#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nuf s ALA 2 N 0.00 2.77 0.33 0.00 0.00 -1.26 -4.97 121.76 118.63 1nuf s ALA 2 Ca 0.00 0.22 -0.29 0.00 0.00 0.00 0.00 51.96 51.89 1nuf s ALA 2 Cb 0.00 -3.19 -0.11 0.00 0.00 0.00 0.00 23.12 19.82 1nuf s ALA 2 CO 0.00 -0.92 1.51 -1.17 0.00 0.00 0.00 175.76 175.18 1nuf s LEU 3 N -4.92 4.34 -0.01 0.00 2.96 -1.26 -4.98 118.68 114.81 1nuf s LEU 3 Ca 0.60 2.96 -0.13 0.00 -0.22 0.00 0.00 54.13 57.34 1nuf s LEU 3 Cb -0.14 -3.65 0.02 0.00 0.50 0.00 0.00 46.19 42.91 1nuf s LEU 3 CO 0.45 -0.85 0.28 -0.83 -1.32 0.00 0.00 176.35 174.07 1nuf s GLY 4 N 0.09 -0.11 -0.31 7.98 0.00 -1.26 -4.96 107.32 108.75 1nuf s GLY 4 Ca 0.57 0.22 -0.29 0.00 0.00 0.00 0.00 44.72 45.22 1nuf s GLY 4 CO 0.56 0.03 1.08 0.14 0.00 0.00 0.00 173.10 174.90 1nuf s VAL 5 N -1.41 4.51 -0.07 1.40 1.01 -1.26 -1.74 120.40 122.85 1nuf s VAL 5 Ca -0.13 1.75 -0.03 0.00 0.00 0.00 0.00 61.98 63.57 1nuf s VAL 5 Cb -0.05 -4.39 -0.27 0.00 0.00 0.00 0.00 36.38 31.67 1nuf s VAL 5 CO 0.03 -0.45 0.58 -0.61 0.00 0.00 0.00 175.10 174.66 1nuf h GLN 6 N 8.06 0.23 -2.59 2.72 4.15 -1.44 -3.47 115.11 122.77 1nuf h GLN 6 Ca -0.21 -0.39 0.13 0.00 0.77 0.00 0.00 58.65 58.95 1nuf h GLN 6 Cb 1.06 0.15 -0.06 0.00 0.21 0.00 0.00 27.48 28.84 1nuf h GLN 6 CO 1.03 1.07 0.42 -1.54 -1.93 0.00 0.00 178.83 177.88 1nuf s SER 7 N -6.88 -0.14 -0.08 -0.69 1.04 -0.92 -5.03 113.70 100.99 1nuf s SER 7 Ca -0.15 -0.58 -0.07 0.00 0.48 0.00 0.00 55.95 55.62 1nuf s SER 7 Cb 0.07 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.80 1nuf s SER 7 CO 0.81 -1.11 0.22 -0.51 0.98 0.00 0.00 173.24 173.63 1nuf s ILE 8 N -3.12 -0.00 -0.28 -1.02 -1.16 -1.26 -2.17 121.20 112.18 1nuf s ILE 8 Ca 0.14 0.01 -0.01 0.00 -0.51 0.00 0.00 60.65 60.28 1nuf s ILE 8 Cb -0.03 -0.32 0.05 0.00 0.61 0.00 0.00 42.46 42.77 1nuf s ILE 8 CO 0.05 0.00 -0.03 0.21 -2.81 0.00 0.00 174.94 172.37 1nuf s ASN 9 N 0.20 4.71 0.00 4.50 3.04 -0.19 -4.98 114.94 122.22 1nuf s ASN 9 Ca -0.01 -1.20 0.29 0.00 0.04 0.00 0.00 52.86 51.97 1nuf s ASN 9 Cb -0.02 -1.68 1.26 0.00 -1.54 0.00 0.00 41.25 39.27 1nuf s ASN 9 CO -0.00 -0.22 1.93 0.79 -3.04 0.00 0.00 177.10 176.56 1nuf n TRP 10 N 4.61 0.00 -4.14 0.43 7.02 -1.26 -1.60 117.44 122.50 1nuf n TRP 10 Ca -0.14 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.01 1nuf n TRP 10 Cb 0.44 -0.46 -0.02 0.00 -2.42 0.00 0.00 31.31 28.84 1nuf n TRP 10 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1nuf n GLN 11 N -1.46 -3.27 -0.23 -0.99 6.02 -1.26 -4.76 117.38 111.42 1nuf n GLN 11 Ca 0.08 0.39 -0.10 0.00 -0.01 0.00 0.00 57.00 57.35 1nuf n GLN 11 Cb 0.31 -4.92 -0.06 0.00 1.02 0.00 0.00 30.24 26.59 1nuf n GLN 11 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1nuf h THR 12 N -1.64 0.04 -0.22 5.09 2.02 -1.91 0.26 112.91 116.55 1nuf h THR 12 Ca -0.60 0.00 0.04 0.00 0.77 0.00 0.00 66.41 66.62 1nuf h THR 12 Cb 1.38 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1nuf h THR 12 CO 0.73 0.00 -0.05 0.00 0.37 0.00 0.00 175.52 176.57 1nuf h ALA 13 N 0.43 0.15 -0.01 6.16 0.00 -1.97 0.41 119.26 124.43 1nuf h ALA 13 Ca 0.15 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1nuf h ALA 13 Cb 0.55 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1nuf h ALA 13 CO -0.72 -0.47 -0.09 0.35 0.00 0.00 0.00 179.25 178.32 1nuf h PHE 14 N 0.01 -0.21 -0.28 0.00 3.04 -1.72 -1.80 116.94 115.97 1nuf h PHE 14 Ca 0.11 0.01 -0.16 0.00 3.98 0.00 0.00 57.97 61.91 1nuf h PHE 14 Cb 0.16 0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 1nuf h PHE 14 CO -0.23 -0.13 -0.45 -0.91 -2.02 0.00 0.00 178.31 174.57 1nuf h ASN 15 N -0.14 0.79 -0.58 0.41 2.35 -0.72 -2.19 115.58 115.49 1nuf h ASN 15 Ca 0.04 -0.38 -0.07 0.00 -0.55 0.00 0.00 56.30 55.34 1nuf h ASN 15 Cb 0.19 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 1nuf h ASN 15 CO -0.10 1.12 0.09 0.03 -1.65 0.00 0.00 177.43 176.92 1nuf h ARG 16 N 0.58 1.00 -0.55 0.81 3.08 -0.13 0.20 114.38 119.37 1nuf h ARG 16 Ca 0.04 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1nuf h ARG 16 Cb 1.01 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 1nuf h ARG 16 CO 0.10 0.93 0.29 0.37 -1.07 0.00 0.00 179.97 180.58 1nuf h GLN 17 N 0.94 0.77 0.00 0.04 -0.00 -1.24 0.18 115.11 115.80 1nuf h GLN 17 Ca 0.19 -0.10 -0.11 0.00 -0.00 0.00 0.00 58.65 58.63 1nuf h GLN 17 Cb 0.43 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 27.74 1nuf h GLN 17 CO 0.01 0.61 -0.50 0.00 0.00 0.00 0.00 178.83 178.95 1nuf h ALA 18 N 1.12 0.93 -0.07 3.38 0.00 -1.07 -2.95 119.26 120.60 1nuf h ALA 18 Ca 0.19 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1nuf h ALA 18 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1nuf h ALA 18 CO -0.03 0.63 0.00 0.72 0.00 0.00 0.00 179.25 180.57 1nuf n HIS 19 N -3.60 0.08 -3.47 0.00 8.25 0.67 -4.95 115.22 112.20 1nuf n HIS 19 Ca -0.00 -0.04 -0.18 0.00 -0.26 0.00 0.00 57.72 57.24 1nuf n HIS 19 Cb 0.58 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.77 1nuf n HIS 19 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1nuf n HIS 20 N 0.40 -2.17 -1.50 4.41 -0.00 0.41 -4.70 115.22 112.07 1nuf n HIS 20 Ca 0.18 0.89 0.00 0.00 -0.00 0.00 0.00 57.72 58.79 1nuf n HIS 20 Cb 0.39 -4.73 0.00 0.00 -0.00 0.00 0.00 29.99 25.64 1nuf n HIS 20 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1nuf n THR 21 N -4.01 0.04 1.85 1.59 -2.24 0.11 -4.84 114.28 106.77 1nuf n THR 21 Ca -0.25 -0.04 0.11 0.00 -2.27 0.00 0.00 64.05 61.59 1nuf n THR 21 Cb 0.66 0.72 0.63 0.00 -2.10 0.00 0.00 70.33 70.24 1nuf n THR 21 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1nuf n ASP 22 N -0.02 0.00 -0.00 3.42 5.75 -1.20 -3.31 116.55 121.18 1nuf n ASP 22 Ca 0.00 -1.19 -0.07 0.00 -0.01 0.00 0.00 54.79 53.52 1nuf n ASP 22 Cb 0.60 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 40.56 1nuf n ASP 22 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1nuf h LYS 23 N 0.00 0.00 -6.77 0.11 1.57 -1.92 -3.47 116.57 106.10 1nuf h LYS 23 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1nuf h LYS 23 Cb 0.00 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.40 1nuf h LYS 23 CO 0.00 0.52 0.83 1.19 -0.57 0.00 0.00 179.45 181.42 1nuf n PHE 24 N -3.06 2.76 0.29 -1.35 3.01 -1.21 -4.86 117.46 113.04 1nuf n PHE 24 Ca -0.14 0.29 0.15 0.00 1.01 0.00 0.00 57.45 58.77 1nuf n PHE 24 Cb 1.01 -2.57 0.87 0.00 -0.01 0.00 0.00 39.48 38.78 1nuf n PHE 24 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1nuf h SER 25 N 4.58 0.00 -4.04 4.37 0.87 -1.60 -3.44 113.55 114.28 1nuf h SER 25 Ca -0.47 0.00 -0.55 0.00 -1.23 0.00 0.00 61.79 59.54 1nuf h SER 25 Cb 1.23 0.00 0.14 0.00 -0.44 0.00 0.00 62.40 63.33 1nuf h SER 25 CO 0.78 0.05 0.63 -0.24 -0.53 0.00 0.00 176.83 177.52 1nuf n SER 26 N -3.64 2.81 0.00 6.23 2.88 -1.26 -4.93 113.62 115.72 1nuf n SER 26 Ca -0.02 0.99 0.13 0.00 -1.33 0.00 0.00 58.87 58.64 1nuf n SER 26 Cb 0.15 -1.59 0.38 0.00 -0.75 0.00 0.00 64.21 62.41 1nuf n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nuf n GLN 27 N -0.96 0.02 -0.95 -1.46 1.13 -1.26 -4.95 117.38 108.94 1nuf n GLN 27 Ca 0.10 0.01 -0.29 0.00 -1.94 0.00 0.00 57.00 54.88 1nuf n GLN 27 Cb 0.44 -1.51 0.19 0.00 0.11 0.00 0.00 30.24 29.47 1nuf n GLN 27 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1nuf s GLU 28 N -3.01 0.26 -0.72 -1.09 2.02 -1.26 -4.96 118.70 109.94 1nuf s GLU 28 Ca 0.12 0.77 -0.24 0.00 0.02 0.00 0.00 54.97 55.65 1nuf s GLU 28 Cb 0.18 -1.70 0.06 0.00 0.10 0.00 0.00 34.13 32.77 1nuf s GLU 28 CO 0.64 -2.91 1.10 -1.17 0.02 0.00 0.00 175.26 172.94 1nuf s LEU 29 N -6.65 4.00 -0.25 1.80 2.96 -1.26 -5.00 118.68 114.28 1nuf s LEU 29 Ca 0.66 -0.92 -0.14 0.00 -0.22 0.00 0.00 54.13 53.51 1nuf s LEU 29 Cb -0.21 -2.47 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1nuf s LEU 29 CO 0.60 -1.54 0.32 -0.63 -1.32 0.00 0.00 176.35 173.77 1nuf s ILE 30 N 4.54 5.23 0.34 6.68 -1.09 -1.26 -1.40 121.20 134.24 1nuf s ILE 30 Ca 0.28 0.49 0.05 0.00 -2.23 0.00 0.00 60.65 59.24 1nuf s ILE 30 Cb -0.12 -3.65 -0.07 0.00 -1.58 0.00 0.00 42.46 37.04 1nuf s ILE 30 CO 0.09 0.22 0.02 -0.76 -1.23 0.00 0.00 174.94 173.28 1nuf s LEU 31 N 1.71 2.43 0.02 2.97 1.43 0.29 -4.59 118.68 122.94 1nuf s LEU 31 Ca 0.14 -1.34 0.07 0.00 -1.03 0.00 0.00 