#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 2.74 -0.12 1.09 5.36 -1.26 -5.12 117.98 120.66 3duf s PHE 5 Ca 0.00 -0.13 0.01 0.00 -0.96 0.00 0.00 56.93 55.85 3duf s PHE 5 Cb 0.00 -1.61 0.02 0.00 -0.34 0.00 0.00 43.02 41.08 3duf s PHE 5 CO 0.00 0.24 -0.16 -0.65 -1.46 0.00 0.00 175.22 173.19 3duf s GLN 6 N -0.94 2.34 0.43 10.12 -1.52 -1.26 -5.13 119.66 123.71 3duf s GLN 6 Ca 0.13 -0.60 -0.12 0.00 -1.95 0.00 0.00 55.36 52.82 3duf s GLN 6 Cb -0.11 -2.02 -0.07 0.00 -0.22 0.00 0.00 33.01 30.60 3duf s GLN 6 CO 0.02 -0.11 0.82 -0.06 -0.25 0.00 0.00 175.29 175.72 3duf s PHE 7 N 1.11 3.47 -0.22 0.91 0.40 -1.26 -4.94 117.98 117.45 3duf s PHE 7 Ca -0.03 1.14 -0.05 0.00 -0.60 0.00 0.00 56.93 57.39 3duf s PHE 7 Cb -0.14 -2.52 -0.19 0.00 0.51 0.00 0.00 43.02 40.67 3duf s PHE 7 CO -0.04 -0.18 2.94 -2.30 0.70 0.00 0.00 175.22 176.35 3duf n PRO 8 N -1.39 1.84 -0.32 0.24 -0.02 -1.26 -4.58 135.00 129.51 3duf n PRO 8 Ca 0.03 -0.98 0.01 0.00 -2.02 0.00 0.00 63.50 60.54 3duf n PRO 8 Cb 0.54 -2.03 0.14 0.00 -0.02 0.00 0.00 33.50 32.14 3duf n PRO 8 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3duf h PHE 9 N 3.92 1.02 -0.07 6.00 0.04 -2.00 -0.63 116.94 125.23 3duf h PHE 9 Ca 0.25 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.04 3duf h PHE 9 Cb 1.05 -0.33 -0.00 0.00 2.20 0.00 0.00 35.95 38.87 3duf h PHE 9 CO 1.68 0.52 0.04 0.00 -0.60 0.00 0.00 178.31 179.96 3duf h ALA 10 N 1.41 0.09 -0.71 2.45 0.00 -1.99 -2.51 119.26 117.99 3duf h ALA 10 Ca 0.38 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 3duf h ALA 10 Cb 0.16 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3duf h ALA 10 CO -0.17 -0.38 0.35 1.49 0.00 0.00 0.00 179.25 180.54 3duf h GLU 11 N 0.04 1.02 -0.03 0.00 4.81 -1.84 -2.14 114.58 116.45 3duf h GLU 11 Ca 0.03 -0.15 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3duf h GLU 11 Cb 0.06 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 3duf h GLU 11 CO -0.00 0.80 -0.18 0.37 -0.73 0.00 0.00 179.01 179.26 3duf h GLN 12 N 1.00 -0.27 0.00 1.92 4.15 -0.96 0.31 115.11 121.26 3duf h GLN 12 Ca 0.25 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.68 3duf h GLN 12 Cb 0.11 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3duf h GLN 12 CO -0.03 -0.18 0.00 1.28 -1.93 0.00 0.00 178.83 177.97 3duf n LEU 13 N -5.31 0.00 -0.08 -2.39 4.32 -0.96 -2.45 117.00 110.12 3duf n LEU 13 Ca -0.05 0.35 -0.09 0.00 -0.02 0.00 0.00 56.01 56.21 3duf n LEU 13 Cb 0.23 -0.35 -0.03 0.00 -1.62 0.00 0.00 43.42 41.65 3duf n LEU 13 CO 0.24 -0.19 -0.47 1.21 -1.22 0.00 0.00 177.39 176.96 3duf n GLU 14 N -1.35 0.48 -0.03 3.23 2.13 0.66 -4.32 120.64 121.45 3duf n GLU 14 Ca 0.06 0.47 -0.04 0.00 0.66 0.00 0.00 57.16 58.30 3duf n GLU 14 Cb 0.12 -1.65 0.18 0.00 0.27 0.00 0.00 31.44 30.36 3duf n GLU 14 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3duf h LYS 15 N -1.00 0.60 -0.06 5.31 1.57 -0.57 -2.97 116.57 119.45 3duf h LYS 15 Ca -0.07 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.51 3duf h LYS 15 Cb 0.74 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 3duf h LYS 15 CO -0.04 0.75 0.02 0.28 -0.57 0.00 0.00 179.45 179.89 3duf h VAL 16 N 0.54 0.99 0.00 0.50 2.07 -1.70 -1.34 116.25 117.30 3duf h VAL 16 Ca 0.09 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.59 3duf h VAL 16 Cb 0.62 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 3duf h VAL 16 CO 0.04 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.64 3duf n ALA 17 N -2.14 1.70 0.11 1.67 0.00 -1.22 -1.62 120.51 119.00 3duf n ALA 17 Ca -0.06 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 3duf n ALA 17 Cb 0.04 -1.35 0.13 0.00 0.00 0.00 0.00 19.45 18.26 3duf n ALA 17 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3duf h GLU 18 N 0.00 0.12 0.00 0.00 4.81 -1.08 -2.59 114.58 115.84 3duf h GLU 18 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3duf h GLU 18 Cb 0.36 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.75 3duf h GLU 18 CO 0.00 0.72 0.00 1.04 -0.73 0.00 0.00 179.01 180.04 3duf n GLN 19 N -3.81 0.16 -3.67 1.92 1.13 -0.64 -3.91 117.38 108.56 3duf n GLN 19 Ca -0.02 0.18 -0.27 0.00 -1.94 0.00 0.00 57.00 54.94 3duf n GLN 19 Cb 0.64 -1.50 -0.10 0.00 0.11 0.00 0.00 30.24 29.39 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 -1.30 3.32 -2.89 1.08 3.01 -0.97 -5.04 117.46 114.67 3duf n PHE 20 Ca 0.06 -4.22 -0.34 0.00 1.01 0.00 0.00 57.45 53.96 3duf n PHE 20 Cb 0.10 -0.58 -0.07 0.00 -0.01 0.00 0.00 39.48 38.93 3duf n PHE 20 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3duf s PRO 21 N -1.90 4.23 -0.14 -1.08 0.04 -1.25 -4.83 135.00 130.07 3duf s PRO 21 Ca 0.32 1.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 3duf s PRO 21 Cb 0.05 -2.33 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 3duf s PRO 21 CO -0.10 0.06 1.42 0.99 0.04 0.00 0.00 177.00 179.42 3duf s THR 22 N -2.05 4.00 -0.09 1.26 2.01 -1.26 -4.33 115.64 115.18 3duf s THR 22 Ca 0.58 1.19 -0.26 0.00 0.31 0.00 0.00 61.69 63.51 3duf s THR 22 Cb -0.11 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 3duf s THR 22 CO 0.16 -0.14 0.84 0.12 -0.69 0.00 0.00 174.62 174.91 3duf s PHE 23 N 3.84 3.54 0.01 4.92 5.36 -0.40 -4.92 117.98 130.34 3duf s PHE 23 Ca 0.62 1.40 -0.02 0.00 -0.96 0.00 0.00 56.93 57.97 3duf s PHE 23 Cb -0.26 -2.99 -0.01 0.00 -0.34 0.00 0.00 43.02 39.42 3duf s PHE 23 CO 0.21 -0.07 0.02 -1.14 -1.46 0.00 0.00 175.22 172.78 3duf s GLN 24 N 1.40 0.32 0.00 10.12 0.74 -1.26 -2.02 119.66 128.96 3duf s GLN 24 Ca 0.43 -0.47 0.00 0.00 0.05 0.00 0.00 55.36 55.37 3duf s GLN 24 Cb -0.18 0.12 0.00 0.00 1.10 0.00 0.00 33.01 34.05 3duf s GLN 24 CO 0.19 -0.06 0.00 -0.89 -0.55 0.00 0.00 175.29 173.98 3duf n ILE 25 N 1.75 0.00 -5.26 -2.34 5.41 -1.26 -4.53 119.36 113.13 3duf n ILE 25 Ca -0.22 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.22 3duf n ILE 25 Cb 0.56 -0.51 -0.16 0.00 -0.71 0.00 0.00 39.64 38.82 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 -4.17 2.08 0.00 1.39 1.43 -1.26 -1.44 118.68 116.70 3duf s LEU 26 Ca 0.00 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 52.71 3duf s LEU 26 Cb 0.00 -1.34 0.08 0.00 0.03 0.00 0.00 46.19 44.96 3duf s LEU 26 CO 0.00 0.32 0.68 -0.46 0.23 0.00 0.00 176.35 177.12 3duf n ASN 27 N 2.38 1.98 -0.29 2.29 0.23 -0.65 -4.93 115.26 116.27 3duf n ASN 27 Ca -0.16 -2.42 0.08 0.00 -0.53 0.00 0.00 54.58 51.54 3duf n ASN 27 Cb 0.51 -0.34 0.30 0.00 -2.08 0.00 0.00 39.78 38.17 3duf n ASN 27 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3duf h GLU 28 N 0.00 0.85 0.00 -3.83 3.07 -1.94 -2.08 114.58 110.65 3duf h GLU 28 Ca -0.25 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 3duf h GLU 28 Cb 1.13 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 3duf h GLU 28 CO 0.36 0.56 -0.08 0.39 -1.40 0.00 0.00 179.01 178.85 3duf n GLU 29 N -4.54 0.21 0.00 2.33 4.71 -1.26 -4.41 120.64 117.68 3duf n GLU 29 Ca 0.16 0.15 0.00 0.00 -0.01 0.00 0.00 57.16 57.46 3duf n GLU 29 Cb 0.33 -1.73 0.00 0.00 -1.01 0.00 0.00 31.44 29.03 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 1.35 0.80 3.84 0.62 0.00 -0.78 -4.86 105.19 106.16 3duf n GLY 30 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.45 4.07 -0.30 1.61 8.01 -1.26 -4.47 118.70 125.91 3duf s GLU 31 Ca 0.00 0.81 -0.26 0.00 0.01 0.00 0.00 54.97 55.53 3duf s GLU 31 Cb 0.00 -2.34 0.01 0.00 -4.31 0.00 0.00 34.13 27.48 3duf s GLU 31 CO 0.00 0.08 0.91 0.08 0.01 0.00 0.00 175.26 176.35 3duf s VAL 32 N -2.07 4.69 -1.72 2.63 1.01 -1.26 -1.64 120.40 122.03 3duf s VAL 32 Ca 0.57 1.48 0.16 0.00 0.00 0.00 0.00 61.98 64.18 3duf s VAL 32 Cb -0.10 -4.25 0.26 0.00 0.00 0.00 0.00 36.38 32.29 3duf s VAL 32 CO 0.17 -0.31 1.16 1.33 0.00 0.00 0.00 175.10 177.45 3duf n VAL 33 N 5.61 0.43 -2.93 2.92 0.24 -0.52 -4.57 118.33 119.51 3duf n VAL 33 Ca 0.07 -0.71 -0.13 0.00 -2.04 0.00 0.00 64.34 61.53 3duf n VAL 33 Cb 0.47 0.98 0.03 0.00 -1.47 0.00 0.00 33.84 33.86 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 0.93 -0.59 0.27 -1.34 2.85 -1.24 -4.97 115.26 111.16 3duf n ASN 34 Ca 0.13 -3.22 0.18 0.00 -0.11 0.00 0.00 54.58 51.55 3duf n ASN 34 Cb 0.45 0.53 0.88 0.00 1.24 0.00 0.00 39.78 42.88 3duf n ASN 34 CO 0.00 0.00 0.00 1.05 -2.11 0.00 0.00 177.26 176.20 3duf h GLU 35 N 2.93 0.00 -0.34 1.20 9.09 -1.87 -0.98 114.58 124.61 3duf h GLU 35 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3duf h GLU 35 Cb 1.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.16 3duf h GLU 35 CO 0.31 0.00 0.00 -0.85 0.05 0.00 0.00 179.01 178.52 3duf n GLU 36 N -3.29 1.02 0.00 1.06 -0.00 -1.26 -2.86 120.64 115.31 3duf n GLU 36 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 57.16 57.13 3duf n GLU 36 Cb 0.35 -1.17 0.00 0.00 -0.00 0.00 0.00 31.44 30.61 3duf n GLU 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3duf n ALA 37 N -0.32 0.40 -1.63 -1.84 0.00 -0.38 -5.07 120.51 111.67 3duf n ALA 37 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 53.44 52.90 3duf n ALA 37 Cb 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.48 3duf n ALA 37 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3duf n MET 38 N -0.20 1.12 -1.59 0.00 1.56 -1.13 -4.91 117.12 111.97 3duf n MET 38 Ca 0.00 0.41 -0.32 0.00 -0.27 0.00 0.00 57.70 57.52 3duf n MET 38 Cb 0.00 -2.06 0.06 0.00 2.15 0.00 0.00 33.22 33.37 3duf n MET 38 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 3duf s PRO 39 N 1.54 2.68 -0.88 2.12 0.04 -1.26 -4.96 135.00 134.27 3duf s PRO 39 Ca 0.89 1.23 -0.20 0.00 0.04 0.00 0.00 61.00 62.97 3duf s PRO 39 Cb -1.00 -1.95 0.11 0.00 0.04 0.00 0.00 34.50 31.70 3duf s PRO 39 CO 0.54 -1.32 1.11 -2.00 0.04 0.00 0.00 177.00 175.37 3duf s GLU 40 N -4.51 3.49 -0.12 4.56 2.56 -1.26 -4.99 118.70 118.44 3duf s GLU 40 Ca 0.63 -1.52 0.03 0.00 0.00 0.00 0.00 54.97 54.11 3duf s GLU 40 Cb -0.18 -4.81 0.00 0.00 2.00 0.00 0.00 34.13 31.15 3duf s GLU 40 CO 0.48 -1.81 -0.23 -0.51 -0.56 0.00 0.00 175.26 172.63 3duf s LEU 41 N 3.13 2.08 0.66 2.70 1.43 -1.26 -5.12 118.68 122.31 3duf s LEU 41 Ca 0.31 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.68 3duf s LEU 41 Cb -0.07 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.75 3duf s LEU 41 CO -0.05 0.12 1.16 -0.94 0.23 0.00 0.00 176.35 176.86 3duf s SER 42 N 0.56 4.85 0.52 2.29 1.04 -1.26 -4.79 113.70 116.90 3duf s SER 42 Ca -0.14 2.20 0.23 0.00 0.48 0.00 0.00 55.95 58.72 3duf s SER 42 Cb -0.17 -2.57 1.34 0.00 0.10 0.00 0.00 66.02 64.72 3duf s SER 42 CO 0.04 -1.81 1.99 0.44 0.98 0.00 0.00 173.24 174.88 3duf h ASP 43 N 0.14 0.06 0.07 7.02 5.19 -1.99 -1.10 116.42 125.80 3duf h ASP 43 Ca -0.48 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 55.93 3duf h ASP 43 Cb 1.27 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.77 3duf h ASP 43 CO 0.53 0.03 -0.03 -0.08 -3.12 0.00 0.00 179.24 176.57 3duf h GLU 44 N 0.06 -0.09 -0.33 3.56 4.57 -2.01 -3.14 114.58 117.21 3duf h GLU 44 Ca 0.25 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.39 3duf h GLU 44 Cb 0.93 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.52 3duf h GLU 44 CO -0.02 0.33 0.01 1.96 -1.18 0.00 0.00 179.01 180.11 3duf h GLN 45 N -0.53 0.50 -0.03 1.92 4.20 -1.63 -2.51 115.11 117.03 3duf h GLN 45 Ca -0.01 -0.10 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 3duf h GLN 45 Cb 0.46 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 3duf h GLN 45 CO 0.02 0.52 -0.27 -0.07 -0.67 0.00 0.00 178.83 178.35 3duf h LEU 46 N 0.48 0.05 -0.28 1.46 3.38 -1.28 -0.38 115.31 118.74 3duf h LEU 46 Ca 0.11 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 3duf h LEU 46 Cb 0.30 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3duf h LEU 46 CO 0.01 0.32 -0.48 0.11 0.09 0.00 0.00 178.44 178.49 3duf h LYS 47 N 0.04 0.00 0.02 1.13 1.57 -1.40 -2.69 116.57 115.25 3duf h LYS 47 Ca 0.01 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 3duf h LYS 47 Cb 0.51 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.84 3duf h LYS 47 CO 0.04 0.48 -1.08 1.49 -0.57 0.00 0.00 179.45 179.81 3duf h GLU 48 N 0.00 0.67 -0.70 3.15 4.57 -1.14 -1.06 114.58 120.07 3duf h GLU 48 Ca -0.00 -0.75 -0.00 0.00 -1.18 0.00 0.00 59.36 57.43 3duf h GLU 48 Cb 1.26 0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 30.03 3duf h GLU 48 CO 0.06 1.32 0.43 1.25 -1.18 0.00 0.00 179.01 180.89 3duf h LEU 49 N 0.36 0.83 -0.66 1.64 5.85 -1.04 -1.64 115.31 120.66 3duf h LEU 49 Ca -0.14 -0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.38 3duf h LEU 49 Cb 1.73 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.53 3duf h LEU 49 CO 0.21 0.64 -0.67 -0.03 -0.34 0.00 0.00 178.44 178.26 3duf h MET 50 N 