#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3duf s GLN 2 N 0.00 4.72 0.02 0.00 -1.52 -1.26 -0.98 119.66 120.64 3duf s GLN 2 Ca 0.00 1.51 -0.07 0.00 -1.95 0.00 0.00 55.36 54.85 3duf s GLN 2 Cb 0.00 -3.33 -0.00 0.00 -0.22 0.00 0.00 33.01 29.45 3duf s GLN 2 CO 0.00 0.27 0.12 -1.64 -0.25 0.00 0.00 175.29 173.80 3duf s MET 3 N -0.41 0.54 0.55 2.91 -1.94 0.04 -4.91 119.30 116.09 3duf s MET 3 Ca 0.46 -0.56 -0.02 0.00 -1.71 0.00 0.00 55.69 53.86 3duf s MET 3 Cb -0.25 0.22 0.02 0.00 2.01 0.00 0.00 34.83 36.83 3duf s MET 3 CO 0.31 -0.13 0.81 0.95 -0.01 0.00 0.00 175.02 176.95 3duf s THR 4 N -1.96 3.24 0.23 2.05 -4.23 -1.26 -1.42 115.64 112.29 3duf s THR 4 Ca -0.10 -0.40 -0.07 0.00 -1.18 0.00 0.00 61.69 59.93 3duf s THR 4 Cb -0.05 -3.25 0.19 0.00 1.34 0.00 0.00 72.50 70.74 3duf s THR 4 CO -0.01 -0.21 1.86 -0.03 -0.54 0.00 0.00 174.62 175.69 3duf h MET 5 N 0.02 0.96 -0.92 3.99 4.05 -1.64 -2.21 114.93 119.18 3duf h MET 5 Ca -0.44 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 58.92 3duf h MET 5 Cb 1.28 -0.22 -0.04 0.00 -0.80 0.00 0.00 31.60 31.82 3duf h MET 5 CO 0.57 0.63 0.57 -0.24 0.23 0.00 0.00 176.91 178.67 3duf h VAL 6 N 0.99 1.25 -0.16 -5.77 3.04 -1.60 -1.25 116.25 112.74 3duf h VAL 6 Ca 0.34 -0.52 -0.08 0.00 -1.01 0.00 0.00 66.70 65.42 3duf h VAL 6 Cb 0.06 -0.06 -0.01 0.00 -2.01 0.00 0.00 31.29 29.27 3duf h VAL 6 CO -0.13 0.26 -0.27 1.56 -1.01 0.00 0.00 177.57 177.97 3duf h GLN 7 N 1.26 0.30 -0.39 4.17 4.20 -1.71 -1.83 115.11 121.10 3duf h GLN 7 Ca 0.33 -0.11 -0.11 0.00 0.06 0.00 0.00 58.65 58.82 3duf h GLN 7 Cb -0.08 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3duf h GLN 7 CO -0.06 0.55 -0.20 0.00 -0.67 0.00 0.00 178.83 178.45 3duf h ALA 8 N 1.46 0.91 -0.25 3.87 0.00 -0.75 -1.93 119.26 122.57 3duf h ALA 8 Ca 0.04 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3duf h ALA 8 Cb 0.62 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3duf h ALA 8 CO 0.04 0.62 0.05 0.82 0.00 0.00 0.00 179.25 180.78 3duf h ILE 9 N 0.67 1.22 -0.96 0.00 2.04 -0.74 -1.42 117.51 118.34 3duf h ILE 9 Ca 0.10 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.20 3duf h ILE 9 Cb 0.70 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 3duf h ILE 9 CO 0.05 0.24 0.59 0.74 0.00 0.00 0.00 178.15 179.77 3duf h THR 10 N 0.22 1.26 -0.62 -0.27 2.02 -1.25 -1.48 112.91 112.80 3duf h THR 10 Ca 0.08 -0.54 -0.09 0.00 0.77 0.00 0.00 66.41 66.62 3duf h THR 10 Cb 0.32 -0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 3duf h THR 10 CO 0.00 0.27 0.03 -0.78 0.37 0.00 0.00 175.52 175.41 3duf h ASP 11 N 1.32 1.04 -0.18 4.18 3.58 -1.16 -2.02 116.42 123.18 3duf h ASP 11 Ca 0.35 -0.28 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 3duf h ASP 11 Cb -0.08 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.69 3duf h ASP 11 CO -0.07 1.08 0.08 0.00 -2.88 0.00 0.00 179.24 177.44 3duf h ALA 12 N 1.03 0.23 -0.83 -0.78 0.00 -0.67 -2.27 119.26 115.97 3duf h ALA 12 Ca 0.18 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3duf h ALA 12 Cb 0.53 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3duf h ALA 12 CO 0.03 -0.18 0.54 -0.07 0.00 0.00 0.00 179.25 179.57 3duf h LEU 13 N 0.14 0.93 -1.04 0.00 3.38 -1.19 -2.51 115.31 115.03 3duf h LEU 13 Ca 0.06 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3duf h LEU 13 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3duf h LEU 13 CO -0.01 0.66 -0.03 -0.09 0.09 0.00 0.00 178.44 179.07 3duf h ARG 14 N 1.10 0.66 -0.32 1.13 2.43 -1.24 -0.95 114.38 117.18 3duf h ARG 14 Ca 0.31 -0.17 -0.15 0.00 -0.81 0.00 0.00 59.98 59.16 3duf h ARG 14 Cb -0.09 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 3duf h ARG 14 CO -0.08 0.69 -0.39 0.82 -1.51 0.00 0.00 179.97 179.50 3duf h ILE 15 N 0.62 1.28 0.00 1.20 2.04 -1.04 -2.46 117.51 119.15 3duf h ILE 15 Ca 0.12 -1.57 -0.18 0.00 1.00 0.00 0.00 64.86 64.24 3duf h ILE 15 Cb 0.43 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 3duf h ILE 15 CO 0.02 0.51 -0.82 -0.33 0.00 0.00 0.00 178.15 177.53 3duf h GLU 16 N 0.64 0.04 -0.17 2.37 4.39 -1.25 -1.17 114.58 119.43 3duf h GLU 16 Ca 0.05 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 3duf h GLU 16 Cb 0.95 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.60 3duf h GLU 16 CO 0.09 0.84 -0.28 -0.07 -1.16 0.00 0.00 179.01 178.42 3duf h LEU 17 N 0.02 0.33 0.02 1.33 3.38 -1.11 -1.46 115.31 117.81 3duf h LEU 17 Ca -0.02 -0.11 -0.22 0.00 0.09 0.00 0.00 57.88 57.62 3duf h LEU 17 Cb 1.45 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 3duf h LEU 17 CO 0.11 0.61 -1.07 0.50 0.09 0.00 0.00 178.44 178.68 3duf h LYS 18 N 0.29 0.04 0.07 1.13 1.63 -1.28 -3.37 116.57 115.08 3duf h LYS 18 Ca 0.04 -0.07 -0.18 0.00 -0.85 0.00 0.00 60.65 59.59 3duf h LYS 18 Cb 0.66 0.03 0.02 0.00 -0.60 0.00 0.00 32.23 32.33 3duf h LYS 18 CO 0.05 1.01 -0.77 -0.91 -3.45 0.00 0.00 179.45 175.38 3duf h ASN 19 N 0.01 0.55 -3.59 4.20 -0.26 -0.93 -3.44 115.58 112.12 3duf h ASN 19 Ca -0.04 -0.85 -0.66 0.00 -0.56 0.00 0.00 56.30 54.19 3duf h ASN 19 Cb 1.81 -0.17 -0.37 0.00 -1.06 0.00 0.00 38.32 38.53 3duf h ASN 19 CO 0.14 1.34 -0.82 -0.62 -1.06 0.00 0.00 177.43 176.41 3duf s ASP 20 N -6.92 3.94 0.00 5.81 -1.08 -0.58 -4.97 116.67 112.86 3duf s ASP 20 Ca -0.13 -1.13 0.07 0.00 -0.52 0.00 0.00 52.55 50.84 3duf s ASP 20 Cb 0.03 -1.46 0.37 0.00 -1.46 0.00 0.00 42.92 40.40 3duf s ASP 20 CO 0.84 -0.14 1.00 -0.81 0.52 0.00 0.00 175.17 176.58 3duf n PRO 21 N 4.53 0.14 0.02 4.34 -0.04 -1.26 -1.87 135.00 140.86 3duf n PRO 21 Ca -0.16 0.14 0.12 0.00 -0.04 0.00 0.00 63.50 63.56 3duf n PRO 21 Cb 0.45 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.60 3duf n PRO 21 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3duf n ASN 22 N -1.18 0.58 -4.74 3.54 3.02 -1.26 -4.91 115.26 110.31 3duf n ASN 22 Ca 0.04 -0.16 -0.41 0.00 -0.03 0.00 0.00 54.58 54.02 3duf n ASN 22 Cb 0.04 0.32 -0.03 0.00 -0.61 0.00 0.00 39.78 39.50 3duf n ASN 22 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3duf s VAL 23 N -3.07 3.42 0.16 2.41 1.01 -0.78 -0.25 120.40 123.29 3duf s VAL 23 Ca 0.09 1.18 0.07 0.00 0.00 0.00 0.00 61.98 63.32 3duf s VAL 23 Cb 0.16 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3duf s VAL 23 CO 0.72 0.19 -0.15 -0.76 0.00 0.00 0.00 175.10 175.10 3duf s LEU 24 N -0.20 2.47 -0.03 3.92 1.43 -0.92 -4.90 118.68 120.45 3duf s LEU 24 Ca 0.54 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3duf s LEU 24 Cb -0.34 -0.65 0.03 0.00 0.03 0.00 0.00 46.19 45.25 3duf s LEU 24 CO 0.37 -0.13 0.00 -0.63 0.23 0.00 0.00 176.35 176.19 3duf s ILE 25 N -2.44 0.17 0.29 -0.59 1.01 -0.69 -0.90 121.20 118.04 3duf s ILE 25 Ca 0.15 0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.70 3duf s ILE 25 Cb -0.03 -0.26 0.02 0.00 0.01 0.00 0.00 42.46 42.19 3duf s ILE 25 CO 0.05 0.14 0.68 0.72 0.00 0.00 0.00 174.94 176.52 3duf s PHE 26 N 1.00 -0.03 -5.00 3.97 -0.71 -1.21 -2.50 117.98 113.50 3duf s PHE 26 Ca -0.10 -0.43 0.00 0.00 -1.04 0.00 0.00 56.93 55.36 3duf s PHE 26 Cb -0.14 0.61 0.00 0.00 -1.21 0.00 0.00 43.02 42.28 3duf s PHE 26 CO -0.02 -1.22 0.00 0.41 -1.34 0.00 0.00 175.22 173.05 3duf n GLY 27 N -0.45 0.09 3.63 1.99 0.00 -1.22 -1.34 105.19 107.89 3duf n GLY 27 Ca -0.04 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 3duf n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3duf s GLU 28 N -2.00 3.99 -1.47 1.61 2.02 -1.26 -1.80 118.70 119.80 3duf s GLU 28 Ca 0.00 0.88 -0.12 0.00 0.02 0.00 0.00 54.97 55.75 3duf s GLU 28 Cb 0.00 -3.75 0.06 0.00 0.10 0.00 0.00 34.13 30.53 3duf s GLU 28 CO 0.00 -0.89 1.05 -0.25 0.02 0.00 0.00 175.26 175.18 3duf n ASP 29 N 6.78 -5.19 -1.32 -0.19 8.00 -1.26 -4.85 116.55 118.50 3duf n ASP 29 Ca 0.10 -0.70 0.08 0.00 0.71 0.00 0.00 54.79 54.98 3duf n ASP 29 Cb 0.47 -4.29 0.31 0.00 -0.02 0.00 0.00 41.12 37.60 3duf n ASP 29 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3duf n VAL 30 N -4.78 2.15 0.00 2.53 0.24 -1.26 -1.53 118.33 115.68 3duf n VAL 30 Ca 0.02 -1.47 0.00 0.00 -2.04 0.00 0.00 64.34 60.85 3duf n VAL 30 Cb 0.54 -0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 3duf n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3duf n GLY 31 N 0.36 0.25 0.30 7.63 0.00 -1.26 -4.38 105.19 108.08 3duf n GLY 31 Ca 0.23 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.38 3duf n GLY 31 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3duf h VAL 32 N 0.00 0.74 -0.19 1.61 -1.51 -1.95 -1.35 116.25 113.61 3duf h VAL 32 Ca 0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 66.70 65.32 3duf h VAL 32 Cb 0.00 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 30.09 3duf h VAL 32 CO 0.00 0.00 -0.52 -1.13 -1.23 0.00 0.00 177.57 174.69 3duf h ASN 33 N 0.00 0.60 0.00 4.19 -1.24 -1.88 -3.48 115.58 113.77 3duf h ASN 33 Ca 0.05 -0.31 0.00 0.00 0.71 0.00 0.00 56.30 56.75 3duf h ASN 33 Cb 0.22 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.10 3duf h ASN 33 CO -0.00 1.01 0.00 0.61 -1.29 0.00 0.00 177.43 177.76 3duf n GLY 34 N 0.20 1.21 0.00 1.57 0.00 -0.51 -4.86 105.19 102.80 3duf n GLY 34 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3duf n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duf n GLY 35 N -2.00 0.62 0.26 -0.02 0.00 -0.59 -1.44 105.19 102.03 3duf n GLY 35 Ca 0.00 -1.83 0.03 0.00 0.00 0.00 0.00 46.02 44.22 3duf n GLY 35 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3duf h VAL 36 N 0.00 0.71 -0.47 1.61 2.07 -1.89 -2.87 116.25 115.41 3duf h VAL 36 Ca 0.00 -0.15 -0.25 0.00 0.82 0.00 0.00 66.70 67.11 3duf h VAL 36 Cb 0.00 0.22 -0.15 0.00 -1.52 0.00 0.00 31.29 29.84 3duf h VAL 36 CO 0.00 0.08 0.01 0.49 0.02 0.00 0.00 177.57 178.17 3duf n PHE 37 N -4.99 1.46 -1.43 1.57 3.72 -1.26 -4.95 117.46 111.58 3duf n PHE 37 Ca 0.12 -1.71 -0.15 0.00 -0.05 0.00 0.00 57.45 55.66 3duf n PHE 37 Cb 0.36 -0.58 -0.07 0.00 -0.94 0.00 0.00 39.48 38.26 3duf n PHE 37 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3duf n ARG 38 N -1.11 -1.53 -0.35 -1.08 1.74 -1.08 -4.86 116.66 108.38 3duf n ARG 38 Ca 0.38 1.00 0.02 0.00 -0.77 0.00 0.00 57.85 58.48 3duf n ARG 38 Cb 1.11 -5.35 0.18 0.00 -1.02 0.00 0.00 32.46 27.38 3duf n ARG 38 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3duf h ALA 39 N 0.15 1.40 -0.38 7.54 0.00 -1.78 -2.82 119.26 123.37 3duf h ALA 39 Ca -0.32 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 3duf h ALA 39 Cb 1.18 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 3duf h ALA 39 CO 0.46 0.49 0.04 0.25 0.00 0.00 0.00 179.25 180.49 3duf n THR 40 N -4.46 2.48 -1.66 0.00 -2.24 -0.52 -4.20 114.28 103.68 3duf n THR 40 Ca 0.14 -2.01 -0.42 0.00 -2.27 0.00 0.00 64.05 59.49 3duf n THR 40 Cb 0.13 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 3duf n THR 40 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3duf s GLU 41 N -2.95 4.02 0.00 -0.78 2.56 -1.07 -2.70 118.70 117.77 3duf s GLU 41 Ca 0.46 2.55 0.00 0.00 0.00 0.00 0.00 54.97 57.97 3duf s GLU 41 Cb 0.38 -4.19 0.00 0.00 2.00 0.00 0.00 34.13 32.32 3duf s GLU 41 CO 0.08 -1.10 0.00 0.41 -0.56 0.00 0.00 175.26 174.09 3duf n GLY 42 N 4.70 0.97 0.18 -1.50 0.00 -1.26 -4.94 105.19 103.34 3duf n GLY 42 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 3duf