54.13 51.96 1nuf s LEU 31 Cb -0.15 -0.57 -0.02 0.00 0.03 0.00 0.00 46.19 45.48 1nuf s LEU 31 CO 0.09 -0.52 -0.20 -0.13 0.23 0.00 0.00 176.35 175.82 1nuf s ARG 32 N -3.81 1.49 0.65 1.70 0.52 -1.26 0.49 118.95 118.72 1nuf s ARG 32 Ca 0.35 -0.83 -0.17 0.00 -0.52 0.00 0.00 55.73 54.56 1nuf s ARG 32 Cb 0.08 -1.52 -0.00 0.00 0.52 0.00 0.00 34.95 34.03 1nuf s ARG 32 CO 0.16 0.40 1.21 -0.98 0.02 0.00 0.00 175.30 176.11 1nuf s ARG 33 N -0.83 2.63 -1.07 3.54 1.70 -0.11 -3.59 118.95 121.22 1nuf s ARG 33 Ca 0.07 1.79 0.00 0.00 -0.47 0.00 0.00 55.73 57.12 1nuf s ARG 33 Cb -0.08 -1.89 0.00 0.00 -0.57 0.00 0.00 34.95 32.41 1nuf s ARG 33 CO 0.01 -1.46 0.00 0.41 -1.08 0.00 0.00 175.30 173.17 1nuf n GLY 34 N 0.41 1.14 2.90 3.88 0.00 -1.00 -4.59 105.19 107.94 1nuf n GLY 34 Ca 0.13 -0.48 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 1nuf n GLY 34 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nuf s GLN 35 N -2.77 0.27 0.61 1.61 0.74 -1.24 -4.78 119.66 114.10 1nuf s GLN 35 Ca 0.00 -0.08 -0.18 0.00 0.05 0.00 0.00 55.36 55.15 1nuf s GLN 35 Cb 0.00 -0.29 -0.03 0.00 1.10 0.00 0.00 33.01 33.79 1nuf s GLN 35 CO 0.00 0.03 1.20 -0.80 -0.55 0.00 0.00 175.29 175.17 1nuf s ASN 36 N 0.13 5.09 -0.04 6.67 -0.87 -1.26 -4.28 114.94 120.38 1nuf s ASN 36 Ca -0.01 2.36 -0.09 0.00 -1.57 0.00 0.00 52.86 53.56 1nuf s ASN 36 Cb -0.04 -2.60 0.01 0.00 -0.02 0.00 0.00 41.25 38.61 1nuf s ASN 36 CO -0.00 -1.66 0.21 0.72 -2.57 0.00 0.00 177.10 173.79 1nuf s PHE 37 N -1.67 -0.14 -0.10 2.20 -0.71 -0.17 -4.97 117.98 112.41 1nuf s PHE 37 Ca 0.77 0.30 -0.02 0.00 -1.04 0.00 0.00 56.93 56.94 1nuf s PHE 37 Cb -0.30 0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.52 1nuf s PHE 37 CO 0.35 -0.21 -0.01 -1.14 -1.34 0.00 0.00 175.22 172.86 1nuf s GLN 38 N -0.60 3.16 0.09 1.99 0.74 -1.26 -0.94 119.66 122.85 1nuf s GLN 38 Ca -0.07 -0.44 0.05 0.00 0.05 0.00 0.00 55.36 54.96 1nuf s GLN 38 Cb -0.04 -2.83 -0.03 0.00 1.10 0.00 0.00 33.01 31.21 1nuf s GLN 38 CO 0.01 0.58 -0.13 0.14 -0.55 0.00 0.00 175.29 175.34 1nuf s VAL 39 N -0.56 1.14 -0.24 1.34 -7.23 0.08 -4.49 120.40 110.44 1nuf s VAL 39 Ca 0.09 -1.48 -0.02 0.00 -1.81 0.00 0.00 61.98 58.77 1nuf s VAL 39 Cb -0.12 -1.25 0.02 0.00 0.56 0.00 0.00 36.38 35.59 1nuf s VAL 39 CO 0.02 -0.34 -0.07 -0.76 -0.31 0.00 0.00 175.10 173.64 1nuf s LEU 40 N -2.06 3.02 -0.28 1.32 1.43 -0.63 -0.56 118.68 120.91 1nuf s LEU 40 Ca 0.02 -0.74 -0.09 0.00 -1.03 0.00 0.00 54.13 52.30 1nuf s LEU 40 Cb -0.07 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 1nuf s LEU 40 CO 0.02 -0.09 0.12 -0.04 0.23 0.00 0.00 176.35 176.59 1nuf s MET 41 N 1.36 3.58 -0.46 1.70 -1.94 0.54 -1.02 119.30 123.06 1nuf s MET 41 Ca 0.02 -0.54 -0.21 0.00 -1.71 0.00 0.00 55.69 53.25 1nuf s MET 41 Cb -0.16 -3.48 0.03 0.00 2.01 0.00 0.00 34.83 33.24 1nuf s MET 41 CO -0.05 -0.28 0.66 0.42 -0.01 0.00 0.00 175.02 175.76 1nuf s ILE 42 N 1.64 4.81 0.51 2.53 1.09 -0.92 0.20 121.20 131.07 1nuf s ILE 42 Ca 0.06 -0.02 0.00 0.00 -1.10 0.00 0.00 60.65 59.60 1nuf s ILE 42 Cb -0.16 -4.25 0.02 0.00 -1.06 0.00 0.00 42.46 37.01 1nuf s ILE 42 CO 0.06 -0.68 0.74 -0.04 -0.10 0.00 0.00 174.94 174.93 1nuf s MET 43 N 2.85 2.76 0.21 2.79 -1.94 -0.82 -1.20 119.30 123.96 1nuf s MET 43 Ca 0.21 -0.62 0.25 0.00 -1.71 0.00 0.00 55.69 53.83 1nuf s MET 43 Cb -0.15 -2.50 0.87 0.00 2.01 0.00 0.00 34.83 35.06 1nuf s MET 43 CO 0.17 -0.55 1.76 0.27 -0.01 0.00 0.00 175.02 176.67 1nuf n ASN 44 N -2.26 0.74 -0.81 3.03 2.04 -0.71 -4.72 115.26 112.57 1nuf n ASN 44 Ca 0.05 0.60 0.00 0.00 -0.44 0.00 0.00 54.58 54.79 1nuf n ASN 44 Cb 0.59 -0.79 0.00 0.00 -2.53 0.00 0.00 39.78 37.05 1nuf n ASN 44 CO 0.00 0.00 0.00 2.29 -0.44 0.00 0.00 177.26 179.11 1nuf n LYS 45 N -2.22 0.00 -2.47 -3.83 2.85 -1.26 -5.03 118.16 106.20 1nuf n LYS 45 Ca 0.05 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 57.04 1nuf n LYS 45 Cb 0.37 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.77 1nuf n LYS 45 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1nuf s GLY 46 N -0.81 1.57 0.10 2.58 0.00 -1.26 -4.51 107.32 104.99 1nuf s GLY 46 Ca 0.00 -0.62 -0.16 0.00 0.00 0.00 0.00 44.72 43.94 1nuf s GLY 46 CO 0.00 -0.38 0.54 -2.27 0.00 0.00 0.00 173.10 171.00 1nuf s LEU 47 N -4.91 4.42 0.16 0.66 0.20 -1.26 -4.99 118.68 112.96 1nuf s LEU 47 Ca 0.52 1.14 0.08 0.00 0.69 0.00 0.00 54.13 56.55 1nuf s LEU 47 Cb -0.10 -3.06 -0.04 0.00 -0.43 0.00 0.00 46.19 42.55 1nuf s LEU 47 CO 0.45 0.19 -0.05 -0.83 -0.29 0.00 0.00 176.35 175.83 1nuf s GLY 48 N -1.42 1.75 0.64 7.98 0.00 -1.26 -5.00 107.32 110.01 1nuf s GLY 48 Ca 0.33 -1.36 0.42 0.00 0.00 0.00 0.00 44.72 44.11 1nuf s GLY 48 CO 0.19 -1.36 2.30 1.48 0.00 0.00 0.00 173.10 175.70 1nuf h SER 49 N 2.98 0.00 1.05 1.64 4.64 -2.03 -2.01 113.55 119.82 1nuf h SER 49 Ca -0.47 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.67 1nuf h SER 49 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 1nuf h SER 49 CO 0.56 0.00 -1.00 -0.55 -0.87 0.00 0.00 176.83 174.97 1nuf h ASN 50 N 0.00 0.00 -3.58 4.97 -1.07 -1.98 -3.47 115.58 110.46 1nuf h ASN 50 Ca -0.00 0.00 -0.38 0.00 0.07 0.00 0.00 56.30 55.99 1nuf h ASN 50 Cb 0.10 0.00 0.16 0.00 -2.07 0.00 0.00 38.32 36.50 1nuf h ASN 50 CO 0.00 0.72 0.35 -0.62 0.07 0.00 0.00 177.43 177.95 1nuf n GLU 51 N -3.16 -1.30 -3.64 4.14 1.02 -0.76 -4.89 120.64 112.05 1nuf n GLU 51 Ca -0.04 -1.78 -0.05 0.00 -0.02 0.00 0.00 57.16 55.27 1nuf n GLU 51 Cb 0.86 -1.23 -0.07 0.00 -0.02 0.00 0.00 31.44 30.98 1nuf n GLU 51 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1nuf s ARG 52 N -5.52 0.32 -0.09 3.49 3.52 -0.79 -4.94 118.95 114.94 1nuf s ARG 52 Ca 0.66 0.43 0.03 0.00 -0.13 0.00 0.00 55.73 56.72 1nuf s ARG 52 Cb -0.02 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.49 1nuf s ARG 52 CO 0.47 -0.05 -0.17 -0.51 -0.81 0.00 0.00 175.30 174.23 1nuf s LEU 53 N 0.48 2.54 -0.13 -0.88 1.43 -1.26 -0.23 118.68 120.63 1nuf s LEU 53 Ca 0.01 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 1nuf s LEU 53 Cb -0.04 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.67 1nuf s LEU 53 CO -0.11 0.24 -0.12 -1.61 0.23 0.00 0.00 176.35 174.98 1nuf s GLU 54 N -0.09 2.02 0.30 1.70 2.02 -0.62 -1.21 118.70 122.82 1nuf s GLU 54 Ca -0.03 -0.46 -0.19 0.00 0.02 0.00 0.00 54.97 54.30 1nuf s GLU 54 Cb -0.14 -1.87 -0.09 0.00 0.10 0.00 0.00 34.13 32.13 1nuf s GLU 54 CO 0.04 -0.20 0.80 -0.06 0.02 0.00 0.00 175.26 175.86 1nuf s PHE 55 N 1.41 3.52 -0.15 1.61 0.40 0.09 -0.71 117.98 124.16 1nuf s PHE 55 Ca 0.02 1.43 -0.01 0.00 -0.60 0.00 0.00 56.93 57.77 1nuf s PHE 55 Cb -0.13 -2.68 0.04 0.00 0.51 0.00 0.00 43.02 40.76 1nuf s PHE 55 CO -0.07 0.18 -0.04 0.42 0.70 0.00 0.00 175.22 176.40 1nuf s ILE 56 N -1.78 0.93 0.10 0.64 1.01 -0.01 -1.47 121.20 120.63 1nuf s ILE 56 Ca 0.50 -0.46 0.09 0.00 0.00 0.00 0.00 60.65 60.78 1nuf s ILE 56 Cb -0.14 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 1nuf s ILE 56 CO 0.19 0.15 -0.19 0.68 0.00 0.00 0.00 174.94 175.78 1nuf s VAL 57 N 1.72 2.79 -0.06 2.92 -7.23 -0.91 -0.54 120.40 119.09 1nuf s VAL 57 Ca 0.02 -1.44 -0.30 0.00 -1.81 0.00 0.00 61.98 58.45 1nuf s VAL 57 Cb -0.15 -2.25 0.08 0.00 0.56 0.00 0.00 36.38 34.63 1nuf s VAL 57 CO -0.07 0.16 0.75 -0.94 -0.31 0.00 0.00 175.10 174.69 1nuf s SER 58 N -1.96 -0.58 -0.00 4.85 1.04 -0.98 -1.92 113.70 114.15 1nuf s SER 58 Ca 0.17 0.58 -0.05 0.00 0.48 0.00 0.00 55.95 57.13 1nuf s SER 58 Cb -0.11 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 1nuf s SER 58 CO 0.09 -0.58 0.09 0.28 0.98 0.00 0.00 173.24 174.10 1nuf s THR 59 N -1.40 0.08 0.00 2.02 -1.32 0.24 -1.85 115.64 113.41 1nuf s THR 59 Ca -0.08 -0.64 0.00 0.00 -1.21 0.00 0.00 61.69 59.77 1nuf s THR 59 Cb -0.00 -0.35 0.00 0.00 -1.51 0.00 0.00 72.50 70.64 1nuf s THR 59 CO 0.06 -0.35 0.00 0.61 -2.21 0.00 0.00 174.62 172.73 1nuf n GLY 60 N 1.74 -0.58 0.00 6.08 0.00 -1.26 -4.15 105.19 107.02 1nuf n GLY 60 Ca -0.21 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.20 1nuf n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nuf n PRO 61 N -0.63 0.16 -3.19 1.61 -0.04 -1.26 -3.99 135.00 127.65 1nuf n PRO 61 Ca 0.00 0.12 -0.21 0.00 -0.04 0.00 0.00 63.50 63.37 1nuf n PRO 61 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 