0.95 0.03 -0.73 1.25 4.05 -1.49 -2.88 114.93 116.10 3duf h MET 50 Ca 0.25 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 3duf h MET 50 Cb -0.04 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.73 3duf h MET 50 CO -0.05 0.68 0.43 -0.09 0.23 0.00 0.00 176.91 178.11 3duf h ARG 51 N 0.02 1.00 0.00 0.39 2.43 -0.36 -2.36 114.38 115.50 3duf h ARG 51 Ca -0.01 -0.10 -0.13 0.00 -0.81 0.00 0.00 59.98 58.93 3duf h ARG 51 Cb 1.18 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.51 3duf h ARG 51 CO 0.09 0.72 -0.64 0.00 -1.51 0.00 0.00 179.97 178.63 3duf h ARG 52 N 1.00 0.00 -0.02 0.20 3.08 -1.25 -2.14 114.38 115.25 3duf h ARG 52 Ca 0.26 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.13 3duf h ARG 52 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3duf h ARG 52 CO -0.05 0.64 -0.79 0.52 -1.07 0.00 0.00 179.97 179.22 3duf h MET 53 N 0.00 0.18 -0.04 0.04 2.86 -1.27 -1.28 114.93 115.41 3duf h MET 53 Ca -0.01 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.39 3duf h MET 53 Cb 1.24 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.94 3duf h MET 53 CO 0.08 0.88 -0.27 0.28 1.06 0.00 0.00 176.91 178.94 3duf h VAL 54 N 0.11 1.46 0.18 -2.22 2.07 -1.45 -2.69 116.25 113.72 3duf h VAL 54 Ca -0.03 -1.76 0.01 0.00 0.82 0.00 0.00 66.70 65.74 3duf h VAL 54 Cb 1.38 2.46 -0.03 0.00 -1.52 0.00 0.00 31.29 33.58 3duf h VAL 54 CO 0.12 0.49 -0.26 0.22 0.02 0.00 0.00 177.57 178.17 3duf h TYR 55 N -0.30 -0.69 -0.49 1.57 5.03 -1.38 -1.73 116.97 118.99 3duf h TYR 55 Ca -0.02 0.01 0.08 0.00 2.58 0.00 0.00 58.73 61.38 3duf h TYR 55 Cb 0.95 0.28 -0.03 0.00 1.55 0.00 0.00 36.73 39.48 3duf h TYR 55 CO 0.14 -0.37 0.33 1.15 -1.32 0.00 0.00 178.16 178.10 3duf h THR 56 N -0.50 0.92 -0.27 1.81 2.02 -1.31 -0.22 112.91 115.35 3duf h THR 56 Ca 0.01 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 3duf h THR 56 Cb 0.50 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 3duf h THR 56 CO -0.11 0.06 -0.18 -0.09 0.37 0.00 0.00 175.52 175.57 3duf h ARG 57 N 0.33 0.61 -0.74 6.66 9.65 -1.08 -2.08 114.38 127.73 3duf h ARG 57 Ca 0.22 -0.29 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 3duf h ARG 57 Cb 0.44 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.98 3duf h ARG 57 CO -0.05 0.87 0.40 0.82 2.80 0.00 0.00 179.97 184.81 3duf h ILE 58 N 0.34 1.22 -0.95 1.20 1.08 -0.39 -2.12 117.51 117.89 3duf h ILE 58 Ca 0.05 -0.56 0.03 0.00 -0.39 0.00 0.00 64.86 63.99 3duf h ILE 58 Cb 0.72 0.25 -0.05 0.00 -3.07 0.00 0.00 36.82 34.67 3duf h ILE 58 CO 0.05 0.25 0.62 0.25 -0.69 0.00 0.00 178.15 178.63 3duf h LEU 59 N 1.02 1.05 -0.08 1.44 5.85 -0.92 -0.94 115.31 122.71 3duf h LEU 59 Ca 0.26 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 3duf h LEU 59 Cb 0.04 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 3duf h LEU 59 CO -0.04 0.73 0.03 -0.78 -0.34 0.00 0.00 178.44 178.03 3duf h ASP 60 N 1.22 0.12 -0.67 1.25 3.58 -0.75 -0.36 116.42 120.82 3duf h ASP 60 Ca 0.37 -0.20 0.03 0.00 0.42 0.00 0.00 57.03 57.64 3duf h ASP 60 Cb -0.03 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 40.94 3duf h ASP 60 CO -0.10 0.29 0.42 1.56 -2.88 0.00 0.00 179.24 178.53 3duf h GLN 61 N -0.06 0.80 -0.24 0.28 4.20 -1.00 -1.22 115.11 117.87 3duf h GLN 61 Ca 0.03 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 3duf h GLN 61 Cb 0.22 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 3duf h GLN 61 CO -0.00 0.53 -0.32 0.00 -0.67 0.00 0.00 178.83 178.36 3duf h ARG 62 N 0.82 0.50 0.19 1.46 2.47 -1.07 -2.28 114.38 116.47 3duf h ARG 62 Ca 0.27 -0.22 -0.01 0.00 -1.26 0.00 0.00 59.98 58.76 3duf h ARG 62 Cb 0.01 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3duf h ARG 62 CO -0.10 0.77 -0.09 0.77 0.56 0.00 0.00 179.97 181.88 3duf h SER 63 N 0.43 -0.21 -0.49 7.04 0.02 -0.58 0.66 113.55 120.42 3duf h SER 63 Ca 0.05 -0.19 0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3duf h SER 63 Cb 0.78 0.05 -0.07 0.00 0.14 0.00 0.00 62.40 63.30 3duf h SER 63 CO 0.06 0.07 0.08 0.40 -1.14 0.00 0.00 176.83 176.31 3duf h ILE 64 N -0.51 0.71 -0.29 3.27 2.04 -1.24 0.22 117.51 121.71 3duf h ILE 64 Ca -0.03 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3duf h ILE 64 Cb 0.39 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 3duf h ILE 64 CO 0.04 0.04 0.10 -1.28 0.00 0.00 0.00 178.15 177.05 3duf h SER 65 N 0.21 0.42 -0.70 1.72 0.87 -1.22 -1.95 113.55 112.90 3duf h SER 65 Ca 0.24 -0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3duf h SER 65 Cb 0.33 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 3duf h SER 65 CO -0.33 0.49 0.43 -0.07 -0.53 0.00 0.00 176.83 176.83 3duf h LEU 66 N 0.31 0.84 -0.69 2.23 3.38 0.11 -2.63 115.31 118.86 3duf h LEU 66 Ca 0.10 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 3duf h LEU 66 Cb 0.22 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3duf h LEU 66 CO -0.01 0.64 -0.24 -1.13 0.09 0.00 0.00 178.44 177.80 3duf h ASN 67 N 0.97 0.78 0.30 -0.43 -0.73 -0.35 -1.05 115.58 115.07 3duf h ASN 67 Ca 0.26 -0.28 0.00 0.00 1.87 0.00 0.00 56.30 58.14 3duf h ASN 67 Cb -0.05 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 38.33 3duf h ASN 67 CO -0.05 0.99 0.00 0.54 -0.37 0.00 0.00 177.43 178.54 3duf n ARG 68 N -4.11 0.05 -0.27 6.67 1.74 -0.75 -1.59 116.66 118.40 3duf n ARG 68 Ca -0.00 0.28 0.09 0.00 -0.77 0.00 0.00 57.85 57.44 3duf n ARG 68 Cb 0.44 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.55 3duf n ARG 68 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3duf n GLN 69 N -1.43 1.39 -2.01 5.56 10.64 -1.09 -4.99 117.38 125.46 3duf n GLN 69 Ca 0.03 -2.85 -0.20 0.00 -1.83 0.00 0.00 57.00 52.16 3duf n GLN 69 Cb 0.11 -1.54 -0.04 0.00 -0.86 0.00 0.00 30.24 27.90 3duf n GLN 69 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3duf n GLY 70 N -1.32 0.61 0.55 2.61 0.00 -0.62 -4.87 105.19 102.15 3duf n GLY 70 Ca 0.17 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.68 1.43 -3.99 1.61 5.12 -0.42 -4.92 116.66 112.82 3duf n ARG 71 Ca -0.22 -1.11 -0.08 0.00 -1.93 0.00 0.00 57.85 54.51 3duf n ARG 71 Cb 0.66 -1.48 -0.10 0.00 -1.16 0.00 0.00 32.46 30.39 3duf n ARG 71 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3duf s LEU 72 N -2.33 2.09 0.00 0.55 1.43 -1.23 -4.90 118.68 114.28 3duf s LEU 72 Ca 0.23 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 3duf s LEU 72 Cb 0.19 0.42 0.00 0.00 0.03 0.00 0.00 46.19 46.83 3duf s LEU 72 CO 0.48 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 177.14 3duf n GLY 73 N 0.56 0.44 3.71 -3.19 0.00 -1.24 -4.66 105.19 100.81 3duf n GLY 73 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3duf n GLY 73 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3duf s PHE 74 N 2.59 2.86 -0.16 1.61 5.36 -0.76 -4.91 117.98 124.56 3duf s PHE 74 Ca 0.00 0.51 -0.07 0.00 -0.96 0.00 0.00 56.93 56.40 3duf s PHE 74 Cb 0.00 -3.96 0.06 0.00 -0.34 0.00 0.00 43.02 38.78 3duf s PHE 74 CO 0.00 -3.65 0.36 -0.47 -1.46 0.00 0.00 175.22 170.00 3duf s TYR 75 N 1.57 -0.56 -0.38 10.12 5.04 -1.26 -4.58 117.35 127.30 3duf s TYR 75 Ca 0.72 1.19 -0.06 0.00 -2.44 0.00 0.00 57.07 56.47 3duf s TYR 75 Cb -0.43 0.19 0.07 0.00 0.35 0.00 0.00 41.96 42.13 3duf s TYR 75 CO 0.32 -0.35 0.17 0.00 -1.34 0.00 0.00 175.55 174.35 3duf s ALA 76 N 1.72 3.14 0.13 3.97 0.00 -1.26 -2.68 121.76 126.77 3duf s ALA 76 Ca -0.07 -2.03 -0.35 0.00 0.00 0.00 0.00 51.96 49.51 3duf s ALA 76 Cb -0.10 -2.41 -0.16 0.00 0.00 0.00 0.00 23.12 20.46 3duf s ALA 76 CO -0.11 -1.53 1.35 -2.30 0.00 0.00 0.00 175.76 173.17 3duf n PRO 77 N 4.80 1.40 0.00 0.00 -0.02 -1.26 -4.86 135.00 135.06 3duf n PRO 77 Ca -0.10 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 61.95 3duf n PRO 77 Cb 0.43 -2.14 0.02 0.00 -0.02 0.00 0.00 33.50 31.79 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 2.42 0.00 -1.69 3.45 -2.24 -1.26 -4.92 114.28 110.04 3duf n THR 78 Ca 0.17 -0.40 -0.54 0.00 -2.27 0.00 0.00 64.05 61.00 3duf n THR 78 Cb 0.23 1.21 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 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 0.14 0.22 0.00 6.98 0.00 -1.26 -1.45 120.51 125.14 3duf n ALA 79 Ca 0.07 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3duf n ALA 79 Cb 0.31 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.43 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 4.41 0.64 0.40 0.00 0.00 -1.26 -1.99 105.19 107.40 3duf n GLY 80 Ca 0.26 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.20 0.93 -0.35 1.61 6.02 -0.53 -4.03 117.38 119.82 3duf n GLN 81 Ca 0.00 -2.30 0.12 0.00 -0.01 0.00 0.00 57.00 54.81 3duf n GLN 81 Cb 0.00 -1.15 0.31 0.00 1.02 0.00 0.00 30.24 30.41 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 0.29 0.75 0.15 -1.09 3.07 -1.91 -1.71 114.58 114.13 3duf h GLU 82 Ca -0.02 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 3duf h GLU 82 Cb 1.18 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 3duf h GLU 82 CO 0.01 0.50 -0.07 0.00 -1.40 0.00 0.00 179.01 178.04 3duf h ALA 83 N 1.63 -0.20 0.00 3.43 0.00 -1.88 0.63 119.26 122.87 3duf h ALA 83 Ca 0.57 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 3duf h ALA 83 Cb 0.85 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3duf h ALA 83 CO -0.37 -0.34 -0.03 0.66 0.00 0.00 0.00 179.25 179.16 3duf h SER 84 N -0.74 0.00 0.00 0.00 4.64 -1.53 -1.22 113.55 114.70 3duf h SER 84 Ca -0.02 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.89 3duf h SER 84 Cb 0.52 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.55 3duf h SER 84 CO 0.03 0.03 -2.30 0.00 -0.87 0.00 0.00 176.83 173.72 3duf n GLN 85 N -3.40 0.60 0.06 4.77 6.02 -0.66 -4.20 117.38 120.57 3duf n GLN 85 Ca -0.02 0.30 -0.23 0.00 -0.01 0.00 0.00 57.00 57.04 3duf n GLN 85 Cb 0.15 -1.55 -0.15 0.00 1.02 0.00 0.00 30.24 29.72 3duf n GLN 85 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3duf h ILE 86 N -0.82 0.86 0.00 5.09 2.04 0.23 -3.16 117.51 121.75 3duf h ILE 86 Ca -0.62 -2.47 0.00 0.00 1.00 0.00 0.00 64.86 62.77 3duf h ILE 86 Cb 1.62 2.70 0.00 0.00 -0.74 0.00 0.00 36.82 40.40 3duf h ILE 86 CO -0.33 0.87 0.00 0.00 0.00 0.00 0.00 178.15 178.70 3duf h ALA 87 N 0.10 1.00 0.02 1.87 0.00 -1.21 -1.53 119.26 119.52 3duf h ALA 87 Ca -0.37 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.28 3duf h ALA 87 Cb 2.08 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.84 3duf h ALA 87 CO 0.16 0.00 -1.40 0.66 0.00 0.00 0.00 179.25 178.67 3duf h SER 88 N 0.00 0.08 1.21 0.00 4.64 -1.66 -3.30 113.55 114.52 3duf h SER 88 Ca 0.00 -0.12 -0.13 0.00 -0.47 0.00 0.00 61.79 61.07 3duf h SER 88 Cb 0.54 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 3duf h SER 88 CO 0.00 1.10 -0.63 -0.74 -0.87 0.00 0.00 176.83 175.69 3duf h HIS 89 N 0.01 0.00 0.00 4.77 6.17 -1.46 -3.17 115.15 121.47 3duf h HIS 89 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 60.37 60.91 3duf h HIS 89 Cb 1.92 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.85 3duf h HIS 89 CO 0.01 0.63 0.00 0.35 0.71 0.00 0.00 177.93 179.64 3duf h PHE 90 N 0.00 0.00 -0.00 5.26 3.57 -1.36 -2.09 116.94 122.33 3duf h PHE 90 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 3duf h PHE 90 Cb 1.41 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.15 3duf h PHE 90 CO 0.00 0.00 -0.25 0.00 -2.23 0.00 0.00 178.31 175.83 3duf n ALA 91 N -1.98 2.94 -2.16 2.41 0.00 -1.20 -4.92 120.51 115.60 3duf n ALA 91 Ca -0.01 -0.23 -0.15 0.00 0.00 0.00 0.00 53.44 53.05 3duf n ALA 91 Cb 0.12 -1.30 0.10 0.00 0.00 0.00 0.00 19.45 18.38 3duf n ALA 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3duf n LEU 92 N -1.47 0.00 -4.26 0.00 4.77 -0.79 -4.83 117.00 110.43 3duf n LEU 92 Ca 0.07 -1.25 -0.16 0.00 -0.03 0.00 0.00 56.01 54.64 3duf n LEU 92 Cb 0.34 -0.53 -0.10 0.00 -2.33 0.00 0.00 43.42 40.79 3duf n LEU 92 CO 0.31 -0.94 -0.43 -1.61 -1.33 0.00 0.00 177.39 173.38 3duf s GLU 93 N -4.48 1.07 0.34 3.23 0.41 -1.26 -5.04 118.70 112.96 3duf s GLU 93 Ca 0.47 -1.36 0.13 0.00 -0.41 0.00 0.00 54.97 53.79 3duf s GLU 93 Cb -0.02 -0.80 0.99 0.00 -1.78 0.00 0.00 34.13 32.52 3duf s GLU 93 CO 0.32 0.13 1.71 -0.22 -0.49 0.00 0.00 175.26 176.71 3duf h LYS 94 N 3.10 0.45 0.00 1.61 1.63 -1.99 0.13 116.57 121.51 3duf h LYS 94 Ca -0.38 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 3duf h LYS 94 Cb 1.20 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 3duf h LYS 94 CO 0.57 0.30 0.00 1.05 -3.45 0.00 0.00 179.45 177.92 3duf h GLU 95 N 0.46 0.00 -7.01 1.90 4.11 -1.96 -3.41 114.58 108.67 3duf h GLU 95 Ca 0.67 0.00 -0.50 0.00 0.07 0.00 0.00 59.36 59.60 3duf h GLU 95 Cb 1.44 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.75 