n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3duf h LEU 43 N 0.00 0.85 -0.39 0.99 3.38 -1.86 -3.07 115.31 115.22 3duf h LEU 43 Ca 0.00 -0.76 -0.02 0.00 0.09 0.00 0.00 57.88 57.19 3duf h LEU 43 Cb 0.00 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3duf h LEU 43 CO 0.00 1.51 0.18 -0.61 0.09 0.00 0.00 178.44 179.60 3duf h GLN 44 N 0.30 0.57 -0.20 1.13 4.15 -1.86 0.64 115.11 119.84 3duf h GLN 44 Ca -0.13 -0.09 0.06 0.00 0.77 0.00 0.00 58.65 59.25 3duf h GLN 44 Cb 1.68 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 29.27 3duf h GLN 44 CO 0.20 0.51 0.17 0.00 -1.93 0.00 0.00 178.83 177.78 3duf h ALA 45 N 1.03 1.99 0.11 3.38 0.00 -1.92 0.36 119.26 124.21 3duf h ALA 45 Ca 0.13 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.75 3duf h ALA 45 Cb 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3duf h ALA 45 CO -0.01 -0.27 -1.47 1.49 0.00 0.00 0.00 179.25 178.99 3duf h GLU 46 N 0.00 0.24 -0.00 0.00 4.81 -1.17 -3.41 114.58 115.05 3duf h GLU 46 Ca 0.09 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 3duf h GLU 46 Cb 0.43 0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3duf h GLU 46 CO -0.00 1.20 -0.64 1.19 -0.73 0.00 0.00 179.01 180.03 3duf n PHE 47 N -3.89 0.00 0.00 0.92 3.72 0.12 -5.11 117.46 113.21 3duf n PHE 47 Ca -0.26 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.14 3duf n PHE 47 Cb 0.91 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.45 3duf n PHE 47 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3duf n GLY 48 N 1.31 1.28 0.32 1.37 0.00 0.12 -4.35 105.19 105.24 3duf n GLY 48 Ca 0.03 -1.74 0.17 0.00 0.00 0.00 0.00 46.02 44.49 3duf n GLY 48 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3duf h GLU 49 N 0.00 0.00 0.00 1.61 4.81 -1.77 -0.75 114.58 118.48 3duf h GLU 49 Ca 0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3duf h GLU 49 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3duf h GLU 49 CO 0.00 0.00 -0.39 0.38 -0.73 0.00 0.00 179.01 178.27 3duf h ASP 50 N 0.00 0.00 0.13 1.04 2.03 -1.96 -3.27 116.42 114.39 3duf h ASP 50 Ca 0.02 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.96 3duf h ASP 50 Cb 0.12 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.56 3duf h ASP 50 CO -0.00 0.39 -2.20 0.54 -1.03 0.00 0.00 179.24 176.94 3duf n ARG 51 N -3.73 0.68 -4.02 4.15 5.12 -0.37 -4.92 116.66 113.57 3duf n ARG 51 Ca -0.01 0.14 -0.23 0.00 -1.93 0.00 0.00 57.85 55.82 3duf n ARG 51 Cb 0.48 -1.61 -0.17 0.00 -1.16 0.00 0.00 32.46 30.00 3duf n ARG 51 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3duf s VAL 52 N -2.53 0.64 0.10 1.55 1.01 -0.70 -1.71 120.40 118.77 3duf s VAL 52 Ca -0.17 -0.11 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 3duf s VAL 52 Cb 0.07 -0.69 0.07 0.00 0.00 0.00 0.00 36.38 35.83 3duf s VAL 52 CO 0.76 0.28 0.60 0.72 0.00 0.00 0.00 175.10 177.47 3duf s PHE 53 N 1.39 -0.55 0.47 5.22 -0.71 -1.04 -4.09 117.98 118.68 3duf s PHE 53 Ca -0.03 0.50 -0.11 0.00 -1.04 0.00 0.00 56.93 56.25 3duf s PHE 53 Cb -0.13 0.50 -0.06 0.00 -1.21 0.00 0.00 43.02 42.12 3duf s PHE 53 CO -0.03 -0.78 0.86 -0.51 -1.34 0.00 0.00 175.22 173.42 3duf s ASP 54 N -2.36 6.46 0.26 1.98 1.01 -1.26 -3.39 116.67 119.37 3duf s ASP 54 Ca -0.02 1.24 0.05 0.00 0.71 0.00 0.00 52.55 54.52 3duf s ASP 54 Cb -0.01 -2.37 -0.06 0.00 1.01 0.00 0.00 42.92 41.50 3duf s ASP 54 CO -0.07 -0.54 -0.02 0.42 0.21 0.00 0.00 175.17 175.18 3duf s THR 55 N -2.60 1.26 1.28 -1.27 -4.23 -0.74 -4.86 115.64 104.48 3duf s THR 55 Ca 0.53 -2.06 -0.16 0.00 -1.18 0.00 0.00 61.69 58.82 3duf s THR 55 Cb -0.10 -2.43 0.33 0.00 1.34 0.00 0.00 72.50 71.64 3duf s THR 55 CO 0.37 -0.28 0.98 -2.84 -0.54 0.00 0.00 174.62 172.30 3duf s PRO 56 N -3.82 -1.85 -1.18 3.99 0.02 -1.26 -4.68 135.00 126.22 3duf s PRO 56 Ca 0.30 0.61 -0.15 0.00 0.02 0.00 0.00 61.00 61.78 3duf s PRO 56 Cb 0.05 -1.46 0.15 0.00 0.02 0.00 0.00 34.50 33.27 3duf s PRO 56 CO 0.10 -4.28 1.42 -1.17 -0.33 0.00 0.00 177.00 172.74 3duf s LEU 57 N -7.55 4.91 -0.28 -5.54 0.20 -1.26 -4.81 118.68 104.35 3duf s LEU 57 Ca 0.69 -2.80 -0.09 0.00 0.69 0.00 0.00 54.13 52.61 3duf s LEU 57 Cb -0.22 -2.42 0.12 0.00 -0.43 0.00 0.00 46.19 43.24 3duf s LEU 57 CO 0.63 -0.84 0.60 0.00 -0.29 0.00 0.00 176.35 176.46 3duf s ALA 58 N 2.02 -1.88 0.05 5.97 0.00 -1.26 -5.07 121.76 121.59 3duf s ALA 58 Ca 0.43 2.18 -0.27 0.00 0.00 0.00 0.00 51.96 54.29 3duf s ALA 58 Cb -0.02 -1.70 -0.17 0.00 0.00 0.00 0.00 23.12 21.23 3duf s ALA 58 CO -0.01 -0.90 1.50 0.93 0.00 0.00 0.00 175.76 177.28 3duf h GLU 59 N 8.03 -0.46 -0.52 0.00 3.07 -1.90 -2.74 114.58 120.07 3duf h GLU 59 Ca -0.18 0.03 0.08 0.00 -0.50 0.00 0.00 59.36 58.79 3duf h GLU 59 Cb 1.10 0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 29.05 3duf h GLU 59 CO 0.11 -0.22 0.16 0.77 -1.40 0.00 0.00 179.01 178.43 3duf h SER 60 N -0.62 0.13 -0.60 1.42 0.02 -1.92 -0.63 113.55 111.35 3duf h SER 60 Ca -0.05 0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.07 3duf h SER 60 Cb 0.45 0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 3duf h SER 60 CO 0.08 0.10 0.40 1.23 -1.14 0.00 0.00 176.83 177.50 3duf h GLY 61 N 0.32 0.58 1.16 -3.77 0.00 -1.92 -0.30 103.07 99.14 3duf h GLY 61 Ca 0.26 -0.17 -0.19 0.00 0.00 0.00 0.00 47.33 47.23 3duf h GLY 61 CO -0.29 0.11 -0.56 -2.22 0.00 0.00 0.00 176.54 173.58 3duf h ILE 62 N 0.42 1.27 -0.19 2.60 2.04 -0.82 -1.91 117.51 120.91 3duf h ILE 62 Ca 0.27 -1.74 -0.02 0.00 1.00 0.00 0.00 64.86 64.37 3duf h ILE 62 Cb 0.53 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 3duf h ILE 62 CO -0.08 0.57 0.04 1.23 0.00 0.00 0.00 178.15 179.92 3duf h GLY 63 N 0.68 0.33 1.00 5.37 0.00 -0.46 -1.92 103.07 108.08 3duf h GLY 63 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.13 3duf h GLY 63 CO 0.12 0.19 0.26 -1.33 0.00 0.00 0.00 176.54 175.78 3duf h GLY 64 N 0.12 0.57 0.31 4.60 0.00 -1.14 -1.95 103.07 105.57 3duf h GLY 64 Ca 0.06 -0.22 0.10 0.00 0.00 0.00 0.00 47.33 47.27 3duf h GLY 64 CO 0.00 0.22 0.15 -2.00 0.00 0.00 0.00 176.54 174.91 3duf h LEU 65 N 0.53 0.08 -1.17 3.11 5.85 -1.24 -0.83 115.31 121.65 3duf h LEU 65 Ca 0.14 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.97 3duf h LEU 65 Cb -0.04 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 3duf h LEU 65 CO -0.03 0.06 0.56 0.00 -0.34 0.00 0.00 178.44 178.69 3duf h ALA 66 N 1.43 1.41 -0.36 1.25 0.00 -0.88 -0.97 119.26 121.14 3duf h ALA 66 Ca 0.29 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 3duf h ALA 66 Cb 0.39 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3duf h ALA 66 CO -0.34 0.54 -0.16 0.82 0.00 0.00 0.00 179.25 180.11 3duf h ILE 67 N 1.14 1.28 -0.48 0.00 2.04 -0.45 -2.77 117.51 118.26 3duf h ILE 67 Ca 0.32 -1.27 -0.09 0.00 1.00 0.00 0.00 64.86 64.82 3duf h ILE 67 Cb -0.10 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 3duf h ILE 67 CO -0.08 0.42 -0.06 1.23 0.00 0.00 0.00 178.15 179.67 3duf h GLY 68 N 0.53 0.91 1.66 5.37 0.00 -0.76 -2.81 103.07 107.98 3duf h GLY 68 Ca 0.08 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 3duf h GLY 68 CO 0.05 0.61 -0.22 1.41 0.00 0.00 0.00 176.54 178.39 3duf h LEU 69 N 0.77 0.40 -1.06 3.11 3.38 -1.16 -2.51 115.31 118.25 3duf h LEU 69 Ca 0.14 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3duf h LEU 69 Cb 0.55 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3duf h LEU 69 CO 0.03 0.64 -0.35 0.00 0.09 0.00 0.00 178.44 178.84 3duf h ALA 70 N 1.40 1.06 0.00 1.53 0.00 -1.28 -1.54 119.26 120.43 3duf h ALA 70 Ca 0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 3duf h ALA 70 Cb 0.60 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3duf h ALA 70 CO 0.04 0.44 -0.13 -0.07 0.00 0.00 0.00 179.25 179.53 3duf h LEU 71 N 0.00 0.00 -3.44 0.00 3.38 -1.20 -2.41 115.31 111.65 3duf h LEU 71 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3duf h LEU 71 Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3duf h LEU 71 CO 0.05 0.13 0.03 0.00 0.09 0.00 0.00 178.44 178.74 3duf n GLN 72 N -3.25 4.59 -0.83 1.13 1.13 -1.00 -4.94 117.38 114.21 3duf n GLN 72 Ca 0.01 -2.97 0.00 0.00 -1.94 0.00 0.00 57.00 52.10 3duf n GLN 72 Cb 0.40 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.53 3duf n GLN 72 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3duf n GLY 73 N 0.52 1.24 3.72 1.08 0.00 -0.91 -5.05 105.19 105.80 3duf n GLY 73 Ca 0.28 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 3duf n GLY 73 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3duf s PHE 74 N -3.78 1.72 -0.50 1.61 0.08 -0.61 -4.95 117.98 111.55 3duf s PHE 74 Ca 0.00 0.71 0.04 0.00 0.12 0.00 0.00 56.93 57.80 3duf s PHE 74 Cb 0.00 -3.47 0.16 0.00 -0.57 0.00 0.00 43.02 39.14 3duf s PHE 74 CO 0.00 -2.97 0.36 0.50 -0.10 0.00 0.00 175.22 173.00 3duf s ARG 75 N -5.32 1.44 0.55 0.44 3.52 0.65 -4.40 118.95 115.82 3duf s ARG 75 Ca 0.67 -2.41 -0.21 0.00 -0.13 0.00 0.00 55.73 53.65 3duf s ARG 75 Cb -0.13 -2.22 -0.05 0.00 -1.56 0.00 0.00 34.95 30.99 3duf s ARG 75 CO 0.55 -1.30 1.28 -2.14 -0.81 0.00 0.00 175.30 172.89 3duf s PRO 76 N -0.27 3.18 -0.41 5.12 0.02 -1.25 -2.15 135.00 139.24 3duf s PRO 76 Ca 0.26 2.05 0.07 0.00 0.02 0.00 0.00 61.00 63.40 3duf s PRO 76 Cb -0.07 -2.19 0.23 0.00 0.02 0.00 0.00 34.50 32.49 3duf s PRO 76 CO -0.13 -1.10 0.53 0.28 -0.33 0.00 0.00 177.00 176.25 3duf n VAL 77 N -1.10 -0.72 -1.51 3.83 0.31 -0.08 -2.49 118.33 116.57 3duf n VAL 77 Ca 0.11 -3.49 -0.30 0.00 -0.01 0.00 0.00 64.34 60.65 3duf n VAL 77 Cb 0.47 -1.40 0.08 0.00 -0.91 0.00 0.00 33.84 32.07 3duf n VAL 77 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3duf s PRO 78 N -0.61 2.36 -0.05 5.55 0.04 -1.19 -3.35 135.00 137.75 3duf s PRO 78 Ca 0.34 0.81 0.02 0.00 0.04 0.00 0.00 61.00 62.21 3duf s PRO 78 Cb 0.14 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.76 3duf s PRO 78 CO -0.14 -1.47 -0.10 -2.00 0.04 0.00 0.00 177.00 173.33 3duf s GLU 79 N -5.08 1.31 -0.25 4.56 2.12 -0.45 -1.73 118.70 119.19 3duf s GLU 79 Ca 0.60 -0.32 -0.09 0.00 0.36 0.00 0.00 54.97 55.52 3duf s GLU 79 Cb -0.15 -1.15 -0.04 0.00 0.26 0.00 0.00 34.13 33.05 3duf s GLU 79 CO 0.55 0.04 0.11 0.42 -0.54 0.00 0.00 175.26 175.84 3duf s ILE 80 N 0.57 4.81 0.24 -3.70 -1.09 -0.58 -4.31 121.20 117.13 3duf s ILE 80 Ca -0.11 -0.01 -0.13 0.00 -2.23 0.00 0.00 60.65 58.18 3duf s ILE 80 Cb -0.13 -3.25 0.31 0.00 -1.58 0.00 0.00 42.46 37.81 3duf s ILE 80 CO 0.02 0.33 1.59 1.56 -1.23 0.00 0.00 174.94 177.21 3duf h GLN 81 N 7.92 -0.02 -3.63 2.79 4.20 -1.91 -3.38 115.11 121.07 3duf h GLN 81 Ca -0.37 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.11 3duf h GLN 81 Cb 1.18 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 28.68 3duf h GLN 81 CO 0.60 -0.01 -0.69 -0.06 -0.67 0.00 0.00 178.83 178.00 3duf s PHE 82 N -6.18 -0.03 -0.58 2.96 0.08 -1.26 -4.23 117.98 108.73 3duf s PHE 82 Ca -0.15 0.10 0.16 0.00 0.12 0.00 0.00 56.93 57.17 3duf s PHE 82 Cb 0.22 -0.02 0.78 0.00 -0.57 0.00 0.00 43.02 43.43 3duf s PHE 82 CO 0.75 -0.03 1.50 0.34 -0.10 0.00 0.00 175.22 177.68 3duf n PHE 83 N 3.22 0.48 0.25 0.36 7.35 -0.73 -1.29 117.46 127.10 3duf n PHE 83 Ca -0.14 0.22 0.12 0.00 -0.76 0.00 0.00 57.45 56.89 3duf n PHE 83 Cb 0.58 -0.85 0.62 0.00 0.35 0.00 0.00 39.48 40.18 3duf n PHE 83 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3duf