1nuf n PRO 61 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1nuf n TYR 62 N -1.39 0.23 -1.59 0.54 4.01 -1.26 -5.06 117.16 112.64 1nuf n TYR 62 Ca 0.08 -3.74 -0.54 0.00 -0.16 0.00 0.00 57.90 53.54 1nuf n TYR 62 Cb 0.20 -0.40 -0.07 0.00 -0.31 0.00 0.00 39.34 38.76 1nuf n TYR 62 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1nuf n PRO 63 N 0.71 1.19 -4.58 -0.72 -0.02 -1.26 -4.94 135.00 125.39 1nuf n PRO 63 Ca 0.24 0.40 -0.27 0.00 -2.02 0.00 0.00 63.50 61.85 1nuf n PRO 63 Cb 0.59 -2.27 -0.17 0.00 -0.02 0.00 0.00 33.50 31.64 1nuf n PRO 63 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nuf s SER 64 N 5.11 2.15 0.16 2.55 0.15 -1.25 -4.84 113.70 117.73 1nuf s SER 64 Ca 1.03 -0.37 -0.15 0.00 0.70 0.00 0.00 55.95 57.16 1nuf s SER 64 Cb -0.97 -0.97 0.08 0.00 -1.71 0.00 0.00 66.02 62.45 1nuf s SER 64 CO 0.58 0.03 1.77 -0.33 1.20 0.00 0.00 173.24 176.49 1nuf h GLU 65 N 7.15 0.35 0.00 5.44 3.07 -1.90 -2.14 114.58 126.55 1nuf h GLU 65 Ca -0.29 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.54 1nuf h GLU 65 Cb 1.19 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 1nuf h GLU 65 CO 0.47 0.23 0.00 -1.13 -1.40 0.00 0.00 179.01 177.19 1nuf n SER 66 N -4.96 0.00 -0.05 1.42 3.41 -1.26 -2.50 113.62 109.69 1nuf n SER 66 Ca 0.02 -1.34 0.01 0.00 -0.26 0.00 0.00 58.87 57.30 1nuf n SER 66 Cb 0.12 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1nuf n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nuf n ALA 67 N -0.67 2.46 -0.82 7.33 0.00 -0.83 -4.98 120.51 123.02 1nuf n ALA 67 Ca 0.06 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1nuf n ALA 67 Cb 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1nuf n ALA 67 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nuf n MET 68 N 0.03 -0.07 -0.21 0.00 2.81 -1.04 -4.76 117.12 113.88 1nuf n MET 68 Ca 0.01 0.02 0.04 0.00 -1.81 0.00 0.00 57.70 55.96 1nuf n MET 68 Cb 0.04 -3.34 0.15 0.00 -0.71 0.00 0.00 33.22 29.36 1nuf n MET 68 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1nuf n THR 69 N -2.05 0.61 -3.64 2.03 -2.24 -1.06 -4.58 114.28 103.34 1nuf n THR 69 Ca 0.00 -0.46 -0.07 0.00 -2.27 0.00 0.00 64.05 61.25 1nuf n THR 69 Cb 0.02 0.05 -0.07 0.00 -2.10 0.00 0.00 70.33 68.23 1nuf n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1nuf s LYS 70 N -1.62 0.46 -0.06 -0.78 2.20 -1.08 -0.59 119.74 118.27 1nuf s LYS 70 Ca 0.21 0.65 -0.10 0.00 -0.36 0.00 0.00 55.97 56.37 1nuf s LYS 70 Cb 0.13 0.18 0.02 0.00 -1.51 0.00 0.00 37.83 36.64 1nuf s LYS 70 CO 0.12 -0.07 0.25 0.00 -0.36 0.00 0.00 175.35 175.29 1nuf s ALA 71 N 0.70 -0.62 -0.12 3.13 0.00 -0.81 -3.80 121.76 120.23 1nuf s ALA 71 Ca -0.02 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.47 1nuf s ALA 71 Cb -0.04 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.85 1nuf s ALA 71 CO -0.10 -0.17 -0.18 0.08 0.00 0.00 0.00 175.76 175.40 1nuf s VAL 72 N -0.41 1.72 0.00 0.00 1.01 -1.26 -2.14 120.40 119.33 1nuf s VAL 72 Ca -0.05 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1nuf s VAL 72 Cb -0.03 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 1nuf s VAL 72 CO 0.01 0.48 -0.04 0.72 0.00 0.00 0.00 175.10 176.28 1nuf s PHE 73 N 0.96 0.33 0.16 5.22 -0.71 -0.54 -4.96 117.98 118.44 1nuf s PHE 73 Ca -0.06 -0.13 -0.30 0.00 -1.04 0.00 0.00 56.93 55.40 1nuf s PHE 73 Cb -0.15 -0.21 -0.08 0.00 -1.21 0.00 0.00 43.02 41.38 1nuf s PHE 73 CO -0.03 -0.02 1.19 -2.14 -1.34 0.00 0.00 175.22 172.88 1nuf s PRO 74 N -0.32 4.49 -0.39 1.99 0.02 -1.26 -0.73 135.00 138.80 1nuf s PRO 74 Ca -0.01 1.84 -0.28 0.00 0.02 0.00 0.00 61.00 62.57 1nuf s PRO 74 Cb -0.03 -3.26 -0.02 0.00 0.02 0.00 0.00 34.50 31.21 1nuf s PRO 74 CO -0.00 -0.11 1.78 -1.17 -0.33 0.00 0.00 177.00 177.17 1nuf s LEU 75 N 0.02 3.47 0.00 -5.54 0.20 -0.35 -3.91 118.68 112.58 1nuf s LEU 75 Ca 0.54 1.09 0.05 0.00 0.69 0.00 0.00 54.13 56.49 1nuf s LEU 75 Cb -0.32 -3.33 0.05 0.00 -0.43 0.00 0.00 46.19 42.17 1nuf s LEU 75 CO 0.35 -1.82 0.41 -1.20 -0.29 0.00 0.00 176.35 173.80 1nuf n SER 76 N 10.66 1.82 -0.00 3.68 7.64 0.86 -4.82 113.62 133.45 1nuf n SER 76 Ca 0.22 -2.17 0.07 0.00 1.01 0.00 0.00 58.87 58.00 1nuf n SER 76 Cb 0.48 -0.16 -0.08 0.00 -1.01 0.00 0.00 64.21 63.44 1nuf n SER 76 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1nuf n ASN 77 N -2.21 0.75 -4.16 6.43 6.94 -1.26 -0.44 115.26 121.31 1nuf n ASN 77 Ca 0.05 -0.76 -0.11 0.00 -0.02 0.00 0.00 54.58 53.74 1nuf n ASN 77 Cb 0.42 1.06 -0.10 0.00 -2.36 0.00 0.00 39.78 38.79 1nuf n ASN 77 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1nuf s GLY 78 N -2.44 0.75 0.26 4.83 0.00 -1.26 -4.81 107.32 104.64 1nuf s GLY 78 Ca 0.04 -1.26 -0.20 0.00 0.00 0.00 0.00 44.72 43.30 1nuf s GLY 78 CO 0.58 -1.36 0.77 -1.35 0.00 0.00 0.00 173.10 171.75 1nuf s SER 79 N -2.79 7.07 0.00 1.64 1.04 -1.26 -4.80 113.70 114.60 1nuf s SER 79 Ca 0.08 1.49 0.00 0.00 0.48 0.00 0.00 55.95 58.00 1nuf s SER 79 Cb 0.02 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.70 1nuf s SER 79 CO -0.03 -0.03 0.00 -1.54 0.98 0.00 0.00 173.24 172.62 1nuf n SER 80 N 0.52 0.79 -5.00 7.02 3.41 -1.26 -5.13 113.62 113.96 1nuf n SER 80 Ca -0.01 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 1nuf n SER 80 Cb 0.51 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.47 1nuf n SER 80 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1nuf s GLY 81 N -0.33 1.84 0.00 5.00 0.00 -1.26 -4.91 107.32 107.66 1nuf s GLY 81 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.14 1nuf s GLY 81 CO 0.00 -1.42 0.00 0.61 0.00 0.00 0.00 173.10 172.29 1nuf n GLY 82 N -1.83 2.88 3.79 0.20 0.00 -1.26 -4.52 105.19 104.45 1nuf n GLY 82 Ca 0.06 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 1nuf n GLY 82 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nuf s TRP 83 N 0.00 3.20 -0.11 1.61 0.52 -1.26 -3.70 118.94 119.21 1nuf s TRP 83 Ca 0.00 1.63 -0.30 0.00 0.02 0.00 0.00 56.10 57.44 1nuf s TRP 83 Cb 0.00 -3.08 0.11 0.00 -1.15 0.00 0.00 33.47 29.35 1nuf s TRP 83 CO 0.00 -0.62 0.88 -1.54 0.02 0.00 0.00 176.95 175.69 1nuf s SER 84 N -1.74 -0.47 -0.06 2.95 1.04 -0.66 -4.82 113.70 109.93 1nuf s SER 84 Ca 0.61 0.49 0.04 0.00 0.48 0.00 0.00 55.95 57.57 1nuf s SER 84 Cb -0.19 0.39 -0.00 0.00 0.10 0.00 0.00 66.02 66.32 1nuf s SER 84 CO 0.24 -0.46 -0.20 0.00 0.98 0.00 0.00 173.24 173.80 1nuf s ALA 85 N -1.27 1.83 -0.14 5.32 0.00 -1.25 -1.61 121.76 124.63 1nuf s ALA 85 Ca -0.05 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.10 1nuf s ALA 85 Cb -0.00 -0.64 0.02 0.00 0.00 0.00 0.00 23.12 22.50 1nuf s ALA 85 CO 0.04 0.30 -0.14 0.08 0.00 0.00 0.00 175.76 176.03 1nuf s VAL 86 N 0.15 1.53 -0.41 0.00 1.01 0.38 -0.10 120.40 122.97 1nuf s VAL 86 Ca -0.09 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 1nuf s VAL 86 Cb -0.14 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.82 1nuf s VAL 86 CO 0.05 0.45 1.15 -0.22 0.00 0.00 0.00 175.10 176.53 1nuf s LEU 87 N 1.39 3.75 -0.04 3.92 2.96 0.41 -1.51 118.68 129.56 1nuf s LEU 87 Ca 0.02 0.75 0.20 0.00 -0.22 0.00 0.00 54.13 54.88 1nuf s LEU 87 Cb -0.13 -3.55 -0.25 0.00 0.50 0.00 0.00 46.19 42.76 1nuf s LEU 87 CO -0.09 -1.13 0.48 0.00 -1.32 0.00 0.00 176.35 174.29 1nuf n GLN 88 N 7.51 0.66 -3.59 1.98 6.02 -0.67 -4.79 117.38 124.49 1nuf n GLN 88 Ca 0.13 -0.04 -0.10 0.00 -0.01 0.00 0.00 57.00 56.97 1nuf n GLN 88 Cb 0.48 -1.60 -0.06 0.00 1.02 0.00 0.00 30.24 30.08 1nuf n GLN 88 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nuf s ALA 89 N -3.12 -1.94 -0.38 -1.58 0.00 -1.21 -5.00 121.76 108.53 1nuf s ALA 89 Ca -0.07 1.66 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1nuf s ALA 89 Cb 0.10 -0.90 0.13 0.00 0.00 0.00 0.00 23.12 22.46 1nuf s ALA 89 CO 0.86 -0.29 0.20 -1.54 0.00 0.00 0.00 175.76 174.99 1nuf s SER 90 N -0.75 3.38 -0.85 0.00 1.04 -1.26 -0.92 113.70 114.33 1nuf s SER 90 Ca -0.01 -2.23 -0.18 0.00 0.48 0.00 0.00 55.95 54.02 1nuf s SER 90 Cb -0.02 -0.68 0.14 0.00 0.10 0.00 0.00 66.02 65.56 1nuf s SER 90 CO -0.00 -0.31 1.00 0.20 0.98 0.00 0.00 173.24 175.10 1nuf s ASN 91 N 0.94 6.56 1.78 7.02 0.01 -0.72 -4.90 114.94 125.62 1nuf s ASN 91 Ca 0.16 -1.98 0.00 0.00 -0.71 0.00 0.00 52.86 50.33 1nuf s ASN 91 Cb -0.22 -2.36 0.00 0.00 0.41 0.00 0.00 41.25 