00 -1.51 0.00 0.00 72.50 69.18 3duf s THR 169 CO 0.03 -0.35 -0.17 -0.31 -2.21 0.00 0.00 174.62 171.61 3duf s TYR 170 N -2.04 1.42 0.33 9.09 1.51 -1.14 -1.91 117.35 124.62 3duf s TYR 170 Ca 0.11 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 55.62 3duf s TYR 170 Cb -0.06 -0.81 0.03 0.00 -0.11 0.00 0.00 41.96 41.02 3duf s TYR 170 CO 0.04 0.10 0.66 -0.08 -1.11 0.00 0.00 175.55 175.16 3duf s THR 171 N -1.11 0.00 0.38 -0.71 -1.32 -1.00 -4.10 115.64 107.78 3duf s THR 171 Ca 0.02 -1.19 0.04 0.00 -1.21 0.00 0.00 61.69 59.35 3duf s THR 171 Cb -0.09 -2.54 0.04 0.00 -1.51 0.00 0.00 72.50 68.39 3duf s THR 171 CO 0.03 0.00 0.35 0.61 -2.21 0.00 0.00 174.62 173.39 3duf n GLY 172 N -0.50 2.62 0.22 6.08 0.00 -1.26 -1.26 105.19 111.08 3duf n GLY 172 Ca -0.04 -2.24 0.07 0.00 0.00 0.00 0.00 46.02 43.80 3duf n GLY 172 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3duf h ASP 173 N 0.35 0.00 -0.27 1.61 2.03 -1.89 -2.71 116.42 115.54 3duf h ASP 173 Ca -0.23 0.00 -0.17 0.00 -0.73 0.00 0.00 57.03 55.91 3duf h ASP 173 Cb 0.87 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.37 3duf h ASP 173 CO 0.35 0.25 -0.49 1.23 -1.03 0.00 0.00 179.24 179.55 3duf h GLY 174 N 1.05 0.88 1.32 7.15 0.00 -1.93 -3.18 103.07 108.37 3duf h GLY 174 Ca -0.00 -1.03 0.08 0.00 0.00 0.00 0.00 47.33 46.38 3duf h GLY 174 CO 0.03 0.92 0.27 -1.33 0.00 0.00 0.00 176.54 176.43 3duf h GLY 175 N 0.56 0.00 0.75 4.60 0.00 -1.87 -2.40 103.07 104.71 3duf h GLY 175 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3duf h GLY 175 CO 0.11 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.35 3duf n THR 176 N -3.90 0.00 -0.01 4.70 -2.24 -1.20 -1.69 114.28 109.94 3duf n THR 176 Ca 0.04 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.91 3duf n THR 176 Cb 0.41 -0.72 -0.16 0.00 -2.10 0.00 0.00 70.33 67.76 3duf n THR 176 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3duf n SER 177 N -0.87 0.16 -4.73 3.42 7.64 -0.90 -4.90 113.62 113.43 3duf n SER 177 Ca 0.06 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.59 3duf n SER 177 Cb 0.03 1.91 0.07 0.00 -1.01 0.00 0.00 64.21 65.21 3duf n SER 177 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3duf s GLN 178 N -3.41 2.48 0.23 1.43 -1.52 -0.68 -4.92 119.66 113.27 3duf s GLN 178 Ca -0.08 1.81 0.07 0.00 -1.95 0.00 0.00 55.36 55.21 3duf s GLN 178 Cb 0.13 -1.87 0.23 0.00 -0.22 0.00 0.00 33.01 31.28 3duf s GLN 178 CO 0.88 -1.59 1.54 0.78 -0.25 0.00 0.00 175.29 176.64 3duf h GLY 179 N 0.20 0.12 2.00 3.09 0.00 -1.93 -3.01 103.07 103.54 3duf h GLY 179 Ca -0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 3duf h GLY 179 CO 0.52 0.15 -0.07 -0.55 0.00 0.00 0.00 176.54 176.59 3duf h ASP 180 N 0.08 0.00 -0.38 0.19 3.32 -1.91 -0.49 116.42 117.23 3duf h ASP 180 Ca -0.01 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 3duf h ASP 180 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 3duf h ASP 180 CO 0.10 0.07 -0.23 0.15 -1.72 0.00 0.00 179.24 177.61 3duf h PHE 181 N 0.00 0.97 0.11 4.55 3.04 -1.76 -0.78 116.94 123.06 3duf h PHE 181 Ca -0.00 -0.25 -0.29 0.00 3.98 0.00 0.00 57.97 61.41 3duf h PHE 181 Cb 0.26 -0.22 0.02 0.00 2.56 0.00 0.00 35.95 38.58 3duf h PHE 181 CO 0.00 1.02 -1.21 -0.92 -2.02 0.00 0.00 178.31 175.18 3duf h TYR 182 N 0.63 0.92 -0.14 0.41 3.20 -1.50 -3.04 116.97 117.45 3duf h TYR 182 Ca 0.08 -0.58 -0.06 0.00 3.14 0.00 0.00 58.73 61.31 3duf h TYR 182 Cb 0.79 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 3duf h TYR 182 CO 0.06 1.42 -0.19 0.93 -1.64 0.00 0.00 178.16 178.74 3duf h GLU 183 N 0.26 0.23 0.50 1.82 5.08 -1.11 -2.41 114.58 118.95 3duf h GLU 183 Ca -0.17 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 3duf h GLU 183 Cb 1.88 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.11 3duf h GLU 183 CO 0.23 0.42 -0.24 0.78 -1.00 0.00 0.00 179.01 179.20 3duf h GLY 184 N 0.84 -0.69 2.00 -3.84 0.00 -1.12 -2.32 103.07 97.93 3duf h GLY 184 Ca 0.04 0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.60 3duf h GLY 184 CO 0.03 -0.25 -0.13 0.16 0.00 0.00 0.00 176.54 176.35 3duf h ILE 185 N -0.95 0.41 -0.08 2.60 3.07 -1.56 -2.49 117.51 118.51 3duf h ILE 185 Ca -0.07 -0.73 -0.23 0.00 1.55 0.00 0.00 64.86 65.38 3duf h ILE 185 Cb 0.60 1.53 0.01 0.00 -0.27 0.00 0.00 36.82 38.69 3duf h ILE 185 CO 0.11 0.13 -0.86 -1.13 -1.05 0.00 0.00 178.15 175.35 3duf h ASN 186 N 0.00 0.81 0.20 2.16 -1.24 -1.42 -1.80 115.58 114.29 3duf h ASN 186 Ca -0.00 -0.57 -0.01 0.00 0.71 0.00 0.00 56.30 56.43 3duf h ASN 186 Cb 0.52 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.33 3duf h ASN 186 CO 0.02 1.36 -0.10 -0.26 -1.29 0.00 0.00 177.43 177.17 3duf h PHE 187 N 0.42 -0.25 -0.96 0.67 -1.00 -1.17 0.17 116.94 114.82 3duf h PHE 187 Ca -0.07 -0.01 0.10 0.00 2.81 0.00 0.00 57.97 60.81 3duf h PHE 187 Cb 1.49 0.08 -0.07 0.00 3.61 0.00 0.00 35.95 41.06 3duf h PHE 187 CO 0.08 0.07 0.61 0.00 -1.61 0.00 0.00 178.31 177.46 3duf h ALA 188 N 0.14 1.56 0.32 2.45 0.00 -1.51 -1.05 119.26 121.17 3duf h ALA 188 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3duf h ALA 188 Cb 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3duf h ALA 188 CO 0.04 0.23 -0.16 0.78 0.00 0.00 0.00 179.25 180.15 3duf h GLY 189 N 0.97 -0.45 1.58 0.00 0.00 -1.08 0.30 103.07 104.39 3duf h GLY 189 Ca 0.46 0.17 0.04 0.00 0.00 0.00 0.00 47.33 48.00 3duf h GLY 189 CO -0.22 -0.17 0.17 0.00 0.00 0.00 0.00 176.54 176.33 3duf h ALA 190 N 0.02 1.78 0.00 3.60 0.00 0.06 -2.20 119.26 122.51 3duf h ALA 190 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3duf h ALA 190 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3duf h ALA 190 CO 0.07 -0.25 -0.67 1.19 0.00 0.00 0.00 179.25 179.60 3duf n PHE 191 N -3.84 0.00 -3.27 0.00 3.72 -0.47 -5.02 117.46 108.59 3duf n PHE 191 Ca 0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.26 3duf n PHE 191 Cb 0.28 -0.01 0.08 0.00 -0.94 0.00 0.00 39.48 38.89 3duf n PHE 191 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3duf n LYS 192 N -1.34 -5.00 -3.31 -1.08 5.02 0.98 -5.00 118.16 108.42 3duf n LYS 192 Ca 0.02 0.79 -0.33 0.00 -2.02 0.00 0.00 58.31 56.78 3duf n LYS 192 Cb 0.21 -5.60 -0.06 0.00 -0.02 0.00 0.00 35.03 29.57 3duf n LYS 192 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3duf s ALA 193 N -3.34 3.49 -1.32 7.82 0.00 -0.75 -4.64 121.76 123.02 3duf s ALA 193 Ca 0.12 -0.14 -0.17 0.00 0.00 0.00 0.00 51.96 51.78 3duf s ALA 193 Cb -0.02 -2.57 0.08 0.00 0.00 0.00 0.00 23.12 20.62 3duf s ALA 193 CO 0.68 0.44 1.80 -0.35 0.00 0.00 0.00 175.76 178.33 3duf n PRO 194 N -0.05 3.17 -4.47 0.00 -0.04 -1.26 -3.26 135.00 129.08 3duf n PRO 194 Ca 0.01 -3.22 -0.20 0.00 -0.04 0.00 0.00 63.50 60.04 3duf n PRO 194 Cb 0.52 -3.41 -0.14 0.00 -0.04 0.00 0.00 33.50 30.43 3duf n PRO 194 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3duf s ALA 195 N 3.71 1.00 -0.27 0.55 0.00 -1.26 -2.36 121.76 123.13 3duf s ALA 195 Ca 0.51 -0.58 -0.09 0.00 0.00 0.00 0.00 51.96 51.81 3duf s ALA 195 Cb 