h GLY 84 N 1.06 0.00 -0.26 7.13 0.00 -1.82 -1.76 103.07 107.41 3duf h GLY 84 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3duf h GLY 84 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 3duf n PHE 85 N -3.44 0.13 0.29 5.60 3.72 -0.41 -4.07 117.46 119.28 3duf n PHE 85 Ca -0.01 -0.06 0.16 0.00 -0.05 0.00 0.00 57.45 57.49 3duf n PHE 85 Cb 0.33 0.00 0.80 0.00 -0.94 0.00 0.00 39.48 39.67 3duf n PHE 85 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 3duf h VAL 86 N 1.32 0.00 -0.90 -4.37 3.04 -1.47 -2.66 116.25 111.21 3duf h VAL 86 Ca 0.00 -0.16 0.04 0.00 -1.01 0.00 0.00 66.70 65.57 3duf h VAL 86 Cb 0.29 0.97 -0.05 0.00 -2.01 0.00 0.00 31.29 30.49 3duf h VAL 86 CO 0.00 0.00 0.59 1.88 -1.01 0.00 0.00 177.57 179.03 3duf h TYR 87 N 0.00 1.08 0.00 3.17 0.05 -1.81 -2.13 116.97 117.33 3duf h TYR 87 Ca 0.00 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 3duf h TYR 87 Cb 0.19 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 37.56 3duf h TYR 87 CO 0.00 0.62 -0.08 0.93 -1.05 0.00 0.00 178.16 178.58 3duf h GLU 88 N 1.11 0.00 -0.29 4.88 3.07 -1.81 -3.18 114.58 118.35 3duf h GLU 88 Ca 0.36 0.00 -0.22 0.00 -0.50 0.00 0.00 59.36 59.00 3duf h GLU 88 Cb 0.05 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.77 3duf h GLU 88 CO -0.11 0.08 -0.66 1.55 -1.40 0.00 0.00 179.01 178.47 3duf n VAL 89 N -3.88 2.23 0.10 3.13 3.14 -0.82 -4.05 118.33 118.17 3duf n VAL 89 Ca -0.02 -3.53 -0.01 0.00 -2.96 0.00 0.00 64.34 57.82 3duf n VAL 89 Cb 0.18 -0.50 0.26 0.00 -1.06 0.00 0.00 33.84 32.72 3duf n VAL 89 CO 0.00 0.00 0.00 0.24 -6.46 0.00 0.00 176.83 170.61 3duf h MET 90 N 1.49 0.23 -0.20 1.45 2.86 -1.50 -3.05 114.93 116.21 3duf h MET 90 Ca 0.13 -0.10 -0.19 0.00 -2.06 0.00 0.00 59.70 57.48 3duf h MET 90 Cb 1.24 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.90 3duf h MET 90 CO 0.30 0.57 -0.65 0.22 1.06 0.00 0.00 176.91 178.40 3duf h ASP 91 N 0.20 0.84 -0.11 1.22 3.58 -1.88 -0.75 116.42 119.54 3duf h ASP 91 Ca 0.02 -0.50 -0.09 0.00 0.42 0.00 0.00 57.03 56.88 3duf h ASP 91 Cb 0.73 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 3duf h ASP 91 CO 0.06 1.27 -0.22 0.28 -2.88 0.00 0.00 179.24 177.75 3duf h SER 92 N 0.54 0.53 0.00 2.28 0.02 -1.91 0.29 113.55 115.30 3duf h SER 92 Ca -0.01 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.73 3duf h SER 92 Cb 1.25 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 3duf h SER 92 CO 0.13 0.75 -0.24 0.40 -1.14 0.00 0.00 176.83 176.73 3duf h ILE 93 N 0.47 1.32 0.05 3.27 2.04 -1.49 -0.49 117.51 122.69 3duf h ILE 93 Ca 0.07 -2.08 -0.34 0.00 1.00 0.00 0.00 64.86 63.52 3duf h ILE 93 Cb 0.64 2.58 -0.04 0.00 -0.74 0.00 0.00 36.82 39.26 3duf h ILE 93 CO 0.05 0.45 -1.97 0.00 0.00 0.00 0.00 178.15 176.67 3duf n GLY 95 N 1.83 -0.71 1.75 0.00 0.00 0.76 -4.60 105.19 104.23 3duf n GLY 95 Ca -0.28 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.36 3duf n GLY 95 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3duf n GLN 96 N -0.77 0.00 0.03 1.61 1.13 0.32 -4.85 117.38 114.85 3duf n GLN 96 Ca 0.12 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 55.10 3duf n GLN 96 Cb 0.34 -0.13 0.08 0.00 0.11 0.00 0.00 30.24 30.64 3duf n GLN 96 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3duf h MET 97 N 0.00 0.45 0.00 -1.09 -0.00 -1.20 -2.73 114.93 110.36 3duf h MET 97 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 59.70 59.41 3duf h MET 97 Cb 0.05 0.04 0.00 0.00 -0.00 0.00 0.00 31.60 31.69 3duf h MET 97 CO 0.00 0.89 0.00 0.00 -0.00 0.00 0.00 176.91 177.80 3duf n ALA 98 N -2.50 1.65 0.16 -3.00 0.00 -0.97 -3.32 120.51 112.53 3duf n ALA 98 Ca -0.03 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.38 3duf n ALA 98 Cb 0.61 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.82 3duf n ALA 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3duf n ARG 99 N -1.49 5.64 -0.08 0.00 1.74 -1.18 -4.40 116.66 116.88 3duf n ARG 99 Ca 0.04 -0.03 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 3duf n ARG 99 Cb 0.16 -0.68 -0.00 0.00 -1.02 0.00 0.00 32.46 30.92 3duf n ARG 99 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3duf h ILE 100 N 0.03 0.71 -0.61 0.55 1.08 -1.48 0.60 117.51 118.39 3duf h ILE 100 Ca 0.00 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.50 3duf h ILE 100 Cb 0.08 0.68 -0.04 0.00 -3.07 0.00 0.00 36.82 34.48 3duf h ILE 100 CO 0.00 0.00 0.36 -0.09 -0.69 0.00 0.00 178.15 177.74 3duf h ARG 101 N 0.02 0.69 0.10 2.37 2.43 -1.83 0.32 114.38 118.49 3duf h ARG 101 Ca 0.15 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3duf h ARG 101 Cb 0.22 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3duf h ARG 101 CO -0.30 0.46 -0.05 -0.92 -1.51 0.00 0.00 179.97 177.64 3duf h TYR 102 N 0.71 -0.12 -0.50 2.20 5.03 -1.77 -0.23 116.97 122.27 3duf h TYR 102 Ca 0.25 -0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.61 3duf h TYR 102 Cb 0.05 0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.35 3duf h TYR 102 CO -0.06 0.20 0.33 -0.09 -1.32 0.00 0.00 178.16 177.22 3duf h ARG 103 N -0.46 0.46 -0.67 1.82 2.43 0.55 -2.05 114.38 116.45 3duf h ARG 103 Ca -0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3duf h ARG 103 Cb 0.38 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3duf h ARG 103 CO 0.02 0.31 0.00 0.25 -1.51 0.00 0.00 179.97 179.04 3duf n THR 104 N -4.48 1.25 -3.04 0.20 -2.24 0.11 -4.97 114.28 101.12 3duf n THR 104 Ca 0.06 -1.07 -0.21 0.00 -2.27 0.00 0.00 64.05 60.56 3duf n THR 104 Cb 0.22 0.39 0.01 0.00 -2.10 0.00 0.00 70.33 68.85 3duf n THR 104 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3duf n GLY 105 N 1.38 -0.51 0.42 3.38 0.00 -0.73 -2.28 105.19 106.85 3duf n GLY 105 Ca 0.24 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.35 3duf n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duf n GLY 106 N -1.28 3.33 0.40 -0.02 0.00 -0.18 -4.96 105.19 102.48 3duf n GLY 106 Ca -0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 3duf n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3duf h ARG 107 N 2.12 -0.77 -6.08 1.61 9.65 -1.73 -3.43 114.38 115.76 3duf h ARG 107 Ca 0.00 0.05 -0.59 0.00 -1.10 0.00 0.00 59.98 58.34 3duf h ARG 107 Cb 0.00 0.17 -0.06 0.00 -1.39 0.00 0.00 29.97 28.70 3duf h ARG 107 CO 0.00 -0.51 -0.53 0.71 2.80 0.00 0.00 179.97 182.44 3duf s TYR 108 N -5.26 3.34 0.12 2.20 2.02 -1.26 -5.13 117.35 113.39 3duf s TYR 108 Ca -0.14 0.11 -0.00 0.00 -0.37 0.00 0.00 57.07 56.67 3duf s TYR 108 Cb 0.03 -1.65 -0.04 0.00 -0.40 0.00 0.00 41.96 39.91 3duf s TYR 108 CO 0.48 0.54 0.02 -3.38 -1.57 0.00 0.00 175.55 171.64 3duf s HIS 109 N -1.59 0.88 -0.75 2.71 -3.43 -1.26 -3.75 115.29 108.10 3duf s HIS 109 Ca 0.33 -1.14 0.03 0.00 -0.80 0.00 0.00 55.06 53.47 3duf s HIS 109 Cb -0.12 -0.52 0.18 0.00 -1.43 0.00 0.00 32.58 30.70 3duf s HIS 109 CO 0.26 -0.40 0.57 -1.64 -2.00 0.00 0.00 174.74 171.52 3duf s MET 110 N -3.98 2.69 -1.23 -0.38 -1.94 -1.26 -4.74 119.30 108.46 3duf s MET 110 Ca 0.20 -3.28 -0.15 0.00 -1.71 0.00 0.00 55.69 50.75 3duf s MET 110 Cb 0.07 -3.59 -0.04 0.00 2.01 0.00 0.00 34.83 33.28 3duf s MET 110 CO -0.00 -1.27 2.20 -0.35 -0.01 0.00 0.00 175.02 175.59 3duf n PRO 111 N 2.16 2.48 -4.92 2.03 -0.04 -1.23 -2.26 135.00 133.21 3duf n PRO 111 Ca 0.19 -2.25 -0.32 0.00 -0.04 0.00 0.00 63.50 61.08 3duf n PRO 111 Cb 0.35 -3.07 -0.14 0.00 -0.04 0.00 0.00 33.50 30.61 3duf n PRO 111 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3duf s ILE 112 N 3.66 2.80 -0.14 0.52 1.01 -1.26 -3.74 121.20 124.05 3duf s ILE 112 Ca 0.52 -0.90 -0.00 0.00 0.00 0.00 0.00 60.65 60.27 3duf s ILE 112 Cb 0.14 -2.09 0.03 0.00 0.01 0.00 0.00 42.46 40.55 3duf s ILE 112 CO -0.02 0.53 -0.10 -0.89 0.00 0.00 0.00 174.94 174.47 3duf s THR 113 N -0.75 1.28 -0.23 2.92 2.01 -1.04 -1.52 115.64 118.30 3duf s THR 113 Ca 0.12 -0.51 -0.12 0.00 0.31 0.00 0.00 61.69 61.49 3duf s THR 113 Cb -0.10 -1.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.08 3duf s THR 113 CO 0.01 0.35 0.21 -0.63 -0.69 0.00 0.00 174.62 173.87 3duf s ILE 114 N 1.60 5.33 -0.10 1.82 -1.09 0.16 -3.17 121.20 125.75 3duf s ILE 114 Ca 0.04 0.28 -0.02 0.00 -2.23 0.00 0.00 60.65 58.72 3duf s ILE 114 Cb -0.13 -3.54 -0.03 0.00 -1.58 0.00 0.00 42.46 37.17 3duf s ILE 114 CO -0.09 0.33 -0.01 -0.13 -1.23 0.00 0.00 174.94 173.81 3duf s ARG 115 N 1.10 3.13 -0.29 2.79 0.52 -0.71 -0.21 118.95 125.29 3duf s ARG 115 Ca 0.10 -0.44 -0.16 0.00 -0.52 0.00 0.00 55.73 54.71 3duf s ARG 115 Cb -0.14 -2.81 0.12 0.00 0.52 0.00 0.00 34.95 32.64 3duf s ARG 115 CO 0.05 0.60 0.88 0.45 0.02 0.00 0.00 175.30 177.30 3duf s SER 116 N -0.60 -0.66 0.49 0.23 0.15 -0.88 -1.52 113.70 110.92 3duf s SER 116 Ca 0.10 1.05 -0.15 0.00 0.70 0.00 0.00 55.95 57.65 3duf s SER 116 Cb -0.12 1.27 -0.07 0.00 -1.71 0.00 0.00 66.02 65.38 3duf s SER 116 CO 0.02 -0.17 0.94 -2.16 1.20 0.00 0.00 173.24 173.08 3duf s PRO 117 N 1.42 3.90 0.24 5.44 0.04 -1.26 -1.90 135.00 142.89 3duf s PRO 117 Ca -0.09 0.85 -0.10 0.00 0.04 0.00 0.00 61.00 61.69 3duf s PRO 117 Cb -0.04 -2.19 0.04 0.00 0.04 0.00 0.00 34.50 32.35 3duf s PRO 117 CO -0.16 -0.23 0.53 1.97 0.04 0.00 0.00 177.00 179.15 3duf n PHE 118 N -1.56 -1.80 0.00 0.56 -1.74 -0.69 -1.78 117.46 110.46 3duf n PHE 118 Ca 0.06 -1.16 0.00 0.00 -0.56 0.00 0.00 57.45 55.78 3duf n PHE 118 Cb 0.54 0.58 0.00 0.00 1.52 0.00 0.00 39.48 42.12 3duf n PHE 118 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3duf n GLY 119 N -0.36 1.27 2.62 4.97 0.00 -0.62 -0.97 105.19 112.09 3duf n GLY 119 Ca -0.05 -1.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.02 3duf n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duf n GLY 120 N 1.26 3.11 0.00 -0.02 0.00 -1.25 -4.30 105.19 104.00 3duf n GLY 120 Ca 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.74 3duf n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duf n GLY 121 N 0.49 1.63 0.46 -0.02 0.00 -1.26 -4.65 105.19 101.83 3duf n GLY 121 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3duf n GLY 121 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3duf n VAL 122 N -1.01 0.00 -3.80 1.61 0.24 -1.26 -4.95 118.33 109.15 3duf n VAL 122 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.00 3duf n VAL 122 Cb 0.00 0.35 0.02 0.00 -1.47 0.00 0.00 33.84 32.74 3duf n VAL 122 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3duf n HIS 123 N 0.00 -1.78 -2.73 6.34 8.25 -1.26 -5.00 115.22 119.04 3duf n HIS 123 Ca 0.00 0.54 -0.23 0.00 -0.26 0.00 0.00 57.72 57.77 3duf n HIS 123 Cb 0.62 -3.53 0.03 0.00 1.12 0.00 0.00 29.99 28.22 3duf n HIS 123 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3duf s THR 124 N -3.65 3.35 1.10 1.59 -4.23 -1.26 -4.99 115.64 107.56 3duf s THR 124 Ca 0.29 -0.48 -0.16 0.00 -1.18 0.00 0.00 61.69 60.16 3duf s THR 124 Cb -0.11 -3.27 0.24 0.00 1.34 0.00 0.00 72.50 70.70 3duf s THR 124 CO 0.88 -0.21 1.12 -2.16 -0.54 0.00 0.00 174.62 173.71 3duf s PRO 125 N -4.73 -0.42 0.51 3.99 0.04 -1.26 -4.57 135.00 128.57 3duf s PRO 125 Ca 0.53 0.12 -0.22 0.00 0.04 0.00 0.00 61.00 61.47 3duf s PRO 125 Cb -0.10 -1.67 -0.07 0.00 0.04 0.00 0.00 34.50 32.69 3duf s PRO 125 CO 0.39 -3.21 1.09 -1.91 0.04 0.00 0.00 177.00 173.40 3duf n GLU 126 N -4.44 1.34 -1.78 4.56 2.13 -1.26 -3.24 