39.08 1nuf s ASN 91 CO -0.05 -1.02 0.00 0.61 -1.51 0.00 0.00 177.10 175.13 1nuf n GLY 92 N 5.20 1.79 0.07 0.66 0.00 -1.26 -2.34 105.19 109.32 1nuf n GLY 92 Ca 0.16 0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.31 1nuf n GLY 92 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1nuf h ASN 93 N 0.00 0.04 -3.47 1.61 4.21 -1.89 -3.40 115.58 112.68 1nuf h ASN 93 Ca 0.00 -0.06 -0.54 0.00 1.21 0.00 0.00 56.30 56.92 1nuf h ASN 93 Cb 0.00 -0.01 -0.03 0.00 -1.12 0.00 0.00 38.32 37.15 1nuf h ASN 93 CO 0.00 1.05 0.17 -0.89 -1.29 0.00 0.00 177.43 176.47 1nuf s THR 94 N -2.65 4.57 -0.17 2.81 2.01 -0.99 -1.94 115.64 119.29 1nuf s THR 94 Ca -0.03 1.67 -0.00 0.00 0.31 0.00 0.00 61.69 63.65 1nuf s THR 94 Cb 0.09 -4.13 -0.00 0.00 0.01 0.00 0.00 72.50 68.47 1nuf s THR 94 CO 0.83 0.43 -0.14 -0.76 -0.69 0.00 0.00 174.62 174.28 1nuf s LEU 95 N -0.52 2.51 -0.32 4.42 1.43 0.13 -1.75 118.68 124.57 1nuf s LEU 95 Ca 0.38 -0.47 -0.19 0.00 -1.03 0.00 0.00 54.13 52.81 1nuf s LEU 95 Cb -0.22 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 1nuf s LEU 95 CO 0.25 0.06 0.56 -0.89 0.23 0.00 0.00 176.35 176.56 1nuf s THR 96 N 0.94 4.99 -0.01 5.49 2.01 -0.10 -0.34 115.64 128.62 1nuf s THR 96 Ca -0.03 0.63 0.07 0.00 0.31 0.00 0.00 61.69 62.67 1nuf s THR 96 Cb -0.15 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.39 1nuf s THR 96 CO -0.02 -0.13 -0.23 -0.63 -0.69 0.00 0.00 174.62 172.91 1nuf s ILE 97 N 2.47 1.85 -0.20 1.82 1.01 0.27 -1.67 121.20 126.75 1nuf s ILE 97 Ca 0.22 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.82 1nuf s ILE 97 Cb -0.15 -1.54 -0.00 0.00 0.01 0.00 0.00 42.46 40.78 1nuf s ILE 97 CO 0.12 0.50 -0.10 -0.55 0.00 0.00 0.00 174.94 174.92 1nuf s SER 98 N -0.60 3.94 0.08 3.58 0.15 -0.57 -0.74 113.70 119.54 1nuf s SER 98 Ca 0.09 -0.45 0.05 0.00 0.70 0.00 0.00 55.95 56.33 1nuf s SER 98 Cb -0.09 -1.65 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 1nuf s SER 98 CO -0.01 0.01 -0.01 -0.63 1.20 0.00 0.00 173.24 173.80 1nuf s ILE 99 N 1.29 3.95 -0.04 6.45 1.01 -0.11 -0.47 121.20 133.28 1nuf s ILE 99 Ca 0.04 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1nuf s ILE 99 Cb -0.14 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.48 1nuf s ILE 99 CO -0.05 0.16 0.13 -0.94 0.00 0.00 0.00 174.94 174.24 1nuf s SER 100 N -2.18 -0.11 0.23 3.58 1.04 -0.64 -1.00 113.70 114.62 1nuf s SER 100 Ca 0.24 0.20 0.07 0.00 0.48 0.00 0.00 55.95 56.95 1nuf s SER 100 Cb -0.12 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.23 1nuf s SER 100 CO 0.16 -0.08 0.13 -0.94 0.98 0.00 0.00 173.24 173.49 1nuf s SER 101 N -0.10 5.28 0.33 7.02 1.04 -1.26 -1.65 113.70 124.36 1nuf s SER 101 Ca -0.02 -0.31 -0.27 0.00 0.48 0.00 0.00 55.95 55.83 1nuf s SER 101 Cb -0.02 -1.28 -0.09 0.00 0.10 0.00 0.00 66.02 64.73 1nuf s SER 101 CO 0.00 0.00 1.04 -2.16 0.98 0.00 0.00 173.24 173.10 1nuf s PRO 102 N -3.59 4.46 0.32 4.02 0.04 -1.24 -2.38 135.00 136.62 1nuf s PRO 102 Ca 0.32 1.57 0.17 0.00 0.04 0.00 0.00 61.00 63.10 1nuf s PRO 102 Cb -0.08 -2.86 0.94 0.00 0.04 0.00 0.00 34.50 32.53 1nuf s PRO 102 CO 0.23 0.11 1.48 0.00 0.04 0.00 0.00 177.00 178.86 1nuf n ALA 103 N 0.59 0.83 -1.33 8.56 0.00 -1.26 -1.31 120.51 126.60 1nuf n ALA 103 Ca 0.02 0.16 -0.04 0.00 0.00 0.00 0.00 53.44 53.58 1nuf n ALA 103 Cb 0.48 -1.05 0.21 0.00 0.00 0.00 0.00 19.45 19.09 1nuf n ALA 103 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nuf n SER 104 N -2.15 2.94 -4.78 0.00 3.41 -1.26 -4.73 113.62 107.06 1nuf n SER 104 Ca -0.01 -3.60 -0.37 0.00 -0.26 0.00 0.00 58.87 54.63 1nuf n SER 104 Cb 0.17 -0.64 -0.05 0.00 -0.26 0.00 0.00 64.21 63.43 1nuf n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nuf s ALA 105 N -3.17 3.17 0.46 7.33 0.00 -0.43 -4.79 121.76 124.34 1nuf s ALA 105 Ca 0.46 0.66 -0.24 0.00 0.00 0.00 0.00 51.96 52.84 1nuf s ALA 105 Cb 0.40 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 20.20 1nuf s ALA 105 CO 0.03 -0.08 1.33 -2.14 0.00 0.00 0.00 175.76 174.91 1nuf s PRO 106 N -2.22 3.63 0.30 0.00 0.02 -1.26 -4.44 135.00 131.02 1nuf s PRO 106 Ca 0.54 2.20 -0.12 0.00 0.02 0.00 0.00 61.00 63.64 1nuf s PRO 106 Cb -0.22 -2.54 -0.08 0.00 0.02 0.00 0.00 34.50 31.68 1nuf s PRO 106 CO 0.28 -0.78 0.67 0.96 -0.33 0.00 0.00 177.00 177.79 1nuf s ILE 107 N -1.30 4.80 -5.00 2.83 -4.36 0.11 -4.85 121.20 113.44 1nuf s ILE 107 Ca 0.63 0.67 0.00 0.00 -0.26 0.00 0.00 60.65 61.69 1nuf s ILE 107 Cb -0.39 -3.64 0.00 0.00 1.25 0.00 0.00 42.46 39.68 1nuf s ILE 107 CO 0.49 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 176.07 1nuf n GLY 108 N -0.48 0.43 3.70 6.27 0.00 -0.60 -4.88 105.19 109.63 1nuf n GLY 108 Ca 0.02 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 1nuf n GLY 108 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nuf s ARG 109 N -2.00 4.41 0.42 1.61 0.52 -1.26 -1.97 118.95 120.68 1nuf s ARG 109 Ca 0.00 1.08 0.07 0.00 -0.52 0.00 0.00 55.73 56.36 1nuf s ARG 109 Cb 0.00 -3.51 -0.06 0.00 0.52 0.00 0.00 34.95 31.90 1nuf s ARG 109 CO 0.00 -0.14 0.09 0.71 0.02 0.00 0.00 175.30 175.99 1nuf s TYR 110 N 1.45 2.54 0.03 -0.53 1.51 -0.51 -4.33 117.35 117.50 1nuf s TYR 110 Ca 0.42 -0.64 0.05 0.00 -1.01 0.00 0.00 57.07 55.88 1nuf s TYR 110 Cb -0.18 -1.86 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 1nuf s TYR 110 CO 0.18 0.31 -0.14 0.99 -1.11 0.00 0.00 175.55 175.78 1nuf s THR 111 N -2.66 1.12 -0.04 -0.71 2.01 -0.77 -2.78 115.64 111.80 1nuf s THR 111 Ca 0.37 -0.89 0.07 0.00 0.31 0.00 0.00 61.69 61.54 1nuf s THR 111 Cb 0.07 -0.99 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 1nuf s THR 111 CO 0.20 0.09 -0.24 -0.32 -0.69 0.00 0.00 174.62 173.66 1nuf s MET 112 N -0.92 2.25 0.12 4.92 1.75 0.77 -2.33 119.30 125.86 1nuf s MET 112 Ca 0.03 -0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 53.58 1nuf s MET 112 Cb -0.07 -2.02 -0.04 0.00 2.84 0.00 0.00 34.83 35.54 1nuf s MET 112 CO 0.01 0.44 0.04 0.00 -0.65 0.00 0.00 175.02 174.86 1nuf s ALA 113 N -0.34 0.81 -0.07 4.11 0.00 0.30 0.63 121.76 127.20 1nuf s ALA 113 Ca 0.02 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 50.58 1nuf s ALA 113 Cb -0.12 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.75 1nuf s ALA 113 CO 0.01 -0.45 -0.09 -1.17 0.00 0.00 0.00 175.76 174.06 1nuf s LEU 114 N -3.03 1.45 -0.37 0.00 2.96 -0.42 -0.83 118.68 118.45 1nuf s LEU 114 Ca 0.21 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 53.78 1nuf s LEU 114 Cb 0.08 -0.72 0.04 0.00 0.50 0.00 0.00 46.19 46.09 1nuf s LEU 114 CO -0.01 -0.02 0.18 -1.58 -1.32 0.00 0.00 176.35 173.60 1nuf s GLN 115 N 0.94 2.69 -0.20 1.98 0.74 0.12 -2.15 119.66 123.78 1nuf s GLN 115 Ca -0.10 -1.20 -0.15 0.00 0.05 0.00 0.00 55.36 53.97 1nuf s GLN 115 Cb -0.15 -3.63 -0.04 0.00 1.10 0.00 0.00 33.01 30.29 1nuf s GLN 115 CO 0.01 -0.74 0.34 0.42 -0.55 0.00 0.00 175.29 174.76 1nuf s ILE 116 N 1.47 5.25 -0.30 -2.34 1.01 -0.09 -1.59 121.20 124.60 1nuf s ILE 116 Ca 0.01 0.58 -0.12 0.00 0.00 0.00 0.00 60.65 61.12 1nuf s ILE 116 Cb -0.20 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1nuf s ILE 116 CO 0.04 0.29 0.22 -0.36 0.00 0.00 0.00 174.94 175.13 1nuf s PHE 117 N 1.14 3.22 -0.30 3.97 0.08 0.68 -2.37 117.98 124.41 1nuf s PHE 117 Ca 0.16 0.06 -0.13 0.00 0.12 0.00 0.00 56.93 57.14 1nuf s PHE 117 Cb -0.14 -2.43 0.13 0.00 -0.57 0.00 0.00 43.02 40.01 1nuf s PHE 117 CO 0.07 -0.22 0.78 0.45 -0.10 0.00 0.00 175.22 176.20 1nuf s SER 118 N 1.74 -0.89 -1.11 1.36 0.15 -1.10 -1.88 113.70 111.97 1nuf s SER 118 Ca 0.08 1.28 -0.04 0.00 0.70 0.00 0.00 55.95 57.96 1nuf s SER 118 Cb -0.16 1.84 -0.04 0.00 -1.71 0.00 0.00 66.02 65.95 1nuf s SER 118 CO 0.11 -0.18 0.95 0.00 1.20 0.00 0.00 173.24 175.31 1nuf n GLN 119 N 4.92 -3.86 -0.68 5.44 6.02 -1.26 -2.71 117.38 125.24 1nuf n GLN 119 Ca -0.13 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.71 1nuf n GLN 119 Cb 0.53 -5.83 0.00 0.00 1.02 0.00 0.00 30.24 25.96 1nuf n GLN 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nuf n GLY 120 N -1.20 0.24 2.95 1.08 0.00 -1.26 -4.94 105.19 102.06 1nuf n GLY 120 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1nuf n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nuf n GLY 121 N -1.73 3.63 3.20 -0.02 0.00 -1.10 -5.16 