3duf h GLU 95 CO -0.49 0.00 0.45 -0.51 0.07 0.00 0.00 179.01 178.54 3duf s ASP 96 N -4.88 6.23 -0.22 3.06 1.01 0.46 -4.70 116.67 117.64 3duf s ASP 96 Ca 0.01 2.20 -0.08 0.00 0.71 0.00 0.00 52.55 55.40 3duf s ASP 96 Cb 0.09 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.39 3duf s ASP 96 CO 0.43 -0.87 0.08 0.12 0.21 0.00 0.00 175.17 175.14 3duf s PHE 97 N -1.64 3.19 -0.21 4.23 2.19 0.12 -4.60 117.98 121.27 3duf s PHE 97 Ca 0.64 -0.08 -0.06 0.00 0.33 0.00 0.00 56.93 57.75 3duf s PHE 97 Cb -0.26 -2.18 -0.03 0.00 -1.31 0.00 0.00 43.02 39.25 3duf s PHE 97 CO 0.31 -0.06 0.04 0.42 1.83 0.00 0.00 175.22 177.75 3duf s ILE 98 N 0.99 4.29 -0.65 3.12 1.01 -0.54 -0.41 121.20 129.01 3duf s ILE 98 Ca 0.05 -0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.51 3duf s ILE 98 Cb -0.14 -2.95 0.16 0.00 0.01 0.00 0.00 42.46 39.54 3duf s ILE 98 CO 0.03 0.42 0.45 -0.76 0.00 0.00 0.00 174.94 175.08 3duf s LEU 99 N 0.94 4.90 0.78 2.97 1.02 -0.46 -2.40 118.68 126.43 3duf s LEU 99 Ca 0.03 -3.28 -0.11 0.00 0.02 0.00 0.00 54.13 50.78 3duf s LEU 99 Cb -0.14 -1.75 0.06 0.00 0.02 0.00 0.00 46.19 44.38 3duf s LEU 99 CO 0.02 -0.23 1.08 -2.16 0.02 0.00 0.00 176.35 175.09 3duf s PRO 100 N -0.67 2.24 0.16 1.29 0.04 -1.26 -3.60 135.00 133.20 3duf s PRO 100 Ca 0.20 0.87 0.02 0.00 0.04 0.00 0.00 61.00 62.14 3duf s PRO 100 Cb -0.16 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.48 3duf s PRO 100 CO -0.07 -1.57 0.20 0.41 0.04 0.00 0.00 177.00 176.02 3duf n GLY 101 N -1.73 2.10 0.15 0.56 0.00 -1.26 -2.09 105.19 102.90 3duf n GLY 101 Ca 0.08 -2.16 0.12 0.00 0.00 0.00 0.00 46.02 44.05 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 0.10 0.00 0.00 1.61 -0.00 -1.85 -2.96 116.97 113.88 3duf h TYR 102 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.65 3duf h TYR 102 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.07 3duf h TYR 102 CO 0.00 0.00 -1.06 -2.13 -0.00 0.00 0.00 178.16 174.97 3duf n ARG 103 N -2.30 0.83 -1.46 0.10 0.63 -1.26 -4.63 116.66 108.57 3duf n ARG 103 Ca 0.02 -0.03 -0.26 0.00 -0.92 0.00 0.00 57.85 56.65 3duf n ARG 103 Cb 0.21 -1.39 -0.05 0.00 0.45 0.00 0.00 32.46 31.68 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 -1.58 6.47 0.06 6.15 8.00 -1.12 -4.53 116.55 130.01 3duf n ASP 104 Ca 0.02 -3.20 -0.12 0.00 0.71 0.00 0.00 54.79 52.20 3duf n ASP 104 Cb 0.33 -1.22 -0.02 0.00 -0.02 0.00 0.00 41.12 40.19 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 1.94 1.39 -0.63 2.53 2.07 -1.82 -3.31 116.25 118.40 3duf h VAL 105 Ca 0.39 -2.31 0.08 0.00 0.82 0.00 0.00 66.70 65.68 3duf h VAL 105 Cb 0.73 2.28 -0.06 0.00 -1.52 0.00 0.00 31.29 32.72 3duf h VAL 105 CO 0.87 0.69 0.30 -0.65 0.02 0.00 0.00 177.57 178.81 3duf h PRO 106 N 0.26 0.52 -0.28 1.57 0.11 -1.99 -2.03 132.00 130.16 3duf h PRO 106 Ca -0.06 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.06 3duf h PRO 106 Cb 1.47 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.42 3duf h PRO 106 CO 0.15 0.35 0.05 1.96 -0.21 0.00 0.00 178.00 180.29 3duf h GLN 107 N 0.54 0.14 0.00 1.05 7.50 -1.86 -0.85 115.11 121.63 3duf h GLN 107 Ca 0.31 -0.01 -0.09 0.00 0.50 0.00 0.00 58.65 59.35 3duf h GLN 107 Cb 0.30 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.78 3duf h GLN 107 CO -0.24 0.09 -0.44 -0.84 -1.50 0.00 0.00 178.83 175.90 3duf h ILE 108 N 0.15 1.21 0.22 2.54 3.07 -1.64 -1.94 117.51 121.11 3duf h ILE 108 Ca 0.13 -1.56 -0.01 0.00 1.55 0.00 0.00 64.86 64.97 3duf h ILE 108 Cb 0.14 1.87 -0.00 0.00 -0.27 0.00 0.00 36.82 38.55 3duf h ILE 108 CO -0.18 0.43 -0.12 0.40 -1.05 0.00 0.00 178.15 177.63 3duf h ILE 109 N 0.00 0.74 0.00 0.16 1.08 -0.58 -1.91 117.51 117.00 3duf h ILE 109 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3duf h ILE 109 Cb 0.83 0.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.32 3duf h ILE 109 CO 0.06 0.00 0.00 0.79 -0.69 0.00 0.00 178.15 178.31 3duf n TRP 110 N -5.24 0.79 1.23 1.37 7.02 -0.41 -2.12 117.44 120.08 3duf n TRP 110 Ca -0.09 0.32 0.13 0.00 -1.02 0.00 0.00 57.50 56.84 3duf n TRP 110 Cb 0.16 -1.02 0.38 0.00 -2.42 0.00 0.00 31.31 28.42 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 -2.23 0.00 0.00 -5.99 -0.00 -0.75 -4.92 115.22 101.33 3duf n HIS 111 Ca 0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.20 3duf n HIS 111 Cb 0.20 -0.14 0.00 0.00 -0.12 0.00 0.00 29.99 29.93 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 1.35 0.40 3.62 1.57 0.00 -0.90 -4.73 105.19 106.50 3duf n GLY 112 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 4.07 0.28 0.99 2.96 -0.83 -4.91 118.68 121.24 3duf s LEU 113 Ca 0.00 0.66 -0.29 0.00 -0.22 0.00 0.00 54.13 54.27 3duf s LEU 113 Cb 0.00 -2.84 -0.14 0.00 0.50 0.00 0.00 46.19 43.72 3duf s LEU 113 CO 0.00 -0.38 1.20 -2.65 -1.32 0.00 0.00 176.35 173.20 3duf n PRO 114 N 5.72 1.70 -0.04 0.98 -0.02 -1.26 -4.43 135.00 137.66 3duf n PRO 114 Ca -0.01 0.60 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 3duf n PRO 114 Cb 0.49 -2.12 0.52 0.00 -0.02 0.00 0.00 33.50 32.38 3duf n PRO 114 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3duf h LEU 115 N 2.87 0.31 -0.83 2.45 5.85 -1.96 -1.42 115.31 122.59 3duf h LEU 115 Ca -0.43 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.17 3duf h LEU 115 Cb 1.31 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 3duf h LEU 115 CO 0.66 0.19 -0.53 0.10 -0.34 0.00 0.00 178.44 178.52 3duf h TYR 116 N 0.35 0.18 0.00 1.25 -0.00 -1.90 -2.02 116.97 114.82 3duf h TYR 116 Ca 0.24 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.73 58.89 3duf h TYR 116 Cb 0.50 -0.03 -0.00 0.00 -0.00 0.00 0.00 36.73 37.19 3duf h TYR 116 CO -0.00 0.64 -0.12 1.96 -0.00 0.00 0.00 178.16 180.65 3duf h GLN 117 N 0.11 0.00 -0.00 0.10 4.20 -1.60 -1.64 115.11 116.28 3duf h GLN 117 Ca 0.00 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 3duf h GLN 117 Cb 0.98 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 3duf h GLN 117 CO 0.08 0.12 -0.70 0.00 -0.67 0.00 0.00 178.83 177.66 3duf h ALA 118 N 1.88 0.84 0.00 3.87 0.00 -1.03 -2.24 119.26 122.59 3duf h ALA 118 Ca -0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 54.91 54.13 3duf h ALA 118 Cb 0.73 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3duf h ALA 118 CO 0.02 0.86 -0.72 0.74 0.00 0.00 0.00 179.25 180.14 3duf h PHE 119 N 0.01 0.00 -0.14 0.00 0.04 -1.03 -3.12 116.94 112.70 3duf h PHE 119 Ca -0.01 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.62 3duf h PHE 119 Cb 1.23 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.37 3duf h PHE 119 CO 0.00 0.72 -0.50 -0.07 -0.60 0.00 0.00 178.31 177.86 3duf h LEU 120 N 0.00 0.42 -1.38 1.54 3.38 -1.15 -2.30 115.31 115.82 3duf h LEU 120 Ca -0.01 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 3duf h LEU 120 Cb 1.55 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.17 3duf h LEU 120 CO 0.09 0.85 0.07 0.15 0.09 0.00 0.00 178.44 179.69 3duf h PHE 121 N 0.30 0.49 -0.02 1.13 3.57 -1.35 -0.29 116.94 120.77 3duf h PHE 121 Ca 0.01 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 3duf h PHE 121 Cb 0.99 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 3duf h PHE 121 CO 0.03 0.44 -0.03 1.03 -2.23 0.00 0.00 178.31 177.55 3duf h SER 122 N 0.48 0.06 -0.62 0.41 0.87 -1.42 -3.27 113.55 110.06 3duf h SER 122 Ca 0.11 -0.54 -0.07 0.00 -1.23 0.00 0.00 61.79 60.06 3duf h SER 122 Cb 0.21 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 3duf h SER 122 CO -0.00 0.59 0.12 0.03 -0.53 0.00 0.00 176.83 177.03 3duf h ARG 123 N -0.47 1.04 0.00 2.24 3.08 -1.31 -2.03 114.38 116.93 3duf h ARG 123 Ca 0.00 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.79 3duf h ARG 123 Cb 0.57 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3duf h ARG 123 CO 0.01 0.95 0.00 0.41 -1.07 0.00 0.00 179.97 180.26 3duf n GLY 124 N -0.66 0.76 2.86 0.04 0.00 -0.16 -4.80 105.19 103.22 3duf n GLY 124 Ca 0.04 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.79 -0.14 0.39 1.61 5.04 -0.94 -5.04 115.29 115.42 3duf s HIS 125 Ca 0.00 0.50 0.17 0.00 -1.54 0.00 0.00 55.06 54.19 3duf s HIS 125 Cb 0.00 -0.19 1.07 0.00 0.04 0.00 0.00 32.58 33.50 3duf s HIS 125 CO 0.00 -0.20 1.78 0.27 -2.34 0.00 0.00 174.74 174.24 3duf h PHE 126 N 7.77 0.69 -0.05 3.88 -5.15 -1.99 -0.55 116.94 121.53 3duf h PHE 126 Ca -0.29 0.02 0.02 0.00 -0.20 0.00 0.00 57.97 57.52 3duf h PHE 126 Cb 1.13 -0.20 -0.00 0.00 0.22 0.00 0.00 35.95 37.09 3duf h PHE 126 CO 0.44 0.08 0.10 1.25 -2.00 0.00 0.00 178.31 178.18 3duf h HIS 127 N 0.43 0.00 0.00 6.09 2.76 -1.97 -1.38 115.15 121.09 3duf h HIS 127 Ca 0.59 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.70 3duf h HIS 127 Cb 1.42 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.37 3duf h HIS 127 CO -0.00 0.00 -0.25 0.78 -1.30 0.00 0.00 177.93 177.16 3duf h GLY 128 N 0.00 0.00 -2.16 5.26 0.00 -1.32 -2.81 103.07 102.03 3duf h GLY 128 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3duf h GLY 128 CO -0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 3duf n ASN 129 N -3.29 3.18 -3.97 0.19 4.13 -0.52 -4.61 115.26 110.36 3duf n ASN 129 Ca 0.01 -1.99 -0.43 0.00 1.68 0.00 0.00 54.58 53.86 3duf n ASN 129 Cb 0.51 -0.37 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 3duf n ASN 129 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 3duf n GLN 130 N 1.25 3.35 -1.69 3.52 7.27 -1.06 -4.83 117.38 125.19 3duf n GLN 130 Ca 0.20 -3.31 -0.54 0.00 0.07 0.00 0.00 57.00 53.42 3duf n GLN 130 Cb 0.51 -3.08 -0.06 0.00 2.41 0.00 0.00 30.24 30.02 3duf n GLN 130 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 3duf n ILE 131 N 4.22 0.34 -1.71 1.69 -0.00 -1.26 -4.93 119.36 117.71 3duf n ILE 131 Ca 0.43 -0.06 -0.34 0.00 -0.00 0.00 0.00 62.75 62.79 3duf n ILE 131 Cb 0.39 -1.40 0.06 0.00 -0.00 0.00 0.00 39.64 38.69 3duf n ILE 131 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 3duf s PRO 132 N 3.23 2.66 0.03 0.38 0.04 -1.26 -4.93 135.00 135.15 3duf s PRO 132 Ca 0.94 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 63.19 3duf s PRO 132 Cb -0.92 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 31.62 3duf s PRO 132 CO 0.58 -1.38 1.71 -2.00 0.04 0.00 0.00 177.00 175.96 3duf s GLU 133 N -3.98 4.18 0.00 4.56 2.56 -1.26 -2.65 118.70 122.11 3duf s GLU 133 Ca 0.69 2.35 0.00 0.00 0.00 0.00 0.00 54.97 58.01 3duf s GLU 133 Cb -0.23 -3.81 0.00 0.00 2.00 0.00 0.00 34.13 32.09 3duf s GLU 133 CO 0.41 -0.81 0.00 0.41 -0.56 0.00 0.00 175.26 174.71 3duf n GLY 134 N 4.14 0.84 3.61 -1.50 0.00 -1.26 -5.08 105.19 105.93 3duf n GLY 134 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.17 5.05 -1.21 1.61 1.01 -1.08 -4.98 120.40 119.63 3duf s VAL 135 Ca 0.00 0.80 -0.14 0.00 0.00 0.00 0.00 61.98 62.65 3duf s VAL 135 Cb 0.00 -3.86 0.17 0.00 0.00 0.00 0.00 36.38 32.69 3duf s VAL 135 CO 0.00 0.03 1.44 0.20 0.00 0.00 0.00 175.10 176.76 3duf s ASN 136 N 1.59 7.08 0.08 3.32 0.01 -1.26 -4.84 114.94 120.92 3duf s ASN 136 Ca 0.21 -3.01 -0.15 0.00 -0.71 0.00 0.00 52.86 49.19 3duf s ASN 136 Cb -0.16 -2.40 0.03 0.00 0.41 0.00 0.00 41.25 39.13 3duf s ASN 136 CO 0.10 -0.74 0.36 0.68 -1.51 0.00 0.00 177.10 175.99 3duf s VAL 137 N 1.55 0.08 0.17 1.60 -7.23 -1.26 -1.47 120.40 113.83 3duf s VAL 137 Ca 0.43 -0.63 0.08 0.00 -1.81 0.00 0.00 61.98 60.05 3duf s VAL 137 Cb -0.03 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.79 3duf s VAL 137 CO 0.00 -0.35 -0.05 -0.76 -0.31 0.00 0.00 175.10 173.63 3duf s LEU 138 N -2.45 3.13 0.96 1.32 1.43 -1.01 -4.94 118.68 117.12 3duf s LEU 138 Ca -0.01 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 3duf s LEU 138 Cb 0.01 -1.82 0.16 0.00 0.03 0.00 0.00 46.19 44.57 3duf s LEU 138 CO -0.08 0.11 1.09 -2.16 0.23 0.00 0.00 176.35 175.54 3duf s PRO 139 N -2.79 0.77 0.30 1.29 0.04 -1.26 -4.50 135.00 128.86 3duf s PRO 139 Ca 0.25 0.76 -0.28 0.00 0.04 0.00 0.00 61.00 61.77 3duf s PRO 139 Cb -0.09 -1.76 -0.13 0.00 0.04 0.00 0.00 34.50 32.55 3duf s PRO 139 CO 0.16 -2.56 1.13 -2.30 0.04 0.00 0.00 177.00 173.47 3duf n PRO 140 N -4.09 1.64 -3.58 0.56 -0.02 -1.26 -4.69 135.00 123.55 3duf n PRO 140 Ca 0.06 0.58 -0.37 0.00 -2.02 0.00 0.00 63.50 61.75 3duf n PRO 140 Cb 0.56 -2.03 -0.09 0.00 -0.02 0.00 0.00 33.50 31.91 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 -1.57 4.10 -0.01 -0.52 2.00 -0.89 -4.84 119.66 117.94 3duf s GLN 141 Ca 0.58 -0.13 0.01 0.00 -2.00 0.00 0.00 55.36 53.82 3duf s GLN 141 Cb -0.66 -3.54 -0.26 0.00 0.80 0.00 0.00 33.01 29.35 3duf s GLN 141 CO 0.60 0.04 0.81 0.97 -0.50 0.00 0.00 175.29 177.21 3duf h ILE 142 N 5.01 1.09 -3.09 -2.34 6.09 -1.93 -2.97 117.51 119.37 3duf h ILE 142 Ca -0.38 -2.79 -0.56 0.00 -1.37 0.00 0.00 64.86 59.77 3duf h ILE 142 Cb 1.17 2.67 -0.06 0.00 0.47 0.00 0.00 36.82 41.07 3duf h ILE 142 CO 0.68 0.78 1.07 -0.63 -3.07 0.00 0.00 178.15 176.98 3duf s ILE 143 N -2.62 3.87 -0.15 2.19 -1.09 -1.26 -4.94 121.20 117.20 3duf s ILE 143 Ca -0.09 0.82 -0.30 0.00 -2.23 0.00 0.00 60.65 58.86 3duf s ILE 143 Cb 0.07 -4.36 -0.07 0.00 -1.58 0.00 0.00 42.46 36.52 3duf s ILE 143 CO 0.84 -0.99 2.13 -0.38 -1.23 0.00 0.00 174.94 175.31 3duf n ILE 144 N 6.95 0.47 0.00 2.92 5.41 -1.26 -2.37 119.36 131.48 3duf n ILE 144 Ca 0.14 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.56 3duf n ILE 144 Cb 0.49 -2.37 0.00 0.00 -0.71 0.00 0.00 39.64 37.04 3duf n ILE 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3duf n GLY 145 N 5.40 2.39 0.38 7.39 0.00 -1.26 -4.94 105.19 114.54 3duf n GLY 145 Ca 0.28 -0.79 0.16 0.00 0.00 0.00 0.00 46.02 45.66 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 2.15 0.00 4.61 0.00 -1.83 0.02 119.26 124.21 3duf h ALA 146 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3duf h ALA 146 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3duf h ALA 146 CO 0.00 -0.34 0.00 -0.56 0.00 0.00 0.00 179.25 178.35 3duf h GLN 147 N 0.37 0.00 0.08 0.00 -0.00 -1.93 -2.93 115.11 110.70 3duf h GLN 147 Ca 0.35 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 59.00 3duf h GLN 147 Cb 0.84 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.32 3duf h GLN 147 CO -0.10 0.00 -0.04 1.88 -0.00 0.00 0.00 178.83 180.57 3duf h TYR 148 N 0.00 -0.10 0.00 0.06 -1.99 -1.29 -2.07 116.97 111.58 3duf h TYR 148 Ca 0.00 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.69 3duf h TYR 148 Cb 0.49 0.03 -0.01 0.00 2.00 0.00 0.00 36.73 39.25 3duf h TYR 148 CO 0.00 0.45 -0.18 -0.84 -0.00 0.00 0.00 178.16 177.59 3duf h ILE 149 N -0.77 0.82 0.00 -2.88 3.07 -1.58 -2.17 117.51 114.00 3duf h ILE 149 Ca -0.01 -0.72 -0.14 0.00 1.55 0.00 0.00 64.86 65.55 3duf h ILE 149 Cb 0.59 1.42 -0.02 0.00 -0.27 0.00 0.00 36.82 38.55 3duf h ILE 149 CO 0.02 0.18 -0.66 1.56 -1.05 0.00 0.00 178.15 178.20 3duf h GLN 150 N 0.00 0.00 -0.67 0.16 4.20 -1.55 -3.19 115.11 114.06 3duf h GLN 150 Ca -0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 3duf h GLN 150 Cb 0.41 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 3duf h GLN 150 CO 0.02 0.66 0.13 0.00 -0.67 0.00 0.00 178.83 178.97 3duf h ALA 151 N 1.34 0.96 -0.92 3.87 0.00 -0.70 -1.92 119.26 121.90 3duf h ALA 151 Ca -0.01 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.72 3duf h ALA 151 Cb 1.43 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.90 3duf h ALA 151 CO 0.09 0.66 0.58 0.00 0.00 0.00 0.00 179.25 180.57 3duf h ALA 152 N 1.10 1.29 -0.15 0.00 0.00 -1.52 -0.66 119.26 119.33 3duf h ALA 152 Ca 0.21 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 3duf h ALA 152 Cb 0.41 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3duf h ALA 152 CO 0.01 0.31 -0.09 0.78 0.00 0.00 0.00 179.25 180.26 3duf h GLY 153 N 1.03 0.34 0.80 0.00 0.00 -1.52 -1.03 103.07 102.69 3duf h GLY 153 Ca 0.41 -0.32 0.04 0.00 0.00 0.00 0.00 47.33 47.46 3duf h GLY 153 CO -0.19 0.29 0.36 -2.08 0.00 0.00 0.00 176.54 174.92 3duf h VAL 154 N -0.03 1.03 0.18 4.60 2.07 -0.98 0.48 116.25 123.61 3duf h VAL 154 Ca 0.03 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3duf h VAL 154 Cb 0.57 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 3duf h VAL 154 CO 0.02 0.13 -0.09 0.00 0.02 0.00 0.00 177.57 177.66 3duf h ALA 155 N 1.29 -0.24 -0.56 1.67 0.00 -1.09 -0.11 119.26 120.22 3duf h ALA 155 Ca 0.26 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.19 3duf h ALA 155 Cb 0.08 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3duf h ALA 155 CO -0.13 -0.63 0.23 1.25 0.00 0.00 0.00 179.25 179.97 3duf h LEU 156 N -0.26 0.26 -0.36 0.00 5.85 -0.80 0.55 115.31 120.54 3duf h LEU 156 Ca -0.02 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3duf h LEU 156 Cb 0.20 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3duf h LEU 156 CO 0.04 0.17 0.21 1.23 -0.34 0.00 0.00 178.44 179.75 3duf h GLY 157 N 0.42 0.50 0.91 3.75 0.00 -0.52 0.14 103.07 108.27 3duf h GLY 157 Ca 0.27 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.48 3duf h GLY 157 CO -0.25 0.14 0.61 1.41 0.00 0.00 0.00 176.54 178.45 3duf h LEU 158 N 0.43 1.03 -1.08 3.11 3.38 -0.25 -1.80 115.31 120.13 3duf h LEU 158 Ca 0.15 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 3duf h LEU 158 Cb 0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3duf h LEU 158 CO -0.07 0.72 -0.27 0.50 0.09 0.00 0.00 178.44 179.40 3duf h LYS 159 N 1.20 0.32 0.00 1.13 3.64 0.05 -1.21 116.57 121.69 3duf h LYS 159 Ca 0.37 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3duf h LYS 159 Cb -0.03 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3duf h LYS 159 CO -0.11 0.57 -0.01 0.52 -2.27 0.00 0.00 179.45 178.15 3duf h MET 160 N 0.28 0.00 -0.19 1.90 2.86 0.08 -3.08 114.93 116.78 3duf h MET 160 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3duf h MET 160 Cb 0.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 3duf h MET 160 CO 0.05 0.01 0.00 0.54 1.06 0.00 0.00 176.91 178.57 3duf n ARG 161 N -3.10 2.27 -1.44 1.72 1.74 -0.89 -4.96 116.66 112.00 3duf n ARG 161 Ca 0.03 -2.02 -0.07 0.00 -0.77 0.00 0.00 57.85 55.01 3duf n ARG 161 Cb 0.46 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.42 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 1.33 0.72 3.74 -0.13 0.00 -1.06 -5.00 105.19 104.79 3duf n GLY 162 Ca 0.16 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 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 -3.04 4.56 -0.25 1.61 3.01 -0.48 -4.92 119.74 120.22 3duf s LYS 163 Ca 0.00 1.77 -0.01 0.00 -1.01 0.00 0.00 55.97 56.72 3duf s LYS 163 Cb 0.00 -3.26 0.13 0.00 -1.01 0.00 0.00 37.83 33.69 3duf s LYS 163 CO 0.00 0.02 2.18 1.63 0.51 0.00 0.00 175.35 179.69 3duf n LYS 164 N 2.40 1.72 -3.09 1.68 4.76 -1.26 -4.63 118.16 119.74 3duf n LYS 164 Ca 0.03 -1.31 -0.13 0.00 -2.87 0.00 0.00 58.31 54.03 3duf n LYS 164 Cb 0.46 -1.57 -0.03 0.00 -1.84 0.00 0.00 35.03 32.05 3duf n LYS 164 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3duf n ALA 165 N 0.74 0.19 -2.28 7.82 0.00 -1.26 -4.93 120.51 120.79 3duf n ALA 165 Ca 0.27 -0.93 -0.10 0.00 0.00 0.00 0.00 53.44 52.68 3duf n ALA 165 Cb 0.58 0.52 -0.09 0.00 0.00 0.00 0.00 19.45 20.46 3duf n ALA 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3duf s VAL 166 N -1.81 0.10 -0.13 0.00 -7.23 -1.26 -4.77 120.40 105.30 3duf s VAL 166 Ca 0.01 -1.78 -0.01 0.00 -1.81 0.00 0.00 61.98 58.39 3duf s VAL 166 Cb 0.00 -1.97 -0.02 0.00 0.56 0.00 0.00 36.38 34.95 3duf s VAL 166 CO 0.01 -0.45 -0.10 0.00 -0.31 0.00 0.00 175.10 174.25 3duf s ALA 167 N -4.02 2.76 -0.04 1.32 0.00 -0.93 -0.70 121.76 120.15 3duf s ALA 167 Ca 0.22 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.37 3duf s ALA 167 Cb 0.06 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.86 3duf s ALA 167 CO 0.01 0.26 -0.23 -1.50 0.00 0.00 0.00 175.76 174.30 3duf s ILE 168 N 0.27 1.84 0.04 0.00 2.07 0.45 -0.49 121.20 125.38 3duf s ILE 168 Ca -0.07 -0.97 0.01 0.00 -1.41 0.00 0.00 60.65 58.21 3duf s ILE 168 Cb -0.15 -1.55 -0.03 0.00 0.13 0.00 0.00 42.46 40.86 3duf s ILE 168 CO 0.05 0.52 -0.05 0.28 -1.91 0.00 0.00 174.94 173.82 3duf s THR 169 N -0.29 0.33 -0.00 4.00 -1.32 -0.99 -1.35 115.64 116.02 3duf s THR 169 Ca 0.02 -1.23 0.04 0.00 -1.21 0.00 0.00 61.69 59.31 3duf s THR 169 Cb -0.11 -0.74 -0.01 0.00 -1.51 0.00 0.00 72.50 70.13 3duf s THR 169 CO 0.01 -0.58 -0.12 -0.31 -2.21 0.00 0.00 174.62 171.41 3duf s TYR 170 N -2.07 1.08 0.25 9.09 1.51 -1.24 -1.65 117.35 124.32 3duf s TYR 170 Ca -0.07 -0.22 -0.06 0.00 -1.01 0.00 0.00 57.07 55.71 3duf s TYR 170 Cb -0.05 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.09 3duf s TYR 170 CO -0.02 -0.01 0.34 -0.08 -1.11 0.00 0.00 175.55 174.66 3duf s THR 171 N -0.37 0.00 0.50 -0.71 -1.32 -0.88 -4.09 115.64 108.79 3duf s THR 171 Ca 0.04 -1.69 0.08 0.00 -1.21 0.00 0.00 61.69 58.91 3duf s THR 171 Cb -0.05 -2.40 0.04 0.00 -1.51 0.00 0.00 72.50 68.58 3duf s THR 171 CO -0.00 0.00 0.56 -0.83 -2.21 0.00 0.00 174.62 172.14 3duf s GLY 172 N -3.12 2.02 0.28 6.08 0.00 -1.26 -0.51 107.32 110.80 3duf s GLY 172 Ca 0.31 -1.79 -0.02 0.00 0.00 0.00 0.00 44.72 43.22 3duf s GLY 172 CO 0.13 -1.72 1.90 1.29 0.00 0.00 0.00 173.10 174.70 3duf h ASP 173 N 0.60 1.01 0.30 1.64 2.03 -1.91 0.56 116.42 120.65 3duf h ASP 173 Ca -0.36 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 55.91 3duf h ASP 173 Cb 1.29 -0.22 -0.00 0.00 -0.83 0.00 0.00 39.33 39.56 3duf h ASP 173 CO 0.49 0.67 -0.15 1.23 -1.03 0.00 0.00 179.24 180.45 3duf h GLY 174 N 1.16 0.00 2.00 7.15 0.00 -1.95 -2.15 103.07 109.27 3duf h GLY 174 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 3duf h GLY 174 CO -0.14 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.07 3duf h GLY 175 N 0.75 0.00 0.84 4.60 0.00 -1.27 -2.91 103.07 105.09 3duf h GLY 175 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3duf h GLY 175 CO 0.02 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.26 3duf n THR 176 N -2.35 0.00 0.03 4.70 -2.24 -0.81 -2.78 114.28 110.83 3duf n THR 176 Ca 0.03 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 3duf n THR 176 Cb 0.31 -0.47 -0.11 0.00 -2.10 0.00 0.00 70.33 67.96 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 -0.92 0.29 -4.76 3.42 7.64 -1.10 -4.91 113.62 113.28 3duf n SER 177 Ca 0.18 0.11 -0.40 0.00 1.01 0.00 0.00 58.87 59.77 3duf n SER 177 Cb 0.08 1.47 -0.04 0.00 -1.01 0.00 0.00 64.21 64.72 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 -3.47 4.55 0.27 1.43 -1.52 -1.12 -4.95 119.66 114.86 3duf s GLN 178 Ca -0.05 1.93 -0.01 0.00 -1.95 0.00 0.00 55.36 55.28 3duf s GLN 178 Cb 0.12 -3.15 0.48 0.00 -0.22 0.00 0.00 33.01 30.24 3duf s GLN 178 CO 0.87 0.09 1.86 0.78 -0.25 0.00 0.00 175.29 178.64 3duf h GLY 179 N 3.69 1.58 1.92 3.09 0.00 -1.93 -1.65 103.07 109.77 3duf h GLY 179 Ca -0.47 -0.45 0.01 0.00 0.00 0.00 0.00 47.33 46.41 3duf h GLY 179 CO 0.66 0.26 0.03 -0.55 0.00 0.00 0.00 176.54 176.95 3duf h ASP 180 N 1.10 0.00 -0.16 0.19 3.32 -1.92 -0.63 116.42 118.31 3duf h ASP 180 Ca 0.46 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.50 3duf h ASP 180 Cb 0.31 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3duf h ASP 180 CO -0.21 0.00 0.07 0.15 -1.72 0.00 0.00 179.24 177.52 3duf h PHE 181 N 0.00 0.24 0.07 4.55 3.57 -1.53 -0.44 116.94 123.41 3duf h PHE 181 Ca 0.01 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3duf h PHE 181 Cb 0.08 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.74 3duf h PHE 181 CO 0.00 0.31 -0.04 -0.92 -2.23 0.00 0.00 178.31 175.43 3duf h TYR 182 N 0.11 -0.09 -0.08 0.41 3.20 -1.31 -2.37 116.97 116.83 3duf h TYR 182 Ca 0.05 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 3duf h TYR 182 Cb 0.17 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.46 3duf h TYR 182 CO -0.01 0.30 0.03 0.93 -1.64 0.00 0.00 178.16 177.77 3duf h GLU 183 N -0.51 0.11 0.14 1.82 5.08 -1.19 -0.02 114.58 120.01 3duf h GLU 183 Ca -0.01 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3duf h GLU 183 Cb 0.44 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3duf h GLU 183 CO 0.02 0.09 -0.07 0.78 -1.00 0.00 0.00 179.01 178.83 3duf h GLY 184 N 0.17 -0.20 1.82 -3.84 0.00 -0.99 -0.69 103.07 99.35 3duf h GLY 184 Ca 0.03 0.08 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 3duf h GLY 184 CO -0.00 -0.07 -0.34 0.16 0.00 0.00 0.00 176.54 176.28 3duf h ILE 185 N -0.62 1.27 -0.33 2.60 3.07 -1.13 -2.61 117.51 119.76 3duf h ILE 185 Ca -0.02 -1.32 -0.11 0.00 1.55 0.00 0.00 64.86 64.96 3duf h ILE 185 Cb 0.47 1.58 -0.01 0.00 -0.27 0.00 0.00 36.82 38.59 3duf h ILE 185 CO 0.03 0.39 -0.24 -1.13 -1.05 0.00 0.00 178.15 176.16 3duf h ASN 186 N 0.18 0.78 -0.53 2.16 -1.24 -0.99 -2.45 115.58 113.48 3duf h ASN 186 Ca 0.02 -0.44 -0.01 0.00 0.71 0.00 0.00 56.30 56.59 3duf h ASN 186 Cb 0.69 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.50 3duf h ASN 186 CO 0.05 1.05 0.31 -0.26 -1.29 0.00 0.00 177.43 177.29 3duf h PHE 187 N 0.51 0.71 -0.48 0.67 -1.00 -0.98 -0.91 116.94 115.46 3duf h PHE 187 Ca 0.06 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.79 3duf h PHE 187 Cb 0.80 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 40.10 3duf h PHE 187 CO 0.07 0.50 0.11 0.00 -1.61 0.00 0.00 178.31 177.38 3duf h ALA 188 N 1.14 1.29 -0.20 2.45 0.00 -1.45 -2.45 119.26 120.04 3duf h ALA 188 Ca 0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3duf h ALA 188 