120.64 117.95 3duf n GLU 126 Ca 0.10 0.49 -0.15 0.00 0.66 0.00 0.00 57.16 58.26 3duf n GLU 126 Cb 0.59 -2.24 -0.04 0.00 0.27 0.00 0.00 31.44 30.02 3duf n GLU 126 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3duf n LEU 127 N -0.27 -1.35 -0.05 4.31 4.77 -1.26 -4.89 117.00 118.26 3duf n LEU 127 Ca 0.11 0.23 -0.04 0.00 -0.03 0.00 0.00 56.01 56.28 3duf n LEU 127 Cb 0.43 -2.27 -0.09 0.00 -2.33 0.00 0.00 43.42 39.16 3duf n LEU 127 CO 0.54 -0.55 -0.84 1.41 -1.33 0.00 0.00 177.39 176.61 3duf n HIS 128 N -3.13 0.00 0.75 -1.77 8.25 -1.20 -3.97 115.22 114.16 3duf n HIS 128 Ca -0.17 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.39 3duf n HIS 128 Cb 0.56 -0.53 -0.12 0.00 1.12 0.00 0.00 29.99 31.02 3duf n HIS 128 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3duf n SER 129 N -2.35 0.83 -4.40 0.41 7.64 -1.26 -4.44 113.62 110.05 3duf n SER 129 Ca -0.16 -0.79 -0.45 0.00 1.01 0.00 0.00 58.87 58.48 3duf n SER 129 Cb 0.79 1.15 -0.02 0.00 -1.01 0.00 0.00 64.21 65.12 3duf n SER 129 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3duf n ASP 130 N -1.57 -1.32 -4.25 6.43 9.92 -1.26 -1.59 116.55 122.91 3duf n ASP 130 Ca 0.02 1.02 -0.40 0.00 -0.53 0.00 0.00 54.79 54.90 3duf n ASP 130 Cb 0.33 -1.00 -0.10 0.00 -0.64 0.00 0.00 41.12 39.72 3duf n ASP 130 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 3duf s SER 131 N -0.94 5.63 -0.13 -2.24 0.01 -1.26 -4.11 113.70 110.67 3duf s SER 131 Ca 0.62 -1.61 0.17 0.00 1.31 0.00 0.00 55.95 56.44 3duf s SER 131 Cb -0.77 -1.99 0.30 0.00 0.21 0.00 0.00 66.02 63.77 3duf s SER 131 CO 0.59 -0.57 1.17 0.18 0.41 0.00 0.00 173.24 175.02 3duf n LEU 132 N 4.90 2.52 0.28 2.44 4.77 -1.26 -4.65 117.00 126.00 3duf n LEU 132 Ca -0.09 -3.00 0.16 0.00 -0.03 0.00 0.00 56.01 53.05 3duf n LEU 132 Cb 0.42 -0.41 0.91 0.00 -2.33 0.00 0.00 43.42 42.01 3duf n LEU 132 CO 0.40 0.69 1.13 1.05 -1.33 0.00 0.00 177.39 179.33 3duf h GLU 133 N 0.24 0.00 -0.36 3.23 9.09 -1.97 -0.23 114.58 124.58 3duf h GLU 133 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 3duf h GLU 133 Cb 1.02 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.10 3duf h GLU 133 CO 0.03 0.00 0.20 0.78 0.05 0.00 0.00 179.01 180.07 3duf h GLY 134 N 0.00 0.53 0.65 1.06 0.00 -1.83 -2.04 103.07 101.44 3duf h GLY 134 Ca 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3duf h GLY 134 CO -0.00 0.21 -0.11 1.41 0.00 0.00 0.00 176.54 178.05 3duf h LEU 135 N 0.50 -0.27 0.00 3.11 3.38 -1.38 -3.07 115.31 117.58 3duf h LEU 135 Ca 0.13 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3duf h LEU 135 Cb 0.01 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3duf h LEU 135 CO -0.02 0.10 0.00 1.33 0.09 0.00 0.00 178.44 179.94 3duf n VAL 136 N -5.08 0.53 0.16 1.22 0.24 -1.12 -2.38 118.33 111.90 3duf n VAL 136 Ca -0.09 0.13 0.10 0.00 -2.04 0.00 0.00 64.34 62.44 3duf n VAL 136 Cb 0.25 -0.89 0.08 0.00 -1.47 0.00 0.00 33.84 31.80 3duf n VAL 136 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3duf h ALA 137 N 2.72 0.76 -0.01 2.33 0.00 -1.27 -3.28 119.26 120.51 3duf h ALA 137 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3duf h ALA 137 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3duf h ALA 137 CO 0.00 0.12 -0.02 1.04 0.00 0.00 0.00 179.25 180.39 3duf n GLN 138 N -2.94 1.20 -3.65 0.00 6.02 -1.00 -4.77 117.38 112.24 3duf n GLN 138 Ca 0.01 -0.41 -0.39 0.00 -0.01 0.00 0.00 57.00 56.21 3duf n GLN 138 Cb 0.58 -1.49 -0.12 0.00 1.02 0.00 0.00 30.24 30.23 3duf n GLN 138 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 3duf s GLN 139 N -2.08 3.34 0.53 -1.09 2.00 -1.24 -5.08 119.66 116.03 3duf s GLN 139 Ca 0.41 -0.72 -0.21 0.00 -2.00 0.00 0.00 55.36 52.84 3duf s GLN 139 Cb 0.21 -3.57 -0.06 0.00 0.80 0.00 0.00 33.01 30.39 3duf s GLN 139 CO 0.37 -0.42 1.20 -2.14 -0.50 0.00 0.00 175.29 173.80 3duf s PRO 140 N 1.62 3.34 0.00 1.67 0.02 -1.26 -3.23 135.00 137.15 3duf s PRO 140 Ca 0.05 1.81 0.00 0.00 0.02 0.00 0.00 61.00 62.88 3duf s PRO 140 Cb -0.17 -2.15 0.00 0.00 0.02 0.00 0.00 34.50 32.20 3duf s PRO 140 CO 0.06 -0.91 0.00 0.41 -0.33 0.00 0.00 177.00 176.24 3duf n GLY 141 N 0.44 0.62 3.36 0.52 0.00 -1.26 -4.76 105.19 104.11 3duf n GLY 141 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 3duf n GLY 141 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3duf s LEU 142 N 0.00 2.23 -0.09 0.99 1.43 -1.20 -4.38 118.68 117.67 3duf s LEU 142 Ca 0.00 -0.61 0.04 0.00 -1.03 0.00 0.00 54.13 52.54 3duf s LEU 142 Cb 0.00 -1.30 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 3duf s LEU 142 CO 0.00 0.24 -0.23 -0.54 0.23 0.00 0.00 176.35 176.05 3duf s LYS 143 N -1.41 2.84 -0.17 1.70 1.02 -1.10 -4.75 119.74 117.88 3duf s LYS 143 Ca 0.12 -0.85 -0.03 0.00 0.02 0.00 0.00 55.97 55.23 3duf s LYS 143 Cb -0.10 -2.21 -0.02 0.00 -0.52 0.00 0.00 37.83 34.98 3duf s LYS 143 CO 0.03 0.22 -0.05 0.08 -0.92 0.00 0.00 175.35 174.71 3duf s VAL 144 N 0.24 3.70 -0.06 3.17 1.01 -0.29 -0.23 120.40 127.95 3duf s VAL 144 Ca -0.15 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.46 3duf s VAL 144 Cb -0.17 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 3duf s VAL 144 CO 0.07 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.74 3duf s VAL 145 N 0.58 1.84 -0.34 2.92 1.01 -0.24 -2.10 120.40 124.08 3duf s VAL 145 Ca -0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 3duf s VAL 145 Cb -0.15 -1.56 0.13 0.00 0.00 0.00 0.00 36.38 34.80 3duf s VAL 145 CO 0.03 0.52 0.20 -0.63 0.00 0.00 0.00 175.10 175.21 3duf s ILE 146 N -0.05 0.06 0.76 2.22 1.01 -1.17 -1.44 121.20 122.59 3duf s ILE 146 Ca -0.05 -1.43 -0.11 0.00 0.00 0.00 0.00 60.65 59.06 3duf s ILE 146 Cb -0.13 -1.06 0.05 0.00 0.01 0.00 0.00 42.46 41.33 3duf s ILE 146 CO 0.04 -0.91 1.08 -2.16 0.00 0.00 0.00 174.94 172.99 3duf s PRO 147 N 1.35 2.37 0.00 2.79 0.04 -1.26 -4.30 135.00 136.00 3duf s PRO 147 Ca 0.16 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.20 3duf s PRO 147 Cb -0.21 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.41 3duf s PRO 147 CO -0.09 -1.51 0.09 -1.13 0.04 0.00 0.00 177.00 174.40 3duf n SER 148 N -3.41 0.18 -4.05 6.66 3.41 -1.26 -4.60 113.62 110.54 3duf n SER 148 Ca 0.08 -0.73 -0.11 0.00 -0.26 0.00 0.00 58.87 57.86 3duf n SER 148 Cb 0.54 0.08 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 3duf n SER 148 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3duf s THR 149 N -0.08 0.36 0.24 6.66 -4.23 -1.26 -5.01 115.64 112.31 3duf s THR 149 Ca 0.00 -1.18 -0.05 0.00 -1.18 0.00 0.00 61.69 59.28 3duf s THR 149 Cb 0.00 -0.69 0.20 0.00 1.34 0.00 0.00 72.50 73.35 3duf s THR 149 CO 0.00 -0.54 1.76 -0.65 -0.54 0.00 0.00 174.62 174.65 3duf h PRO 150 N 4.25 0.53 -0.73 3.99 0.11 -1.88 0.06 132.00 138.33 3duf h PRO 150 Ca -0.34 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.75 3duf h PRO 150 Cb 1.19 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 3duf h PRO 150 CO 0.46 0.35 0.48 -0.92 -0.21 0.00 0.00 178.00 178.16 3duf h TYR 151 N 0.55 0.91 -0.08 0.65 3.20 -1.92 -2.24 116.97 118.04 3duf h TYR 151 Ca 0.38 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 62.12 3duf h TYR 151 Cb 0.49 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3duf h TYR 151 CO -0.13 0.57 -0.65 -0.44 -1.64 0.00 0.00 178.16 175.87 3duf h ASP 152 N 0.98 0.35 -0.24 -2.11 3.32 -1.76 -2.75 116.42 114.22 3duf h ASP 152 Ca 0.27 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 3duf h ASP 152 Cb -0.10 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 3duf h ASP 152 CO -0.07 0.91 0.04 0.00 -1.72 0.00 0.00 179.24 178.40 3duf h ALA 153 N 1.09 0.32 -0.34 3.45 0.00 -0.71 0.13 119.26 123.21 3duf h ALA 153 Ca -0.01 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 3duf h ALA 153 Cb 1.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3duf h ALA 153 CO 0.11 -0.01 0.02 -0.22 0.00 0.00 0.00 179.25 179.14 3duf h LYS 154 N 0.20 0.58 -0.07 0.00 3.64 -1.47 -2.02 116.57 117.43 3duf h LYS 154 Ca 0.07 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 3duf h LYS 154 Cb 0.32 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3duf h LYS 154 CO 0.00 0.69 0.02 0.78 -2.27 0.00 0.00 179.45 178.67 3duf h GLY 155 N 0.39 0.12 2.00 5.01 0.00 -1.40 -2.93 103.07 106.26 3duf h GLY 155 Ca 0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 3duf h GLY 155 CO 0.01 0.07 -0.17 1.41 0.00 0.00 0.00 176.54 177.86 3duf h LEU 156 N -0.09 0.00 -0.01 3.11 3.38 -0.77 -2.99 115.31 117.94 3duf h LEU 156 Ca 0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 3duf h LEU 156 Cb 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3duf h LEU 156 CO -0.00 0.17 -0.67 0.25 0.09 0.00 0.00 178.44 178.28 3duf h LEU 157 N 0.00 0.00 -0.17 1.67 5.85 -1.27 -1.91 115.31 119.48 3duf h LEU 157 Ca -0.00 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.52 3duf h LEU 157 Cb 0.53 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 3duf h LEU 157 CO 0.02 0.67 -0.93 0.40 -0.34 0.00 0.00 178.44 178.27 3duf h ILE 158 N 0.00 1.63 -0.16 4.05 2.04 -1.40 -2.83 117.51 120.84 3duf h ILE 158 Ca -0.01 -3.07 -0.20 0.00 1.00 0.00 0.00 64.86 62.58 3duf h ILE 158 Cb 1.51 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 40.28 3duf h ILE 158 CO 0.09 0.88 -0.71 0.28 0.00 0.00 0.00 178.15 178.69 3duf h SER 159 N 0.02 0.81 -0.41 1.72 0.02 -1.51 -2.86 113.55 111.34 3duf h SER 159 Ca -0.02 -0.51 -0.06 0.00 -0.84 0.00 0.00 61.79 60.36 3duf h SER 159 Cb 1.62 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.91 3duf h SER 159 CO 0.13 1.29 0.02 0.00 -1.14 0.00 0.00 176.83 177.13 3duf h ALA 160 N 0.71 0.55 -0.34 3.77 0.00 -1.37 -1.41 119.26 121.17 3duf h ALA 160 Ca -0.03 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 3duf h ALA 160 Cb 1.31 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3duf h ALA 160 CO 0.14 0.31 -0.21 0.82 0.00 0.00 0.00 179.25 180.32 3duf h ILE 161 N 0.55 1.26 0.00 0.00 1.08 -1.55 -3.06 117.51 115.80 3duf h ILE 161 Ca 0.12 -1.27 -0.05 0.00 -0.39 0.00 0.00 64.86 63.27 3duf h ILE 161 Cb 0.45 1.23 -0.01 0.00 -3.07 0.00 0.00 36.82 35.42 3duf h ILE 161 CO 0.02 0.42 -0.25 0.03 -0.69 0.00 0.00 178.15 177.68 3duf h ARG 162 N 0.57 0.00 -6.56 2.37 3.08 -1.43 -3.45 114.38 108.96 3duf h ARG 162 Ca 0.09 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.61 3duf h ARG 162 Cb 0.67 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.76 3duf h ARG 162 CO 0.05 0.25 1.01 0.34 -1.07 0.00 0.00 179.97 180.54 3duf s ASP 163 N -6.32 6.49 -0.00 7.04 -1.08 -0.54 -4.87 116.67 117.39 3duf s ASP 163 Ca 0.05 2.69 0.00 0.00 -0.52 0.00 0.00 52.55 54.78 3duf s ASP 163 Cb 0.06 -2.58 0.02 0.00 -1.46 0.00 0.00 42.92 38.96 3duf s ASP 163 CO 0.70 -0.93 0.70 0.59 0.52 0.00 0.00 175.17 176.76 3duf n ASN 164 N 4.82 0.77 -4.45 -0.34 3.02 -1.26 -4.63 115.26 113.19 3duf n ASN 164 Ca 0.16 -2.02 -0.22 0.00 -0.03 0.00 0.00 54.58 52.47 3duf n ASN 164 Cb 0.38 -0.33 -0.10 0.00 -0.61 0.00 0.00 39.78 39.11 3duf n ASN 164 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3duf s ASP 165 N -0.36 2.81 0.34 6.41 1.01 -1.25 -3.48 116.67 122.15 3duf s ASP 165 Ca 0.01 -1.23 -0.28 0.00 0.71 0.00 0.00 52.55 51.76 3duf s ASP 165 Cb 0.01 -0.18 -0.10 0.00 1.01 0.00 0.00 42.92 43.67 3duf s ASP 165 CO 0.01 -0.39 1.26 -2.16 0.21 0.00 0.00 175.17 174.09 3duf s PRO 166 N -3.75 4.30 -0.02 8.23 0.04 -0.96 -4.07 135.00 138.77 3duf s PRO 166 Ca 0.31 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.45 3duf s PRO 166 Cb 0.05 -2.98 0.02 0.00 0.04 0.00 0.00 34.50 31.62 3duf s PRO 166 CO 0.13 -0.19 -0.00 0.08 0.04 0.00 0.00 177.00 177.06 3duf s VAL 167 N -1.20 0.12 -0.41 -0.36 1.01 -0.58 -2.70 120.40 116.28 3duf s VAL 167 Ca 0.51 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 62.41 3duf s VAL 167 Cb -0.37 -0.19 0.04 0.00 0.00 0.00 0.00 36.38 35.86 3duf s VAL 167 CO 0.48 0.10 0.28 -0.63 0.00 0.00 0.00 175.10 175.34 3duf s ILE 168 N 0.67 4.89 -0.46 2.22 1.01 0.68 -0.66 121.20 129.55 3duf s ILE 168 Ca -0.06 -0.91 -0.16 0.00 0.00 0.00 0.00 60.65 59.52 3duf s ILE 168 Cb -0.09 -3.80 0.05 0.00 0.01 0.00 0.00 42.46 38.64 3duf s ILE 168 CO -0.01 -0.36 0.39 0.12 0.00 0.00 0.00 174.94 175.07 3duf s PHE 169 N 1.60 3.22 -0.22 3.97 5.36 0.71 -1.08 117.98 131.55 3duf s PHE 169 Ca 0.03 -0.77 -0.11 0.00 -0.96 0.00 0.00 56.93 55.12 3duf s PHE 169 Cb -0.21 -3.03 -0.05 0.00 -0.34 0.00 0.00 43.02 39.39 3duf s PHE 169 CO 0.07 -0.76 0.18 -0.51 -1.46 0.00 0.00 175.22 172.74 3duf s LEU 170 N 1.77 4.16 -0.23 6.12 1.43 -0.52 -2.08 118.68 129.33 3duf s LEU 170 Ca 0.06 0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 53.33 3duf s LEU 170 Cb -0.22 -2.15 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 3duf s LEU 170 CO 0.08 0.09 -0.04 -1.61 0.23 0.00 0.00 176.35 175.11 3duf s GLU 171 N 0.81 3.33 -0.03 1.70 2.02 -0.80 -4.13 118.70 121.59 3duf s GLU 171 Ca 0.09 -0.66 -0.30 0.00 0.02 0.00 0.00 54.97 54.12 3duf s GLU 171 Cb -0.13 -3.