105.19 104.01 1nuf n GLY 121 Ca 0.00 -2.34 -0.13 0.00 0.00 0.00 0.00 46.02 43.55 1nuf n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nuf s ILE 122 N -2.47 0.04 0.10 -0.61 1.01 -1.26 -2.70 121.20 115.30 1nuf s ILE 122 Ca 0.02 -0.31 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 1nuf s ILE 122 Cb -0.00 -0.51 0.03 0.00 0.01 0.00 0.00 42.46 41.99 1nuf s ILE 122 CO 0.01 -0.17 0.36 -0.94 0.00 0.00 0.00 174.94 174.20 1nuf s SER 123 N -0.72 -0.18 0.21 3.58 1.04 -1.00 -5.01 113.70 111.61 1nuf s SER 123 Ca -0.08 -0.29 0.05 0.00 0.48 0.00 0.00 55.95 56.10 1nuf s SER 123 Cb -0.04 0.43 -0.05 0.00 0.10 0.00 0.00 66.02 66.46 1nuf s SER 123 CO 0.02 -0.77 -0.06 -0.44 0.98 0.00 0.00 173.24 172.97 1nuf s SER 124 N -2.58 1.99 -0.28 7.02 0.01 -1.26 -0.92 113.70 117.68 1nuf s SER 124 Ca 0.01 -1.13 -0.19 0.00 1.31 0.00 0.00 55.95 55.95 1nuf s SER 124 Cb 0.02 -0.03 0.12 0.00 0.21 0.00 0.00 66.02 66.33 1nuf s SER 124 CO -0.09 -0.40 0.91 0.54 0.41 0.00 0.00 173.24 174.61 1nuf s VAL 125 N -3.30 0.00 0.22 3.43 0.11 -0.91 -4.99 120.40 114.95 1nuf s VAL 125 Ca 0.24 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.99 1nuf s VAL 125 Cb 0.04 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.80 1nuf s VAL 125 CO 0.06 0.00 1.15 -0.75 -3.33 0.00 0.00 175.10 172.23 1nuf s LYS 126 N 1.00 4.55 -0.25 1.54 2.20 -1.26 -1.30 119.74 126.22 1nuf s LYS 126 Ca -0.05 1.84 -0.06 0.00 -0.36 0.00 0.00 55.97 57.34 1nuf s LYS 126 Cb -0.04 -3.23 -0.16 0.00 -1.51 0.00 0.00 37.83 32.89 1nuf s LYS 126 CO -0.12 0.03 -0.21 1.28 -0.36 0.00 0.00 175.35 175.97 1nuf n LEU 127 N 2.02 2.53 0.00 5.43 4.77 0.20 -4.92 117.00 127.04 1nuf n LEU 127 Ca 0.02 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1nuf n LEU 127 Cb 0.45 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1nuf n LEU 127 CO 0.55 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.99 1nuf n GLY 128 N 1.84 -0.57 3.12 -0.72 0.00 -0.95 -4.99 105.19 102.91 1nuf n GLY 128 Ca -0.48 -0.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.72 1nuf n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nuf s THR 129 N -3.35 0.20 0.21 2.61 -4.23 -1.26 -0.16 115.64 109.66 1nuf s THR 129 Ca 0.00 -1.64 -0.22 0.00 -1.18 0.00 0.00 61.69 58.65 1nuf s THR 129 Cb 0.00 -1.46 0.05 0.00 1.34 0.00 0.00 72.50 72.43 1nuf s THR 129 CO 0.00 -0.91 0.65 0.72 -0.54 0.00 0.00 174.62 174.55 1nuf s PHE 130 N -3.87 -0.39 -0.10 3.99 -0.71 -1.12 -4.62 117.98 111.17 1nuf s PHE 130 Ca 0.06 0.07 -0.01 0.00 -1.04 0.00 0.00 56.93 56.02 1nuf s PHE 130 Cb 0.07 0.62 -0.03 0.00 -1.21 0.00 0.00 43.02 42.48 1nuf s PHE 130 CO -0.10 -1.01 -0.06 0.42 -1.34 0.00 0.00 175.22 173.12 1nuf s ILE 131 N -3.82 3.70 -0.15 -4.49 1.01 -0.49 -1.42 121.20 115.54 1nuf s ILE 131 Ca 0.05 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1nuf s ILE 131 Cb -0.03 -2.55 -0.00 0.00 0.01 0.00 0.00 42.46 39.88 1nuf s ILE 131 CO -0.04 0.56 -0.15 -0.22 0.00 0.00 0.00 174.94 175.09 1nuf s LEU 132 N -0.36 2.53 0.44 2.97 1.98 -0.83 0.10 118.68 125.51 1nuf s LEU 132 Ca 0.05 -0.44 0.05 0.00 -2.89 0.00 0.00 54.13 50.90 1nuf s LEU 132 Cb -0.12 -1.58 -0.06 0.00 0.66 0.00 0.00 46.19 45.09 1nuf s LEU 132 CO 0.02 0.10 0.01 -0.76 -1.89 0.00 0.00 176.35 173.83 1nuf s LEU 133 N 0.73 2.67 0.52 -0.68 1.43 0.18 -1.56 118.68 121.97 1nuf s LEU 133 Ca -0.06 -1.46 -0.21 0.00 -1.03 0.00 0.00 54.13 51.36 1nuf s LEU 133 Cb -0.15 -0.82 -0.06 0.00 0.03 0.00 0.00 46.19 45.19 1nuf s LEU 133 CO 0.01 -0.58 1.23 -0.36 0.23 0.00 0.00 176.35 176.88 1nuf s PHE 134 N -2.79 2.56 -0.83 0.29 0.08 -0.81 -0.93 117.98 115.55 1nuf s PHE 134 Ca 0.26 1.48 -0.01 0.00 0.12 0.00 0.00 56.93 58.78 1nuf s PHE 134 Cb 0.07 -3.53 0.21 0.00 -0.57 0.00 0.00 43.02 39.20 1nuf s PHE 134 CO 0.13 -2.11 0.70 1.21 -0.10 0.00 0.00 175.22 175.05 1nuf s ASN 135 N -1.32 5.75 0.00 1.36 3.84 -1.26 -4.67 114.94 118.64 1nuf s ASN 135 Ca 0.70 -3.63 0.00 0.00 0.21 0.00 0.00 52.86 50.14 1nuf s ASN 135 Cb -0.32 -1.87 0.00 0.00 -0.55 0.00 0.00 41.25 38.51 1nuf s ASN 135 CO 0.38 -0.19 0.88 -2.65 -2.79 0.00 0.00 177.10 172.72 1nuf n PRO 136 N 2.44 0.00 0.06 0.43 -0.02 -1.26 -0.68 135.00 135.97 1nuf n PRO 136 Ca 0.19 0.38 0.09 0.00 -2.02 0.00 0.00 63.50 62.14 1nuf n PRO 136 Cb 0.37 -1.51 -0.05 0.00 -0.02 0.00 0.00 33.50 32.29 1nuf n PRO 136 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1nuf n TRP 137 N -1.38 0.75 -2.69 6.00 8.01 -1.26 -1.31 117.44 125.56 1nuf n TRP 137 Ca 0.00 0.22 -0.43 0.00 -1.31 0.00 0.00 57.50 55.98 1nuf n TRP 137 Cb 0.01 -0.89 -0.03 0.00 -2.01 0.00 0.00 31.31 28.39 1nuf n TRP 137 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 1nuf s LEU 138 N -5.25 3.78 0.46 -0.99 0.20 0.15 -4.91 118.68 112.12 1nuf s LEU 138 Ca -0.03 0.36 0.24 0.00 0.69 0.00 0.00 54.13 55.39 1nuf s LEU 138 Cb 0.10 -3.41 1.26 0.00 -0.43 0.00 0.00 46.19 43.70 1nuf s LEU 138 CO 0.82 -1.16 1.85 -0.55 -0.29 0.00 0.00 176.35 177.01 1nuf h ASN 139 N 9.13 0.25 -0.27 3.68 -1.07 -1.89 0.11 115.58 125.52 1nuf h ASN 139 Ca -0.23 0.03 0.00 0.00 0.07 0.00 0.00 56.30 56.17 1nuf h ASN 139 Cb 1.07 -0.01 0.00 0.00 -2.07 0.00 0.00 38.32 37.30 1nuf h ASN 139 CO 1.09 0.08 0.00 1.33 0.07 0.00 0.00 177.43 180.00 1nuf n VAL 140 N -4.43 0.36 -3.67 6.14 0.24 -1.26 -4.83 118.33 110.89 1nuf n VAL 140 Ca 0.20 -0.42 -0.36 0.00 -2.04 0.00 0.00 64.34 61.73 1nuf n VAL 140 Cb 0.86 0.29 -0.07 0.00 -1.47 0.00 0.00 33.84 33.44 1nuf n VAL 140 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1nuf s ASP 141 N -1.25 6.34 0.57 -1.34 3.68 0.38 -4.94 116.67 120.11 1nuf s ASP 141 Ca 0.27 0.39 0.32 0.00 2.13 0.00 0.00 52.55 55.66 1nuf s ASP 141 Cb 0.15 -2.13 1.44 0.00 -1.45 0.00 0.00 42.92 40.93 1nuf s ASP 141 CO 0.21 0.18 1.78 0.77 0.13 0.00 0.00 175.17 178.24 1nuf h SER 142 N 6.41 0.00 -0.38 -0.34 4.64 -1.88 0.42 113.55 122.42 1nuf h SER 142 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1nuf h SER 142 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1nuf h SER 142 CO 0.73 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 178.02 1nuf n VAL 143 N -3.89 0.50 -1.61 0.95 0.24 -1.26 -1.79 118.33 111.47 1nuf n VAL 143 Ca 0.18 -0.52 -0.46 0.00 -2.04 0.00 0.00 64.34 61.51 1nuf n VAL 143 Cb 1.04 0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 33.68 1nuf n VAL 143 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1nuf n PHE 144 N 0.65 1.54 -3.61 6.34 7.35 0.15 -4.39 117.46 125.48 1nuf n PHE 144 Ca 0.14 0.63 -0.27 0.00 -0.76 0.00 0.00 57.45 57.19 1nuf n PHE 144 Cb 0.34 -2.31 -0.17 0.00 0.35 0.00 0.00 39.48 37.69 1nuf n PHE 144 CO 0.00 0.00 0.00 1.41 -0.76 0.00 0.00 176.76 177.41 1nuf s MET 145 N -0.95 0.13 0.26 -4.13 -2.45 -0.43 -4.89 119.30 106.83 1nuf s MET 145 Ca 0.65 -0.19 -0.00 0.00 -1.25 0.00 0.00 55.69 54.89 1nuf s MET 145 Cb -0.73 -1.73 0.35 0.00 1.25 0.00 0.00 34.83 33.98 1nuf s MET 145 CO 0.55 -0.74 1.73 0.78 1.05 0.00 0.00 175.02 178.39 1nuf h GLY 146 N 8.40 0.70 -4.24 2.11 0.00 -1.94 -3.44 103.07 104.66 1nuf h GLY 146 Ca -0.16 -0.53 -0.52 0.00 0.00 0.00 0.00 47.33 46.12 1nuf h GLY 146 CO 0.32 0.49 0.50 0.21 0.00 0.00 0.00 176.54 178.06 1nuf s ASN 147 N -6.74 7.20 0.02 0.19 3.84 -1.26 -4.96 114.94 113.23 1nuf s ASN 147 Ca -0.08 2.04 -0.25 0.00 0.21 0.00 0.00 52.86 54.77 1nuf s ASN 147 Cb 0.14 -2.59 -0.17 0.00 -0.55 0.00 0.00 41.25 38.08 1nuf s ASN 147 CO 0.80 -0.31 1.34 -0.74 -2.79 0.00 0.00 177.10 175.40 1nuf h HIS 148 N 5.81 -0.31 -0.58 0.43 -0.00 -1.99 -1.22 115.15 117.29 1nuf h HIS 148 Ca -0.43 -0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 59.93 1nuf h HIS 148 Cb 1.21 0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 28.70 1nuf h HIS 148 CO 0.64 0.00 0.36 0.00 -0.00 0.00 0.00 177.93 178.93 1nuf h ALA 149 N 0.04 0.73 0.45 5.26 0.00 -1.99 0.09 119.26 123.83 1nuf h ALA 149 Ca -0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1nuf h ALA 149 Cb 0.45 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1nuf h ALA 149 CO 0.06 0.20 -0.26 0.93 0.00 0.00 0.00 179.25 180.18 1nuf h GLU 150 N 0.78 -0.64 -0.82 0.00 5.08 -1.97 -1.63 114.58 115.37 1nuf h GLU 150 Ca 0.21 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.70 1nuf h GLU 150 Cb -0.04 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 