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3duf h ALA 188 CO -0.03 0.50 -0.11 0.78 0.00 0.00 0.00 179.25 180.39 3duf h GLY 189 N 0.91 0.47 0.97 0.00 0.00 -1.01 0.55 103.07 104.96 3duf h GLY 189 Ca 0.16 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.09 3duf h GLY 189 CO -0.00 0.39 0.64 0.00 0.00 0.00 0.00 176.54 177.57 3duf h ALA 190 N 0.69 1.34 -0.60 3.60 0.00 -0.95 -1.70 119.26 121.66 3duf h ALA 190 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3duf h ALA 190 Cb 0.60 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3duf h ALA 190 CO 0.03 0.58 0.00 1.19 0.00 0.00 0.00 179.25 181.05 3duf n PHE 191 N -4.42 0.86 -4.15 0.00 3.72 -0.94 -4.96 117.46 107.57 3duf n PHE 191 Ca 0.12 -0.42 -0.36 0.00 -0.05 0.00 0.00 57.45 56.75 3duf n PHE 191 Cb 0.06 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 38.54 3duf n PHE 191 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3duf n LYS 192 N 1.24 -1.01 -3.41 -1.08 4.81 -0.30 -4.92 118.16 113.49 3duf n LYS 192 Ca 0.20 0.14 -0.31 0.00 -0.87 0.00 0.00 58.31 57.48 3duf n LYS 192 Cb 0.54 -3.36 -0.05 0.00 0.02 0.00 0.00 35.03 32.18 3duf n LYS 192 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3duf s ALA 193 N -3.99 3.59 -1.29 3.14 0.00 0.03 -4.41 121.76 118.83 3duf s ALA 193 Ca 0.20 -0.35 -0.18 0.00 0.00 0.00 0.00 51.96 51.63 3duf s ALA 193 Cb -0.10 -2.39 0.05 0.00 0.00 0.00 0.00 23.12 20.67 3duf s ALA 193 CO 0.97 0.46 1.80 -0.35 0.00 0.00 0.00 175.76 178.64 3duf n PRO 194 N -0.29 2.99 -4.35 0.00 -0.04 -1.26 -2.36 135.00 129.68 3duf n PRO 194 Ca -0.00 -3.13 -0.20 0.00 -0.04 0.00 0.00 63.50 60.13 3duf n PRO 194 Cb 0.53 -3.50 -0.15 0.00 -0.04 0.00 0.00 33.50 30.33 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 4.90 0.81 -0.30 0.55 0.00 -1.26 -2.19 121.76 124.27 3duf s ALA 195 Ca 0.55 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 52.14 3duf s ALA 195 Cb 0.04 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.87 3duf s ALA 195 CO 0.07 0.13 0.08 0.42 0.00 0.00 0.00 175.76 176.46 3duf s ILE 196 N 0.21 3.95 -0.31 0.00 1.01 0.35 -2.72 121.20 123.69 3duf s ILE 196 Ca -0.03 -0.72 -0.14 0.00 0.00 0.00 0.00 60.65 59.75 3duf s ILE 196 Cb -0.08 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 3duf s ILE 196 CO 0.00 0.07 0.34 -0.36 0.00 0.00 0.00 174.94 174.99 3duf s PHE 197 N 1.49 3.22 -0.14 3.97 0.08 0.18 -2.34 117.98 124.44 3duf s PHE 197 Ca 0.02 0.14 -0.02 0.00 0.12 0.00 0.00 56.93 57.19 3duf s PHE 197 Cb -0.17 -2.59 -0.02 0.00 -0.57 0.00 0.00 43.02 39.67 3duf s PHE 197 CO 0.02 -0.32 -0.07 0.08 -0.10 0.00 0.00 175.22 174.83 3duf s VAL 198 N 1.99 3.56 -0.23 -0.44 1.01 -0.66 -0.12 120.40 125.52 3duf s VAL 198 Ca 0.12 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 3duf s VAL 198 Cb -0.16 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.71 3duf s VAL 198 CO 0.11 0.51 -0.09 -0.69 0.00 0.00 0.00 175.10 174.94 3duf s VAL 199 N 0.29 2.73 -0.90 2.92 1.01 0.49 -2.06 120.40 124.88 3duf s VAL 199 Ca -0.06 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 60.83 3duf s VAL 199 Cb -0.15 -2.32 0.20 0.00 0.00 0.00 0.00 36.38 34.11 3duf s VAL 199 CO 0.04 0.31 0.93 -1.10 0.00 0.00 0.00 175.10 175.28 3duf s GLN 200 N 1.33 3.68 -0.66 2.72 -0.21 0.33 -0.80 119.66 126.05 3duf s GLN 200 Ca 0.02 -2.34 -0.27 0.00 0.02 0.00 0.00 55.36 52.79 3duf s GLN 200 Cb -0.15 -4.61 0.01 0.00 1.00 0.00 0.00 33.01 29.26 3duf s GLN 200 CO -0.06 -1.44 1.51 1.21 -2.12 0.00 0.00 175.29 174.38 3duf s ASN 201 N 2.53 5.85 -0.19 5.90 3.84 -0.41 -4.14 114.94 128.32 3duf s ASN 201 Ca 0.24 -0.03 0.15 0.00 0.21 0.00 0.00 52.86 53.44 3duf s ASN 201 Cb -0.08 -2.55 0.69 0.00 -0.55 0.00 0.00 41.25 38.77 3duf s ASN 201 CO -0.09 -2.00 1.61 -0.46 -2.79 0.00 0.00 177.10 173.37 3duf n ASN 202 N 10.58 4.90 0.00 -4.21 0.23 -1.26 -1.26 115.26 124.24 3duf n ASN 202 Ca 0.11 -2.86 0.00 0.00 -0.53 0.00 0.00 54.58 51.30 3duf n ASN 202 Cb 0.50 -0.61 0.00 0.00 -2.08 0.00 0.00 39.78 37.59 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 0.31 0.00 -3.82 -3.83 1.74 -1.26 -4.47 116.66 105.34 3duf n ARG 203 Ca 0.25 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 57.20 3duf n ARG 203 Cb 1.03 -3.04 -0.13 0.00 -1.02 0.00 0.00 32.46 29.30 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 -2.55 -0.11 -0.85 -1.55 0.08 -1.26 -1.22 117.98 110.52 3duf s PHE 204 Ca 0.00 0.31 -0.06 0.00 0.12 0.00 0.00 56.93 57.30 3duf s PHE 204 Cb 0.00 0.00 0.21 0.00 -0.57 0.00 0.00 43.02 42.66 3duf s PHE 204 CO 0.00 -0.08 0.74 0.00 -0.10 0.00 0.00 175.22 175.78 3duf s ALA 205 N 0.32 4.12 0.00 5.36 0.00 0.14 -4.83 121.76 126.87 3duf s ALA 205 Ca -0.02 -3.59 0.00 0.00 0.00 0.00 0.00 51.96 48.35 3duf s ALA 205 Cb -0.03 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.04 3duf s ALA 205 CO -0.01 -2.18 0.00 -0.89 0.00 0.00 0.00 175.76 172.68 3duf n ILE 206 N 3.03 0.00 1.26 0.00 5.41 -1.26 -1.78 119.36 126.02 3duf n ILE 206 Ca 0.17 0.00 0.14 0.00 1.00 0.00 0.00 62.75 64.06 3duf n ILE 206 Cb 0.40 0.00 0.58 0.00 -0.71 0.00 0.00 39.64 39.90 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 6.62 0.32 -4.62 4.38 3.41 -1.26 -4.85 113.62 117.62 3duf n SER 207 Ca 0.00 -0.24 -0.43 0.00 -0.26 0.00 0.00 58.87 57.94 3duf n SER 207 Cb 0.00 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 63.78 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 -2.68 4.44 0.40 6.66 2.01 -0.74 -4.97 115.64 120.76 3duf s THR 208 Ca 0.23 1.42 -0.27 0.00 0.31 0.00 0.00 61.69 63.38 3duf s THR 208 Cb 0.19 -4.45 -0.09 0.00 0.01 0.00 0.00 72.50 68.16 3duf s THR 208 CO 0.52 -0.66 1.39 -2.16 -0.69 0.00 0.00 174.62 173.02 3duf s PRO 209 N 3.85 3.99 0.46 4.92 0.04 -1.26 -0.69 135.00 146.31 3duf s PRO 209 Ca 0.44 2.36 0.24 0.00 0.04 0.00 0.00 61.00 64.08 3duf s PRO 209 Cb -0.11 -2.84 1.30 0.00 0.04 0.00 0.00 34.50 32.90 3duf s PRO 209 CO 0.21 -0.55 1.70 -0.24 0.04 0.00 0.00 177.00 178.16 3duf h VAL 210 N 2.65 0.00 0.00 -0.36 3.04 -1.54 0.81 116.25 120.86 3duf h VAL 210 Ca -0.50 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.17 3duf h VAL 210 Cb 1.25 0.53 -0.00 0.00 -2.01 0.00 0.00 31.29 31.05 3duf h VAL 210 CO 0.63 0.00 -0.10 1.05 -1.01 0.00 0.00 177.57 178.14 3duf h GLU 211 N 0.00 0.00 -0.01 4.17 4.11 -1.86 -2.59 114.58 118.40 3duf h GLU 211 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3duf h GLU 211 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3duf h GLU 211 CO 0.00 0.10 -0.23 1.63 0.07 0.00 0.00 179.01 180.57 3duf n LYS 212 N -3.33 1.34 0.04 1.06 5.02 0.28 -4.21 118.16 118.36 3duf n LYS 212 Ca -0.01 -0.96 -0.11 0.00 -2.02 0.00 0.00 58.31 55.22 3duf n LYS 212 Cb 0.29 -1.48 -0.13 0.00 -0.02 0.00 0.00 35.03 33.69 3duf n LYS 212 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3duf h GLN 213 N 2.34 0.09 -1.66 1.97 1.08 -1.56 -3.49 115.11 113.87 3duf h GLN 213 Ca 0.00 -0.15 0.17 0.00 -1.45 0.00 0.00 58.65 57.22 3duf h GLN 213 Cb 0.66 0.06 -0.20 0.00 -0.05 0.00 0.00 27.48 27.94 3duf h GLN 213 CO 0.00 0.91 0.67 -0.08 -0.95 0.00 0.00 178.83 179.39 3duf s THR 214 N -2.65 0.00 -0.46 -0.54 -1.32 -1.25 -4.94 115.64 104.47 3duf s THR 214 Ca -0.04 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 60.56 3duf s THR 214 Cb 0.08 -1.00 0.66 0.00 -1.51 0.00 0.00 72.50 70.74 3duf s THR 214 CO 0.83 0.00 1.51 1.33 -2.21 0.00 0.00 174.62 176.09 3duf n VAL 215 N 0.16 2.18 -2.78 5.08 0.24 -1.26 -4.79 118.33 117.16 3duf n VAL 215 Ca -0.05 -1.12 -0.40 0.00 -2.04 0.00 0.00 64.34 60.73 3duf n VAL 215 Cb 0.59 -0.29 -0.05 0.00 -1.47 0.00 0.00 33.84 32.62 3duf n VAL 215 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3duf s ALA 216 N -2.38 3.33 0.17 2.33 0.00 -1.26 -4.97 121.76 118.98 3duf s ALA 216 Ca 0.44 0.56 -0.17 0.00 0.00 0.00 0.00 51.96 52.79 3duf s ALA 216 Cb 0.33 -3.19 0.10 0.00 0.00 0.00 0.00 23.12 20.37 3duf s ALA 216 CO 0.14 0.14 1.67 -0.22 0.00 0.00 0.00 175.76 177.49 3duf h LYS 217 N 4.69 0.02 -4.98 0.00 3.11 -1.94 -3.44 116.57 114.03 3duf h LYS 217 Ca -0.45 -0.00 -0.38 0.00 -2.81 0.00 0.00 60.65 57.01 3duf h LYS 217 Cb 1.20 -0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 32.29 3duf h LYS 217 CO 0.69 0.01 -0.61 0.95 -2.81 0.00 0.00 179.45 177.68 3duf s THR 218 N -6.21 0.73 -0.15 1.00 -4.23 -1.26 -5.03 115.64 100.49 3duf s THR 218 Ca -0.14 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.55 3duf s THR 218 Cb 0.14 -2.66 -0.11 0.00 1.34 0.00 0.00 72.50 71.21 3duf s THR 218 CO 0.71 -0.02 0.84 0.18 -0.54 0.00 0.00 174.62 175.80 3duf n LEU 219 N -0.51 0.81 0.25 4.79 4.77 -1.26 -3.99 117.00 121.86 3duf n LEU 219 Ca -0.01 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 3duf n LEU 219 Cb 0.66 0.05 0.63 0.00 -2.33 0.00 0.00 43.42 42.43 3duf n LEU 219 CO 0.39 0.07 0.91 0.00 -1.33 0.00 0.00 177.39 177.43 3duf h ALA 220 N 1.56 1.12 0.00 -1.18 0.00 -1.94 -2.29 119.26 116.53 3duf h ALA 220 Ca -0.13 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3duf h ALA 220 Cb 1.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3duf h ALA 220 CO 0.03 0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.47 3duf n GLN 221 N -3.45 0.34 0.00 0.00 10.64 -1.26 -3.07 117.38 120.59 3duf n GLN 221 Ca -0.01 0.03 0.09 0.00 -1.83 0.00 0.00 57.00 55.28 3duf n GLN 221 Cb 0.32 -1.50 0.43 0.00 -0.86 0.00 0.00 30.24 28.63 3duf n GLN 221 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3duf n LYS 222 N -1.31 0.13 0.06 2.61 5.02 -0.86 -1.96 118.16 121.84 3duf n LYS 222 Ca 0.12 0.15 0.13 0.00 -2.02 0.00 0.00 58.31 56.69 3duf n LYS 222 Cb 0.23 -1.50 0.49 0.00 -0.02 0.00 0.00 35.03 34.23 3duf n LYS 222 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3duf n ALA 223 N -1.40 2.24 0.02 7.82 0.00 -1.17 -3.36 120.51 124.66 3duf n ALA 223 Ca 0.07 -0.05 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 3duf n ALA 223 Cb 0.18 -1.45 0.15 0.00 0.00 0.00 0.00 19.45 18.33 3duf n ALA 223 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3duf h VAL 224 N 0.00 1.30 0.00 0.00 2.07 -1.59 -0.29 116.25 117.74 3duf h VAL 224 Ca 0.00 -1.53 -0.02 0.00 0.82 0.00 0.00 66.70 65.98 3duf h VAL 224 Cb 0.60 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3duf h VAL 224 CO 0.00 0.47 -0.08 0.00 0.02 0.00 0.00 177.57 177.99 3duf h ALA 225 N 1.19 1.68 -0.02 1.67 0.00 -1.76 -0.04 119.26 121.98 3duf h ALA 225 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3duf h ALA 225 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3duf h ALA 225 CO 0.07 0.10 -0.20 0.00 0.00 0.00 0.00 179.25 179.22 3duf n ALA 226 N -2.44 2.92 -2.49 0.00 0.00 -0.92 -4.97 120.51 112.61 3duf n ALA 226 Ca -0.03 -0.66 -0.13 0.00 0.00 0.00 0.00 53.44 52.62 3duf n ALA 226 Cb 0.16 -0.82 0.01 0.00 0.00 0.00 0.00 19.45 18.80 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 1.37 -0.11 3.46 0.00 0.00 -0.03 -4.87 105.19 105.02 3duf n GLY 227 Ca 0.12 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.78 2.00 0.25 -0.61 -4.36 -0.26 -5.00 121.20 110.43 3duf s ILE 228 Ca 0.09 -2.21 -0.30 0.00 -0.26 0.00 0.00 60.65 57.97 3duf s ILE 228 Cb -0.04 -2.44 -0.11 0.00 1.25 0.00 0.00 42.46 41.12 3duf s ILE 228 CO 0.12 -0.32 1.56 -2.84 0.24 0.00 0.00 174.94 173.69 3duf s PRO 229 N -3.64 4.18 0.03 0.37 0.02 -1.26 -4.35 135.00 130.35 3duf s PRO 229 Ca 0.30 2.46 0.05 0.00 0.02 0.00 0.00 61.00 63.83 3duf s PRO 229 Cb 0.01 -3.08 -0.02 0.00 0.02 0.00 0.00 34.50 31.43 3duf s PRO 229 CO 0.13 -0.58 -0.16 0.20 -0.33 0.00 0.00 177.00 176.27 3duf s GLY 230 N 0.65 0.85 -0.04 0.52 0.00 -1.26 -1.29 107.32 106.74 3duf s GLY 230 Ca 0.65 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.54 3duf s GLY 230 CO 0.42 -0.77 -0.02 -0.42 0.00 0.00 0.00 173.10 172.31 3duf s ILE 231 N -0.71 0.36 -0.13 0.90 -1.09 -0.26 -4.97 121.20 115.30 3duf s ILE 231 Ca 0.04 0.00 -0.13 0.00 -2.23 0.00 0.00 60.65 58.34 3duf s ILE 231 Cb -0.07 -0.44 -0.05 0.00 -1.58 0.00 0.00 42.46 40.32 3duf s ILE 231 CO 0.01 0.20 0.28 -1.58 -1.23 0.00 0.00 174.94 172.61 3duf s GLN 232 N 1.13 4.07 0.04 2.79 0.74 -1.26 -0.52 119.66 126.65 3duf s GLN 232 Ca -0.08 0.09 0.01 0.00 0.05 0.00 0.00 55.36 55.43 3duf s GLN 232 Cb -0.14 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.59 3duf s GLN 232 CO -0.01 0.40 -0.06 0.54 -0.55 0.00 0.00 175.29 175.60 3duf s VAL 233 N -0.02 0.41 -0.48 1.34 0.11 0.12 -1.27 120.40 120.61 3duf s VAL 233 Ca 0.17 -1.11 -0.28 0.00 -2.93 0.00 0.00 61.98 57.83 3duf s VAL 233 Cb -0.13 -0.61 0.00 0.00 -1.53 0.00 0.00 36.38 34.12 3duf s VAL 233 CO 0.05 -0.47 1.52 -0.62 -3.33 0.00 0.00 175.10 172.25 3duf s ASP 234 N -1.69 6.07 0.00 3.54 2.15 -0.85 -0.82 116.67 125.07 3duf s ASP 234 Ca -0.10 0.62 0.12 0.00 0.43 0.00 0.00 