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.04 3duf s GLU 171 CO 0.03 -0.22 1.27 -1.58 0.02 0.00 0.00 175.26 174.77 3duf s HIS 172 N 1.47 3.08 0.25 1.61 2.46 -1.26 -1.70 115.29 121.21 3duf s HIS 172 Ca 0.05 1.09 -0.03 0.00 0.47 0.00 0.00 55.06 56.64 3duf s HIS 172 Cb -0.14 -3.50 0.47 0.00 -0.13 0.00 0.00 32.58 29.27 3duf s HIS 172 CO -0.03 -1.69 1.75 -0.07 -2.47 0.00 0.00 174.74 172.23 3duf h LEU 173 N 8.22 0.42 -1.54 8.88 3.38 -1.33 -1.48 115.31 131.86 3duf h LEU 173 Ca -0.35 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3duf h LEU 173 Cb 1.17 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 3duf h LEU 173 CO 0.89 0.18 -0.14 0.50 0.09 0.00 0.00 178.44 179.97 3duf h LYS 174 N 0.55 0.00 -0.06 1.13 3.64 -1.82 -2.98 116.57 117.03 3duf h LYS 174 Ca 0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 3duf h LYS 174 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3duf h LYS 174 CO -0.36 0.14 0.00 1.28 -2.27 0.00 0.00 179.45 178.24 3duf n LEU 175 N -3.39 2.68 -0.12 5.20 4.77 -0.58 -4.14 117.00 121.42 3duf n LEU 175 Ca -0.01 -0.93 -0.05 0.00 -0.03 0.00 0.00 56.01 55.00 3duf n LEU 175 Cb 0.33 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 3duf n LEU 175 CO 0.30 0.46 0.92 1.88 -1.33 0.00 0.00 177.39 179.62 3duf h TYR 176 N 4.10 0.16 -0.30 -1.77 0.05 -1.34 -3.34 116.97 114.53 3duf h TYR 176 Ca 0.00 0.02 -0.22 0.00 0.05 0.00 0.00 58.73 58.58 3duf h TYR 176 Cb 0.88 -0.01 -0.36 0.00 1.01 0.00 0.00 36.73 38.24 3duf h TYR 176 CO 0.03 0.04 -0.99 2.89 -1.05 0.00 0.00 178.16 179.07 3duf n ARG 177 N -5.07 1.36 0.07 4.88 1.85 -1.26 -1.69 116.66 116.80 3duf n ARG 177 Ca 0.03 -2.94 -0.11 0.00 -1.00 0.00 0.00 57.85 53.83 3duf n ARG 177 Cb 0.17 -1.06 -0.13 0.00 -1.05 0.00 0.00 32.46 30.39 3duf n ARG 177 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3duf h SER 178 N 2.10 0.17 -5.15 2.89 4.64 -1.72 -3.48 113.55 112.99 3duf h SER 178 Ca -0.20 -0.18 -0.06 0.00 -0.47 0.00 0.00 61.79 60.88 3duf h SER 178 Cb 1.38 -0.05 -0.11 0.00 -0.31 0.00 0.00 62.40 63.30 3duf h SER 178 CO 0.11 1.14 -0.12 0.72 -0.87 0.00 0.00 176.83 177.81 3duf s PHE 179 N -2.68 0.06 0.00 4.77 -0.71 -1.26 -5.14 117.98 113.02 3duf s PHE 179 Ca -0.01 -0.42 0.05 0.00 -1.04 0.00 0.00 56.93 55.51 3duf s PHE 179 Cb 0.09 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 42.06 3duf s PHE 179 CO 0.84 -0.80 -0.14 -0.98 -1.34 0.00 0.00 175.22 172.80 3duf s ARG 180 N -3.90 2.31 0.09 1.99 1.70 -1.26 -4.30 118.95 115.58 3duf s ARG 180 Ca 0.11 -0.84 0.03 0.00 -0.47 0.00 0.00 55.73 54.56 3duf s ARG 180 Cb 0.01 -2.31 -0.04 0.00 -0.57 0.00 0.00 34.95 32.04 3duf s ARG 180 CO -0.03 0.58 -0.08 -1.14 -1.08 0.00 0.00 175.30 173.54 3duf s GLN 181 N -1.21 0.79 -0.03 3.89 0.74 -0.51 -4.88 119.66 118.46 3duf s GLN 181 Ca 0.14 -1.18 -0.30 0.00 0.05 0.00 0.00 55.36 54.07 3duf s GLN 181 Cb -0.11 -0.35 -0.03 0.00 1.10 0.00 0.00 33.01 33.62 3duf s GLN 181 CO 0.04 0.03 1.12 -2.00 -0.55 0.00 0.00 175.29 173.93 3duf s GLU 182 N -3.08 4.43 -0.06 1.67 2.56 -1.26 -0.78 118.70 122.17 3duf s GLU 182 Ca 0.06 1.59 0.01 0.00 0.00 0.00 0.00 54.97 56.63 3duf s GLU 182 Cb -0.00 -3.48 0.02 0.00 2.00 0.00 0.00 34.13 32.66 3duf s GLU 182 CO -0.02 -0.30 -0.07 0.08 -0.56 0.00 0.00 175.26 174.40 3duf s VAL 183 N 1.65 0.76 0.72 3.70 1.01 -0.15 -4.78 120.40 123.30 3duf s VAL 183 Ca 0.54 -0.22 -0.16 0.00 0.00 0.00 0.00 61.98 62.14 3duf s VAL 183 Cb -0.24 -0.76 0.03 0.00 0.00 0.00 0.00 36.38 35.41 3duf s VAL 183 CO 0.24 0.29 1.25 -2.84 0.00 0.00 0.00 175.10 174.04 3duf s PRO 184 N 1.08 2.15 0.38 2.72 0.02 -1.26 -2.20 135.00 137.88 3duf s PRO 184 Ca -0.08 1.93 -0.00 0.00 0.02 0.00 0.00 61.00 62.86 3duf s PRO 184 Cb -0.14 -1.81 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 3duf s PRO 184 CO -0.01 -1.87 0.60 -1.21 -0.33 0.00 0.00 177.00 174.18 3duf s GLU 185 N -3.71 3.46 0.00 5.54 8.01 -1.26 -4.88 118.70 125.86 3duf s GLU 185 Ca 0.78 -0.26 0.00 0.00 0.01 0.00 0.00 54.97 55.50 3duf s GLU 185 Cb -0.34 -2.61 0.00 0.00 -4.31 0.00 0.00 34.13 26.88 3duf s GLU 185 CO 0.44 0.06 0.00 0.41 0.01 0.00 0.00 175.26 176.18 3duf n GLY 186 N -1.89 -0.69 3.81 -1.39 0.00 -1.26 -4.94 105.19 98.84 3duf n GLY 186 Ca -0.03 -1.73 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 3duf n GLY 186 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3duf s GLU 187 N -1.17 4.27 -0.11 1.61 4.04 -1.26 -5.06 118.70 121.02 3duf s GLU 187 Ca 0.00 0.96 -0.30 0.00 0.04 0.00 0.00 54.97 55.67 3duf s GLU 187 Cb 0.00 -2.69 0.12 0.00 0.02 0.00 0.00 34.13 31.58 3duf s GLU 187 CO 0.00 0.27 0.95 1.52 -1.84 0.00 0.00 175.26 176.15 3duf s TYR 188 N -1.72 -0.39 0.09 4.83 -0.85 -1.26 -5.19 117.35 112.86 3duf s TYR 188 Ca 0.49 0.57 0.06 0.00 -0.52 0.00 0.00 57.07 57.67 3duf s TYR 188 Cb -0.15 0.47 -0.03 0.00 0.38 0.00 0.00 41.96 42.63 3duf s TYR 188 CO 0.20 -0.41 -0.17 0.95 -1.52 0.00 0.00 175.55 174.60 3duf s THR 189 N -1.62 1.36 -0.08 -3.49 -4.23 -1.26 -4.60 115.64 101.71 3duf s THR 189 Ca -0.01 -1.45 0.05 0.00 -1.18 0.00 0.00 61.69 59.10 3duf s THR 189 Cb -0.01 -1.31 -0.01 0.00 1.34 0.00 0.00 72.50 72.51 3duf s THR 189 CO -0.00 -0.20 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.02 3duf s ILE 190 N -1.37 2.15 0.28 2.99 1.01 -1.14 -4.98 121.20 120.13 3duf s ILE 190 Ca 0.03 -1.01 -0.30 0.00 0.00 0.00 0.00 60.65 59.37 3duf s ILE 190 Cb -0.09 -1.80 -0.11 0.00 0.01 0.00 0.00 42.46 40.47 3duf s ILE 190 CO 0.03 0.56 1.48 -2.84 0.00 0.00 0.00 174.94 174.18 3duf s PRO 191 N 0.08 4.21 0.10 2.79 0.02 -1.26 -4.54 135.00 136.39 3duf s PRO 191 Ca -0.10 2.40 -0.30 0.00 0.02 0.00 0.00 61.00 63.02 3duf s PRO 191 Cb -0.16 -3.07 -0.06 0.00 0.02 0.00 0.00 34.50 31.24 3duf s PRO 191 CO 0.06 -0.48 1.12 0.42 -0.33 0.00 0.00 177.00 177.79 3duf s ILE 192 N -0.18 4.13 0.00 2.83 -1.09 -1.26 -3.08 121.20 122.55 3duf s ILE 192 Ca 0.59 1.64 0.00 0.00 -2.23 0.00 0.00 60.65 60.65 3duf s ILE 192 Cb -0.44 -4.05 0.00 0.00 -1.58 0.00 0.00 42.46 36.39 3duf s ILE 192 CO 0.47 0.19 0.00 0.61 -1.23 0.00 0.00 174.94 174.98 3duf n GLY 193 N 2.68 0.81 3.29 6.18 0.00 -1.26 -5.01 105.19 111.88 3duf n GLY 193 Ca 0.06 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3duf n GLY 193 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3duf s LYS 194 N -0.65 3.31 0.69 1.61 2.47 -1.18 -4.10 119.74 121.89 3duf s LYS 194 Ca 0.00 -0.67 -0.01 0.00 -1.56 0.00 0.00 55.97 53.73 3duf s LYS 194 Cb 0.00 -2.87 0.10 0.00 -1.46 0.00 0.00 37.83 33.60 3duf s LYS 194 CO 0.00 -0.13 0.96 0.00 0.16 0.00 0.00 175.35 176.33 3duf s ALA 195 N 1.26 3.64 0.01 3.13 0.00 -1.25 -4.65 121.76 123.91 3duf s ALA 195 Ca 0.03 -1.53 -0.07 0.00 0.00 0.00 0.00 51.96 50.38 3duf s ALA 195 Cb -0.14 -2.11 -0.00 0.00 0.00 0.00 0.00 23.12 20.87 3duf s ALA 195 CO -0.04 -1.31 0.14 0.16 0.00 0.00 0.00 175.76 174.71 3duf s ASP 196 N -4.65 0.05 -0.25 0.00 -4.77 -0.85 -5.01 116.67 101.20 3duf s ASP 196 Ca 0.64 -0.29 -0.28 0.00 -3.30 0.00 0.00 52.55 49.32 3duf s ASP 196 Cb -0.07 0.22 0.01 0.00 -1.09 0.00 0.00 42.92 41.99 3duf s ASP 196 CO 0.43 -0.42 0.99 -0.63 0.70 0.00 0.00 175.17 176.24 3duf s ILE 197 N -1.78 4.69 -0.39 2.11 -1.09 -1.26 -1.65 121.20 121.83 3duf s ILE 197 Ca -0.12 1.88 0.23 0.00 -2.23 0.00 0.00 60.65 60.40 3duf s ILE 197 Cb -0.06 -4.28 -0.14 0.00 -1.58 0.00 0.00 42.46 36.41 3duf s ILE 197 CO -0.00 -0.20 0.90 0.29 -1.23 0.00 0.00 174.94 174.70 3duf n LYS 198 N 6.32 0.45 -3.63 2.79 4.76 0.02 -4.88 118.16 124.00 3duf n LYS 198 Ca 0.10 -0.02 -0.03 0.00 -2.87 0.00 0.00 58.31 55.50 3duf n LYS 198 Cb 0.46 -1.63 -0.05 0.00 -1.84 0.00 0.00 35.03 31.97 3duf n LYS 198 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3duf s ARG 199 N -3.31 0.59 0.43 1.97 3.52 -1.14 -4.95 118.95 116.06 3duf s ARG 199 Ca -0.00 1.28 -0.24 0.00 -0.13 0.00 0.00 55.73 56.65 3duf s ARG 199 Cb 0.13 0.56 -0.08 0.00 -1.56 0.00 0.00 34.95 34.00 3duf s ARG 199 CO 0.83 -0.17 1.14 -2.00 -0.81 0.00 0.00 175.30 174.28 3duf s GLU 200 N 2.37 3.92 0.35 5.12 2.56 -1.26 -1.30 118.70 130.46 3duf s GLU 200 Ca -0.07 1.72 -0.15 0.00 0.00 0.00 0.00 54.97 56.48 3duf s GLU 200 Cb -0.09 -2.50 0.04 0.00 2.00 0.00 0.00 34.13 33.58 3duf s GLU 200 CO -0.19 -0.40 0.71 0.20 -0.56 0.00 0.00 175.26 175.02 3duf s GLY 201 N -1.36 0.45 0.00 -1.50 0.00 -1.26 -4.54 107.32 99.11 3duf s GLY 201 Ca 0.61 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 44.54 3duf s GLY 201 CO 0.34 -0.39 0.00 0.58 0.00 0.00 0.00 173.10 173.63 3duf n LYS 202 N -0.51 0.47 -0.12 2.90 2.85 -0.85 -4.72 118.16 118.18 3duf n LYS 202 Ca -0.06 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.03 3duf n LYS 202 Cb 0.60 -0.04 -0.11 0.00 -0.65 0.00 0.00 35.03 34.83 3duf n LYS 202 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3duf n ASP 203 N 0.00 2.09 -3.84 -5.58 8.00 -0.39 -4.48 116.55 112.35 3duf n ASP 203 Ca 0.00 -0.11 -0.12 0.00 0.71 0.00 0.00 54.79 55.27 3duf n ASP 203 Cb 0.00 -0.40 -0.11 0.00 -0.02 0.00 0.00 41.12 40.59 3duf n ASP 203 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3duf s ILE 204 N -2.49 0.05 -0.15 0.53 2.07 -1.22 -4.34 121.20 115.65 3duf s ILE 204 Ca -0.33 -0.39 -0.05 0.00 -1.41 0.00 0.00 60.65 58.47 3duf s ILE 204 Cb 0.09 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.28 3duf s ILE 204 CO 0.56 -0.22 0.02 -0.89 -1.91 0.00 0.00 174.94 172.50 3duf s THR 205 N -0.76 4.42 -0.29 4.00 2.01 -0.43 -0.17 115.64 124.42 3duf s THR 205 Ca -0.08 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 61.74 3duf s THR 205 Cb -0.05 -2.95 0.06 0.00 0.01 0.00 0.00 72.50 69.57 3duf s THR 205 CO 0.01 0.51 