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 3duf s ALA 195 CO 0.04 0.23 0.12 0.42 0.00 0.00 0.00 175.76 176.57 3duf s ILE 196 N -0.42 4.65 -0.41 0.00 -1.09 0.23 -2.70 121.20 121.45 3duf s ILE 196 Ca 0.03 -0.11 -0.13 0.00 -2.23 0.00 0.00 60.65 58.22 3duf s ILE 196 Cb -0.05 -3.22 0.04 0.00 -1.58 0.00 0.00 42.46 37.65 3duf s ILE 196 CO -0.00 0.27 0.28 -0.36 -1.23 0.00 0.00 174.94 173.90 3duf s PHE 197 N 1.66 3.25 -0.18 3.97 0.08 0.54 -2.38 117.98 124.91 3duf s PHE 197 Ca 0.06 -0.91 -0.10 0.00 0.12 0.00 0.00 56.93 56.11 3duf s PHE 197 Cb -0.16 -2.70 -0.05 0.00 -0.57 0.00 0.00 43.02 39.54 3duf s PHE 197 CO 0.06 -0.69 0.15 0.08 -0.10 0.00 0.00 175.22 174.73 3duf s VAL 198 N 1.60 5.41 -0.30 -0.44 1.01 -0.80 0.57 120.40 127.44 3duf s VAL 198 Ca 0.03 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.28 3duf s VAL 198 Cb -0.21 -3.48 0.08 0.00 0.00 0.00 0.00 36.38 32.78 3duf s VAL 198 CO 0.07 0.46 -0.00 -0.69 0.00 0.00 0.00 175.10 174.94 3duf s VAL 199 N 0.16 1.97 -0.87 2.92 1.01 0.18 -2.36 120.40 123.42 3duf s VAL 199 Ca 0.10 -1.89 -0.22 0.00 0.00 0.00 0.00 61.98 59.97 3duf s VAL 199 Cb -0.11 -2.33 0.08 0.00 0.00 0.00 0.00 36.38 34.02 3duf s VAL 199 CO -0.00 -0.39 1.20 -1.10 0.00 0.00 0.00 175.10 174.81 3duf s GLN 200 N 1.11 3.43 -0.70 2.72 -0.21 -0.39 -0.96 119.66 124.65 3duf s GLN 200 Ca 0.03 -1.16 -0.25 0.00 0.02 0.00 0.00 55.36 54.00 3duf s GLN 200 Cb -0.19 -4.79 0.05 0.00 1.00 0.00 0.00 33.01 29.08 3duf s GLN 200 CO -0.09 -1.96 1.15 1.21 -2.12 0.00 0.00 175.29 173.48 3duf s ASN 201 N 4.05 6.17 -0.20 5.90 3.84 -0.05 -3.66 114.94 131.00 3duf s ASN 201 Ca 0.34 -0.65 0.15 0.00 0.21 0.00 0.00 52.86 52.92 3duf s ASN 201 Cb -0.07 -2.50 0.77 0.00 -0.55 0.00 0.00 41.25 38.90 3duf s ASN 201 CO -0.02 -1.68 1.70 -0.46 -2.79 0.00 0.00 177.10 173.85 3duf n ASN 202 N 8.71 5.36 0.00 -4.21 0.23 -1.26 -2.07 115.26 122.01 3duf n ASN 202 Ca 0.00 -2.83 0.00 0.00 -0.53 0.00 0.00 54.58 51.22 3duf n ASN 202 Cb 0.48 -0.65 0.00 0.00 -2.08 0.00 0.00 39.78 37.53 3duf n ASN 202 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3duf n ARG 203 N 0.63 0.00 -4.32 -3.83 1.74 -1.26 -4.66 116.66 104.95 3duf n ARG 203 Ca 0.27 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 57.17 3duf n ARG 203 Cb 1.10 -1.79 -0.15 0.00 -1.02 0.00 0.00 32.46 30.61 3duf n ARG 203 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3duf s PHE 204 N -1.90 0.74 -0.70 -1.55 0.08 -1.26 -1.02 117.98 112.38 3duf s PHE 204 Ca 0.00 -0.15 -0.07 0.00 0.12 0.00 0.00 56.93 56.83 3duf s PHE 204 Cb 0.00 -0.48 0.18 0.00 -0.57 0.00 0.00 43.02 42.15 3duf s PHE 204 CO 0.00 -0.01 0.56 0.00 -0.10 0.00 0.00 175.22 175.66 3duf s ALA 205 N -0.22 3.76 0.00 5.36 0.00 -0.31 -4.79 121.76 125.56 3duf s ALA 205 Ca 0.03 -3.29 0.00 0.00 0.00 0.00 0.00 51.96 48.70 3duf s ALA 205 Cb -0.03 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.12 3duf s ALA 205 CO -0.00 -2.17 0.00 -0.89 0.00 0.00 0.00 175.76 172.70 3duf n ILE 206 N 3.64 0.00 1.35 0.00 5.41 -1.26 -1.79 119.36 126.71 3duf n ILE 206 Ca 0.10 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.90 3duf n ILE 206 Cb 0.41 0.00 0.17 0.00 -0.71 0.00 0.00 39.64 39.51 3duf n ILE 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3duf n SER 207 N 6.82 1.13 -4.57 4.38 3.41 -1.26 -4.89 113.62 118.65 3duf n SER 207 Ca 0.00 -1.92 -0.41 0.00 -0.26 0.00 0.00 58.87 56.29 3duf n SER 207 Cb 0.00 -0.13 -0.08 0.00 -0.26 0.00 0.00 64.21 63.74 3duf n SER 207 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3duf s THR 208 N -1.74 5.09 0.58 6.66 2.01 -0.74 -5.06 115.64 122.44 3duf s THR 208 Ca 0.18 0.39 -0.19 0.00 0.31 0.00 0.00 61.69 62.38 3duf s THR 208 Cb 0.09 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 3duf s THR 208 CO 0.13 -0.07 1.22 -2.16 -0.69 0.00 0.00 174.62 173.05 3duf s PRO 209 N 2.23 3.06 0.62 4.92 0.04 -1.26 -1.16 135.00 143.45 3duf s PRO 209 Ca 0.17 1.87 0.33 0.00 0.04 0.00 0.00 61.00 63.41 3duf s PRO 209 Cb -0.16 -2.01 1.88 0.00 0.04 0.00 0.00 34.50 34.26 3duf s PRO 209 CO 0.12 -1.15 2.17 -0.24 0.04 0.00 0.00 177.00 177.94 3duf h VAL 210 N 1.04 0.29 0.00 -0.36 3.04 -1.46 -0.86 116.25 117.94 3duf h VAL 210 Ca -0.50 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.14 3duf h VAL 210 Cb 1.29 0.88 -0.01 0.00 -2.01 0.00 0.00 31.29 31.45 3duf h VAL 210 CO 0.56 0.00 -0.23 -0.33 -1.01 0.00 0.00 177.57 176.56 3duf h GLU 211 N 0.00 0.00 -0.00 4.17 3.07 -1.86 -2.47 114.58 117.49 3duf h GLU 211 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 3duf h GLU 211 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3duf h GLU 211 CO -0.00 0.23 -0.43 1.63 -1.40 0.00 0.00 179.01 179.04 3duf n LYS 212 N -3.66 0.09 0.06 2.33 4.01 -0.33 -3.88 118.16 116.79 3duf n LYS 212 Ca -0.01 -0.05 -0.08 0.00 -0.51 0.00 0.00 58.31 57.66 3duf n LYS 212 Cb 0.35 -1.50 -0.12 0.00 -0.51 0.00 0.00 35.03 33.25 3duf n LYS 212 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 3duf h GLN 213 N 0.12 0.03 -2.48 1.97 1.08 -1.44 -3.49 115.11 110.90 3duf h GLN 213 Ca 0.00 -0.05 0.15 0.00 -1.45 0.00 0.00 58.65 57.30 3duf h GLN 213 Cb 0.50 0.02 -0.08 0.00 -0.05 0.00 0.00 27.48 27.87 3duf h GLN 213 CO 0.00 1.02 0.43 -0.08 -0.95 0.00 0.00 178.83 179.25 3duf s THR 214 N -2.71 0.00 -2.24 -0.54 -1.32 -1.23 -4.94 115.64 102.67 3duf s THR 214 Ca 0.00 -0.67 0.19 0.00 -1.21 0.00 0.00 61.69 60.00 3duf s THR 214 Cb 0.10 -1.91 0.11 0.00 -1.51 0.00 0.00 72.50 69.29 3duf s THR 214 CO 0.83 0.00 1.07 0.55 -2.21 0.00 0.00 174.62 174.86 3duf n VAL 215 N -0.45 0.00 -2.35 5.08 3.14 -1.26 -4.69 118.33 117.80 3duf n VAL 215 Ca -0.06 -0.45 -0.42 0.00 -2.96 0.00 0.00 64.34 60.46 3duf n VAL 215 Cb 0.61 1.36 -0.03 0.00 -1.06 0.00 0.00 33.84 34.71 3duf n VAL 215 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3duf s ALA 216 N -1.76 3.45 0.30 1.55 0.00 -1.26 -4.94 121.76 119.10 3duf s ALA 216 Ca 0.21 0.95 0.31 0.00 0.00 0.00 0.00 51.96 53.43 3duf s ALA 216 Cb 0.16 -3.45 1.46 0.00 0.00 0.00 0.00 23.12 21.29 3duf s ALA 216 CO 0.30 -0.44 2.04 0.87 0.00 0.00 0.00 175.76 178.53 3duf h LYS 217 N 6.05 0.00 -4.82 0.00 1.79 -1.98 -3.44 116.57 114.16 3duf h LYS 217 Ca -0.43 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 57.72 3duf h LYS 217 Cb 1.21 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.72 3duf h LYS 217 CO 0.79 0.09 -0.62 0.95 -1.08 0.00 0.00 179.45 179.58 3duf s THR 218 N -3.91 0.45 -0.13 -0.16 -4.23 -1.26 -5.05 115.64 101.36 3duf s THR 218 Ca -0.01 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.70 3duf s THR 218 Cb 0.11 -2.57 -0.28 0.00 1.34 0.00 0.00 72.50 71.10 3duf s THR 218 CO 0.56 -0.04 0.27 0.18 -0.54 0.00 0.00 174.62 175.05 3duf n LEU 219 N -0.41 0.03 -0.13 4.79 4.77 -1.26 -4.28 117.00 120.50 3duf n LEU 219 Ca -0.00 0.01 0.02 0.00 -0.03 0.00 0.00 56.01 56.01 3duf n LEU 219 Cb 0.66 0.28 0.31 0.00 -2.33 0.00 0.00 43.42 42.33 3duf n LEU 219 CO 0.36 0.28 1.20 0.00 -1.33 0.00 0.00 177.39 177.90 3duf h ALA 220 N 1.43 1.53 0.00 -1.18 0.00 -1.93 -1.87 