1nuf h GLU 150 CO -0.04 -0.43 0.54 -0.09 -1.00 0.00 0.00 179.01 177.99 1nuf h ARG 151 N -0.66 0.80 -0.51 2.33 2.43 -0.99 0.14 114.38 117.92 1nuf h ARG 151 Ca -0.05 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 1nuf h ARG 151 Cb 0.54 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 1nuf h ARG 151 CO 0.06 0.53 0.05 0.93 -1.51 0.00 0.00 179.97 180.03 1nuf h GLU 152 N 0.82 0.82 -0.01 0.20 4.39 -0.69 -2.19 114.58 117.93 1nuf h GLU 152 Ca 0.37 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 1nuf h GLU 152 Cb 0.36 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1nuf h GLU 152 CO -0.14 0.79 -0.04 1.49 -1.16 0.00 0.00 179.01 179.95 1nuf h GLU 153 N 0.78 0.04 -0.49 2.33 4.57 -0.12 -1.71 114.58 119.98 1nuf h GLU 153 Ca 0.16 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1nuf h GLU 153 Cb 0.40 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 1nuf h GLU 153 CO 0.01 0.72 0.00 0.66 -1.18 0.00 0.00 179.01 179.22 1nuf n TYR 154 N -4.72 0.47 0.00 0.92 4.01 -0.13 -3.71 117.16 114.00 1nuf n TYR 154 Ca -0.09 -0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 1nuf n TYR 154 Cb 0.36 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1nuf n TYR 154 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1nuf n VAL 155 N 0.21 0.00 0.50 -0.72 0.31 -0.82 -1.05 118.33 116.75 1nuf n VAL 155 Ca 0.09 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.53 1nuf n VAL 155 Cb 0.34 -0.16 0.05 0.00 -0.91 0.00 0.00 33.84 33.16 1nuf n VAL 155 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nuf n GLN 156 N -2.01 0.34 -2.73 5.55 1.13 -0.82 -4.80 117.38 114.03 1nuf n GLN 156 Ca 0.00 0.02 -0.42 0.00 -1.94 0.00 0.00 57.00 54.66 1nuf n GLN 156 Cb 0.00 -1.64 -0.03 0.00 0.11 0.00 0.00 30.24 28.68 1nuf n GLN 156 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1nuf s GLU 157 N -3.22 4.45 0.00 -1.09 2.56 -0.71 -4.93 118.70 115.77 1nuf s GLU 157 Ca 0.03 1.34 0.13 0.00 0.00 0.00 0.00 54.97 56.48 1nuf s GLU 157 Cb 0.14 -3.52 0.17 0.00 2.00 0.00 0.00 34.13 32.92 1nuf s GLU 157 CO 0.79 -0.22 1.01 -0.40 -0.56 0.00 0.00 175.26 175.88 1nuf n ASP 158 N 4.65 2.35 -4.40 -1.70 5.75 -1.26 -4.90 116.55 117.04 1nuf n ASP 158 Ca 0.07 -1.66 -0.34 0.00 -0.01 0.00 0.00 54.79 52.85 1nuf n ASP 158 Cb 0.50 -0.07 -0.13 0.00 -1.03 0.00 0.00 41.12 40.39 1nuf n ASP 158 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nuf s ALA 159 N -1.08 2.87 0.43 2.12 0.00 -1.26 -1.47 121.76 123.38 1nuf s ALA 159 Ca 0.18 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1nuf s ALA 159 Cb 0.12 -1.58 -0.03 0.00 0.00 0.00 0.00 23.12 21.63 1nuf s ALA 159 CO 0.17 -0.05 0.06 0.20 0.00 0.00 0.00 175.76 176.13 1nuf s GLY 160 N 0.84 2.67 -0.02 0.00 0.00 0.68 -4.96 107.32 106.53 1nuf s GLY 160 Ca -0.01 -1.18 -0.00 0.00 0.00 0.00 0.00 44.72 43.53 1nuf s GLY 160 CO 0.01 -2.00 0.03 -0.42 0.00 0.00 0.00 173.10 170.73 1nuf s ILE 161 N -3.04 -0.05 -0.11 0.90 -1.09 -1.26 -1.50 121.20 115.04 1nuf s ILE 161 Ca 0.20 0.24 0.03 0.00 -2.23 0.00 0.00 60.65 58.89 1nuf s ILE 161 Cb 0.04 -0.10 0.01 0.00 -1.58 0.00 0.00 42.46 40.83 1nuf s ILE 161 CO 0.11 0.11 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.10 1nuf s ILE 162 N 1.25 1.81 0.09 2.92 1.01 -0.39 -4.35 121.20 123.53 1nuf s ILE 162 Ca -0.07 -0.85 -0.27 0.00 0.00 0.00 0.00 60.65 59.46 1nuf s ILE 162 Cb -0.13 -1.60 -0.06 0.00 0.01 0.00 0.00 42.46 40.68 1nuf s ILE 162 CO -0.03 0.50 0.86 -0.36 0.00 0.00 0.00 174.94 175.92 1nuf s PHE 163 N 0.72 3.79 0.00 3.97 0.40 -1.26 -0.93 117.98 124.66 1nuf s PHE 163 Ca -0.11 1.65 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 1nuf s PHE 163 Cb -0.16 -2.93 0.00 0.00 0.51 0.00 0.00 43.02 40.44 1nuf s PHE 163 CO 0.02 0.26 0.00 1.33 0.70 0.00 0.00 175.22 177.52 1nuf n VAL 164 N 2.71 0.00 0.00 -0.44 0.24 -0.47 -4.79 118.33 115.57 1nuf n VAL 164 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1nuf n VAL 164 Cb 0.50 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1nuf n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1nuf n GLY 165 N 1.27 1.02 3.38 7.63 0.00 -1.26 -1.09 105.19 116.14 1nuf n GLY 165 Ca 0.00 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 1nuf n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nuf s SER 166 N -4.00 0.23 0.00 1.61 1.04 -1.18 -4.55 113.70 106.84 1nuf s SER 166 Ca 0.00 -1.25 0.12 0.00 0.48 0.00 0.00 55.95 55.30 1nuf s SER 166 Cb 0.00 0.50 0.71 0.00 0.10 0.00 0.00 66.02 67.32 1nuf s SER 166 CO 0.00 -1.01 1.14 0.35 0.98 0.00 0.00 173.24 174.69 1nuf n THR 167 N -0.36 0.00 -0.10 2.02 -2.24 -1.26 -1.73 114.28 110.60 1nuf n THR 167 Ca 0.01 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.67 1nuf n THR 167 Cb 0.64 -0.79 -0.15 0.00 -2.10 0.00 0.00 70.33 67.92 1nuf n THR 167 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1nuf n ASN 168 N -0.98 0.44 -3.22 3.42 5.03 -1.26 -4.88 115.26 113.80 1nuf n ASN 168 Ca 0.09 -0.02 -0.02 0.00 0.87 0.00 0.00 54.58 55.50 1nuf n ASN 168 Cb 0.04 0.68 -0.02 0.00 -1.02 0.00 0.00 39.78 39.45 1nuf n ASN 168 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1nuf s ARG 169 N -2.50 0.67 -0.01 3.52 1.70 -0.71 -5.13 118.95 116.49 1nuf s ARG 169 Ca -0.15 -0.05 -0.30 0.00 -0.47 0.00 0.00 55.73 54.75 1nuf s ARG 169 Cb 0.07 -0.02 -0.05 0.00 -0.57 0.00 0.00 34.95 34.38 1nuf s ARG 169 CO 0.78 -1.13 1.40 0.42 -1.08 0.00 0.00 175.30 175.69 1nuf s ILE 170 N 2.17 3.75 0.09 4.99 1.01 -1.16 -3.12 121.20 128.93 1nuf s ILE 170 Ca 0.14 1.11 0.00 0.00 0.00 0.00 0.00 60.65 61.90 1nuf s ILE 170 Cb -0.08 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.67 1nuf s ILE 170 CO -0.15 -0.01 0.01 0.61 0.00 0.00 0.00 174.94 175.40 1nuf n GLY 171 N 3.65 3.89 3.26 6.18 0.00 -0.25 -4.97 105.19 116.95 1nuf n GLY 171 Ca 0.13 -2.23 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 1nuf n GLY 171 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1nuf s MET 172 N -2.33 0.81 -0.03 1.61 0.23 -1.26 -1.37 119.30 116.96 1nuf s MET 172 Ca 0.01 -0.44 0.02 0.00 -1.03 0.00 0.00 55.69 54.25 1nuf s MET 172 Cb -0.00 0.35 0.01 0.00 -1.53 0.00 0.00 34.83 33.66 1nuf s MET 172 CO 0.01 -0.26 -0.08 0.96 -2.03 0.00 0.00 175.02 173.62 1nuf s ILE 173 N -2.38 0.71 0.56 3.16 -4.36 -0.11 -4.91 121.20 113.88 1nuf s ILE 173 Ca -0.06 -0.31 -0.17 0.00 -0.26 0.00 0.00 60.65 59.85 1nuf s ILE 173 Cb -0.01 -0.65 -0.05 0.00 1.25 0.00 0.00 42.46 43.00 1nuf s ILE 173 CO -0.02 0.23 1.07 -0.83 0.24 0.00 0.00 174.94 175.63 1nuf s GLY 174 N 0.31 2.32 -0.07 6.27 0.00 -1.26 -1.26 107.32 113.63 1nuf s GLY 174 Ca -0.05 0.54 -0.03 0.00 0.00 0.00 0.00 44.72 45.18 1nuf s GLY 174 CO 0.00 0.87 0.16 0.86 0.00 0.00 0.00 173.10 175.00 1nuf s TRP 175 N -2.20 -0.19 -0.64 1.90 -0.11 -0.56 -4.87 118.94 112.27 1nuf s TRP 175 Ca 0.66 0.52 -0.19 0.00 1.22 0.00 0.00 56.10 58.31 1nuf s TRP 175 Cb -0.18 -0.05 0.10 0.00 -1.50 0.00 0.00 33.47 31.84 1nuf s TRP 175 CO 0.31 -0.17 0.79 1.21 -4.62 0.00 0.00 176.95 174.48 1nuf s ASN 176 N 1.07 6.23 0.05 5.86 2.47 0.72 -0.23 114.94 131.10 1nuf s ASN 176 Ca -0.08 -1.43 -0.23 0.00 0.42 0.00 0.00 52.86 51.54 1nuf s ASN 176 Cb -0.10 -2.33 -0.15 0.00 -1.45 0.00 0.00 41.25 37.22 1nuf s ASN 176 CO -0.06 -1.16 1.50 -0.26 -3.72 0.00 0.00 177.10 173.40 1nuf h PHE 177 N 9.20 0.14 -5.86 0.43 0.05 -1.58 -0.15 116.94 119.17 1nuf h PHE 177 Ca -0.25 -0.02 -0.44 0.00 3.82 0.00 0.00 57.97 61.08 1nuf h PHE 177 Cb 1.08 -0.04 -0.08 0.00 2.00 0.00 0.00 35.95 38.91 1nuf h PHE 177 CO 0.89 0.36 -0.67 0.41 -0.18 0.00 0.00 178.31 179.12 1nuf n GLY 178 N -0.38 -0.49 0.32 -1.45 0.00 -1.08 -4.20 105.19 97.91 1nuf n GLY 178 Ca -0.06 0.13 0.19 0.00 0.00 0.00 0.00 46.02 46.28 1nuf n GLY 178 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1nuf h GLN 179 N -1.43 0.00 -0.01 1.61 -0.00 -1.87 -0.25 115.11 113.17 1nuf h GLN 179 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.14 1nuf h GLN 179 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.82 1nuf h GLN 179 CO 0.62 0.00 -0.20 1.19 -0.00 0.00 0.00 178.83 180.45 1nuf n PHE 180 N -3.46 0.00 -1.59 0.06 3.72 -1.26 -3.80 117.46 111.13 1nuf n PHE 180 Ca -0.03 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.04 1nuf n PHE 180 Cb 0.08 -0.13 0.06 0.00 -0.94 0.00 0.00 39.48 