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.79 3duf s ILE 206 N 0.04 2.66 -0.19 1.82 1.01 0.40 -0.59 121.20 126.35 3duf s ILE 206 Ca 0.03 -1.54 -0.18 0.00 0.00 0.00 0.00 60.65 58.96 3duf s ILE 206 Cb -0.13 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 3duf s ILE 206 CO 0.02 -0.12 0.49 -0.63 0.00 0.00 0.00 174.94 174.70 3duf s ILE 207 N 1.18 5.13 0.33 2.92 -1.09 0.26 -1.47 121.20 128.45 3duf s ILE 207 Ca -0.06 0.90 -0.08 0.00 -2.23 0.00 0.00 60.65 59.18 3duf s ILE 207 Cb -0.20 -3.81 0.01 0.00 -1.58 0.00 0.00 42.46 36.88 3duf s ILE 207 CO -0.03 0.21 0.55 0.00 -1.23 0.00 0.00 174.94 174.44 3duf s ALA 208 N 1.48 0.13 0.00 9.38 0.00 -0.74 -0.38 121.76 131.63 3duf s ALA 208 Ca 0.23 -1.16 -0.28 0.00 0.00 0.00 0.00 51.96 50.75 3duf s ALA 208 Cb -0.15 1.02 0.08 0.00 0.00 0.00 0.00 23.12 24.07 3duf s ALA 208 CO 0.09 -0.86 0.74 1.52 0.00 0.00 0.00 175.76 177.25 3duf s TYR 209 N -3.14 -0.53 0.00 0.00 1.13 -1.26 -1.28 117.35 112.26 3duf s TYR 209 Ca 0.25 0.68 0.00 0.00 -1.41 0.00 0.00 57.07 56.59 3duf s TYR 209 Cb -0.02 0.48 0.00 0.00 -1.10 0.00 0.00 41.96 41.32 3duf s TYR 209 CO 0.15 -0.63 0.00 0.41 -2.51 0.00 0.00 175.55 172.97 3duf n GLY 210 N 0.33 0.18 0.07 5.49 0.00 -1.26 -3.30 105.19 106.70 3duf n GLY 210 Ca -0.16 -0.97 0.09 0.00 0.00 0.00 0.00 46.02 44.98 3duf n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3duf n ALA 211 N 7.02 1.61 0.49 4.61 0.00 -1.26 -2.52 120.51 130.46 3duf n ALA 211 Ca 0.00 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.59 3duf n ALA 211 Cb 0.00 -1.30 0.35 0.00 0.00 0.00 0.00 19.45 18.50 3duf n ALA 211 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3duf h MET 212 N 0.00 0.00 -0.46 0.00 2.07 -1.94 -3.11 114.93 111.49 3duf h MET 212 Ca 0.00 0.00 -0.10 0.00 -2.07 0.00 0.00 59.70 57.53 3duf h MET 212 Cb 0.29 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.00 3duf h MET 212 CO 0.00 0.00 -0.13 0.28 1.07 0.00 0.00 176.91 178.13 3duf h VAL 213 N 0.00 1.26 -0.33 -2.22 2.07 -1.67 0.24 116.25 115.61 3duf h VAL 213 Ca 0.00 -1.23 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 3duf h VAL 213 Cb 0.78 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3duf h VAL 213 CO 0.00 0.42 -0.08 -0.74 0.02 0.00 0.00 177.57 177.19 3duf h HIS 214 N 0.76 0.71 -0.53 1.57 -0.00 -1.74 0.13 115.15 116.06 3duf h HIS 214 Ca 0.12 -0.15 -0.05 0.00 -0.00 0.00 0.00 60.37 60.29 3duf h HIS 214 Cb 0.64 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.85 3duf h HIS 214 CO 0.04 0.81 0.12 0.93 -0.00 0.00 0.00 177.93 179.82 3duf h GLU 215 N 0.42 0.81 -0.16 5.26 4.39 -1.43 -0.93 114.58 122.92 3duf h GLU 215 Ca 0.08 -0.16 -0.18 0.00 0.34 0.00 0.00 59.36 59.43 3duf h GLU 215 Cb 0.58 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.10 3duf h GLU 215 CO 0.03 0.73 -0.65 0.77 -1.16 0.00 0.00 179.01 178.74 3duf h SER 216 N 0.78 0.71 -0.18 1.42 0.02 -0.27 -1.03 113.55 115.00 3duf h SER 216 Ca 0.17 -0.42 -0.12 0.00 -0.84 0.00 0.00 61.79 60.58 3duf h SER 216 Cb 0.30 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 3duf h SER 216 CO -0.00 1.17 -0.30 -0.07 -1.14 0.00 0.00 176.83 176.49 3duf h LEU 217 N 0.45 0.69 -1.18 5.07 3.38 -0.46 -1.72 115.31 121.54 3duf h LEU 217 Ca -0.02 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 3duf h LEU 217 Cb 1.23 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3duf h LEU 217 CO 0.12 0.95 -0.40 0.50 0.09 0.00 0.00 178.44 179.71 3duf h LYS 218 N 0.57 0.00 -0.03 1.13 3.64 -1.07 -2.21 116.57 118.60 3duf h LYS 218 Ca 0.07 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.26 3duf h LYS 218 Cb 0.81 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 3duf h LYS 218 CO 0.07 0.40 -0.81 0.00 -2.27 0.00 0.00 179.45 176.84 3duf h ALA 219 N 1.60 0.56 -0.76 5.00 0.00 -0.84 -3.22 119.26 121.60 3duf h ALA 219 Ca -0.00 -0.66 -0.06 0.00 0.00 0.00 0.00 54.91 54.19 3duf h ALA 219 Cb 0.74 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3duf h ALA 219 CO 0.05 0.82 0.24 0.00 0.00 0.00 0.00 179.25 180.37 3duf h ALA 220 N 0.95 0.99 -0.23 0.00 0.00 -0.71 -1.73 119.26 118.52 3duf h ALA 220 Ca -0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3duf h ALA 220 Cb 1.41 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3duf h ALA 220 CO 0.13 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 180.02 3duf h ALA 221 N 1.13 1.53 0.00 0.00 0.00 -1.50 -0.04 119.26 120.38 3duf h ALA 221 Ca 0.24 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3duf h ALA 221 Cb 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3duf h ALA 221 CO -0.01 0.34 -0.43 0.93 0.00 0.00 0.00 179.25 180.08 3duf h GLU 222 N 0.34 0.00 0.07 0.00 4.39 -1.47 -3.23 114.58 114.68 3duf h GLU 222 Ca 0.08 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.52 3duf h GLU 222 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3duf h GLU 222 CO 0.01 0.43 -1.23 -0.07 -1.16 0.00 0.00 179.01 176.99 3duf h LEU 223 N 0.00 0.22 -2.12 1.33 3.38 -0.44 -3.23 115.31 114.45 3duf h LEU 223 Ca -0.00 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3duf h LEU 223 Cb 1.24 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 3duf h LEU 223 CO 0.06 1.21 -0.07 -0.08 0.09 0.00 0.00 178.44 179.64 3duf h GLU 224 N 0.04 0.00 0.00 1.13 4.57 -0.90 -1.19 114.58 118.23 3duf h GLU 224 Ca -0.11 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.97 3duf h GLU 224 Cb 1.90 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.48 3duf h GLU 224 CO 0.16 0.07 -0.46 0.87 -1.18 0.00 0.00 179.01 178.47 3duf h LYS 225 N 0.00 0.00 -0.70 1.92 1.57 -1.59 -3.10 116.57 114.68 3duf h LYS 225 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3duf h LYS 225 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3duf h LYS 225 CO 0.01 0.46 0.00 0.39 -0.57 0.00 0.00 179.45 179.74 3duf n GLU 226 N -3.47 2.84 0.00 3.15 1.02 -0.54 -4.96 120.64 118.70 3duf n GLU 226 Ca 0.00 -2.64 0.00 0.00 -0.02 0.00 0.00 57.16 54.50 3duf n GLU 226 Cb 0.60 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 3duf n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3duf n GLY 227 N 1.51 1.53 3.69 0.62 0.00 -1.02 -5.05 105.19 106.47 3duf n GLY 227 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 3duf n GLY 227 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3duf s ILE 228 N -2.32 4.87 -0.67 -0.61 1.09 -0.69 -4.95 121.20 117.91 3duf s ILE 228 Ca 0.00 1.79 -0.13 0.00 -1.10 0.00 0.00 60.65 61.21 3duf s ILE 228 Cb 0.00 -4.20 0.17 0.00 -1.06 0.00 0.00 42.46 37.37 3duf s ILE 228 CO 0.00 0.06 0.59 -0.55 -0.10 0.00 0.00 174.94 174.94 3duf s SER 229 N 1.07 6.27 0.01 3.58 0.15 -1.26 -2.89 113.70 120.64 3duf s SER 229 Ca 0.43 -2.34 -0.26 0.00 0.70 0.00 0.00 55.95 54.48 3duf s SER 229 Cb -0.18 -2.14 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 3duf s SER 229 CO 0.16 -0.65 0.81 0.00 1.20 0.00 0.00 173.24 174.77 3duf s ALA 230 N 0.73 3.30 -0.18 5.45 0.00 -1.26 -1.26 121.76 128.54 3duf s ALA 230 Ca 0.12 0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.31 3duf s ALA 230 Cb -0.19 -3.09 -0.05 0.00 0.00 0.00 0.00 23.12 19.79 3duf s ALA 230 CO -0.04 -0.05 0.15 -2.00 0.00 0.00 0.00 175.76 173.82 3duf s GLU 231 N 0.41 4.06 -0.17 0.00 2.12 0.76 -4.28 118.70 121.59 3duf s GLU 231 Ca 0.42 -0.17 -0.03 0.00 0.36 0.00 0.00 54.97 55.55 3duf s GLU 231 Cb -0.20 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 3duf s GLU 231 CO 0.23 0.39 -0.05 0.08 -0.54 0.00 0.00 175.26 175.37 3duf s VAL 232 N 0.10 3.59 -0.15 3.70 1.01 -0.42 -0.45 120.40 127.78 3duf s VAL 232 Ca 0.10 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.65 3duf s VAL 232 Cb -0.11 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.70 3duf s VAL 232 CO -0.00 0.47 -0.20 0.54 0.00 0.00 0.00 175.10 175.91 3duf s VAL 233 N 0.75 1.96 -0.29 2.92 0.11 -0.54 -0.80 120.40 124.50 3duf s VAL 233 Ca -0.02 -0.90 -0.16 0.00 -2.93 0.00 0.00 61.98 57.97 3duf s VAL 233 Cb -0.15 -1.76 -0.02 0.00 -1.53 0.00 0.00 36.38 32.92 3duf s VAL 233 CO 0.02 0.53 0.44 -0.62 -3.33 0.00 0.00 175.10 172.13 3duf s ASP 234 N 1.08 6.30 0.12 3.54 2.15 -0.66 -1.80 116.67 127.41 3duf s ASP 234 Ca -0.01 0.22 -0.22 0.00 0.43 0.00 0.00 52.55 52.97 3duf s ASP 234 Cb -0.14 -2.24 -0.05 0.00 -0.30 0.00 0.00 42.92 40.19 3duf s ASP 234 CO -0.07 -0.29 1.68 -0.07 -0.17 0.00 0.00 175.17 176.25 3duf h LEU 235 N 8.77 -0.35 0.00 -1.34 3.38 -1.50 -2.26 115.31 122.01 3duf h LEU 235 Ca -0.30 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3duf h LEU 235 Cb 1.15 0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3duf h LEU 235 CO 0.69 -0.16 0.00 0.54 0.09 0.00 0.00 178.44 179.61 3duf n ARG 236 N -5.25 0.00 -3.43 1.13 1.74 -1.26 -3.75 116.66 105.83 3duf n ARG 236 Ca -0.04 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.89 3duf n ARG 236 Cb 0.17 -3.26 -0.11 0.00 -1.02 0.00 0.00 32.46 28.25 3duf n ARG 236 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3duf s THR 237 N -0.60 -0.42 -2.06 0.55 2.01 -1.26 -3.04 115.64 110.81 3duf s THR 237 Ca 0.00 -0.20 0.12 0.00 0.31 0.00 0.00 61.69 61.92 3duf s THR 237 Cb 0.00 -0.80 0.30 0.00 0.01 0.00 0.00 72.50 72.01 3duf s THR 237 CO 0.00 -0.25 1.33 1.33 -0.69 0.00 0.00 174.62 176.34 3duf n VAL 238 N 5.33 0.22 -3.15 3.82 0.24 -0.89 -4.17 118.33 119.73 3duf n VAL 238 Ca -0.04 -0.25 0.05 0.00 -2.04 0.00 0.00 64.34 62.06 3duf n VAL 238 Cb 0.49 0.13 -0.00 0.00 -1.47 0.00 0.00 33.84 32.98 3duf n VAL 238 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3duf s GLN 239 N -1.78 0.18 0.67 7.34 2.00 -1.21 -4.50 119.66 122.36 3duf s GLN 239 Ca 0.20 0.21 -0.12 0.00 -2.00 0.00 0.00 55.36 53.65 3duf s GLN 239 Cb 0.10 0.10 -0.01 0.00 0.80 0.00 0.00 33.01 34.01 3duf s GLN 239 CO 0.15 -0.31 1.05 -1.25 -0.50 0.00 0.00 175.29 174.44 3duf s PRO 240 N 2.95 3.10 0.33 1.67 0.04 -1.26 -1.14 135.00 140.68 3duf s PRO 240 Ca 0.21 0.97 -0.12 0.00 0.04 0.00 0.00 61.00 62.10 3duf s PRO 240 Cb -0.04 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 3duf s PRO 240 CO -0.21 -0.97 0.70 -0.51 0.04 0.00 0.00 177.00 176.05 3duf s LEU 241 N -5.29 4.01 -1.16 -3.56 1.43 -1.26 -4.56 118.68 108.29 3duf s LEU 241 Ca 0.59 1.14 -0.15 0.00 -1.03 0.00 0.00 54.13 54.67 3duf s LEU 241 Cb -0.14 -3.96 0.15 0.00 0.03 0.00 0.00 46.19 42.27 3duf s LEU 241 CO 0.51 -0.24 1.41 -0.62 0.23 0.00 0.00 176.35 177.64 3duf s ASP 242 N -2.60 6.95 0.33 2.29 -1.08 -1.26 -4.83 116.67 116.46 3duf s ASP 242 Ca 0.52 -2.71 0.02 0.00 -0.52 0.00 0.00 52.55 49.85 3duf s ASP 242 Cb -0.10 -2.43 0.56 0.00 -1.46 0.00 0.00 42.92 39.49 3duf s ASP 242 CO 0.23 -0.88 1.92 0.40 0.52 0.00 0.00 175.17 177.36 3duf h ILE 243 N 5.05 1.19 -0.64 4.11 1.08 -1.95 -2.25 117.51 124.10 3duf h ILE 243 Ca 0.30 -0.58 -0.07 0.00 -0.39 0.00 0.00 64.86 64.12 3duf h ILE 243 Cb 0.91 0.55 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 3duf h ILE 243 CO 1.25 0.23 0.12 -0.33 -0.69 0.00 0.00 178.15 178.73 3duf h GLU 244 N 0.75 1.06 -0.01 2.37 5.08 -1.98 -0.63 114.58 121.22 3duf h GLU 244 Ca 0.18 -0.27 -0.23 0.00 -1.00 0.00 0.00 59.36 58.03 3duf h GLU 244 Cb 0.13 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.27 3duf h GLU 244 CO -0.02 0.97 -0.90 1.15 -1.00 0.00 0.00 179.01 179.21 3duf h THR 245 N 0.97 1.32 -0.35 1.13 2.02 -1.94 -2.38 112.91 113.68 