119.26 117.24 3duf h ALA 220 Ca -0.31 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3duf h ALA 220 Cb 1.71 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3duf h ALA 220 CO 0.02 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.69 3duf n GLN 221 N -4.43 0.03 0.20 0.00 10.64 -1.26 -2.33 117.38 120.23 3duf n GLN 221 Ca 0.06 0.41 0.14 0.00 -1.83 0.00 0.00 57.00 55.78 3duf n GLN 221 Cb 0.05 -1.58 0.63 0.00 -0.86 0.00 0.00 30.24 28.49 3duf n GLN 221 CO 0.00 0.00 0.00 0.87 -1.83 0.00 0.00 177.06 176.10 3duf h LYS 222 N 0.00 0.00 0.00 2.61 1.57 -1.59 -2.02 116.57 117.14 3duf h LYS 222 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3duf h LYS 222 Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 3duf h LYS 222 CO 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 179.45 178.86 3duf h ALA 223 N 2.13 1.00 -0.89 3.86 0.00 -1.67 -3.13 119.26 120.56 3duf h ALA 223 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.94 3duf h ALA 223 Cb 0.33 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 3duf h ALA 223 CO 0.00 0.03 0.56 0.28 0.00 0.00 0.00 179.25 180.12 3duf h VAL 224 N 0.00 1.09 0.00 0.00 2.07 -1.55 0.42 116.25 118.28 3duf h VAL 224 Ca -0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3duf h VAL 224 Cb 0.55 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3duf h VAL 224 CO 0.00 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.79 3duf n ALA 225 N -2.35 1.70 0.01 1.67 0.00 -1.18 -1.78 120.51 118.57 3duf n ALA 225 Ca 0.12 -0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.58 3duf n ALA 225 Cb 0.14 -1.23 -0.10 0.00 0.00 0.00 0.00 19.45 18.26 3duf n ALA 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3duf n ALA 226 N -1.43 2.52 -0.72 0.00 0.00 -0.51 -5.01 120.51 115.36 3duf n ALA 226 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.16 3duf n ALA 226 Cb 0.15 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3duf n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3duf n GLY 227 N 1.72 0.58 3.75 0.00 0.00 0.02 -4.81 105.19 106.45 3duf n GLY 227 Ca -0.02 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.25 3duf n GLY 227 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3duf s ILE 228 N -2.00 4.11 0.44 -0.61 -4.36 -1.01 -5.01 121.20 112.76 3duf s ILE 228 Ca 0.00 -1.41 -0.25 0.00 -0.26 0.00 0.00 60.65 58.73 3duf s ILE 228 Cb 0.00 -3.15 -0.08 0.00 1.25 0.00 0.00 42.46 40.48 3duf s ILE 228 CO 0.00 -0.23 1.31 -2.16 0.24 0.00 0.00 174.94 174.10 3duf s PRO 229 N -3.39 3.78 0.08 0.37 0.04 -1.26 -4.33 135.00 130.29 3duf s PRO 229 Ca 0.31 2.15 0.06 0.00 0.04 0.00 0.00 61.00 63.55 3duf s PRO 229 Cb -0.09 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 31.80 3duf s PRO 229 CO 0.22 -0.64 -0.15 0.20 0.04 0.00 0.00 177.00 176.67 3duf s GLY 230 N -0.82 0.92 -0.13 0.56 0.00 -1.26 -1.84 107.32 104.74 3duf s GLY 230 Ca 0.60 -1.04 -0.06 0.00 0.00 0.00 0.00 44.72 44.23 3duf s GLY 230 CO 0.48 -1.06 0.30 -0.26 0.00 0.00 0.00 173.10 172.55 3duf s ILE 231 N -1.27 -0.16 -0.19 0.90 -4.36 -0.66 -4.98 121.20 110.49 3duf s ILE 231 Ca -0.01 0.17 -0.15 0.00 -0.26 0.00 0.00 60.65 60.40 3duf s ILE 231 Cb -0.10 -0.47 -0.04 0.00 1.25 0.00 0.00 42.46 43.10 3duf s ILE 231 CO 0.03 0.07 0.36 -1.58 0.24 0.00 0.00 174.94 174.06 3duf s GLN 232 N 1.65 4.20 0.23 0.37 0.74 -1.26 -1.68 119.66 123.90 3duf s GLN 232 Ca -0.06 0.16 0.11 0.00 0.05 0.00 0.00 55.36 55.62 3duf s GLN 232 Cb -0.10 -3.50 -0.05 0.00 1.10 0.00 0.00 33.01 30.45 3duf s GLN 232 CO -0.10 0.04 -0.21 0.08 -0.55 0.00 0.00 175.29 174.56 3duf s VAL 233 N 1.06 2.28 -0.58 1.34 1.01 0.30 -0.67 120.40 125.14 3duf s VAL 233 Ca 0.18 -2.18 -0.28 0.00 0.00 0.00 0.00 61.98 59.70 3duf s VAL 233 Cb -0.14 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.11 3duf s VAL 233 CO 0.07 -0.30 1.25 -0.62 0.00 0.00 0.00 175.10 175.50 3duf s ASP 234 N -3.06 6.37 0.00 3.32 2.15 -0.58 -1.16 116.67 123.71 3duf s ASP 234 Ca 0.24 0.13 0.08 0.00 0.43 0.00 0.00 52.55 53.43 3duf s ASP 234 Cb -0.06 -2.55 0.43 0.00 -0.30 0.00 0.00 42.92 40.43 3duf s ASP 234 CO 0.11 -1.55 1.04 0.61 -0.17 0.00 0.00 175.17 175.21 3duf n GLY 235 N 5.12 -0.42 0.78 2.66 0.00 -0.28 -1.75 105.19 111.30 3duf n GLY 235 Ca 0.09 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.15 3duf n GLY 235 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3duf n MET 236 N -1.17 2.20 -3.54 1.61 2.81 -1.25 -3.23 117.12 114.55 3duf n MET 236 Ca 0.05 -1.95 -0.41 0.00 -1.81 0.00 0.00 57.70 53.58 3duf n MET 236 Cb 0.05 -1.34 -0.09 0.00 -0.71 0.00 0.00 33.22 31.12 3duf n MET 236 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3duf s ASP 237 N -1.10 5.78 0.14 7.83 -1.08 -0.72 -4.24 116.67 123.28 3duf s ASP 237 Ca 0.27 -1.47 -0.21 0.00 -0.52 0.00 0.00 52.55 50.61 3duf s ASP 237 Cb 0.15 -2.04 0.00 0.00 -1.46 0.00 0.00 42.92 39.57 3duf s ASP 237 CO 0.21 -0.57 1.66 -0.65 0.52 0.00 0.00 175.17 176.34 3duf h PRO 238 N 8.50 -0.16 -0.65 4.34 0.11 -1.89 -2.16 132.00 140.10 3duf h PRO 238 Ca -0.24 0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.82 3duf h PRO 238 Cb 1.09 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3duf h PRO 238 CO 0.80 -0.10 0.18 -0.07 -0.21 0.00 0.00 178.00 178.59 3duf h LEU 239 N -0.16 0.95 -0.20 2.35 3.38 -1.96 -2.29 115.31 117.38 3duf h LEU 239 Ca 0.11 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3duf h LEU 239 Cb 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3duf h LEU 239 CO -0.28 0.91 0.01 0.00 0.09 0.00 0.00 178.44 179.16 3duf h ALA 240 N 1.22 0.27 -0.71 1.53 0.00 -1.85 -1.54 119.26 118.19 3duf h ALA 240 Ca 0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3duf h ALA 240 Cb 0.32 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3duf h ALA 240 CO -0.00 -0.02 0.42 0.28 0.00 0.00 0.00 179.25 179.93 3duf h VAL 241 N 0.12 1.20 -0.03 0.00 2.07 -1.33 -1.48 116.25 116.80 3duf h VAL 241 Ca 0.06 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3duf h VAL 241 Cb 0.37 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 3duf h VAL 241 CO 0.01 0.21 0.01 0.22 0.02 0.00 0.00 177.57 178.04 3duf h TYR 242 N 0.97 0.04 -0.86 1.57 3.20 -1.14 -1.78 116.97 118.98 3duf h TYR 242 Ca 0.25 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 3duf h TYR 242 Cb -0.03 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 3duf h TYR 242 CO 0.00 0.17 0.50 0.00 -1.64 0.00 0.00 178.16 177.19 3duf h ALA 243 N 0.87 1.10 -0.43 1.82 0.00 -0.95 0.47 119.26 122.14 3duf h ALA 243 Ca 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3duf h ALA 243 Cb 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3duf h ALA 243 CO -0.00 0.58 0.15 0.00 0.00 0.00 0.00 179.25 179.98 3duf h ALA 244 N 1.27 0.56 -0.38 0.00 0.00 -1.18 0.32 119.26 119.84 3duf h ALA 244 Ca 0.31 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3duf h ALA 244 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3duf h ALA 244 CO -0.05 0.19 -0.24 0.28 0.00 0.00 0.00 179.25 179.43 3duf h VAL 245 N 