38.56 1nuf n PHE 180 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1nuf s GLU 181 N -2.46 2.57 0.06 -1.08 0.41 -0.11 -1.63 118.70 116.47 1nuf s GLU 181 Ca 0.27 1.38 -0.37 0.00 -0.41 0.00 0.00 54.97 55.84 1nuf s GLU 181 Cb 0.20 -1.92 -0.19 0.00 -1.78 0.00 0.00 34.13 30.43 1nuf s GLU 181 CO 0.49 -1.43 0.96 -1.91 -0.49 0.00 0.00 175.26 172.89 1nuf n GLU 182 N -2.74 0.10 -0.13 1.61 4.07 -1.26 -1.60 120.64 120.69 1nuf n GLU 182 Ca 0.10 0.03 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 1nuf n GLU 182 Cb 0.52 -1.43 0.00 0.00 -0.06 0.00 0.00 31.44 30.48 1nuf n GLU 182 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1nuf n ASP 183 N 1.68 0.00 0.24 4.31 4.64 -1.26 -4.81 116.55 121.35 1nuf n ASP 183 Ca 0.19 0.00 -0.15 0.00 -1.38 0.00 0.00 54.79 53.45 1nuf n ASP 183 Cb 0.13 -1.58 -0.08 0.00 -1.04 0.00 0.00 41.12 38.55 1nuf n ASP 183 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 1nuf h ILE 184 N 0.00 0.50 -0.40 5.18 1.08 -1.58 -0.93 117.51 121.37 1nuf h ILE 184 Ca 0.00 -0.33 0.08 0.00 -0.39 0.00 0.00 64.86 64.22 1nuf h ILE 184 Cb 0.00 0.65 -0.09 0.00 -3.07 0.00 0.00 36.82 34.31 1nuf h ILE 184 CO 0.00 0.05 -0.24 0.25 -0.69 0.00 0.00 178.15 177.53 1nuf h LEU 185 N -0.83 -0.80 -0.26 1.44 5.85 -1.75 -1.43 115.31 117.54 1nuf h LEU 185 Ca -0.06 0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1nuf h LEU 185 Cb 0.56 0.41 -0.07 0.00 0.37 0.00 0.00 40.66 41.93 1nuf h LEU 185 CO 0.10 -0.26 -0.24 -1.28 -0.34 0.00 0.00 178.44 176.42 1nuf h SER 186 N -0.17 -0.77 -0.61 1.25 0.87 -1.92 -1.74 113.55 110.46 1nuf h SER 186 Ca 0.19 0.14 0.06 0.00 -1.23 0.00 0.00 61.79 60.95 1nuf h SER 186 Cb 0.47 0.37 -0.05 0.00 -0.44 0.00 0.00 62.40 62.74 1nuf h SER 186 CO -0.50 -0.27 0.32 0.40 -0.53 0.00 0.00 176.83 176.25 1nuf h ILE 187 N -0.24 0.94 -0.51 2.23 2.04 -0.51 -0.63 117.51 120.84 1nuf h ILE 187 Ca 0.14 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 1nuf h ILE 187 Cb 0.46 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1nuf h ILE 187 CO -0.40 0.11 0.30 0.00 0.00 0.00 0.00 178.15 178.16 1nuf h LEU 189 N 0.70 0.00 -0.93 0.00 3.38 -0.43 -2.71 115.31 115.32 1nuf h LEU 189 Ca 0.18 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 1nuf h LEU 189 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1nuf h LEU 189 CO -0.03 0.48 -0.22 0.28 0.09 0.00 0.00 178.44 179.04 1nuf h SER 190 N 0.00 0.52 -0.56 -0.43 0.02 0.62 -3.01 113.55 110.71 1nuf h SER 190 Ca -0.00 -0.17 0.11 0.00 -0.84 0.00 0.00 61.79 60.89 1nuf h SER 190 Cb 0.92 -0.14 -0.09 0.00 0.14 0.00 0.00 62.40 63.23 1nuf h SER 190 CO 0.06 0.75 0.03 0.40 -1.14 0.00 0.00 176.83 176.92 1nuf h ILE 191 N 0.46 0.57 0.00 3.27 2.04 -0.90 -0.27 117.51 122.69 1nuf h ILE 191 Ca 0.07 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 1nuf h ILE 191 Cb 0.64 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1nuf h ILE 191 CO 0.05 0.03 -0.03 -0.07 0.00 0.00 0.00 178.15 178.13 1nuf h LEU 192 N 0.14 0.00 -1.21 1.44 3.38 -1.62 -0.14 115.31 117.31 1nuf h LEU 192 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1nuf h LEU 192 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1nuf h LEU 192 CO -0.46 0.03 0.00 0.47 0.09 0.00 0.00 178.44 178.57 1nuf n ASP 193 N -3.89 1.77 0.00 -0.43 8.00 -0.13 -3.73 116.55 118.14 1nuf n ASP 193 Ca -0.03 -1.87 0.00 0.00 0.71 0.00 0.00 54.79 53.60 1nuf n ASP 193 Cb 0.11 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1nuf n ASP 193 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1nuf n ARG 194 N 0.43 0.16 -1.69 -1.24 5.12 -0.08 -4.90 116.66 114.46 1nuf n ARG 194 Ca 0.14 -0.70 -0.32 0.00 -1.93 0.00 0.00 57.85 55.04 1nuf n ARG 194 Cb 0.31 -0.93 0.04 0.00 -1.16 0.00 0.00 32.46 30.73 1nuf n ARG 194 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1nuf s SER 195 N -0.25 5.35 0.26 0.55 1.04 -1.12 -4.90 113.70 114.62 1nuf s SER 195 Ca 0.00 1.75 -0.03 0.00 0.48 0.00 0.00 55.95 58.15 1nuf s SER 195 Cb 0.00 -2.52 0.39 0.00 0.10 0.00 0.00 66.02 63.99 1nuf s SER 195 CO 0.00 -1.47 1.88 -0.07 0.98 0.00 0.00 173.24 174.56 1nuf h LEU 196 N -0.34 1.00 -0.66 2.42 3.38 -1.94 -1.53 115.31 117.64 1nuf h LEU 196 Ca -0.45 0.01 0.07 0.00 0.09 0.00 0.00 57.88 57.60 1nuf h LEU 196 Cb 1.22 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.71 1nuf h LEU 196 CO 0.56 0.64 0.34 0.78 0.09 0.00 0.00 178.44 180.85 1nuf h ASN 197 N 1.14 0.48 0.44 -0.43 4.21 -1.94 -0.85 115.58 118.63 1nuf h ASN 197 Ca 0.42 0.04 -0.10 0.00 1.21 0.00 0.00 56.30 57.87 1nuf h ASN 197 Cb 0.16 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.30 1nuf h ASN 197 CO -0.17 0.30 -0.48 0.15 -1.29 0.00 0.00 177.43 175.94 1nuf h PHE 198 N 0.62 0.05 0.05 1.19 3.04 -1.51 -0.10 116.94 120.28 1nuf h PHE 198 Ca 0.31 -0.02 -0.25 0.00 3.98 0.00 0.00 57.97 61.99 1nuf h PHE 198 Cb 0.25 -0.01 0.01 0.00 2.56 0.00 0.00 35.95 38.76 1nuf h PHE 198 CO -0.10 0.51 -1.06 0.00 -2.02 0.00 0.00 178.31 175.64 1nuf h ARG 199 N 0.04 0.44 0.52 1.11 3.08 -0.96 -1.68 114.38 116.92 1nuf h ARG 199 Ca -0.00 -0.54 -0.03 0.00 0.07 0.00 0.00 59.98 59.49 1nuf h ARG 199 Cb 0.86 0.17 0.01 0.00 0.08 0.00 0.00 29.97 31.08 1nuf h ARG 199 CO 0.06 1.19 -0.25 -0.09 -1.07 0.00 0.00 179.97 179.82 1nuf h ARG 200 N 0.22 -0.67 -1.83 0.04 2.43 -1.01 -3.42 114.38 110.13 1nuf h ARG 200 Ca -0.11 0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 58.87 1nuf h ARG 200 Cb 1.73 0.15 -0.30 0.00 -0.42 0.00 0.00 29.97 31.13 1nuf h ARG 200 CO 0.19 -0.37 -0.57 0.34 -1.51 0.00 0.00 179.97 178.05 1nuf s ASP 201 N -4.72 0.76 0.12 -3.80 3.68 -0.06 -5.04 116.67 107.61 1nuf s ASP 201 Ca -0.15 -0.53 -0.20 0.00 2.13 0.00 0.00 52.55 53.81 1nuf s ASP 201 Cb 0.02 0.93 -0.07 0.00 -1.45 0.00 0.00 42.92 42.35 1nuf s ASP 201 CO 0.52 -0.36 1.77 0.00 0.13 0.00 0.00 175.17 177.23 1nuf h ALA 202 N 8.16 0.26 -0.27 3.66 0.00 -1.49 -2.29 119.26 127.28 1nuf h ALA 202 Ca -0.09 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1nuf h ALA 202 Cb 1.11 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1nuf h ALA 202 CO 0.28 -0.26 -0.10 0.00 0.00 0.00 0.00 179.25 179.18 1nuf h ALA 203 N 1.07 0.14 -0.01 0.00 0.00 -1.93 -1.89 119.26 116.63 1nuf h ALA 203 Ca 0.07 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1nuf h ALA 203 Cb -0.02 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1nuf h ALA 203 CO -0.02 -0.50 -0.58 1.15 0.00 0.00 0.00 179.25 179.31 1nuf h THR 204 N -0.04 1.41 0.34 0.00 2.02 -1.94 -2.78 112.91 111.92 1nuf h THR 204 Ca 0.14 -1.97 -0.02 0.00 0.77 0.00 0.00 66.41 65.33 1nuf h THR 204 Cb 0.25 2.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1nuf h THR 204 CO -0.30 0.57 -0.17 -0.78 0.37 0.00 0.00 175.52 175.21 1nuf h ASP 205 N 0.04 -0.39 -0.67 4.18 3.58 -0.99 -2.23 116.42 119.94 1nuf h ASP 205 Ca -0.01 -0.09 0.07 0.00 0.42 0.00 0.00 57.03 57.42 1nuf h ASP 205 Cb 1.03 0.10 -0.04 0.00 1.72 0.00 0.00 39.33 42.14 1nuf h ASP 205 CO 0.08 -0.14 0.44 0.58 -2.88 0.00 0.00 179.24 177.32 1nuf h VAL 206 N -0.64 1.00 0.00 2.25 2.07 -1.36 -0.94 116.25 118.62 1nuf h VAL 206 Ca -0.05 -0.22 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 1nuf h VAL 206 Cb 0.46 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1nuf h VAL 206 CO 0.08 0.12 -0.39 0.00 0.02 0.00 0.00 177.57 177.40 1nuf h ALA 207 N 1.64 1.05 -0.01 1.67 0.00 -1.37 -2.80 119.26 119.45 1nuf h ALA 207 Ca 0.29 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1nuf h ALA 207 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1nuf h ALA 207 CO -0.09 0.49 -0.04 0.43 0.00 0.00 0.00 179.25 180.03 1nuf n SER 208 N -3.64 0.81 -0.18 0.00 7.64 -0.38 -3.90 113.62 113.98 1nuf n SER 208 Ca -0.01 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.76 1nuf n SER 208 Cb 0.49 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1nuf n SER 208 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1nuf n ARG 209 N -0.47 0.89 -0.28 1.43 1.74 -1.06 -2.40 116.66 116.51 1nuf n ARG 209 Ca 0.19 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.36 1nuf n ARG 209 Cb 0.27 -1.16 0.25 0.00 -1.02 0.00 0.00 32.46 30.80 1nuf n ARG 209 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nuf n ASN 210 N -0.30 3.50 -4.03 0.55 2.04 -1.25 -0.71 115.26 115.06 1nuf n ASN 210 Ca 