3duf h THR 245 Ca 0.20 -2.18 -0.05 0.00 0.77 0.00 0.00 66.41 65.15 3duf h THR 245 Cb 0.41 2.43 -0.01 0.00 -1.74 0.00 0.00 68.15 69.24 3duf h THR 245 CO 0.01 0.66 0.04 0.40 0.37 0.00 0.00 175.52 177.00 3duf h ILE 246 N 0.25 1.25 -0.28 3.11 2.04 -1.39 -2.85 117.51 119.63 3duf h ILE 246 Ca -0.11 -0.89 -0.09 0.00 1.00 0.00 0.00 64.86 64.77 3duf h ILE 246 Cb 1.57 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 3duf h ILE 246 CO 0.18 0.30 -0.20 0.40 0.00 0.00 0.00 178.15 178.83 3duf h ILE 247 N 0.42 1.25 -0.40 -0.67 1.08 -1.20 -2.08 117.51 115.92 3duf h ILE 247 Ca 0.10 -1.18 -0.03 0.00 -0.39 0.00 0.00 64.86 63.36 3duf h ILE 247 Cb 0.39 1.25 -0.02 0.00 -3.07 0.00 0.00 36.82 35.37 3duf h ILE 247 CO 0.01 0.38 0.11 1.23 -0.69 0.00 0.00 178.15 179.19 3duf h GLY 248 N 0.98 0.63 1.63 5.37 0.00 -1.29 -1.34 103.07 109.05 3duf h GLY 248 Ca 0.08 -0.32 -0.27 0.00 0.00 0.00 0.00 47.33 46.81 3duf h GLY 248 CO 0.04 0.30 -1.25 0.23 0.00 0.00 0.00 176.54 175.87 3duf h SER 249 N 0.57 0.42 -0.17 0.19 0.87 -1.26 -3.02 113.55 111.17 3duf h SER 249 Ca 0.14 -0.45 -0.17 0.00 -1.23 0.00 0.00 61.79 60.07 3duf h SER 249 Cb 0.20 -0.14 0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3duf h SER 249 CO -0.01 1.36 -0.57 0.58 -0.53 0.00 0.00 176.83 177.66 3duf h VAL 250 N 0.07 1.32 0.00 2.23 2.07 -1.23 -2.16 116.25 118.55 3duf h VAL 250 Ca -0.13 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.57 3duf h VAL 250 Cb 1.97 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 3duf h VAL 250 CO 0.20 0.57 0.00 -0.62 0.02 0.00 0.00 177.57 177.74 3duf n GLU 251 N -4.11 0.00 -0.01 1.57 1.02 -0.52 0.60 120.64 119.19 3duf n GLU 251 Ca -0.07 0.23 -0.22 0.00 -0.02 0.00 0.00 57.16 57.09 3duf n GLU 251 Cb 0.64 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.42 3duf n GLU 251 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3duf h LYS 252 N 0.00 0.22 0.00 3.49 3.64 -1.34 -3.41 116.57 119.17 3duf h LYS 252 Ca 0.00 -0.37 -0.35 0.00 -1.27 0.00 0.00 60.65 58.65 3duf h LYS 252 Cb 0.27 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 32.16 3duf h LYS 252 CO 0.00 1.18 -2.26 0.25 -2.27 0.00 0.00 179.45 176.35 3duf n THR 253 N -3.85 1.41 0.00 1.00 -2.24 -0.84 -4.98 114.28 104.78 3duf n THR 253 Ca -0.28 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 60.65 3duf n THR 253 Cb 0.92 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 3duf n THR 253 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3duf n GLY 254 N 1.71 2.39 3.20 3.38 0.00 0.20 -4.79 105.19 111.28 3duf n GLY 254 Ca -0.30 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 3duf n GLY 254 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3duf s ARG 255 N -0.22 0.89 -0.09 1.61 0.52 -1.26 -0.69 118.95 119.70 3duf s ARG 255 Ca 0.00 -1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 53.87 3duf s ARG 255 Cb 0.00 -0.87 0.11 0.00 0.52 0.00 0.00 34.95 34.70 3duf s ARG 255 CO 0.00 0.19 0.90 0.00 0.02 0.00 0.00 175.30 176.41 3duf s ALA 256 N -1.51 -1.87 0.01 2.13 0.00 -1.26 -1.31 121.76 117.96 3duf s ALA 256 Ca 0.01 1.36 -0.04 0.00 0.00 0.00 0.00 51.96 53.30 3duf s ALA 256 Cb -0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 3duf s ALA 256 CO 0.02 -0.43 0.06 0.96 0.00 0.00 0.00 175.76 176.38 3duf s ILE 257 N -1.73 0.09 -0.11 0.00 -4.36 0.24 -3.57 121.20 111.77 3duf s ILE 257 Ca -0.01 -0.78 0.01 0.00 -0.26 0.00 0.00 60.65 59.61 3duf s ILE 257 Cb -0.01 -0.36 -0.02 0.00 1.25 0.00 0.00 42.46 43.33 3duf s ILE 257 CO -0.00 -0.43 -0.14 -0.69 0.24 0.00 0.00 174.94 173.92 3duf s VAL 258 N -1.40 2.96 -0.03 8.37 1.01 -0.63 -0.58 120.40 130.10 3duf s VAL 258 Ca -0.15 -0.71 0.07 0.00 0.00 0.00 0.00 61.98 61.19 3duf s VAL 258 Cb -0.09 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3duf s VAL 258 CO 0.00 0.54 -0.23 -0.69 0.00 0.00 0.00 175.10 174.72 3duf s VAL 259 N 0.14 2.29 0.09 2.92 1.01 0.49 -0.60 120.40 126.75 3duf s VAL 259 Ca -0.07 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 60.68 3duf s VAL 259 Cb -0.15 -1.82 0.05 0.00 0.00 0.00 0.00 36.38 34.46 3duf s VAL 259 CO 0.05 0.58 0.52 0.00 0.00 0.00 0.00 175.10 176.25 3duf s GLN 260 N -0.58 1.11 0.00 2.72 -2.07 -0.75 -4.21 119.66 115.87 3duf s GLN 260 Ca 0.09 -0.38 0.24 0.00 -1.82 0.00 0.00 55.36 53.49 3duf s GLN 260 Cb -0.11 0.51 0.27 0.00 -1.09 0.00 0.00 33.01 32.59 3duf s GLN 260 CO -0.00 -0.43 1.27 -0.85 -1.32 0.00 0.00 175.29 173.96 3duf n GLU 261 N 0.08 1.28 -2.32 9.60 0.28 -1.26 -4.12 120.64 124.17 3duf n GLU 261 Ca -0.17 -0.98 -0.30 0.00 -0.16 0.00 0.00 57.16 55.55 3duf n GLU 261 Cb 0.62 -1.48 -0.00 0.00 1.43 0.00 0.00 31.44 32.01 3duf n GLU 261 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3duf s ALA 262 N -2.40 3.23 0.49 -1.84 0.00 -1.26 -4.32 121.76 115.66 3duf s ALA 262 Ca 0.22 -0.20 -0.21 0.00 0.00 0.00 0.00 51.96 51.77 3duf s ALA 262 Cb 0.19 -2.88 -0.09 0.00 0.00 0.00 0.00 23.12 20.34 3duf s ALA 262 CO 0.51 -0.43 0.76 1.04 0.00 0.00 0.00 175.76 177.64 3duf n GLN 263 N -2.24 0.85 -0.34 0.00 3.00 -1.26 -2.61 117.38 114.78 3duf n GLN 263 Ca 0.04 0.32 0.13 0.00 -0.01 0.00 0.00 57.00 57.48 3duf n GLN 263 Cb 0.54 -1.84 0.34 0.00 0.00 0.00 0.00 30.24 29.28 3duf n GLN 263 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 3duf h ARG 264 N 0.81 0.71 -0.02 -1.09 2.43 -1.61 0.12 114.38 115.73 3duf h ARG 264 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3duf h ARG 264 Cb 1.37 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 3duf h ARG 264 CO 0.52 0.47 0.00 0.00 -1.51 0.00 0.00 179.97 179.45 3duf n GLN 265 N -4.71 1.10 0.00 0.20 10.64 -1.26 -4.83 117.38 118.52 3duf n GLN 265 Ca 0.22 -0.15 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 3duf n GLN 265 Cb 0.57 -1.30 0.00 0.00 -0.86 0.00 0.00 30.24 28.65 3duf n GLN 265 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3duf n ALA 266 N -0.63 0.00 -0.84 2.61 0.00 0.41 -5.09 120.51 116.97 3duf n ALA 266 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 3duf n ALA 266 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 3duf n ALA 266 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3duf n GLY 267 N 4.69 -0.53 0.19 0.00 0.00 -1.26 -4.39 105.19 103.89 3duf n GLY 267 Ca 0.00 -1.01 0.04 0.00 0.00 0.00 0.00 46.02 45.06 3duf n GLY 267 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3duf n ILE 268 N -1.10 1.38 -0.00 -0.61 -5.35 -1.26 -4.57 119.36 107.85 3duf n ILE 268 Ca 0.00 -1.45 -0.09 0.00 -0.27 0.00 0.00 62.75 60.94 3duf n ILE 268 Cb 0.00 0.22 -0.03 0.00 -1.74 0.00 0.00 39.64 38.08 3duf n ILE 268 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3duf h ALA 269 N 0.44 -0.04 -0.95 -1.28 0.00 -1.94 -1.99 119.26 113.50 3duf h ALA 269 Ca 0.00 0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.11 3duf h ALA 269 Cb 0.76 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.74 3duf h ALA 269 CO 0.02 -0.58 0.60 0.00 0.00 0.00 0.00 179.25 179.29 3duf h ALA 270 N 0.92 1.72 -0.49 0.00 0.00 -1.86 -0.32 119.26 119.23 3duf h ALA 270 Ca 0.09 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3duf h ALA 270 Cb 0.28 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3duf h ALA 270 CO -0.22 0.00 0.07 -0.91 0.00 0.00 0.00 179.25 178.19 3duf h ASN 271 N 0.79 0.73 -0.07 0.00 2.35 -1.72 0.04 115.58 117.70 3duf h ASN 271 Ca 0.49 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 56.04 3duf h ASN 271 Cb 0.71 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.89 3duf h ASN 271 CO -0.26 0.75 -0.18 0.58 -1.65 0.00 0.00 177.43 176.68 3duf h VAL 272 N 0.74 1.42 -0.57 2.81 2.07 -0.76 -1.83 116.25 120.14 3duf h VAL 272 Ca 0.16 -1.51 0.07 0.00 0.82 0.00 0.00 66.70 66.24 3duf h VAL 272 Cb 0.35 2.23 -0.06 0.00 -1.52 0.00 0.00 31.29 32.28 3duf h VAL 272 CO 0.01 0.43 0.25 0.58 0.02 0.00 0.00 177.57 178.85 3duf h VAL 273 N -0.24 0.86 -0.47 2.57 2.07 -1.04 -0.39 116.25 119.61 3duf h VAL 273 Ca -0.00 -0.16 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 3duf h VAL 273 Cb 0.78 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3duf h VAL 273 CO 0.04 0.08 -0.07 0.00 0.02 0.00 0.00 177.57 177.64 3duf h ALA 274 N 1.36 1.00 0.00 1.67 0.00 -0.98 -2.08 119.26 120.23 3duf h ALA 274 Ca 0.27 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3duf h ALA 274 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3duf h ALA 274 CO -0.24 0.60 -0.24 0.93 0.00 0.00 0.00 179.25 180.30 3duf h GLU 275 N 0.75 0.00 0.01 0.00 4.39 -0.53 -2.99 114.58 116.21 3duf h GLU 275 Ca 0.13 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 3duf h GLU 275 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3duf h GLU 275 CO 0.03 0.24 -0.08 0.82 -1.16 0.00 0.00 179.01 178.87 3duf h ILE 276 N 0.00 1.77 -0.05 3.13 2.04 -0.74 -3.14 117.51 120.52 3duf h ILE 276 Ca -0.00 -2.36 0.01 0.00 1.00 0.00 0.00 64.86 63.51 3duf h ILE 276 Cb 0.75 3.37 -0.00 0.00 -0.74 0.00 0.00 36.82 40.20 3duf h ILE 276 CO 0.03 0.62 0.04 -1.13 0.00 0.00 0.00 178.15 177.71 3duf h ASN 277 N -0.95 0.00 0.38 1.72 -1.24 -1.43 0.01 115.58 114.07 3duf h ASN 277 Ca -0.01 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.77 3duf h ASN 277 Cb 1.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.11 3duf h ASN 277 CO 0.01 0.00 -0.97 -0.08 -1.29 0.00 0.00 177.43 175.10 3duf h GLU 278 N 0.00 0.38 0.00 6.67 4.81 -1.60 -3.25 114.58 121.60 3duf h GLU 278 Ca 0.02 -0.43 -0.18 0.00 -0.13 0.00 0.00 59.36 58.64 3duf h GLU 278 Cb 0.11 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 3duf h GLU 278 CO -0.00 1.11 -1.92 0.54 -0.73 0.00 0.00 179.01 178.01 3duf n ARG 279 N -3.72 1.22 -1.09 1.92 1.74 -0.91 -4.72 116.66 111.11 3duf n ARG 279 Ca -0.07 -0.05 0.03 0.00 -0.77 0.00 0.00 57.85 56.99 3duf n ARG 279 Cb 0.86 -1.38 0.13 0.00 -1.02 0.00 0.00 32.46 31.04 3duf n ARG 279 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3duf n ALA 280 N -2.38 3.26 0.29 7.54 0.00 -0.06 -4.80 120.51 124.36 3duf n ALA 280 Ca -0.17 -2.99 0.15 0.00 0.00 0.00 0.00 53.44 50.44 3duf n ALA 280 Cb 0.79 -0.50 0.88 0.00 0.00 0.00 0.00 19.45 20.62 3duf n ALA 280 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3duf h ILE 281 N 3.32 0.44 0.00 0.00 6.09 -1.65 -1.90 117.51 123.82 3duf h ILE 281 Ca -0.06 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.20 3duf h ILE 281 Cb 1.35 1.15 0.00 0.00 0.47 0.00 0.00 36.82 39.80 3duf h ILE 281 CO 0.09 0.05 -0.18 0.18 -3.07 0.00 0.00 178.15 175.22 3duf n LEU 282 N -3.62 0.41 -0.01 2.19 4.77 -1.26 -3.63 117.00 115.85 3duf n LEU 282 Ca -0.02 0.39 0.08 0.00 -0.03 0.00 0.00 56.01 56.42 3duf n LEU 282 Cb 0.15 -0.36 -0.11 0.00 -2.33 0.00 0.00 43.42 40.76 3duf n LEU 282 CO 0.27 -0.03 -0.51 -1.20 -1.33 0.00 0.00 177.39 174.59 3duf n SER 283 N -1.79 1.19 -4.68 -1.43 7.64 -0.75 -4.98 113.62 108.82 3duf n SER 283 Ca 0.06 -0.24 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 3duf n SER 283 Cb 0.38 1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 65.07 3duf n SER 283 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3duf s LEU 284 N -3.71 4.32 0.00 -3.43 1.43 -0.99 -4.44 118.68 111.86 3duf s LEU 284 Ca -0.03 2.21 0.24 0.00 -1.03 0.00 0.00 54.13 55.52 3duf s LEU 284 Cb 0.11 -3.56 0.25 0.00 0.03 0.00 0.00 46.19 43.02 3duf s LEU 284 CO 0.65 -0.80 1.23 -0.62 0.23 0.00 0.00 176.35 177.05 3duf n GLU 285 N 5.74 0.01 -3.84 1.70 -0.58 0.14 -4.97 120.64 118.83 3duf n GLU 285 Ca 0.14 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.81 3duf n GLU 285 Cb 0.43 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.79 3duf n GLU 285 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3duf s ALA 286 N -3.00 -1.15 0.37 0.62 0.00 -1.26 -4.99 121.76 112.34 3duf s ALA 286 Ca 0.10 -0.39 -0.26 0.00 0.00 0.00 0.00 51.96 51.41 3duf s ALA 286 Cb 0.17 0.78 -0.09 0.00 0.00 0.00 0.00 23.12 23.98 3duf s ALA 286 CO 0.76 -1.03 1.09 -1.25 0.00 0.00 0.00 175.76 175.34 3duf s PRO 287 N -3.40 4.26 -0.71 0.00 0.04 -1.26 -4.87 135.00 129.06 3duf s PRO 287 Ca 0.13 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.58 3duf s PRO 287 Cb -0.05 -2.75 0.04 0.00 0.04 0.00 0.00 34.50 31.78 3duf s PRO 287 CO 0.08 -0.10 1.22 0.08 0.04 0.00 0.00 177.00 178.32 3duf s VAL 288 N -1.46 3.85 0.70 -0.36 1.01 -1.26 -4.79 120.40 118.09 3duf s VAL 288 Ca 0.54 0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.76 3duf s VAL 288 Cb -0.27 -4.86 0.03 0.00 0.00 0.00 0.00 36.38 31.28 3duf s VAL 288 CO 0.34 -1.74 1.06 -0.76 0.00 0.00 0.00 175.10 174.00 3duf s LEU 289 N 5.39 2.88 0.07 3.92 1.43 -1.23 -4.88 118.68 126.25 3duf s LEU 289 Ca 0.34 0.86 0.09 0.00 -1.03 0.00 0.00 54.13 54.38 3duf s LEU 289 Cb -0.09 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 3duf s LEU 289 CO 0.15 -1.44 -0.24 -0.13 0.23 0.00 0.00 176.35 174.93 3duf s ARG 290 N -5.31 1.47 -0.20 1.70 0.52 -1.26 -1.61 118.95 114.28 3duf s ARG 290 Ca 0.58 -1.09 -0.00 0.00 -0.52 0.00 0.00 55.73 54.70 3duf s ARG 290 Cb -0.11 -1.70 0.01 0.00 0.52 0.00 0.00 34.95 33.68 3duf s ARG 290 CO 0.49 0.42 -0.15 0.08 0.02 0.00 0.00 175.30 176.16 3duf s VAL 291 N -0.90 2.43 0.37 3.52 1.01 0.23 -4.95 120.40 122.11 3duf s VAL 291 Ca 0.10 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 3duf s VAL 291 Cb -0.10 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.25 3duf s VAL 291 CO 0.03 0.48 0.63 0.00 0.00 0.00 0.00 175.10 176.24 3duf s ALA 292 N 1.33 0.07 0.50 5.51 0.00 -1.26 -1.81 121.76 126.10 3duf s ALA 292 Ca 0.05 -1.17 -0.07 0.00 0.00 0.00 0.00 51.96 50.76 3duf s ALA 292 Cb -0.14 0.92 -0.04 0.00 0.00 0.00 0.00 23.12 23.86 3duf s ALA 292 CO -0.10 -0.89 0.83 0.00 0.00 0.00 0.00 175.76 175.60 3duf s ALA 293 N -2.62 3.34 0.56 0.00 0.00 -1.07 -4.72 121.76 117.24 3duf s ALA 293 Ca 0.23 -0.38 -0.21 0.00 0.00 0.00 0.00 51.96 51.61 3duf s ALA 293 Cb -0.03 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.35 3duf s ALA 293 CO 0.16 -0.36 1.31 -2.14 0.00 0.00 0.00 175.76 174.74 3duf s PRO 294 N -4.68 3.11 0.00 0.00 0.02 -1.26 -1.85 135.00 130.34 3duf s PRO 294 Ca 0.49 2.12 -0.02 0.00 0.02 0.00 0.00 61.00 63.61 3duf s PRO 294 Cb -0.10 -2.18 -0.10 0.00 0.02 0.00 0.00 34.50 32.13 3duf s PRO 294 CO 0.44 -1.18 1.87 -0.25 -0.33 0.00 0.00 177.00 177.55 3duf n ASP 295 N -1.15 2.86 -4.67 2.53 8.00 -1.26 -4.57 116.55 118.29 3duf n ASP 295 Ca 0.11 -1.95 -0.26 0.00 0.71 0.00 0.00 54.79 53.39 3duf n ASP 295 Cb 0.46 -0.72 -0.09 0.00 -0.02 0.00 0.00 41.12 40.74 3duf n ASP 295 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3duf s THR 296 N 1.62 2.14 0.73 -3.53 -4.23 -1.26 -5.04 115.64 106.07 3duf s THR 296 Ca 0.26 -1.87 -0.15 0.00 -1.18 0.00 0.00 61.69 58.75 3duf s THR 296 Cb 0.12 -2.99 0.04 0.00 1.34 0.00 0.00 72.50 71.01 3duf s THR 296 CO 0.00 -0.00 1.20 -0.69 -0.54 0.00 0.00 174.62 174.58 3duf s VAL 297 N -2.66 2.38 0.16 2.29 1.01 -1.26 -4.85 120.40 117.47 3duf s VAL 297 Ca 0.38 0.18 -0.33 0.00 0.00 0.00 0.00 61.98 62.21 3duf s VAL 297 Cb 0.07 -2.75 -0.16 0.00 0.00 0.00 0.00 36.38 33.54 3duf s VAL 297 CO 0.20 -0.10 1.15 0.00 0.00 0.00 0.00 175.10 176.35 3duf n TYR 298 N -2.71 1.22 -1.61 5.22 4.19 -1.26 -4.87 117.16 117.35 3duf n TYR 298 Ca 0.13 0.70 -0.32 0.00 3.31 0.00 0.00 57.90 61.72 3duf n TYR 298 Cb 0.50 -2.26 0.06 0.00 0.49 0.00 0.00 39.34 38.13 3duf n TYR 298 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 3duf s PRO 299 N -0.33 2.65 0.56 2.98 0.04 -1.26 -5.01 135.00 134.63 3duf s PRO 299 Ca 0.74 1.31 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 3duf s PRO 299 Cb -0.88 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 31.68 3duf s PRO 299 CO 0.52 -1.36 1.29 -0.06 0.04 0.00 0.00 177.00 177.44 3duf s PHE 300 N -2.53 2.33 0.20 0.56 0.08 -1.26 -4.84 117.98 112.53 3duf s PHE 300 Ca 0.65 1.44 -0.13 0.00 0.12 0.00 0.00 56.93 59.01 3duf s PHE 300 Cb -0.19 -3.67 0.25 0.00 -0.57 0.00 0.00 43.02 38.84 3duf s PHE 300 CO 0.46 -2.61 1.30 0.00 -0.10 0.00 0.00 175.22 174.27 3duf n ALA 301 N -1.24 -0.03 0.90 5.36 0.00 -1.26 -0.74 120.51 123.50 3duf n ALA 301 Ca 0.12 0.86 0.06 0.00 0.00 0.00 0.00 53.44 54.47 3duf n ALA 301 Cb 0.47 -0.42 0.33 0.00 0.00 0.00 0.00 19.45 19.83 3duf n ALA 301 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3duf n GLN 302 N -5.27 0.45 -0.03 0.00 7.27 -1.26 -2.47 117.38 116.06 3duf n GLN 302 Ca 0.10 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.18 3duf n GLN 302 Cb 0.36 -1.39 0.03 0.00 2.41 0.00 0.00 30.24 31.65 3duf n GLN 302 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3duf n ALA 303 N -0.89 2.15 -0.28 1.69 0.00 0.08 -4.74 120.51 118.52 3duf n ALA 303 Ca 0.08 -0.91 -0.01 0.00 0.00 0.00 0.00 53.44 52.60 3duf n ALA 303 Cb 0.04 -0.10 0.11 0.00 0.00 0.00 0.00 19.45 19.50 3duf n ALA 303 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3duf h GLU 304 N 0.50 0.89 -0.98 0.00 5.08 -1.54 -2.88 114.58 115.66 3duf h GLU 304 Ca 0.00 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3duf h GLU 304 Cb 0.45 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 3duf h GLU 304 CO 0.00 0.59 0.64 0.66 -1.00 0.00 0.00 179.01 179.90 3duf h SER 305 N 0.92 1.05 0.57 1.42 4.64 -1.85 -1.66 113.55 118.65 3duf h SER 305 Ca 0.33 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3duf h SER 305 Cb 0.10 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 3duf h SER 305 CO -0.15 0.71 -0.51 1.33 -0.87 0.00 0.00 176.83 177.35 3duf n VAL 306 N -4.45 0.06 -0.09 0.95 0.24 -1.17 -4.48 118.33 109.39 3duf n VAL 306 Ca 0.13 -0.05 -0.10 0.00 -2.04 0.00 0.00 64.34 62.29 3duf n VAL 306 Cb 0.11 0.16 -0.04 0.00 -1.47 0.00 0.00 33.84 32.60 3duf n VAL 306 CO 0.00 0.00 0.00 1.87 -2.14 0.00 0.00 176.83 176.56 3duf n TRP 307 N -1.60 0.40 -1.71 6.34 -0.00 -1.02 -4.97 117.44 114.88 3duf n TRP 307 Ca 0.05 0.17 -0.43 0.00 -0.00 0.00 0.00 57.50 57.29 3duf n TRP 307 Cb 0.35 -0.68 -0.02 0.00 -0.00 0.00 0.00 31.31 30.97 3duf n TRP 307 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 3duf n LEU 308 N -4.50 3.76 -4.76 5.87 4.77 -0.65 -4.56 117.00 116.92 3duf n LEU 308 Ca -0.16 1.16 -0.41 0.00 -0.03 0.00 0.00 56.01 56.57 3duf n LEU 308 Cb 0.47 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.03 3duf n LEU 308 CO 0.16 -0.21 1.05 -2.84 -1.33 0.00 0.00 177.39 174.21 3duf s PRO 309 N -0.83 4.29 0.48 3.23 0.02 -1.26 -4.94 135.00 135.99 3duf s PRO 309 Ca 0.63 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.97 3duf s PRO 309 Cb -0.57 -3.07 -0.01 0.00 0.02 0.00 0.00 34.50 30.88 3duf s PRO 309 CO 0.53 -0.32 0.06 0.27 -0.33 0.00 0.00 177.00 177.20 3duf n ASN 310 N 1.34 2.55 0.06 2.53 0.23 -1.26 -5.00 115.26 115.71 3duf n ASN 310 Ca 0.03 -3.29 0.11 0.00 -0.53 0.00 0.00 54.58 50.91 3duf n ASN 310 Cb 0.41 0.66 0.58 0.00 -2.08 0.00 0.00 39.78 39.34 3duf n ASN 310 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 3duf h PHE 311 N 1.45 0.21 -0.47 -2.53 -0.00 -1.96 -2.11 116.94 111.52 3duf h PHE 311 Ca -0.39 0.01 -0.13 0.00 -0.00 0.00 0.00 57.97 57.45 3duf h PHE 311 Cb 1.30 -0.07 -0.01 0.00 -0.00 0.00 0.00 35.95 37.17 3duf h PHE 311 CO 0.00 0.11 -0.21 0.87 -0.00 0.00 0.00 178.31 179.08 3duf h LYS 312 N 0.21 0.96 -0.07 6.09 1.57 -1.96 -0.87 116.57 122.50 3duf h LYS 312 Ca 0.16 -0.41 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 3duf h LYS 312 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3duf h LYS 312 CO -0.03 1.08 -0.18 -0.44 -0.57 0.00 0.00 179.45 179.31 3duf h ASP 313 N 0.83 0.11 0.88 0.86 3.32 -1.79 -1.63 116.42 119.00 3duf h ASP 313 Ca 0.11 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 3duf h ASP 313 Cb 0.78 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 3duf h ASP 313 CO 0.06 0.30 -0.61 0.58 -1.72 0.00 0.00 179.24 177.85 3duf h VAL 314 N 0.11 1.26 0.12 -1.35 2.07 -1.08 -2.30 116.25 115.07 3duf h VAL 314 Ca 0.02 -2.22 -0.01 0.00 0.82 0.00 0.00 66.70 65.31 3duf h VAL 314 Cb 0.38 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 3duf h VAL 314 CO 0.03 0.60 -0.06 0.40 0.02 0.00 0.00 177.57 178.55 3duf h ILE 315 N 0.00 1.04 -0.72 4.57 2.04 -0.48 -2.54 117.51 121.43 3duf h ILE 315 Ca -0.01 -1.14 0.15 0.00 1.00 0.00 0.00 64.86 64.87 3duf h ILE 315 Cb 1.21 1.70 -0.11 0.00 -0.74 0.00 0.00 36.82 38.89 3duf h ILE 315 CO 0.08 0.25 0.14 -0.08 0.00 0.00 0.00 178.15 178.55 3duf h GLU 316 N -0.75 0.23 0.00 2.37 4.81 -1.31 -0.05 114.58 119.89 3duf h GLU 316 Ca -0.02 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 3duf h GLU 316 Cb 0.54 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3duf h GLU 316 CO 0.03 0.15 -0.24 1.15 -0.73 0.00 0.00 179.01 179.37 3duf h THR 317 N 0.24 0.55 -0.05 0.32 2.02 -1.47 -2.42 112.91 112.10 3duf h THR 317 Ca 0.40 -1.25 -0.24 0.00 0.77 0.00 0.00 66.41 66.08 3duf h THR 317 Cb 0.68 1.87 0.01 0.00 -1.74 0.00 0.00 68.15 68.97 3duf h THR 317 CO -0.52 0.24 -0.94 0.00 0.37 0.00 0.00 175.52 174.67 3duf h ALA 318 N 1.76 0.24 -0.47 6.16 0.00 -0.59 -2.99 119.26 123.37 3duf h ALA 318 Ca -0.00 -0.67 -0.10 0.00 0.00 0.00 0.00 54.91 54.14 3duf h ALA 318 Cb 0.85 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3duf h ALA 318 CO 0.03 0.71 -0.11 0.87 0.00 0.00 0.00 179.25 180.75 3duf h LYS 319 N 0.41 0.90 -0.68 0.00 1.57 -1.18 -1.95 116.57 115.63 3duf h LYS 319 Ca -0.10 -0.34 0.05 0.00 -1.87 0.00 0.00 60.65 58.39 3duf h LYS 319 Cb 1.58 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.80 3duf h LYS 319 CO 0.18 0.99 0.45 -0.22 -0.57 0.00 0.00 179.45 180.28 3duf h LYS 320 N 0.74 0.71 0.00 3.15 3.64 -1.47 -0.31 116.57 123.03 3duf h LYS 320 Ca 0.12 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.30 3duf h LYS 320 Cb 0.66 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 3duf h LYS 320 CO 0.05 0.47 -0.76 0.28 -2.27 0.00 0.00 179.45 177.22 3duf h VAL 321 N 0.73 1.38 -0.16 2.00 2.07 -1.35 -3.21 116.25 117.72 3duf h VAL 321 Ca 0.29 -2.74 -0.17 0.00 0.82 0.00 0.00 66.70 64.90 3duf h VAL 321 Cb 0.20 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.51 3duf h VAL 321 CO -0.09 0.74 -0.61 0.24 0.02 0.00 0.00 177.57 177.87 3duf h MET 322 N 0.00 0.55 -0.81 1.57 2.86 -0.39 -3.26 114.93 115.45 3duf h MET 322 Ca -0.01 -0.38 -0.14 0.00 -2.06 0.00 0.00 59.70 57.12 3duf h MET 322 Cb 1.48 0.06 -0.08 0.00 0.06 0.00 0.00 31.60 33.11 3duf h MET 322 CO 0.10 0.99 0.18 0.09 1.06 0.00 0.00 176.91 179.33 3duf n ASN 323 N -3.93 4.12 0.00 1.22 3.02 -0.27 -5.10 115.26 114.32 3duf n ASN 323 Ca -0.04 -2.86 0.10 0.00 -0.03 0.00 0.00 54.58 51.76 3duf n ASN 323 Cb 0.64 -0.68 0.61 0.00 -0.61 0.00 0.00 39.78 39.74 3duf n ASN 323 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97