0.55 1.27 -0.40 0.00 2.07 -1.00 -1.68 116.25 117.06 3duf h VAL 245 Ca 0.14 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 3duf h VAL 245 Cb 0.24 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3duf h VAL 245 CO -0.01 0.45 0.03 0.50 0.02 0.00 0.00 177.57 178.56 3duf h LYS 246 N 0.66 0.68 -0.49 1.57 3.64 -0.72 -0.54 116.57 121.37 3duf h LYS 246 Ca 0.09 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 3duf h LYS 246 Cb 0.75 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 3duf h LYS 246 CO 0.06 0.76 0.07 0.00 -2.27 0.00 0.00 179.45 178.07 3duf h ALA 247 N 0.90 1.20 0.00 5.00 0.00 -0.82 -1.04 119.26 124.50 3duf h ALA 247 Ca 0.12 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3duf h ALA 247 Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3duf h ALA 247 CO 0.02 0.54 -0.54 0.00 0.00 0.00 0.00 179.25 179.26 3duf h ALA 248 N 1.34 0.83 -0.16 0.00 0.00 -1.17 -2.94 119.26 117.16 3duf h ALA 248 Ca 0.16 -0.49 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 3duf h ALA 248 Cb 0.34 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3duf h ALA 248 CO 0.01 0.67 -0.61 -0.09 0.00 0.00 0.00 179.25 179.23 3duf h ARG 249 N 0.00 0.57 -0.19 0.00 2.43 -0.32 -2.53 114.38 114.34 3duf h ARG 249 Ca -0.01 -0.39 -0.04 0.00 -0.81 0.00 0.00 59.98 58.74 3duf h ARG 249 Cb 1.16 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 3duf h ARG 249 CO 0.07 1.01 -0.03 0.93 -1.51 0.00 0.00 179.97 180.44 3duf h GLU 250 N 0.42 0.35 -0.06 0.20 5.08 -1.16 -2.89 114.58 116.53 3duf h GLU 250 Ca -0.01 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3duf h GLU 250 Cb 1.18 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 3duf h GLU 250 CO 0.12 0.59 0.02 -0.09 -1.00 0.00 0.00 179.01 178.65 3duf h ARG 251 N 0.08 0.05 -0.68 2.33 2.43 -1.54 -2.26 114.38 114.79 3duf h ARG 251 Ca 0.05 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3duf h ARG 251 Cb 0.45 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 3duf h ARG 251 CO 0.02 0.03 0.42 0.00 -1.51 0.00 0.00 179.97 178.93 3duf h ALA 252 N 1.04 0.86 0.00 2.80 0.00 -1.50 -1.73 119.26 120.73 3duf h ALA 252 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3duf h ALA 252 Cb 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.53 3duf h ALA 252 CO -0.03 0.32 0.00 0.44 0.00 0.00 0.00 179.25 179.98 3duf n ILE 253 N -4.58 0.46 0.62 0.00 -5.35 -1.09 -2.27 119.36 107.15 3duf n ILE 253 Ca 0.06 0.02 0.10 0.00 -0.27 0.00 0.00 62.75 62.65 3duf n ILE 253 Cb 0.04 -0.71 0.27 0.00 -1.74 0.00 0.00 39.64 37.50 3duf n ILE 253 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3duf n ASN 254 N -1.76 2.59 0.00 7.28 4.05 -0.72 -4.93 115.26 121.77 3duf n ASN 254 Ca 0.05 -1.91 0.00 0.00 0.45 0.00 0.00 54.58 53.17 3duf n ASN 254 Cb 0.31 -0.25 0.00 0.00 1.23 0.00 0.00 39.78 41.07 3duf n ASN 254 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3duf n GLY 255 N 1.31 0.40 0.22 8.20 0.00 -0.96 -4.91 105.19 109.44 3duf n GLY 255 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 3duf n GLY 255 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3duf h GLU 256 N 0.88 0.00 0.00 1.61 5.08 -1.59 -3.50 114.58 117.07 3duf h GLU 256 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3duf h GLU 256 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3duf h GLU 256 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 3duf n GLY 257 N 0.75 0.79 3.93 -3.84 0.00 -1.26 -4.99 105.19 100.58 3duf n GLY 257 Ca 0.03 -2.24 -0.28 0.00 0.00 0.00 0.00 46.02 43.54 3duf n GLY 257 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3duf s PRO 258 N -0.88 1.62 -0.00 1.61 0.04 -1.20 -3.57 135.00 132.62 3duf s PRO 258 Ca 0.00 -0.26 -0.06 0.00 0.04 0.00 0.00 61.00 60.73 3duf s PRO 258 Cb 0.00 -2.02 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 3duf s PRO 258 CO 0.00 -1.72 0.11 0.99 0.04 0.00 0.00 177.00 176.42 3duf s THR 259 N -3.53 0.08 -0.25 1.26 2.01 -1.10 -4.27 115.64 109.84 3duf s THR 259 Ca 0.65 -0.64 -0.03 0.00 0.31 0.00 0.00 61.69 61.98 3duf s THR 259 Cb -0.08 -0.37 0.01 0.00 0.01 0.00 0.00 72.50 72.07 3duf s THR 259 CO 0.48 -0.35 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.80 3duf s LEU 260 N -1.21 3.19 -0.22 4.42 2.96 -0.77 -0.34 118.68 126.71 3duf s LEU 260 Ca -0.13 -0.72 -0.03 0.00 -0.22 0.00 0.00 54.13 53.03 3duf s LEU 260 Cb -0.07 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.90 3duf s LEU 260 CO 0.01 -0.11 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.25 3duf s ILE 261 N 1.39 3.28 -0.27 6.68 1.01 0.19 -1.65 121.20 131.83 3duf s ILE 261 Ca 0.02 -0.56 -0.07 0.00 0.00 0.00 0.00 60.65 60.04 3duf s ILE 261 Cb -0.16 -2.50 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 3duf s ILE 261 CO -0.03 0.41 0.07 -0.70 0.00 0.00 0.00 174.94 174.69 3duf s GLU 262 N 1.46 3.38 -0.10 2.79 2.12 -0.68 0.50 118.70 128.18 3duf s GLU 262 Ca 0.05 -0.66 -0.09 0.00 0.36 0.00 0.00 54.97 54.64 3duf s GLU 262 Cb -0.14 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 3duf s GLU 262 CO -0.04 -0.31 0.20 0.95 -0.54 0.00 0.00 175.26 175.52 3duf s THR 263 N 1.56 5.40 -0.64 -1.70 -4.23 -0.13 -0.53 115.64 115.36 3duf s THR 263 Ca 0.05 0.35 -0.13 0.00 -1.18 0.00 0.00 61.69 60.77 3duf s THR 263 Cb -0.16 -3.47 0.16 0.00 1.34 0.00 0.00 72.50 70.37 3duf s THR 263 CO 0.03 0.60 0.57 -0.76 -0.54 0.00 0.00 174.62 174.52 3duf s LEU 264 N -0.97 6.27 0.00 4.79 1.43 -0.31 -0.87 118.68 129.03 3duf s LEU 264 Ca 0.17 -2.21 0.00 0.00 -1.03 0.00 0.00 54.13 51.06 3duf s LEU 264 Cb -0.13 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.93 3duf s LEU 264 CO 0.06 -0.70 0.00 0.00 0.23 0.00 0.00 176.35 175.94 3duf s PHE 266 N 1.33 -0.44 -0.10 0.00 5.36 -1.26 -4.35 117.98 118.51 3duf s PHE 266 Ca 0.00 0.59 0.00 0.00 -0.96 0.00 0.00 56.93 56.56 3duf s PHE 266 Cb 0.00 0.48 -0.02 0.00 -0.34 0.00 0.00 43.02 43.14 3duf s PHE 266 CO 0.00 -0.51 -0.11 0.50 -1.46 0.00 0.00 175.22 173.64 3duf s ARG 267 N -1.99 3.07 0.06 10.12 3.52 -1.26 -3.56 118.95 128.91 3duf s ARG 267 Ca -0.02 -0.63 0.23 0.00 -0.13 0.00 0.00 55.73 55.18 3duf s ARG 267 Cb -0.01 -2.60 0.09 0.00 -1.56 0.00 0.00 34.95 30.87 3duf s ARG 267 CO -0.01 0.42 1.06 0.66 -0.81 0.00 0.00 175.30 176.62 3duf n TYR 268 N 2.94 0.30 -3.08 5.12 4.01 0.11 -4.97 117.16 121.59 3duf n TYR 268 Ca -0.18 0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 3duf n TYR 268 Cb 0.53 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3duf n TYR 268 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3duf n GLY 269 N 1.37 3.57 3.88 2.72 0.00 -1.26 -5.07 105.19 110.39 3duf n GLY 269 Ca 0.02 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.62 3duf n GLY 269 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3duf s PRO 270 N -0.48 3.33 0.14 1.61 0.04 -1.26 -4.99 135.00 133.38 3duf s PRO 270 Ca 0.00 0.64 -0.31 0.00 0.04 0.00 0.00 61.00 61.37 3duf s PRO 270 Cb 0.00 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 3duf s PRO 270 CO 0.00 -0.74 1.56 1.25 0.04 