52.55 53.62 3duf s ASP 234 Cb -0.08 -2.54 0.72 0.00 -0.30 0.00 0.00 42.92 40.71 3duf s ASP 234 CO -0.01 -1.69 1.20 0.61 -0.17 0.00 0.00 175.17 175.12 3duf n GLY 235 N 5.27 -0.63 1.13 2.66 0.00 0.31 -2.20 105.19 111.72 3duf n GLY 235 Ca 0.16 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.80 3.06 -3.97 1.61 2.81 -1.19 -3.41 117.12 115.23 3duf n MET 236 Ca 0.09 -2.53 -0.31 0.00 -1.81 0.00 0.00 57.70 53.14 3duf n MET 236 Cb 0.04 -1.57 -0.15 0.00 -0.71 0.00 0.00 33.22 30.82 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 -1.06 4.01 0.16 7.83 2.15 -0.93 -3.98 116.67 124.83 3duf s ASP 237 Ca 0.40 -1.24 -0.24 0.00 0.43 0.00 0.00 52.55 51.89 3duf s ASP 237 Cb 0.24 -1.27 0.04 0.00 -0.30 0.00 0.00 42.92 41.62 3duf s ASP 237 CO 0.23 -0.23 1.59 -0.65 -0.17 0.00 0.00 175.17 175.94 3duf h PRO 238 N 7.91 -0.28 -0.72 4.34 0.11 -1.88 -2.40 132.00 139.08 3duf h PRO 238 Ca -0.18 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.93 3duf h PRO 238 Cb 1.06 0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 3duf h PRO 238 CO 0.43 -0.19 0.35 -0.07 -0.21 0.00 0.00 178.00 178.31 3duf h LEU 239 N -0.29 0.93 -0.53 2.35 3.38 -1.96 -1.87 115.31 117.32 3duf h LEU 239 Ca 0.16 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 3duf h LEU 239 Cb 0.56 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3duf h LEU 239 CO -0.53 0.80 0.10 0.00 0.09 0.00 0.00 178.44 178.90 3duf h ALA 240 N 1.17 0.71 -0.44 1.53 0.00 -1.84 -1.62 119.26 118.77 3duf h ALA 240 Ca 0.25 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3duf h ALA 240 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3duf h ALA 240 CO -0.03 0.43 0.10 0.28 0.00 0.00 0.00 179.25 180.03 3duf h VAL 241 N 0.76 1.23 -0.05 0.00 2.07 -1.32 -2.00 116.25 116.95 3duf h VAL 241 Ca 0.16 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.88 3duf h VAL 241 Cb 0.38 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 3duf h VAL 241 CO 0.01 0.29 -0.04 0.22 0.02 0.00 0.00 177.57 178.06 3duf h TYR 242 N 0.58 -0.10 -0.74 1.57 5.03 -1.11 -1.87 116.97 120.32 3duf h TYR 242 Ca 0.14 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.44 3duf h TYR 242 Cb 0.33 0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.62 3duf h TYR 242 CO 0.02 -0.07 0.39 0.00 -1.32 0.00 0.00 178.16 177.19 3duf h ALA 243 N 0.99 0.96 -0.76 1.82 0.00 -1.25 0.34 119.26 121.35 3duf h ALA 243 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3duf h ALA 243 Cb 0.10 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.54 3duf h ALA 243 CO -0.08 0.49 0.47 0.00 0.00 0.00 0.00 179.25 180.13 3duf h ALA 244 N 1.20 1.02 0.02 0.00 0.00 -1.10 0.65 119.26 121.05 3duf h ALA 244 Ca 0.26 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.94 3duf h ALA 244 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3duf h ALA 244 CO -0.04 0.24 -0.94 0.28 0.00 0.00 0.00 179.25 178.80 3duf h VAL 245 N 0.91 1.51 0.05 0.00 2.07 -0.93 -2.14 116.25 117.71 3duf h VAL 245 Ca 0.32 -2.75 -0.00 0.00 0.82 0.00 0.00 66.70 65.09 3duf h VAL 245 Cb 0.07 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 3duf h VAL 245 CO -0.13 0.80 -0.02 0.50 0.02 0.00 0.00 177.57 178.73 3duf h LYS 246 N 0.10 -0.06 -0.29 1.57 1.63 0.21 -0.92 116.57 118.81 3duf h LYS 246 Ca -0.05 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.75 3duf h LYS 246 Cb 1.59 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 33.22 3duf h LYS 246 CO 0.14 0.09 0.17 0.00 -3.45 0.00 0.00 179.45 176.40 3duf h ALA 247 N 0.75 0.38 -0.48 5.00 0.00 -0.93 -1.16 119.26 122.81 3duf h ALA 247 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.87 3duf h ALA 247 Cb 0.18 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3duf h ALA 247 CO 0.01 -0.10 0.32 0.00 0.00 0.00 0.00 179.25 179.48 3duf h ALA 248 N 1.04 1.78 -0.10 0.00 0.00 -1.29 -0.78 119.26 119.91 3duf h ALA 248 Ca 0.10 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 3duf h ALA 248 Cb 0.05 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.70 3duf h ALA 248 CO -0.02 0.17 -0.74 -0.09 0.00 0.00 0.00 179.25 178.57 3duf h ARG 249 N 0.54 0.67 -0.30 0.00 2.43 -0.72 -1.25 114.38 115.76 3duf h ARG 249 Ca 0.19 -0.59 -0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3duf h ARG 249 Cb 0.10 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3duf h ARG 249 CO -0.05 1.20 0.17 1.49 -1.51 0.00 0.00 179.97 181.28 3duf h GLU 250 N 0.34 0.42 -0.41 0.20 4.81 -0.70 -0.74 114.58 118.49 3duf h GLU 250 Ca -0.06 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3duf h GLU 250 Cb 1.38 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 3duf h GLU 250 CO 0.15 0.34 0.24 -0.09 -0.73 0.00 0.00 179.01 178.92 3duf h ARG 251 N 0.37 0.57 -0.07 1.92 2.43 -1.19 -3.08 114.38 115.33 3duf h ARG 251 Ca 0.11 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3duf h ARG 251 Cb 0.04 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 3duf h ARG 251 CO -0.02 0.45 0.02 0.00 -1.51 0.00 0.00 179.97 178.91 3duf h ALA 252 N 1.09 0.07 0.00 2.80 0.00 -0.92 -2.51 119.26 119.79 3duf h ALA 252 Ca 0.15 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3duf h ALA 252 Cb 0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3duf h ALA 252 CO -0.03 -0.45 0.00 0.44 0.00 0.00 0.00 179.25 179.21 3duf n ILE 253 N -5.08 0.13 -1.29 0.00 -5.35 -0.31 -2.28 119.36 105.18 3duf n ILE 253 Ca -0.06 0.03 -0.00 0.00 -0.27 0.00 0.00 62.75 62.45 3duf n ILE 253 Cb 0.04 -0.75 0.22 0.00 -1.74 0.00 0.00 39.64 37.41 3duf n ILE 253 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3duf n ASN 254 N -1.07 2.92 -1.35 7.28 3.02 -0.97 -4.97 115.26 120.12 3duf n ASN 254 Ca 0.12 -3.51 -0.18 0.00 -0.03 0.00 0.00 54.58 50.98 3duf n ASN 254 Cb 0.08 -0.60 -0.08 0.00 -0.61 0.00 0.00 39.78 38.57 3duf n ASN 254 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3duf n GLY 255 N -0.95 1.69 0.08 7.41 0.00 -0.96 -4.86 105.19 107.60 3duf n GLY 255 Ca 0.29 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.40 3duf n GLY 255 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3duf n GLU 256 N -2.03 0.39 0.00 1.61 1.02 -1.07 -5.01 120.64 115.56 3duf n GLU 256 Ca -0.18 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 3duf n GLU 256 Cb 0.64 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 3duf n GLU 256 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3duf n GLY 257 N 1.39 -1.04 3.92 0.62 0.00 -1.26 -4.98 105.19 103.84 3duf n GLY 257 Ca 0.10 -2.14 -0.26 0.00 0.00 0.00 0.00 46.02 43.72 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 0.00 2.25 -0.04 1.61 0.04 -0.99 -4.00 135.00 133.86 3duf s PRO 258 Ca 0.00 -0.17 -0.08 0.00 0.04 0.00 0.00 61.00 60.79 3duf s PRO 258 Cb 0.00 -2.15 0.01 0.00 0.04 0.00 0.00 34.50 32.40 3duf s PRO 258 CO 0.00 -1.23 0.19 0.99 0.04 0.00 0.00 177.00 176.99 3duf s THR 259 N -3.27 0.04 -0.16 1.26 2.01 -1.10 -4.42 115.64 110.01 3duf s THR 259 Ca 0.60 -0.33 -0.04 0.00 0.31 0.00 0.00 61.69 62.23 3duf s THR 259 Cb -0.11 -0.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.99 3duf s THR 259 CO 0.45 -0.18 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.95 3duf s LEU 260 N -0.65 3.27 -0.23 4.42 2.96 -0.41 -0.65 118.68 127.40 3duf s LEU 260 Ca -0.07 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 3duf s LEU 260 Cb -0.04 -1.79 0.06 0.00 0.50 0.00 0.00 46.19 44.92 3duf s LEU 260 CO 0.01 0.17 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.54 3duf s ILE 261 N 0.35 1.36 -0.18 6.68 1.01 0.83 -1.11 121.20 130.14 3duf s ILE 261 Ca -0.04 -1.09 -0.17 0.00 0.00 0.00 0.00 60.65 59.34 3duf s ILE 261 Cb -0.14 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 3duf s ILE 261 CO 0.03 -0.11 0.46 -0.70 0.00 0.00 0.00 174.94 174.63 3duf s GLU 262 N 1.48 4.22 -0.10 2.79 2.12 0.32 -0.38 118.70 129.14 3duf s GLU 262 Ca -0.05 0.34 -0.00 0.00 0.36 0.00 0.00 54.97 55.62 3duf s GLU 262 Cb -0.18 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.66 3duf s GLU 262 CO -0.07 -0.04 -0.08 0.95 -0.54 0.00 0.00 175.26 175.49 3duf s THR 263 N 1.28 3.56 -0.54 -1.70 -4.23 0.02 0.14 115.64 114.18 3duf s THR 263 Ca 0.23 -0.51 -0.18 0.00 -1.18 0.00 0.00 61.69 60.05 3duf s THR 263 Cb -0.15 -2.48 0.09 0.00 1.34 0.00 0.00 72.50 71.29 3duf s THR 263 CO 0.09 0.56 0.60 -0.76 -0.54 0.00 0.00 174.62 174.57 3duf s LEU 264 N -0.29 5.38 0.00 4.79 1.43 0.00 -1.29 118.68 128.70 3duf s LEU 264 Ca 0.04 -1.28 0.00 0.00 -1.03 0.00 0.00 54.13 51.86 3duf s LEU 264 Cb -0.13 -2.32 0.00 0.00 0.03 0.00 0.00 46.19 43.77 3duf s LEU 264 CO 0.02 -0.93 0.00 0.00 0.23 0.00 0.00 176.35 175.68 3duf s PHE 266 N -0.10 -0.55 -0.29 0.00 5.36 -1.26 -4.14 117.98 117.01 3duf s PHE 266 Ca 0.00 0.43 0.02 0.00 -0.96 0.00 0.00 56.93 56.42 3duf s PHE 266 Cb 0.00 0.53 0.08 0.00 -0.34 0.00 0.00 43.02 43.29 3duf s PHE 266 CO 0.00 -0.81 -0.00 -0.98 -1.46 0.00 0.00 175.22 171.97 3duf s ARG 267 N -3.39 1.53 0.20 10.12 1.70 -1.26 -3.95 118.95 123.90 3duf s ARG 267 Ca -0.01 -1.38 -0.11 0.00 -0.47 0.00 0.00 55.73 53.77 3duf s ARG 267 Cb -0.01 -2.76 0.25 0.00 -0.57 0.00 0.00 34.95 31.86 3duf s ARG 267 CO -0.10 -0.78 1.73 1.88 -1.08 0.00 0.00 175.30 176.95 3duf h TYR 268 N 7.82 0.27 -1.66 5.89 0.05 -1.75 -3.44 116.97 124.16 3duf h TYR 268 Ca -0.12 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.69 3duf h TYR 268 Cb 1.04 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.74 3duf h TYR 268 CO 0.49 0.04 0.00 0.41 -1.05 0.00 0.00 178.16 178.04 3duf n GLY 269 N -1.29 -1.70 3.84 3.88 0.00 -1.26 -5.06 105.19 103.60 3duf n GLY 269 Ca 0.08 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 3duf n GLY 269 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3duf s PRO 270 N -2.68 2.54 0.10 1.61 0.02 -1.26 -4.99 135.00 130.33 3duf s PRO 270 Ca 0.00 0.58 -0.24 0.00 0.02 0.00 0.00 61.00 61.37 3duf s PRO 270 Cb 0.00 -1.97 -0.13 0.00 0.02 0.00 0.00 34.50 32.42 3duf s PRO 270 CO 0.00 -1.29 1.72 1.25 -0.33 0.00 0.00 177.00 178.35 3duf h HIS 271 N -0.84 -0.13 -3.75 6.54 -0.00 -1.94 -3.37 115.15 111.65 3duf h HIS 271 Ca -0.46 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 59.84 3duf h HIS 271 Cb 1.26 0.05 -0.10 0.00 -0.00 0.00 0.00 27.41 28.62 3duf h HIS 271 CO 0.50 -0.08 -0.18 0.95 -0.00 0.00 0.00 177.93 179.12 3duf s THR 272 N -6.18 0.01 -2.16 6.26 -4.23 -1.26 -4.22 115.64 103.86 3duf s THR 272 Ca -0.14 -1.43 0.17 0.00 -1.18 0.00 0.00 61.69 59.12 3duf s THR 272 Cb 0.07 -2.16 0.41 0.00 1.34 0.00 0.00 72.50 72.16 3duf s THR 272 CO 0.66 -0.04 1.48 0.23 -0.54 0.00 0.00 174.62 176.42 3duf n MET 273 N -0.35 1.59 0.00 3.99 0.00 -1.09 -3.95 117.12 117.30 3duf n MET 273 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 57.70 56.78 3duf n MET 273 Cb 0.62 -1.33 0.00 0.00 0.00 0.00 0.00 33.22 32.51 3duf n MET 273 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 3duf n SER 274 N 0.14 0.18 0.00 7.83 2.88 -1.26 -4.76 113.62 118.62 3duf n SER 274 Ca 0.14 -1.86 0.00 0.00 -1.33 0.00 0.00 58.87 55.82 3duf n SER 274 Cb 0.26 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 3duf n SER 274 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3duf n GLY 275 N 0.35 0.73 3.37 0.46 0.00 -1.26 -5.12 105.19 103.73 3duf n GLY 275 Ca 0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3duf n GLY 275 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3duf s ASP 276 N -0.54 4.28 -0.39 1.61 2.15 -1.25 -5.08 116.67 117.45 3duf s ASP 276 Ca 0.00 -0.32 -0.03 0.00 0.43 0.00 0.00 52.55 52.63 3duf s ASP 276 Cb 0.00 -1.70 0.10 0.00 -0.30 0.00 0.00 42.92 41.02 3duf s ASP 276 CO 0.00 0.09 0.18 -0.62 -0.17 0.00 0.00 175.17 174.64 3duf s ASP 277 N 0.84 5.23 0.28 -0.34 2.15 -1.26 -4.75 116.67 118.82 3duf s ASP 277 Ca -0.02 -1.87 0.02 0.00 0.43 0.00 0.00 52.55 51.11 3duf s ASP 277 Cb -0.15 -1.82 0.63 0.00 -0.30 0.00 0.00 42.92 41.28 3duf s ASP 277 CO 0.01 -0.50 1.76 -0.65 -0.17 0.00 0.00 175.17 175.62 3duf h PRO 278 N 8.07 0.64 -0.15 4.34 0.11 -1.96 -2.62 132.00 140.42 3duf h PRO 278 Ca -0.15 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.91 3duf h PRO 278 Cb 1.05 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 3duf h PRO 278 CO 0.67 0.42 0.02 1.79 -0.21 0.00 0.00 178.00 180.69 3duf h THR 279 N 0.66 1.09 0.00 -1.15 1.35 -1.95 -0.98 112.91 111.92 3duf h THR 279 Ca 0.52 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 3duf h THR 279 Cb 0.78 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 3duf h THR 279 CO -0.39 0.11 0.11 0.03 -0.25 0.00 0.00 175.52 175.13 3duf h ARG 280 N 0.21 0.00 0.00 4.72 3.08 -1.91 -3.28 114.38 117.20 3duf h ARG 280 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3duf