0.00 0.00 177.00 179.11 3duf h HIS 271 N -0.44 -1.53 -3.84 0.56 -0.00 -1.96 -3.36 115.15 104.58 3duf h HIS 271 Ca -0.44 0.07 -0.24 0.00 -0.00 0.00 0.00 60.37 59.76 3duf h HIS 271 Cb 1.21 0.72 -0.05 0.00 -0.00 0.00 0.00 27.41 29.29 3duf h HIS 271 CO 0.60 -0.48 -0.08 0.25 -0.00 0.00 0.00 177.93 178.22 3duf n THR 272 N -5.40 0.00 -0.66 6.26 -2.24 -1.26 -4.06 114.28 106.92 3duf n THR 272 Ca -0.03 -1.64 0.09 0.00 -2.27 0.00 0.00 64.05 60.20 3duf n THR 272 Cb 0.35 1.06 0.32 0.00 -2.10 0.00 0.00 70.33 69.97 3duf n THR 272 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3duf n MET 273 N -0.56 3.61 -3.01 -0.78 0.00 -0.84 -3.97 117.12 111.56 3duf n MET 273 Ca -0.01 -2.80 -0.41 0.00 0.00 0.00 0.00 57.70 54.48 3duf n MET 273 Cb 0.58 -1.84 -0.05 0.00 0.00 0.00 0.00 33.22 31.90 3duf n MET 273 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 3duf s SER 274 N -1.10 6.71 1.23 7.83 0.01 -1.24 -4.80 113.70 122.34 3duf s SER 274 Ca 0.46 0.88 0.00 0.00 1.31 0.00 0.00 55.95 58.60 3duf s SER 274 Cb 0.31 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 64.16 3duf s SER 274 CO 0.20 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 174.04 3duf n GLY 275 N 3.92 2.16 0.30 3.44 0.00 -1.26 -2.74 105.19 111.01 3duf n GLY 275 Ca 0.02 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.44 3duf n GLY 275 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3duf n ASP 276 N 8.10 0.29 -4.05 1.61 8.00 -1.26 -4.53 116.55 124.71 3duf n ASP 276 Ca 0.00 -0.97 -0.24 0.00 0.71 0.00 0.00 54.79 54.29 3duf n ASP 276 Cb 0.00 -0.15 -0.16 0.00 -0.02 0.00 0.00 41.12 40.79 3duf n ASP 276 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3duf s ASP 277 N -0.92 1.79 -1.35 -2.24 -0.00 -1.11 -1.48 116.67 111.36 3duf s ASP 277 Ca 0.00 -0.30 -0.13 0.00 -0.00 0.00 0.00 52.55 52.13 3duf s ASP 277 Cb 0.00 -0.68 0.10 0.00 -0.00 0.00 0.00 42.92 42.34 3duf s ASP 277 CO 0.00 0.07 1.97 -0.81 -0.00 0.00 0.00 175.17 176.40 3duf n PRO 278 N 3.54 3.22 -0.01 8.23 -0.04 -1.25 -3.72 135.00 144.98 3duf n PRO 278 Ca -0.21 -3.13 0.00 0.00 -0.04 0.00 0.00 63.50 60.12 3duf n PRO 278 Cb 0.52 -3.15 -0.02 0.00 -0.04 0.00 0.00 33.50 30.81 3duf n PRO 278 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3duf n THR 279 N 4.54 0.08 -1.41 0.52 -1.04 -0.55 -5.05 114.28 111.36 3duf n THR 279 Ca 0.46 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.05 62.07 3duf n THR 279 Cb 0.39 -0.23 0.09 0.00 -1.82 0.00 0.00 70.33 68.76 3duf n THR 279 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3duf s ARG 280 N -2.12 2.26 -0.34 -2.82 0.52 -0.89 -4.83 118.95 110.73 3duf s ARG 280 Ca -0.01 1.44 -0.31 0.00 -0.52 0.00 0.00 55.73 56.33 3duf s ARG 280 Cb 0.01 -1.88 -0.13 0.00 0.52 0.00 0.00 34.95 33.47 3duf s ARG 280 CO 0.10 -1.68 1.18 0.98 0.02 0.00 0.00 175.30 175.90 3duf n TYR 281 N -3.02 1.09 -3.82 -0.53 4.19 -1.26 -4.93 117.16 108.87 3duf n TYR 281 Ca 0.11 0.71 -0.36 0.00 3.31 0.00 0.00 57.90 61.67 3duf n TYR 281 Cb 0.52 -1.52 -0.13 0.00 0.49 0.00 0.00 39.34 38.69 3duf n TYR 281 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3duf s ARG 282 N 2.56 3.55 -0.63 2.98 0.52 -1.26 -5.06 118.95 121.61 3duf s ARG 282 Ca 0.74 -0.53 -0.22 0.00 -0.52 0.00 0.00 55.73 55.20 3duf s ARG 282 Cb -1.02 -3.20 0.08 0.00 0.52 0.00 0.00 34.95 31.33 3duf s ARG 282 CO 0.53 -0.18 0.89 0.45 0.02 0.00 0.00 175.30 177.01 3duf s SER 283 N 1.54 6.18 0.56 0.23 0.15 -1.26 -4.88 113.70 116.23 3duf s SER 283 Ca 0.06 -1.07 0.34 0.00 0.70 0.00 0.00 55.95 55.98 3duf s SER 283 Cb -0.15 -2.39 1.59 0.00 -1.71 0.00 0.00 66.02 63.37 3duf s SER 283 CO 0.01 -1.34 2.08 0.11 1.20 0.00 0.00 173.24 175.30 3duf h LYS 284 N 9.45 0.00 -0.18 5.44 1.79 -1.99 -2.86 116.57 128.22 3duf h LYS 284 Ca -0.29 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.11 3duf h LYS 284 Cb 1.07 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.72 3duf h LYS 284 CO 1.15 0.05 -0.18 1.49 -1.08 0.00 0.00 179.45 180.88 3duf h GLU 285 N 0.00 0.44 -0.01 3.15 4.81 -2.02 -2.78 114.58 118.18 3duf h GLU 285 Ca -0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3duf h GLU 285 Cb 0.37 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.76 3duf h GLU 285 CO 0.01 0.80 0.00 1.28 -0.73 0.00 0.00 179.01 180.37 3duf n LEU 286 N -4.48 0.13 -0.06 1.64 4.77 -1.11 -3.30 117.00 114.58 3duf n LEU 286 Ca -0.06 -0.05 -0.03 0.00 -0.03 0.00 0.00 56.01 55.84 3duf n LEU 286 Cb 0.39 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 3duf n LEU 286 CO 0.41 0.02 -0.24 -0.33 -1.33 0.00 0.00 177.39 175.92 3duf h GLU 287 N 0.19 0.00 -0.69 3.23 4.39 -1.28 -3.30 114.58 117.13 3duf h GLU 287 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 3duf h GLU 287 Cb 0.04 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 3duf h GLU 287 CO 0.00 0.00 0.17 -0.91 -1.16 0.00 0.00 179.01 177.11 3duf h ASN 288 N -0.99 1.03 -0.73 1.42 2.35 -1.64 0.38 115.58 117.40 3duf h ASN 288 Ca 0.00 -0.21 0.12 0.00 -0.55 0.00 0.00 56.30 55.66 3duf h ASN 288 Cb 0.35 -0.27 -0.08 0.00 0.05 0.00 0.00 38.32 38.37 3duf h ASN 288 CO 0.00 0.98 0.32 -0.08 -1.65 0.00 0.00 177.43 177.01 3duf h GLU 289 N 1.04 0.50 0.00 0.81 4.81 -1.76 -1.07 114.58 118.91 3duf h GLU 289 Ca 0.22 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3duf h GLU 289 Cb 0.36 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3duf h GLU 289 CO 0.00 0.33 -0.60 0.91 -0.73 0.00 0.00 179.01 178.92 3duf n TRP 290 N -4.94 0.22 0.26 0.92 7.02 -0.95 -3.72 117.44 116.25 3duf n TRP 290 Ca 0.13 0.06 0.14 0.00 -1.02 0.00 0.00 57.50 56.81 3duf n TRP 290 Cb 0.35 -0.41 0.61 0.00 -2.42 0.00 0.00 31.31 29.44 3duf n TRP 290 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3duf h ALA 291 N 2.78 1.03 0.00 6.99 0.00 0.11 -2.16 119.26 128.01 3duf h ALA 291 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3duf h ALA 291 Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3duf h ALA 291 CO 0.00 0.12 -0.27 1.63 0.00 0.00 0.00 179.25 180.73 3duf n LYS 292 N -3.26 0.20 -0.03 0.00 5.02 -1.08 -3.50 118.16 115.52 3duf n LYS 292 Ca 0.00 0.11 0.12 0.00 -2.02 0.00 0.00 58.31 56.53 3duf n LYS 292 Cb 0.34 -1.68 0.20 0.00 -0.02 0.00 0.00 35.03 33.87 3duf n LYS 292 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3duf n LYS 293 N -2.00 2.22 -1.57 1.97 5.02 -0.82 -4.94 118.16 118.04 3duf n LYS 293 Ca 0.05 -1.78 -0.61 0.00 -2.02 0.00 0.00 58.31 53.95 3duf n LYS 293 Cb 0.41 -1.47 -0.09 0.00 -0.02 0.00 0.00 35.03 33.86 3duf n LYS 293 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3duf n ASP 294 N 1.13 1.00 0.28 4.39 -0.08 -1.20 -4.79 116.55 117.27 3duf n ASP 294 Ca 0.16 1.08 0.18 0.00 -1.51 0.00 0.00 54.79 54.70 3duf n ASP 294 Cb 0.55 -0.80 0.93 0.00 2.34 0.00 0.00 41.12 44.14 3duf n ASP 294 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3duf h PRO 295 N 4.38 0.00 0.08 -0.67 0.13 -1.87 -0.70 132.00 133.35 3duf h PRO 295 Ca -0.40 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.47 3duf h PRO 295 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3duf h PRO 295 CO 0.86 0.00 -1.13 -0.07 -0.23 0.00 0.00 178.00 177.44 3duf h LEU 296 N 0.00 0.42 0.80 1.56 3.38 -1.89 -2.99 115.31 116.60 3duf h LEU 296 Ca 0.04 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 3duf h LEU 296 Cb 0.44 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.06 3duf h LEU 296 CO -0.00 1.28 -0.39 0.58 0.09 0.00 0.00 178.44 180.00 3duf h VAL 297 N 0.11 0.21 -0.63 1.22 2.07 -1.47 -1.35 116.25 116.41 3duf h VAL 297 Ca -0.11 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3duf h VAL 297 Cb 1.82 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 3duf h VAL 297 CO 0.19 0.00 0.19 0.08 0.02 0.00 0.00 177.57 178.05 3duf h ARG 298 N -1.09 0.96 -0.06 1.57 0.11 -1.67 -2.51 114.38 111.70 3duf h ARG 298 Ca -0.11 -0.19 -0.15 0.00 0.10 0.00 0.00 59.98 59.63 3duf h ARG 298 Cb 0.83 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.75 3duf h ARG 298 CO 0.18 0.83 -0.61 0.35 0.10 0.00 0.00 179.97 180.82 3duf h PHE 299 N 0.93 0.29 -0.83 4.08 3.57 -1.54 -2.47 116.94 120.97 3duf h PHE 299 Ca 0.21 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3duf h PHE 299 Cb 0.28 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 3duf h PHE 299 CO 0.02 0.78 0.47 -0.09 -2.23 0.00 0.00 178.31 177.26 3duf h ARG 300 N 0.16 1.14 0.00 1.11 2.43 -0.90 -1.06 114.38 117.27 3duf h ARG 300 Ca -0.01 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 58.98 3duf h ARG 300 Cb 1.12 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 3duf h ARG 300 CO 0.09 0.82 -0.28 0.87 -1.51 0.00 0.00 179.97 179.97 3duf h LYS 301 N 1.14 0.00 0.00 0.20 1.57 -1.27 -2.14 116.57 116.07 3duf h LYS 301 Ca 0.29 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.97 3duf h LYS 301 Cb -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3duf h LYS 301 CO -0.05 0.28 -0.48 0.35 -0.57 0.00 0.00 179.45 178.99 3duf h PHE 302 N 0.00 0.00 0.00 -1.35 3.57 -0.79 -1.82 116.94 116.55 3duf h PHE 302 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3duf h PHE 302 Cb 0.73 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.47 3duf h PHE 302 CO 0.00 0.48 -1.07 1.28 -2.23 0.00 0.00 178.31 176.77 3duf n LEU 303 N -3.26 0.77 0.09 0.59 4.77 -0.51 -3.80 117.00 115.64 3duf n LEU 303 Ca 0.02 0.29 -0.20 0.00 -0.03 0.00 0.00 56.01 56.09 3duf n LEU 303 Cb 0.70 -0.06 -0.15 0.00 -2.33 0.00 0.00 43.42 41.58 3duf n LEU 303 CO 0.40 -0.16 -0.33 -0.33 -1.33 0.00 0.00 177.39 175.64 3duf h GLU 304 N 0.00 0.35 0.00 3.23 5.08 -1.41 0.34 114.58 122.18 3duf h GLU 304 Ca 0.00 -0.60 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 3duf h GLU 304 Cb 0.98 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3duf h GLU 304 CO 0.00 1.25 0.00 0.00 -1.00 0.00 0.00 179.01 179.26 3duf n ALA 305 N -2.71 1.85 -1.07 3.43 0.00 -0.69 -0.44 120.51 120.89 3duf n ALA 305 Ca -0.17 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3duf n ALA 305 Cb 1.06 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3duf n ALA 305 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3duf n LYS 306 N -0.70 0.00 -3.89 0.00 5.02 -1.16 -5.03 118.16 112.39 3duf n LYS 306 Ca 0.03 -0.41 -0.31 0.00 -2.02 0.00 0.00 58.31 55.60 3duf n LYS 306 Cb 0.01 -0.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.54 3duf n LYS 306 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3duf n GLY 307 N 0.00 -0.46 0.59 0.72 0.00 0.42 -4.83 105.19 101.62 3duf n GLY 307 Ca 0.00 0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.20 3duf n GLY 307 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3duf n LEU 308 N -4.13 3.04 -3.74 0.99 4.77 0.11 -4.96 117.00 113.09 3duf n LEU 308 Ca 0.05 -2.36 -0.12 0.00 -0.03 0.00 0.00 56.01 53.55 3duf n LEU 308 Cb 0.51 -0.30 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 3duf n LEU 308 CO 0.72 0.68 -0.06 0.86 -1.33 0.00 0.00 177.39 178.26 3duf s TRP 309 N -1.64 -0.38 0.24 -1.77 -0.11 -1.18 -4.88 118.94 109.22 3duf s TRP 309 Ca 0.26 0.89 0.07 0.00 1.22 0.00 0.00 56.10 58.53 3duf s TRP 309 Cb 0.18 0.11 -0.05 0.00 -1.50 0.00 0.00 33.47 32.21 3duf s TRP 309 CO 0.11 -0.23 -0.09 -1.12 -4.62 0.00 0.00 176.95 171.00 3duf s SER 310 N 0.93 2.52 0.16 5.86 0.01 -1.26 -4.68 113.70 117.25 3duf s SER 310 Ca -0.06 -1.12 -0.10 0.00 1.31 0.00 0.00 55.95 55.97 3duf s SER 310 Cb -0.07 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.05 3duf s SER 310 CO -0.07 -0.30 1.57 -0.33 0.41 0.00 0.00 173.24 174.53 3duf h GLU 311 N 2.43 1.02 -0.44 12.44 5.08 -2.02 -2.45 114.58 130.64 3duf h GLU 311 Ca -0.39 -0.40 -0.07 0.00 -1.00 0.00 0.00 59.36 57.50 3duf h GLU 311 Cb 1.23 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 3duf h GLU 311 CO 0.65 1.09 -0.00 1.05 -1.00 0.00 0.00 179.01 180.79 3duf h GLU 312 N 0.88 0.71 -0.65 2.33 9.09 -2.00 -2.38 114.58 122.56 3duf h GLU 312 Ca 0.13 -0.18 -0.03 0.00 0.05 0.00 0.00 59.36 59.33 3duf h GLU 312 Cb 0.73 -0.09 -0.03 0.00 -1.65 0.00 0.00 28.75 27.71 3duf h GLU 312 CO 0.06 0.73 0.29 1.49 0.05 0.00 0.00 179.01 181.62 3duf h GLU 313 N 0.67 0.93 -0.04 1.06 4.81 -1.91 -1.62 114.58 118.48 3duf h GLU 313 Ca 0.13 -0.13 -0.18 0.00 -0.13 0.00 0.00 59.36 59.05 3duf h GLU 313 Cb 0.42 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3duf h GLU 313 CO 0.02 0.74 -0.74 1.49 -0.73 0.00 0.00 179.01 179.78 3duf h GLU 314 N 0.93 0.26 -0.55 1.92 4.81 -1.09 -2.78 114.58 118.07 3duf h GLU 314 Ca 0.22 -0.22 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 3duf h GLU 314 Cb 0.13 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3duf h GLU 314 CO -0.03 0.89 -0.06 -0.91 -0.73 0.00 0.00 179.01 178.17 3duf h ASN 315 N 0.17 1.01 0.14 1.04 2.35 -0.97 0.05 115.58 119.38 3duf h ASN 315 Ca -0.03 -0.33 -0.05 0.00 -0.55 0.00 0.00 56.30 55.34 3duf h ASN 315 Cb 1.31 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 3duf h ASN 315 CO 0.12 1.10 -0.18 0.78 -1.65 0.00 0.00 177.43 177.60 3duf h ASN 316 N 0.90 0.09 -0.05 5.81 2.35 -1.26 0.51 115.58 123.93 3duf h ASN 316 Ca 0.15 -0.02 -0.24 0.00 -0.55 0.00 0.00 56.30 55.64 3duf h ASN 316 Cb 0.62 -0.02 0.02 0.00 0.05 0.00 0.00 38.32 38.99 3duf h ASN 316 CO 0.04 0.29 -0.92 0.58 -1.65 0.00 0.00 177.43 175.77 3duf h VAL 317 N 0.09 1.29 -0.25 2.81 2.07 -1.18 -2.75 116.25 118.33 3duf h VAL 317 Ca 0.02 -2.14 -0.08 0.00 0.82 0.00 0.00 66.70 65.32 3duf h VAL 317 Cb 0.38 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 3duf h VAL 317 CO 0.03 0.66 -0.16 0.40 0.02 0.00 0.00 177.57 178.52 3duf h ILE 318 N 0.39 1.31 0.00 4.57 2.04 -0.22 -2.02 117.51 123.57 3duf h ILE 318 Ca -0.10 -1.28 -0.05 0.00 1.00 0.00 0.00 64.86 64.44 3duf h ILE 318 Cb 1.57 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 3duf h ILE 318 CO 0.18 0.40 -0.23 -0.33 0.00 0.00 0.00 178.15 178.17 3duf h GLU 319 N 0.28 0.00 -0.00 2.37 4.39 -0.10 -2.24 114.58 119.28 3duf h GLU 319 Ca 0.05 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.57 3duf h GLU 319 Cb 0.69 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 