h ARG 280 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 3duf h ARG 280 CO -0.00 0.00 -0.04 2.48 -1.07 0.00 0.00 179.97 181.34 3duf n TYR 281 N -2.75 0.00 -4.16 3.04 0.18 -0.81 -5.10 117.16 107.57 3duf n TYR 281 Ca -0.02 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.60 3duf n TYR 281 Cb 0.16 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.00 3duf n TYR 281 CO 0.00 0.00 0.00 -0.98 -2.08 0.00 0.00 176.86 173.80 3duf s ARG 282 N -0.24 0.69 0.38 -3.48 1.70 -0.44 -5.02 118.95 112.53 3duf s ARG 282 Ca 0.00 -0.77 -0.21 0.00 -0.47 0.00 0.00 55.73 54.28 3duf s ARG 282 Cb 0.00 -0.60 -0.10 0.00 -0.57 0.00 0.00 34.95 33.68 3duf s ARG 282 CO 0.00 0.13 0.91 -1.54 -1.08 0.00 0.00 175.30 173.72 3duf s SER 283 N -1.41 7.02 0.40 -2.89 1.04 -1.26 -4.37 113.70 112.23 3duf s SER 283 Ca -0.04 1.66 0.08 0.00 0.48 0.00 0.00 55.95 58.13 3duf s SER 283 Cb -0.09 -2.52 0.83 0.00 0.10 0.00 0.00 66.02 64.34 3duf s SER 283 CO 0.01 -0.25 1.99 0.11 0.98 0.00 0.00 173.24 176.08 3duf h LYS 284 N 2.34 0.40 -0.97 4.02 1.79 -1.97 -2.18 116.57 119.99 3duf h LYS 284 Ca -0.48 -0.05 0.09 0.00 -2.18 0.00 0.00 60.65 58.02 3duf h LYS 284 Cb 1.18 -0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 31.68 3duf h LYS 284 CO 0.63 0.37 0.61 0.93 -1.08 0.00 0.00 179.45 180.91 3duf h GLU 285 N 0.40 1.01 -0.01 3.15 3.07 -2.00 0.44 114.58 120.64 3duf h GLU 285 Ca 0.10 -0.06 -0.14 0.00 -0.50 0.00 0.00 59.36 58.75 3duf h GLU 285 Cb 0.15 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 3duf h GLU 285 CO -0.00 0.67 -0.65 1.25 -1.40 0.00 0.00 179.01 178.87 3duf h LEU 286 N 1.04 0.07 -0.20 1.33 5.85 -1.79 -2.94 115.31 118.67 3duf h LEU 286 Ca 0.45 -0.04 -0.22 0.00 0.84 0.00 0.00 57.88 58.91 3duf h LEU 286 Cb 0.32 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.34 3duf h LEU 286 CO -0.22 0.70 -0.77 -0.33 -0.34 0.00 0.00 178.44 177.49 3duf h GLU 287 N 0.04 0.75 -0.45 1.25 5.08 -1.00 -2.88 114.58 117.37 3duf h GLU 287 Ca -0.01 -0.61 -0.00 0.00 -1.00 0.00 0.00 59.36 57.74 3duf h GLU 287 Cb 1.16 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 3duf h GLU 287 CO 0.09 1.22 0.27 -0.91 -1.00 0.00 0.00 179.01 178.68 3duf h ASN 288 N 0.51 0.55 -0.48 1.42 2.35 -0.96 0.52 115.58 119.49 3duf h ASN 288 Ca -0.05 -0.06 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3duf h ASN 288 Cb 1.39 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.59 3duf h ASN 288 CO 0.16 0.45 0.30 -0.08 -1.65 0.00 0.00 177.43 176.60 3duf h GLU 289 N 0.60 0.59 0.00 0.81 4.81 -1.54 -2.54 114.58 117.32 3duf h GLU 289 Ca 0.16 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3duf h GLU 289 Cb 0.00 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3duf h GLU 289 CO -0.03 0.39 0.00 -1.49 -0.73 0.00 0.00 179.01 177.15 3duf h TRP 290 N 0.61 0.00 -0.07 0.92 4.06 -1.23 -2.73 115.95 117.51 3duf h TRP 290 Ca 0.18 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.98 3duf h TRP 290 Cb -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.12 3duf h TRP 290 CO -0.05 0.00 -0.65 0.00 -3.56 0.00 0.00 178.44 174.18 3duf h ALA 291 N 2.42 0.78 0.00 1.49 0.00 -0.48 -2.74 119.26 120.73 3duf h ALA 291 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3duf h ALA 291 Cb 0.64 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3duf h ALA 291 CO 0.00 0.75 0.00 0.87 0.00 0.00 0.00 179.25 180.87 3duf h LYS 292 N 0.19 0.00 -0.57 0.00 1.57 -1.30 -2.57 116.57 113.89 3duf h LYS 292 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3duf h LYS 292 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3duf h LYS 292 CO 0.10 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.61 3duf n LYS 293 N -2.47 2.59 -1.71 3.15 4.76 -1.03 -4.96 118.16 118.48 3duf n LYS 293 Ca 0.02 -1.98 -0.58 0.00 -2.87 0.00 0.00 58.31 52.91 3duf n LYS 293 Cb 0.28 -1.56 -0.07 0.00 -1.84 0.00 0.00 35.03 31.84 3duf n LYS 293 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3duf n ASP 294 N 0.90 2.35 -0.21 4.39 -0.08 -0.97 -4.83 116.55 118.09 3duf n ASP 294 Ca 0.18 1.08 -0.02 0.00 -1.51 0.00 0.00 54.79 54.52 3duf n ASP 294 Cb 0.56 -1.14 0.18 0.00 2.34 0.00 0.00 41.12 43.06 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 7.11 1.00 0.00 -0.67 0.13 -1.91 -2.03 132.00 135.63 3duf h PRO 295 Ca -0.46 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.53 3duf h PRO 295 Cb 1.32 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 3duf h PRO 295 CO 0.96 0.77 -0.01 -0.07 -0.23 0.00 0.00 178.00 179.42 3duf h LEU 296 N 1.00 0.00 0.00 1.56 3.38 -1.89 -2.28 115.31 117.09 3duf h LEU 296 Ca 0.25 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 3duf h LEU 296 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3duf h LEU 296 CO -0.03 0.01 -0.40 0.58 0.09 0.00 0.00 178.44 178.69 3duf h VAL 297 N 0.00 1.53 0.00 1.22 2.07 -1.74 -2.95 116.25 116.38 3duf h VAL 297 Ca -0.00 -2.30 -0.09 0.00 0.82 0.00 0.00 66.70 65.13 3duf h VAL 297 Cb 0.10 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 3duf h VAL 297 CO 0.00 0.53 -0.41 0.08 0.02 0.00 0.00 177.57 177.79 3duf h ARG 298 N -0.98 0.00 0.03 1.57 0.11 -1.45 -2.81 114.38 110.85 3duf h ARG 298 Ca -0.11 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.75 3duf h ARG 298 Cb 1.11 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 3duf h ARG 298 CO -0.06 0.41 -0.98 0.35 0.10 0.00 0.00 179.97 179.80 3duf h PHE 299 N 0.00 0.42 -0.61 4.08 3.57 -1.57 -2.69 116.94 120.13 3duf h PHE 299 Ca -0.00 -0.25 -0.05 0.00 3.53 0.00 0.00 57.97 61.20 3duf h PHE 299 Cb 0.94 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 3duf h PHE 299 CO 0.00 1.09 0.18 -0.09 -2.23 0.00 0.00 178.31 177.26 3duf h ARG 300 N 0.13 0.94 0.00 1.11 2.43 -1.32 -1.29 114.38 116.38 3duf h ARG 300 Ca -0.07 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 58.80 3duf h ARG 300 Cb 1.63 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 31.02 3duf h ARG 300 CO 0.16 0.82 -0.54 0.87 -1.51 0.00 0.00 179.97 179.76 3duf h LYS 301 N 0.91 0.00 0.05 0.20 1.57 -1.51 -3.09 116.57 114.70 3duf h LYS 301 Ca 0.20 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3duf h LYS 301 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3duf h LYS 301 CO -0.01 0.54 -0.02 0.35 -0.57 0.00 0.00 179.45 179.74 3duf h PHE 302 N 0.00 -0.06 0.00 -1.35 3.57 -0.93 -1.48 116.94 116.69 3duf h PHE 302 Ca -0.01 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 3duf h PHE 302 Cb 1.04 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.79 3duf h PHE 302 CO 0.00 0.24 0.00 1.28 -2.23 0.00 0.00 178.31 177.60 3duf n LEU 303 N -4.98 0.00 -0.07 0.59 4.77 -0.61 -1.85 117.00 114.85 3duf n LEU 303 Ca -0.08 0.16 -0.15 0.00 -0.03 0.00 0.00 56.01 55.90 3duf n LEU 303 Cb 0.17 -0.16 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 3duf n LEU 303 CO 0.33 -0.09 -1.05 -0.62 -1.33 0.00 0.00 177.39 174.63 3duf n GLU 304 N -1.16 0.68 0.00 3.23 1.02 -0.94 0.44 120.64 123.92 3duf n GLU 304 Ca 0.08 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 3duf n GLU 304 Cb 0.08 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 3duf n GLU 304 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3duf n ALA 305 N -2.96 2.40 -0.10 0.62 0.00 -0.60 -2.08 120.51 117.79 3duf n ALA 305 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3duf n ALA 305 Cb 1.06 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 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 0.01 2.41 -2.55 0.00 5.02 -1.21 -5.07 118.16 116.77 3duf n LYS 306 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 3duf n LYS 306 Cb 0.22 -0.20 0.04 0.00 -0.02 0.00 0.00 35.03 35.07 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 -0.21 0.00 0.72 0.00 -0.88 -5.00 105.19 99.82 3duf n GLY 307 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.53 0.00 -4.14 0.99 4.77 0.17 -5.01 117.00 111.24 3duf n LEU 308 Ca -0.06 -0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.42 3duf n LEU 308 Cb 0.57 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.50 3duf n LEU 308 CO 0.34 0.00 -0.53 0.86 -1.33 0.00 0.00 177.39 176.73 3duf s TRP 309 N -0.89 2.21 0.33 -1.77 -0.11 -1.10 -5.00 118.94 112.62 3duf s TRP 309 Ca 0.00 -0.94 0.09 0.00 1.22 0.00 0.00 56.10 56.47 3duf s TRP 309 Cb 0.00 -1.52 -0.05 0.00 -1.50 0.00 0.00 33.47 30.39 3duf s TRP 309 CO 0.00 -0.42 -0.00 -1.54 -4.62 0.00 0.00 176.95 170.37 3duf s SER 310 N 0.58 4.16 0.27 5.86 1.04 -1.26 -4.82 113.70 119.51 3duf s SER 310 Ca -0.15 -0.99 0.03 0.00 0.48 0.00 0.00 55.95 55.33 3duf s SER 310 Cb -0.17 -0.53 0.36 0.00 0.10 0.00 0.00 66.02 65.78 3duf s SER 310 CO 0.05 -0.22 1.66 1.05 0.98 0.00 0.00 173.24 176.76 3duf h GLU 311 N 1.84 0.38 0.06 4.02 4.11 -2.00 -2.68 114.58 120.30 3duf h GLU 311 Ca -0.43 -0.18 -0.00 0.00 0.07 0.00 0.00 59.36 58.82 3duf h GLU 311 Cb 1.25 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3duf h GLU 311 CO 0.66 0.72 -0.03 1.49 0.07 0.00 0.00 179.01 181.92 3duf h GLU 312 N 0.31 -0.07 -0.25 1.06 4.81 -1.99 -2.24 114.58 116.20 3duf h GLU 312 Ca 0.03 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.34 3duf h GLU 312 Cb 0.84 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 3duf h GLU 312 CO 0.07 -0.03 0.22 1.49 -0.73 0.00 0.00 179.01 180.03 3duf h GLU 313 N -0.10 0.00 0.08 1.92 4.81 -1.90 -1.20 114.58 118.19 3duf h GLU 313 Ca -0.01 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.95 3duf h GLU 313 Cb 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3duf h GLU 313 CO 0.01 0.00 -1.30 1.49 -0.73 0.00 0.00 179.01 178.48 3duf h GLU 314 N 0.00 0.17 0.00 1.92 4.81 -1.13 -3.25 114.58 117.10 3duf h GLU 314 Ca 0.12 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 58.98 3duf h GLU 314 Cb 0.56 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3duf h GLU 314 CO -0.00 1.07 -0.34 -0.91 -0.73 0.00 0.00 179.01 178.10 3duf h ASN 315 N 0.05 0.00 -0.33 1.04 4.21 -0.68 -1.90 115.58 117.97 3duf h ASN 315 Ca -0.15 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.24 3duf h ASN 315 Cb 1.94 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 39.13 3duf h ASN 315 CO 0.16 0.34 -0.28 0.78 -1.29 0.00 0.00 177.43 177.15 3duf h ASN 316 N 0.00 0.82 0.37 5.81 2.35 -1.42 -2.21 115.58 121.31 3duf h ASN 316 Ca -0.00 -0.45 -0.14 0.00 -0.55 0.00 0.00 56.30 55.16 3duf h ASN 316 Cb 0.92 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 3duf h ASN 316 CO 0.04 1.10 -0.57 0.58 -1.65 0.00 0.00 177.43 176.94 3duf h VAL 317 N 0.55 1.38 -0.23 2.81 2.07 -1.56 -2.02 116.25 119.24 3duf h VAL 317 Ca 0.06 -1.90 -0.08 0.00 0.82 0.00 0.00 66.70 65.59 3duf h VAL 317 Cb 0.85 1.96 -0.00 0.00 -1.52 0.00 0.00 31.29 32.57 3duf h VAL 317 CO 0.07 0.56 -0.18 0.40 0.02 0.00 0.00 177.57 178.44 3duf h ILE 318 N 0.15 1.32 0.00 4.57 2.04 -1.26 -2.01 117.51 122.32 3duf h ILE 318 Ca -0.00 -1.32 -0.10 0.00 1.00 0.00 0.00 64.86 64.44 3duf h ILE 318 Cb 1.04 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 3duf h ILE 318 CO 0.09 0.41 -0.45 -0.33 0.00 0.00 0.00 178.15 177.86 3duf h GLU 319 N 0.23 0.00 -0.16 2.37 4.39 -1.41 -2.54 114.58 117.46 3duf h GLU 319 Ca 0.04 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 3duf h GLU 319 Cb 0.72 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 3duf h GLU 319 CO 0.05 0.45 -0.14 0.37 -1.16 0.00 0.00 179.01 178.58 3duf h GLN 320 N 0.00 0.37 0.63 2.33 4.15 -1.32 -2.73 115.11 118.54 3duf h GLN 320 Ca -0.00 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.20 3duf h GLN 320 Cb 1.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.77 3duf h GLN 320 CO 0.06 0.74 -0.33 0.00 -1.93 0.00 0.00 178.83 177.37 3duf h ALA 321 N 0.63 -0.89 -1.00 3.38 0.00 -1.29 -0.43 119.26 119.65 3duf h ALA 321 Ca 0.03 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.93 3duf h ALA 321 Cb 0.66 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 18.73 3duf h ALA 321 CO 0.04 -1.01 0.61 0.87 0.00 0.00 0.00 179.25 179.76 3duf h LYS 322 N -0.89 0.76 0.34 0.00 1.57 -1.54 0.25 116.57 117.07 3duf h LYS 322 Ca -0.08 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 3duf h LYS 322 Cb 0.70 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3duf h LYS 322 CO 0.12 0.51 -0.16 1.49 -0.57 0.00 0.00 179.45 180.83 3duf h GLU 323 N 0.79 -0.44 -0.46 3.15 4.22 -1.18 0.99 114.58 121.64 3duf h GLU 323 Ca 0.57 0.03 0.03 0.00 0.08 0.00 0.00 59.36 60.07 3duf h GLU 323 Cb 0.86 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 3duf h GLU 323 CO -0.37 -0.17 0.30 0.93 -2.18 0.00 0.00 179.01 177.52 3duf h GLU 324 N -0.69 0.51 -0.24 1.92 5.08 -0.14 0.10 114.58 121.12 3duf h GLU 324 Ca -0.05 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 3duf h GLU 324 Cb 0.48 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 3duf h GLU 324 CO 0.08 0.34 -0.31 0.82 -1.00 0.00 0.00 179.01 178.93 3duf h ILE 325 N 0.52 1.32 -0.70 3.13 2.04 -0.39 0.07 117.51 123.51 3duf h ILE 325 Ca 0.18 -1.50 0.06 0.00 1.00 0.00 0.00 64.86 64.60 3duf h ILE 325 Cb 0.08 1.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.82 3duf h ILE 325 CO -0.04 0.47 0.39 0.50 0.00 0.00 0.00 178.15 179.47 3duf h LYS 326 N 0.35 0.69 -0.09 2.37 1.63 0.46 -0.20 116.57 121.77 3duf h LYS 326 Ca 0.03 -0.04 -0.15 0.00 -0.85 0.00 0.00 60.65 59.64 3duf h LYS 326 Cb 0.89 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.36 3duf h LYS 326 CO 0.07 0.45 -0.60 0.93 -3.45 0.00 0.00 179.45 176.86 3duf h GLU 327 N 0.71 0.30 -0.21 1.90 4.39 -0.90 -2.95 114.58 117.82 3duf h GLU 327 Ca 0.32 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.78 3duf h GLU 327 Cb 0.22 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3duf h GLU 327 CO -0.19 0.81 -0.01 0.00 -1.16 0.00 0.00 179.01 178.46 3duf h ALA 328 N 1.14 0.28 -0.81 3.43 0.00 -0.01 -1.61 119.26 121.70 3duf h ALA 328 Ca -0.00 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.70 3duf h ALA 328 Cb 1.11 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 3duf h ALA 328 CO 0.10 0.02 0.53 0.82 0.00 0.00 0.00 179.25 180.71 3duf h ILE 329 N 0.13 1.18 -0.48 0.00 1.08 -1.10 -1.90 117.51 116.43 3duf h ILE 329 Ca 0.06 -0.37 -0.06 0.00 -0.39 0.00 0.00 64.86 64.10 3duf h ILE 329 Cb 0.42 0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.17 3duf h ILE 329 CO 0.01 0.20 0.05 0.50 -0.69 0.00 0.00 178.15 178.22 3duf h LYS 330 N 1.07 0.81 0.00 2.37 3.64 -1.42 -2.82 116.57 120.22 3duf h LYS 330 Ca 0.30 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3duf h LYS 330 Cb -0.09 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3duf h LYS 330 CO -0.08 0.83 0.00 -0.22 -2.27 0.00 0.00 179.45 177.71 3duf h LYS 331 N 0.67 0.00 0.00 1.90 3.64 -0.97 -2.28 116.57 119.53 3duf h LYS 331 Ca 0.14 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 3duf h LYS 331 Cb 0.43 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3duf h LYS 331 CO 0.01 0.00 -0.71 0.00 -2.27 0.00 0.00 179.45 176.48 3duf h ALA 332 N 2.03 0.70 0.04 5.00 0.00 -1.14 -3.30 119.26 122.59 3duf h ALA 332 Ca 0.00 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.43 3duf h ALA 332 Cb 0.46 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.31 3duf h ALA 332 CO 0.00 0.32 -0.86 -0.44 0.00 0.00 0.00 179.25 178.26 3duf h ASP 333 N 0.00 0.69 0.00 0.00 3.32 -1.18 -3.14 116.42 116.11 3duf h ASP 333 Ca -0.03 -0.79 0.00 0.00 0.02 0.00 0.00 57.03 56.23 3duf h ASP 333 Cb 1.20 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.53 3duf h ASP 333 CO 0.02 1.40 0.00 -0.62 -1.72 0.00 0.00 179.24 178.32 3duf n GLU 334 N -4.03 0.27 -2.52 3.56 1.02 -1.00 -4.66 120.64 113.27 3duf n GLU 334 Ca -0.12 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.60 3duf n GLU 334 Cb 0.80 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.72 3duf n GLU 334 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3duf s THR 335 N -2.00 4.36 0.25 2.62 2.01 -1.19 -4.97 115.64 116.72 3duf s THR 335 Ca 0.12 1.60 -0.30 0.00 0.31 0.00 0.00 61.69 63.41 3duf s THR 335 Cb 0.06 -4.22 -0.14 0.00 0.01 0.00 0.00 72.50 68.21 3duf s THR 335 CO 0.09 -0.35 1.26 -0.81 -0.69 0.00 0.00 174.62 174.12 3duf n PRO 336 N 6.87 1.72 -1.30 4.92 -0.04 -1.26 -4.92 135.00 140.98 3duf n PRO 336 Ca 0.13 0.61 -0.34 0.00 -0.04 0.00 0.00 63.50 63.86 3duf n PRO 336 Cb 0.46 -2.16 0.11 0.00 -0.04 0.00 0.00 33.50 31.87 3duf n PRO 336 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3duf s LYS 337 N -0.83 1.93 0.17 0.54 1.02 -1.26 -4.99 119.74 116.31 3duf s LYS 337 Ca 0.66 1.78 -0.30 0.00 0.02 0.00 0.00 55.97 58.13 3duf s LYS 337 Cb -0.69 -1.81 -0.08 0.00 -0.52 0.00 0.00 37.83 34.73 3duf s LYS 337 CO 0.54 -2.00 1.17 -0.65 -0.92 0.00 0.00 175.35 173.48 3duf s GLN 338 N -3.99 4.52 0.19 1.68 -0.21 -1.26 -5.07 119.66 115.52 3duf s GLN 338 Ca 0.74 1.81 0.11 0.00 0.02 0.00 0.00 55.36 58.04 3duf s GLN 338 Cb -0.30 -3.27 -0.04 0.00 1.00 0.00 0.00 33.01 30.40 3duf s GLN 338 CO 0.47 -0.06 -0.23 0.15 -2.12 0.00 0.00 175.29 173.51 3duf s LYS 339 N -0.10 1.56 0.32 2.91 1.02 -1.26 -5.04 119.74 119.15 3duf s LYS 339 Ca 0.52 -1.49 0.03 0.00 0.02 0.00 0.00 55.97 55.05 3duf s LYS 339 Cb -0.31 -1.88 0.63 0.00 -0.52 0.00 0.00 37.83 35.75 3duf s LYS 339 CO 0.35 0.41 1.89 0.28 -0.92 0.00 0.00 175.35 177.36 3duf h VAL 340 N 3.19 0.98 0.00 3.17 2.07 -1.97 -1.88 116.25 121.81 3duf h VAL 340 Ca -0.47 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.70 3duf h VAL 340 Cb 1.21 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3duf h VAL 340 CO 0.48 0.17 -0.19 0.71 0.02 0.00 0.00 177.57 178.76 3duf h THR 341 N 0.91 0.82 -0.48 2.57 1.35 -1.93 -1.75 112.91 114.39 3duf h THR 341 Ca 0.42 -0.75 -0.11 0.00 -0.55 0.00 0.00 66.41 65.41 3duf h THR 341 Cb 0.39 1.44 -0.02 0.00 -1.73 0.00 0.00 68.15 68.23 3duf h THR 341 CO -0.18 0.19 -0.15 0.44 -0.25 0.00 0.00 175.52 175.57 3duf h ASP 342 N 0.00 0.93 0.28 5.36 3.32 -1.75 -1.74 116.42 122.82 3duf h ASP 342 Ca -0.00 -0.32 -0.18 0.00 0.02 0.00 0.00 57.03 56.55 3duf h ASP 342 Cb 0.43 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3duf h ASP 342 CO 0.02 1.07 -0.71 -0.07 -1.72 0.00 0.00 179.24 177.83 3duf h LEU 343 N 0.82 0.45 0.54 1.55 3.38 -1.36 -3.08 115.31 117.60 3duf h LEU 343 Ca 0.12 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3duf h LEU 343 Cb 0.70 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.32 3duf h LEU 343 CO 0.05 1.02 -0.26 0.40 0.09 0.00 0.00 178.44 179.74 3duf h ILE 344 N 0.26 0.45 -1.21 1.22 1.08 -1.20 -3.06 117.51 115.05 3duf h ILE 344 Ca -0.03 -0.12 0.36 0.00 -0.39 0.00 0.00 64.86 64.69 3duf h ILE 344 Cb 1.28 0.50 -0.11 0.00 -3.07 0.00 0.00 36.82 35.43 3duf h ILE 344 CO 0.12 0.02 0.79 0.28 -0.69 0.00 0.00 178.15 178.67 3duf h SER 345 N -0.80 0.31 -0.32 1.72 0.02 -1.32 -0.93 113.55 112.22 3duf h SER 345 Ca -0.07 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3duf h SER 345 Cb 0.59 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.20 3duf h SER 345 CO 0.12 -0.06 0.00 2.30 -1.14 0.00 0.00 176.83 178.05 3duf n ILE 346 N -4.63 0.42 0.09 3.27 -5.35 -1.16 -4.26 119.36 107.75 3duf n ILE 346 Ca 0.32 -0.51 -0.07 0.00 -0.27 0.00 0.00 62.75 62.22 3duf n ILE 346 Cb 1.20 0.43 -0.01 0.00 -1.74 0.00 0.00 39.64 39.53 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 2.73 0.08 -3.71 6.28 2.86 -1.19 -3.48 114.93 118.51 3duf h MET 347 Ca 0.00 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.45 3duf h MET 347 Cb 0.61 0.03 -0.09 0.00 0.06 0.00 0.00 31.60 32.21 3duf h MET 347 CO 0.00 0.90 -0.12 -0.06 1.06 0.00 0.00 176.91 178.69 3duf s PHE 348 N -3.10 0.47 -0.06 -0.22 0.08 -1.26 -5.07 117.98 108.81 3duf s PHE 348 Ca -0.01 -0.82 -0.19 0.00 0.12 0.00 0.00 56.93 56.02 3duf s PHE 348 Cb 0.11 0.17 -0.14 0.00 -0.57 0.00 0.00 43.02 42.58 3duf s PHE 348 CO 0.81 -1.04 0.75 1.49 -0.10 0.00 0.00 175.22 177.13 3duf h GLU 349 N 2.23 -0.19 -4.96 0.44 4.81 -1.93 -3.42 114.58 111.56 3duf h GLU 349 Ca -0.27 0.01 -0.67 0.00 -0.13 0.00 0.00 59.36 58.30 3duf h GLU 349 Cb 1.25 0.04 -0.36 0.00 0.63 0.00 0.00 28.75 30.31 3duf h GLU 349 CO 0.36 0.23 -0.82 -1.21 -0.73 0.00 0.00 179.01 176.84 3duf s GLU 350 N -3.08 2.62 0.14 1.92 2.02 -1.26 -5.10 118.70 115.96 3duf s GLU 350 Ca -0.11 -1.09 -0.32 0.00 0.02 0.00 0.00 54.97 53.47 3duf s GLU 350 Cb 0.00 -2.75 -0.11 0.00 0.10 0.00 0.00 34.13 31.37 3duf s GLU 350 CO 0.43 -0.40 1.79 1.28 0.02 0.00 0.00 175.26 178.38 3duf n LEU 351 N 4.53 3.95 -4.66 1.80 4.77 -1.26 -5.01 117.00 121.12 3duf n LEU 351 Ca -0.17 1.01 -0.29 0.00 -0.03 0.00 0.00 56.01 56.53 3duf n LEU 351 Cb 0.46 -1.54 0.20 0.00 -2.33 0.00 0.00 43.42 40.21 3duf n LEU 351 CO 0.24 0.14 0.65 -2.16 -1.33 0.00 0.00 177.39 174.92 3duf s PRO 352 N 2.19 -0.21 0.09 3.23 0.04 -1.26 -4.75 135.00 134.33 3duf s PRO 352 Ca 0.80 0.21 -0.33 0.00 0.04 0.00 0.00 61.00 61.72 3duf s PRO 352 Cb -0.51 -1.69 -0.15 0.00 0.04 0.00 0.00 34.50 32.20 3duf s PRO 352 CO 0.36 -3.09 1.59 0.35 0.04 0.00 0.00 177.00 176.25 3duf h PHE 353 N -2.14 -1.14 -1.00 0.56 3.57 -1.99 -1.68 116.94 113.11 3duf h PHE 353 Ca -0.50 0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.14 3duf h PHE 353 Cb 1.31 0.44 -0.09 0.00 2.79 0.00 0.00 35.95 40.41 3duf h PHE 353 CO -0.72 -0.58 0.63 -2.95 -2.23 0.00 0.00 178.31 172.46 3duf h ASN 354 N -0.86 0.89 1.56 0.41 -1.07 -2.00 -0.77 115.58 113.73 3duf h ASN 354 Ca -0.04 0.06 -0.06 0.00 0.07 0.00 0.00 56.30 56.33 3duf h ASN 354 Cb 0.76 -0.11 -0.01 0.00 -2.07 0.00 0.00 38.32 36.89 3duf h ASN 354 CO -0.06 0.43 -0.28 -0.07 0.07 0.00 0.00 177.43 177.52 3duf h LEU 355 N 0.93 0.00 -0.53 6.14 3.38 -1.92 -2.61 115.31 120.70 3duf h LEU 355 Ca 0.52 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.33 3duf h LEU 355 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3duf h LEU 355 CO -0.30 0.28 -0.68 0.50 0.09 0.00 0.00 178.44 178.33 3duf h LYS 356 N 0.00 0.26 -0.12 1.13 3.64 -0.19 -0.01 116.57 121.29 3duf h LYS 356 Ca -0.00 -0.21 -0.23 0.00 -1.27 0.00 0.00 60.65 58.94 3duf h LYS 356 Cb 1.14 0.04 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 3duf h LYS 356 CO 0.04 0.85 -0.82 0.93 -2.27 0.00 0.00 179.45 178.18 3duf h GLU 357 N 0.18 0.77 0.00 1.90 5.08 -1.30 -3.12 114.58 118.08 3duf h GLU 357 Ca -0.02 -0.66 0.00 0.00 -1.00 0.00 0.00 59.36 57.68 3duf h GLU 357 Cb 1.23 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.62 3duf h GLU 357 CO 0.11 1.26 0.00 1.96 -1.00 0.00 0.00 179.01 181.34 3duf h GLN 358 N 0.49 0.00 -0.18 2.33 4.20 -1.38 -2.45 115.11 118.11 3duf h GLN 358 Ca -0.07 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.49 3duf h GLN 358 Cb 1.45 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 3duf h GLN 358 CO 0.17 0.00 -0.51 -0.92 -0.67 0.00 0.00 178.83 176.90 3duf h TYR 359 N 0.00 0.62 0.01 2.96 5.03 -0.93 -2.18 116.97 122.48 3duf h TYR 359 Ca 0.00 -0.21 -0.06 0.00 2.58 0.00 0.00 58.73 61.04 3duf h TYR 359 Cb 0.70 -0.12 0.01 0.00 1.55 0.00 0.00 36.73 38.86 3duf h TYR 359 CO 0.00 0.91 -0.25 0.93 -1.32 0.00 0.00 178.16 178.42 3duf h GLU 360 N 0.39 0.14 -0.72 1.82 4.39 -1.52 -1.81 114.58 117.28 3duf h GLU 360 Ca 0.02 -0.18 0.15 0.00 0.34 0.00 0.00 59.36 59.69 3duf h GLU 360 Cb 1.03 0.05 -0.11 0.00 -0.10 0.00 0.00 28.75 29.63 3duf h GLU 360 CO 0.09 0.96 0.16 0.82 -1.16 0.00 0.00 179.01 179.89 3duf h ILE 361 N -0.59 0.53 0.00 3.13 1.08 -1.43 -0.45 117.51 119.78 3duf h ILE 361 Ca -0.04 -0.09 -0.07 0.00 -0.39 0.00 0.00 64.86 64.27 3duf h ILE 361 Cb 1.06 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 3duf h ILE 361 CO 0.05 0.05 -0.47 1.88 -0.69 0.00 0.00 178.15 178.97 3duf h TYR 362 N 0.26 0.00 0.00 1.37 -1.99 -1.48 -3.03 116.97 112.11 3duf h TYR 362 Ca 0.40 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 61.09 3duf h TYR 362 Cb 0.67 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.39 3duf h TYR 362 CO -0.27 0.34 -0.21 -0.22 -0.00 0.00 0.00 178.16 177.80 3duf h LYS 363 N 0.00 0.00 0.01 4.88 1.63 -0.22 -1.93 116.57 120.94 3duf h LYS 363 Ca -0.02 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.57 3duf h LYS 363 Cb 1.27 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.90 3duf h LYS 363 CO 0.04 0.21 -0.93 1.49 -3.45 0.00 0.00 179.45 176.81 3duf h GLU 364 N 0.00 0.29 -0.00 1.90 4.57 -1.09 -3.16 114.58 117.09 3duf h GLU 364 Ca -0.00 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 3duf h GLU 364 Cb 0.48 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 3duf h GLU 364 CO 0.03 1.04 -0.14 1.63 -1.18 0.00 0.00 179.01 180.39 3duf n LYS 365 N -3.68 0.19 0.02 1.92 4.01 -0.81 -3.69 118.16 116.11 3duf n LYS 365 Ca -0.05 -0.05 0.02 0.00 -0.51 0.00 0.00 58.31 57.72 3duf n LYS 365 Cb 0.84 -1.50 -0.09 0.00 -0.51 0.00 0.00 35.03 33.77 3duf n LYS 365 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 3duf n GLU 366 N -1.36 0.63 -0.28 1.97 1.02 -0.79 -4.16 120.64 117.66 3duf n GLU 366 Ca 0.09 0.12 0.01 0.00 -0.02 0.00 0.00 57.16 57.36 3duf n GLU 366 Cb 0.32 -1.74 0.14 0.00 -0.02 0.00 0.00 31.44 30.14 3duf n GLU 366 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3duf h SER 367 N 0.00 0.71 0.00 1.62 4.64 -1.62 -3.52 113.55 115.38 3duf h SER 367 Ca -0.16 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 3duf h SER 367 Cb 1.50 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3duf h SER 367 CO 0.03 0.43 0.00 2.29 -0.87 0.00 0.00 176.83 178.72