3duf h GLU 319 CO 0.04 0.23 -0.84 0.37 -1.16 0.00 0.00 179.01 177.66 3duf h GLN 320 N 0.00 0.14 -0.14 2.33 4.15 -1.38 -2.45 115.11 117.75 3duf h GLN 320 Ca -0.00 -0.15 -0.04 0.00 0.77 0.00 0.00 58.65 59.23 3duf h GLN 320 Cb 0.65 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 3duf h GLN 320 CO 0.03 0.90 -0.07 0.00 -1.93 0.00 0.00 178.83 177.76 3duf h ALA 321 N 1.05 0.20 -0.17 3.38 0.00 -0.80 -1.21 119.26 121.71 3duf h ALA 321 Ca -0.03 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 3duf h ALA 321 Cb 1.46 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 3duf h ALA 321 CO 0.12 -0.00 -0.34 0.87 0.00 0.00 0.00 179.25 179.90 3duf h LYS 322 N -0.03 0.36 -0.24 0.00 1.57 -1.50 -1.37 116.57 115.36 3duf h LYS 322 Ca 0.03 -0.15 -0.16 0.00 -1.87 0.00 0.00 60.65 58.50 3duf h LYS 322 Cb 0.53 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3duf h LYS 322 CO 0.02 0.66 -0.49 1.49 -0.57 0.00 0.00 179.45 180.56 3duf h GLU 323 N 0.31 0.75 0.00 3.15 4.81 -1.36 -2.19 114.58 120.05 3duf h GLU 323 Ca 0.04 -0.49 -0.10 0.00 -0.13 0.00 0.00 59.36 58.68 3duf h GLU 323 Cb 0.74 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 3duf h GLU 323 CO 0.06 1.11 -0.47 0.93 -0.73 0.00 0.00 179.01 179.91 3duf h GLU 324 N 0.49 0.00 -0.15 1.92 5.08 -1.16 -3.05 114.58 117.71 3duf h GLU 324 Ca 0.01 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.18 3duf h GLU 324 Cb 1.09 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.35 3duf h GLU 324 CO 0.11 0.47 -0.65 0.82 -1.00 0.00 0.00 179.01 178.76 3duf h ILE 325 N 0.00 1.31 -0.85 3.13 1.08 -1.19 -2.46 117.51 118.53 3duf h ILE 325 Ca -0.00 -1.89 0.01 0.00 -0.39 0.00 0.00 64.86 62.59 3duf h ILE 325 Cb 1.03 2.03 -0.04 0.00 -3.07 0.00 0.00 36.82 36.76 3duf h ILE 325 CO 0.06 0.59 0.56 0.50 -0.69 0.00 0.00 178.15 179.17 3duf h LYS 326 N 0.38 1.11 -0.32 2.37 3.64 -1.39 -1.34 116.57 121.02 3duf h LYS 326 Ca -0.04 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.11 3duf h LYS 326 Cb 1.28 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3duf h LYS 326 CO 0.13 0.73 -0.43 0.93 -2.27 0.00 0.00 179.45 178.54 3duf h GLU 327 N 1.14 0.82 -0.01 1.90 5.08 -1.54 -2.92 114.58 119.05 3duf h GLU 327 Ca 0.32 -0.45 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 3duf h GLU 327 Cb -0.11 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3duf h GLU 327 CO -0.08 1.09 -0.50 0.00 -1.00 0.00 0.00 179.01 178.52 3duf h ALA 328 N 0.84 1.17 -0.30 3.43 0.00 -1.11 -1.15 119.26 122.15 3duf h ALA 328 Ca 0.04 -0.45 -0.16 0.00 0.00 0.00 0.00 54.91 54.34 3duf h ALA 328 Cb 1.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3duf h ALA 328 CO 0.10 0.62 -0.46 0.97 0.00 0.00 0.00 179.25 180.48 3duf h ILE 329 N 0.01 1.29 -0.16 0.00 -0.00 -1.18 -2.64 117.51 114.82 3duf h ILE 329 Ca -0.00 -1.65 -0.18 0.00 -0.00 0.00 0.00 64.86 63.03 3duf h ILE 329 Cb 0.88 1.55 -0.00 0.00 -0.00 0.00 0.00 36.82 39.25 3duf h ILE 329 CO 0.07 0.53 -0.65 0.50 -0.00 0.00 0.00 178.15 178.60 3duf h LYS 330 N 0.62 0.60 0.00 2.19 3.64 -1.32 -2.46 116.57 119.84 3duf h LYS 330 Ca 0.04 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 3duf h LYS 330 Cb 1.03 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3duf h LYS 330 CO 0.10 1.05 0.00 -0.22 -2.27 0.00 0.00 179.45 178.11 3duf h LYS 331 N 0.44 0.00 0.00 1.90 1.63 -1.15 -2.25 116.57 117.13 3duf h LYS 331 Ca -0.01 0.00 -0.25 0.00 -0.85 0.00 0.00 60.65 59.53 3duf h LYS 331 Cb 1.22 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.81 3duf h LYS 331 CO 0.12 0.00 -1.48 0.00 -3.45 0.00 0.00 179.45 174.64 3duf h ALA 332 N 2.06 0.67 -0.07 5.00 0.00 -1.11 -3.29 119.26 122.52 3duf h ALA 332 Ca 0.00 -1.24 -0.18 0.00 0.00 0.00 0.00 54.91 53.49 3duf h ALA 332 Cb 0.33 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3duf h ALA 332 CO 0.00 1.40 -0.72 -0.44 0.00 0.00 0.00 179.25 179.49 3duf h ASP 333 N 0.00 0.42 0.83 0.00 3.32 -0.97 -3.25 116.42 116.76 3duf h ASP 333 Ca -0.20 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 56.51 3duf h ASP 333 Cb 1.89 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 41.30 3duf h ASP 333 CO 0.08 1.00 -0.32 -0.33 -1.72 0.00 0.00 179.24 177.96 3duf h GLU 334 N 0.24 0.00 -6.78 3.56 5.08 -1.55 -3.45 114.58 111.68 3duf h GLU 334 Ca -0.03 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.80 3duf h GLU 334 Cb 1.29 0.00 0.08 0.00 0.50 0.00 0.00 28.75 30.62 3duf h GLU 334 CO 0.12 0.32 0.88 0.95 -1.00 0.00 0.00 179.01 180.28 3duf s THR 335 N -3.67 2.15 0.84 1.13 -4.23 -1.23 -4.94 115.64 105.69 3duf s THR 335 Ca 0.00 0.12 -0.12 0.00 -1.18 0.00 0.00 61.69 60.51 3duf s THR 335 Cb 0.11 -3.08 0.10 0.00 1.34 0.00 0.00 72.50 70.97 3duf s THR 335 CO 0.67 0.02 1.19 -2.16 -0.54 0.00 0.00 174.62 173.79 3duf s PRO 336 N -0.32 1.46 0.50 3.99 0.04 -1.26 -4.99 135.00 134.41 3duf s PRO 336 Ca 0.64 1.69 -0.20 0.00 0.04 0.00 0.00 61.00 63.17 3duf s PRO 336 Cb -0.47 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.23 3duf s PRO 336 CO 0.46 -2.33 1.06 0.15 0.04 0.00 0.00 177.00 176.37 3duf s LYS 337 N -4.29 3.72 0.27 4.56 1.02 -1.26 -5.02 119.74 118.74 3duf s LYS 337 Ca 0.71 1.41 -0.29 0.00 0.02 0.00 0.00 55.97 57.82 3duf s LYS 337 Cb -0.27 -2.08 -0.09 0.00 -0.52 0.00 0.00 37.83 34.87 3duf s LYS 337 CO 0.53 -0.50 1.11 -0.65 -0.92 0.00 0.00 175.35 174.91 3duf s GLN 338 N -3.23 4.62 0.12 1.68 -0.21 -1.26 -5.05 119.66 116.33 3duf s GLN 338 Ca 0.68 1.82 0.10 0.00 0.02 0.00 0.00 55.36 57.98 3duf s GLN 338 Cb -0.18 -3.20 -0.04 0.00 1.00 0.00 0.00 33.01 30.60 3duf s GLN 338 CO 0.21 0.17 -0.22 0.15 -2.12 0.00 0.00 175.29 173.48 3duf s LYS 339 N -1.30 1.63 0.51 2.91 1.02 -1.26 -5.02 119.74 118.23 3duf s LYS 339 Ca 0.45 -1.24 0.29 0.00 0.02 0.00 0.00 55.97 55.49 3duf s LYS 339 Cb -0.32 -2.02 1.39 0.00 -0.52 0.00 0.00 37.83 36.36 3duf s LYS 339 CO 0.41 0.47 1.86 0.28 -0.92 0.00 0.00 175.35 177.45 3duf h VAL 340 N 3.74 0.55 -0.48 3.17 2.07 -1.96 0.32 116.25 123.65 3duf h VAL 340 Ca -0.50 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 3duf h VAL 340 Cb 1.17 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3duf h VAL 340 CO 0.43 0.02 0.13 0.71 0.02 0.00 0.00 177.57 178.88 3duf h THR 341 N 0.11 1.23 -0.84 2.57 1.35 -1.94 -1.43 112.91 113.95 3duf h THR 341 Ca 0.47 -0.80 0.10 0.00 -0.55 0.00 0.00 66.41 65.63 3duf h THR 341 Cb 1.68 0.85 -0.08 0.00 -1.73 0.00 0.00 68.15 68.87 3duf h THR 341 CO -0.06 0.29 0.48 0.44 -0.25 0.00 0.00 175.52 176.41 3duf h ASP 342 N 0.64 0.68 -0.13 5.36 3.32 -1.34 0.12 116.42 125.07 3duf h ASP 342 Ca 0.15 0.05 -0.11 0.00 0.02 0.00 0.00 57.03 57.14 3duf h ASP 342 Cb 0.30 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3duf h ASP 342 CO -0.00 0.37 -0.28 -0.07 -1.72 0.00 0.00 179.24 177.54 3duf h LEU 343 N 0.78 0.61 -0.52 1.55 3.38 -1.31 -2.87 115.31 116.93 3duf h LEU 343 Ca 0.41 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 3duf h LEU 343 Cb 0.41 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3duf h LEU 343 CO -0.26 0.86 -0.64 0.40 0.09 0.00 0.00 178.44 178.88 3duf h ILE 344 N 0.52 1.37 -0.27 1.22 2.04 -0.11 -3.27 117.51 119.01 3duf h ILE 344 Ca 0.07 -2.01 -0.08 0.00 1.00 0.00 0.00 64.86 63.83 3duf h ILE 344 Cb 0.75 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 3duf h ILE 344 CO 0.06 0.60 -0.19 0.28 0.00 0.00 0.00 178.15 178.91 3duf h SER 345 N 0.27 0.47 -0.28 1.72 0.02 -0.61 -3.07 113.55 112.07 3duf h SER 345 Ca -0.01 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 3duf h SER 345 Cb 1.19 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.60 3duf h SER 345 CO 0.11 0.67 0.00 2.30 -1.14 0.00 0.00 176.83 178.77 3duf n ILE 346 N -4.16 0.37 0.03 3.27 -5.35 -1.11 -4.12 119.36 108.28 3duf n ILE 346 Ca 0.00 -0.39 -0.19 0.00 -0.27 0.00 0.00 62.75 61.90 3duf n ILE 346 Cb 0.36 0.21 -0.11 0.00 -1.74 0.00 0.00 39.64 38.36 3duf n ILE 346 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 3duf h MET 347 N 1.79 0.54 0.00 6.28 2.86 -1.64 -3.48 114.93 121.28 3duf h MET 347 Ca 0.00 -0.60 -0.28 0.00 -2.06 0.00 0.00 59.70 56.76 3duf h MET 347 Cb 0.41 0.17 -0.07 0.00 0.06 0.00 0.00 31.60 32.17 3duf h MET 347 CO 0.00 1.22 -0.27 1.19 1.06 0.00 0.00 176.91 180.12 3duf n PHE 348 N -4.04 -0.54 -0.07 -0.22 3.01 -1.26 -5.05 117.46 109.29 3duf n PHE 348 Ca -0.11 -1.68 -0.17 0.00 1.01 0.00 0.00 57.45 56.50 3duf n PHE 348 Cb 0.79 0.19 -0.14 0.00 -0.01 0.00 0.00 39.48 40.31 3duf n PHE 348 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 3duf n GLU 349 N -0.38 0.69 -3.76 -1.08 0.00 -1.26 -4.76 120.64 110.08 3duf n GLU 349 Ca 0.04 0.18 -0.30 0.00 0.00 0.00 0.00 57.16 57.09 3duf n GLU 349 Cb 0.37 -1.62 -0.15 0.00 0.00 0.00 0.00 31.44 30.04 3duf n GLU 349 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.13 175.30 3duf s GLU 350 N -2.54 0.79 0.20 3.44 4.04 -1.26 -5.12 118.70 118.26 3duf s GLU 350 Ca -0.23 -1.05 -0.32 0.00 0.04 0.00 0.00 54.97 53.41 3duf s GLU 350 Cb 0.08 -2.09 -0.14 0.00 0.02 0.00 0.00 34.13 31.99 3duf s GLU 350 CO 0.72 -0.93 1.41 1.28 -1.84 0.00 0.00 175.26 175.90 3duf n LEU 351 N 4.83 2.81 -4.77 1.83 4.77 -1.26 -4.99 117.00 120.21 3duf n LEU 351 Ca -0.03 1.13 -0.29 0.00 -0.03 0.00 0.00 56.01 56.79 3duf n LEU 351 Cb 0.43 -1.39 0.14 0.00 -2.33 0.00 0.00 43.42 40.27 3duf n LEU 351 CO 0.12 -0.58 0.70 -2.16 -1.33 0.00 0.00 177.39 174.14 3duf s PRO 352 N -0.05 1.04 0.22 3.23 0.04 -1.26 -4.77 135.00 133.46 3duf s PRO 352 Ca 0.72 0.34 -0.08 0.00 0.04 0.00 0.00 61.00 62.02 3duf s PRO 352 Cb -0.70 -1.82 0.36 0.00 0.04 0.00 0.00 34.50 32.38 3duf s PRO 352 CO 0.47 -2.27 1.69 0.27 0.04 0.00 0.00 177.00 177.20 3duf h PHE 353 N -1.56 0.20 0.00 0.56 -0.00 -2.00 -2.38 116.94 111.77 3duf h PHE 353 Ca -0.51 0.04 -0.03 0.00 -0.00 0.00 0.00 57.97 57.47 3duf h PHE 353 Cb 1.33 0.01 -0.00 0.00 -0.00 0.00 0.00 35.95 37.29 3duf h PHE 353 CO 0.30 -0.07 -0.16 -2.95 -0.00 0.00 0.00 178.31 175.43 3duf h ASN 354 N 0.25 0.00 0.51 -0.68 -1.07 -2.01 -2.64 115.58 109.94 3duf h ASN 354 Ca 0.36 0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.43 3duf h ASN 354 Cb 0.57 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.81 3duf h ASN 354 CO -0.46 0.16 -1.46 -0.07 0.07 0.00 0.00 177.43 175.67 3duf h LEU 355 N 0.00 0.37 -0.46 6.14 3.38 -1.82 -3.11 115.31 119.80 3duf h LEU 355 Ca -0.00 -0.49 0.09 0.00 0.09 0.00 0.00 57.88 57.58 3duf h LEU 355 Cb 0.31 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 3duf h LEU 355 CO 0.02 1.40 -0.08 0.11 0.09 0.00 0.00 178.44 179.98 3duf h LYS 356 N 0.06 0.03 0.36 1.13 1.79 -1.08 0.98 116.57 119.84 3duf h LYS 356 Ca -0.21 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.24 3duf h LYS 356 Cb 2.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.64 3duf h LYS 356 CO 0.17 0.02 -0.17 0.93 -1.08 0.00 0.00 179.45 179.31 3duf h GLU 357 N 0.03 -0.47 0.00 3.15 5.08 -1.62 -2.84 114.58 117.92 3duf h GLU 357 Ca 0.23 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3duf h GLU 357 Cb 0.35 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3duf h GLU 357 CO -0.45 -0.26 0.00 1.96 -1.00 0.00 0.00 179.01 179.26 3duf h GLN 358 N -0.57 0.00 0.00 2.33 4.20 -1.35 -1.20 115.11 118.52 3duf h GLN 358 Ca -0.05 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.47 3duf h GLN 358 Cb 0.42 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 3duf h GLN 358 CO 0.08 0.00 -0.94 -0.92 -0.67 0.00 0.00 178.83 176.39 3duf h TYR 359 N 0.00 0.00 0.02 2.96 5.03 -0.57 -2.45 116.97 121.96 3duf h TYR 359 Ca 0.00 0.00 -0.26 0.00 2.58 0.00 0.00 58.73 61.05 3duf h TYR 359 Cb 0.06 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 38.31 3duf h TYR 359 CO 0.00 0.86 -1.33 0.93 -1.32 0.00 0.00 178.16 177.30 3duf h GLU 360 N 0.00 0.05 -0.27 1.82 4.39 -1.19 -1.64 114.58 117.74 3duf h GLU 360 Ca -0.03 -0.09 -0.15 0.00 0.34 0.00 0.00 59.36 59.43 3duf h GLU 360 Cb 1.68 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.36 3duf h GLU 360 CO 0.11 0.86 -0.45 0.82 -1.16 0.00 0.00 179.01 179.19 3duf h ILE 361 N 0.01 1.30 -0.01 3.13 1.08 -1.42 -2.87 117.51 118.73 3duf h ILE 361 Ca -0.14 -1.64 0.00 0.00 -0.39 0.00 0.00 64.86 62.69 3duf h ILE 361 Cb 1.90 1.57 0.00 0.00 -3.07 0.00 0.00 36.82 37.22 3duf h ILE 361 CO 0.12 0.52 -0.27 -1.22 -0.69 0.00 0.00 178.15 176.61 3duf n TYR 362 N -4.02 0.00 0.03 1.37 4.01 -0.92 -2.84 117.16 114.78 3duf n TYR 362 Ca -0.02 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.60 3duf n TYR 362 Cb 0.56 -0.13 -0.14 0.00 -0.31 0.00 0.00 39.34 39.32 3duf n TYR 362 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3duf h LYS 363 N 1.16 0.10 0.04 -0.72 6.56 -1.18 -2.97 116.57 119.57 3duf h LYS 363 Ca 0.00 -0.18 -0.10 0.00 -1.06 0.00 0.00 60.65 59.32 3duf h LYS 363 Cb 0.51 0.07 0.01 0.00 -0.57 0.00 0.00 32.23 32.24 3duf h LYS 363 CO 0.00 0.87 -0.40 1.05 -2.06 0.00 0.00 179.45 178.91 3duf h GLU 364 N 0.03 0.20 0.00 3.15 -0.00 -1.59 -2.85 114.58 113.52 3duf h GLU 364 Ca -0.22 -0.27 0.00 0.00 -0.00 0.00 0.00 59.36 58.87 3duf h GLU 364 Cb 1.96 0.09 0.00 0.00 -0.00 0.00 0.00 28.75 30.80 3duf h GLU 364 CO 0.12 1.05 0.00 1.57 -0.00 0.00 0.00 179.01 181.75 3duf h LYS 365 N -0.54 0.00 0.12 1.06 2.10 -1.67 -2.11 116.57 115.53 3duf h LYS 365 Ca -0.06 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.44 3duf h LYS 365 Cb 1.23 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.58 3duf h LYS 365 CO 0.08 0.00 -0.66 1.49 -2.00 0.00 0.00 179.45 178.35 3duf h GLU 366 N 0.00 0.24 0.00 0.07 4.81 -1.51 -3.30 114.58 114.89 3duf h GLU 366 Ca 0.00 -0.42 -0.00 0.00 -0.13 0.00 0.00 59.36 58.81 3duf h GLU 366 Cb 0.20 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3duf h GLU 366 CO 0.00 1.20 -0.01 0.66 -0.73 0.00 0.00 179.01 180.13 3duf h SER 367 N -0.49 0.00 -0.03 1.04 4.64 -1.23 -3.51 113.55 113.97 3duf h SER 367 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3duf h SER 367 Cb 1.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 3duf h SER 367 CO 0.12 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.38