0.00 -1.99 -0.31 0.00 -0.44 0.00 0.00 54.58 51.84 1nuf n ASN 210 Cb 0.08 -0.37 -0.16 0.00 -2.53 0.00 0.00 39.78 36.80 1nuf n ASN 210 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1nuf s ASP 211 N -1.02 2.94 0.47 0.53 2.15 -1.01 -4.82 116.67 115.91 1nuf s ASP 211 Ca 0.38 -0.62 0.14 0.00 0.43 0.00 0.00 52.55 52.88 1nuf s ASP 211 Cb 0.20 -1.23 1.11 0.00 -0.30 0.00 0.00 42.92 42.70 1nuf s ASP 211 CO 0.26 -0.07 2.07 1.55 -0.17 0.00 0.00 175.17 178.81 1nuf h PRO 212 N 8.02 0.24 -0.03 4.34 0.13 -1.90 -0.88 132.00 141.92 1nuf h PRO 212 Ca -0.36 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1nuf h PRO 212 Cb 1.12 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1nuf h PRO 212 CO 0.53 0.16 0.02 0.87 -0.23 0.00 0.00 178.00 179.35 1nuf h LYS 213 N 0.25 0.04 0.01 0.86 1.57 -1.94 0.67 116.57 118.04 1nuf h LYS 213 Ca 0.13 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1nuf h LYS 213 Cb 0.20 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1nuf h LYS 213 CO -0.03 0.05 -0.01 -0.92 -0.57 0.00 0.00 179.45 177.98 1nuf h TYR 214 N 0.02 -0.02 -0.82 -1.35 3.20 -1.69 -1.88 116.97 114.44 1nuf h TYR 214 Ca 0.01 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1nuf h TYR 214 Cb 0.01 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 1nuf h TYR 214 CO -0.07 0.34 0.41 0.28 -1.64 0.00 0.00 178.16 177.49 1nuf h VAL 215 N -0.38 1.25 0.88 1.81 2.07 -1.14 -1.00 116.25 119.74 1nuf h VAL 215 Ca -0.00 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.81 1nuf h VAL 215 Cb 0.37 0.18 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1nuf h VAL 215 CO 0.00 0.29 -0.45 1.23 0.02 0.00 0.00 177.57 178.67 1nuf h GLY 216 N 1.18 -1.29 0.20 2.17 0.00 0.42 -2.47 103.07 103.29 1nuf h GLY 216 Ca 0.28 0.49 0.13 0.00 0.00 0.00 0.00 47.33 48.23 1nuf h GLY 216 CO -0.04 -0.46 0.30 -0.09 0.00 0.00 0.00 176.54 176.25 1nuf h ARG 217 N -1.21 0.44 -0.42 4.80 2.43 -1.18 -1.68 114.38 117.56 1nuf h ARG 217 Ca -0.12 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 1nuf h ARG 217 Cb 0.94 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 1nuf h ARG 217 CO 0.18 0.29 0.27 0.28 -1.51 0.00 0.00 179.97 179.49 1nuf h VAL 218 N 0.46 1.11 -0.80 0.20 2.07 -1.17 -2.62 116.25 115.50 1nuf h VAL 218 Ca 0.40 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.72 1nuf h VAL 218 Cb 0.58 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1nuf h VAL 218 CO -0.38 0.10 0.51 -0.07 0.02 0.00 0.00 177.57 177.76 1nuf h LEU 219 N 0.56 0.93 -1.57 2.57 3.38 -0.84 -0.83 115.31 119.51 1nuf h LEU 219 Ca 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1nuf h LEU 219 Cb -0.06 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1nuf h LEU 219 CO -0.03 0.69 0.00 0.77 0.09 0.00 0.00 178.44 179.96 1nuf h SER 220 N 1.09 0.00 0.03 -0.43 4.64 -1.01 -2.07 113.55 115.80 1nuf h SER 220 Ca 0.29 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.23 1nuf h SER 220 Cb -0.09 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 61.94 1nuf h SER 220 CO -0.06 0.00 -2.32 0.00 -0.87 0.00 0.00 176.83 173.58 1nuf n ALA 221 N -1.87 1.25 1.04 5.18 0.00 -0.48 -4.07 120.51 121.56 1nuf n ALA 221 Ca -0.01 -0.96 0.13 0.00 0.00 0.00 0.00 53.44 52.61 1nuf n ALA 221 Cb 0.12 -0.24 0.61 0.00 0.00 0.00 0.00 19.45 19.93 1nuf n ALA 221 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nuf n MET 222 N -3.45 0.14 0.00 0.00 2.00 -0.44 -3.34 117.12 112.03 1nuf n MET 222 Ca -0.43 0.04 0.13 0.00 0.00 0.00 0.00 57.70 57.45 1nuf n MET 222 Cb 0.99 -1.50 0.53 0.00 0.00 0.00 0.00 33.22 33.23 1nuf n MET 222 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 175.97 175.08 1nuf n ILE 223 N -1.42 0.00 -5.14 2.02 2.08 -0.82 -1.11 119.36 114.97 1nuf n ILE 223 Ca 0.09 -0.00 -0.32 0.00 0.56 0.00 0.00 62.75 63.08 1nuf n ILE 223 Cb 0.27 -0.30 -0.15 0.00 -0.75 0.00 0.00 39.64 38.72 1nuf n ILE 223 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1nuf s ASN 224 N -2.98 3.43 0.53 4.38 2.20 -1.21 0.19 114.94 121.48 1nuf s ASN 224 Ca 0.14 -0.38 0.31 0.00 -0.94 0.00 0.00 52.86 51.99 1nuf s ASN 224 Cb 0.19 -0.65 1.47 0.00 -2.00 0.00 0.00 41.25 40.26 1nuf s ASN 224 CO 0.57 0.31 1.89 0.28 -2.94 0.00 0.00 177.10 177.21 1nuf h SER 225 N 5.58 0.02 -2.40 3.54 0.02 -1.07 -3.30 113.55 115.94 1nuf h SER 225 Ca -0.42 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 59.98 1nuf h SER 225 Cb 1.14 -0.00 0.22 0.00 0.14 0.00 0.00 62.40 63.90 1nuf h SER 225 CO 0.48 0.01 -1.33 0.59 -1.14 0.00 0.00 176.83 175.44 1nuf n ASN 226 N -4.28 -4.32 -1.47 3.07 4.13 -1.26 -2.29 115.26 108.83 1nuf n ASN 226 Ca 0.18 0.34 -0.15 0.00 1.68 0.00 0.00 54.58 56.64 1nuf n ASN 226 Cb 0.95 -0.91 -0.03 0.00 -1.54 0.00 0.00 39.78 38.24 1nuf n ASN 226 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1nuf n ASP 227 N 2.00 -4.69 -2.59 6.41 8.00 -1.26 -2.74 116.55 121.69 1nuf n ASP 227 Ca 0.03 0.16 -0.11 0.00 0.71 0.00 0.00 54.79 55.57 1nuf n ASP 227 Cb 0.53 -3.69 -0.00 0.00 -0.02 0.00 0.00 41.12 37.94 1nuf n ASP 227 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1nuf n ASP 228 N -0.69 -3.27 -3.15 -2.24 9.92 -1.07 -4.87 116.55 111.19 1nuf n ASP 228 Ca -0.17 0.17 0.04 0.00 -0.53 0.00 0.00 54.79 54.31 1nuf n ASP 228 Cb 0.57 -2.80 -0.01 0.00 -0.64 0.00 0.00 41.12 38.25 1nuf n ASP 228 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1nuf s ASN 229 N -2.12 -1.16 0.00 -2.24 2.47 -0.97 -5.13 114.94 105.79 1nuf s ASN 229 Ca 0.06 0.52 0.00 0.00 0.42 0.00 0.00 52.86 53.86 1nuf s ASN 229 Cb -0.03 1.89 0.00 0.00 -1.45 0.00 0.00 41.25 41.66 1nuf s ASN 229 CO 0.07 -0.22 0.00 0.61 -3.72 0.00 0.00 177.10 173.85 1nuf n GLY 230 N 5.41 -1.53 0.19 1.21 0.00 -1.24 -4.60 105.19 104.63 1nuf n GLY 230 Ca 0.00 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 1nuf n GLY 230 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nuf n VAL 231 N 3.58 1.46 -3.75 1.61 0.31 -0.27 -4.49 118.33 116.78 1nuf n VAL 231 Ca 0.00 0.08 -0.36 0.00 -0.01 0.00 0.00 64.34 64.05 1nuf n VAL 231 Cb 0.00 -2.20 -0.10 0.00 -0.91 0.00 0.00 33.84 30.63 1nuf n VAL 231 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1nuf s LEU 232 N -7.74 4.01 -0.27 7.52 1.43 0.13 -1.19 118.68 122.57 1nuf s LEU 232 Ca -0.28 0.10 -0.24 0.00 -1.03 0.00 0.00 54.13 52.68 1nuf s LEU 232 Cb 0.05 -2.06 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 1nuf s LEU 232 CO 0.40 0.10 0.83 0.00 0.23 0.00 0.00 176.35 177.90 1nuf s ALA 233 N 0.86 3.59 0.65 4.21 0.00 -0.56 -0.59 121.76 129.93 1nuf s ALA 233 Ca 0.07 -0.25 -0.13 0.00 0.00 0.00 0.00 51.96 51.65 1nuf s ALA 233 Cb -0.13 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1nuf s ALA 233 CO 0.03 -1.07 1.06 0.20 0.00 0.00 0.00 175.76 175.98 1nuf s GLY 234 N 1.47 1.90 -0.30 0.00 0.00 -1.26 -0.47 107.32 108.67 1nuf s GLY 234 Ca 0.34 0.27 -0.12 0.00 0.00 0.00 0.00 44.72 45.21 1nuf s GLY 234 CO 0.10 0.59 0.87 0.21 0.00 0.00 0.00 173.10 174.87 1nuf s ASN 235 N -3.23 -0.79 -0.18 1.64 3.04 -0.70 -4.76 114.94 109.97 1nuf s ASN 235 Ca 0.61 0.93 0.14 0.00 0.04 0.00 0.00 52.86 54.58 1nuf s ASN 235 Cb -0.16 1.84 0.43 0.00 -1.54 0.00 0.00 41.25 41.82 1nuf s ASN 235 CO 0.46 -0.15 1.20 0.79 -3.04 0.00 0.00 177.10 176.36 1nuf n TRP 236 N 5.20 0.39 0.07 0.43 8.01 -1.26 -4.69 117.44 125.59 1nuf n TRP 236 Ca -0.09 -1.40 0.10 0.00 -1.31 0.00 0.00 57.50 54.81 1nuf n TRP 236 Cb 0.52 -0.24 -0.06 0.00 -2.01 0.00 0.00 31.31 29.52 1nuf n TRP 236 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 1nuf n SER 237 N -0.69 0.61 0.00 -0.99 3.41 -1.26 -4.84 113.62 109.86 1nuf n SER 237 Ca 0.19 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1nuf n SER 237 Cb 0.83 0.86 0.00 0.00 -0.26 0.00 0.00 64.21 65.64 1nuf n SER 237 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nuf n GLY 238 N 1.23 0.91 3.11 5.00 0.00 -1.26 -5.01 105.19 109.16 1nuf n GLY 238 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1nuf n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nuf s THR 239 N -2.25 2.32 -0.26 2.61 2.01 -1.26 -4.94 115.64 113.87 1nuf s THR 239 Ca 0.00 -1.34 0.09 0.00 0.31 0.00 0.00 61.69 60.76 1nuf s THR 239 Cb 0.00 -2.23 0.45 0.00 0.01 0.00 0.00 72.50 70.73 1nuf s THR 239 CO 0.00 0.15 1.27 -1.22 -0.69 0.00 0.00 174.62 174.13 1nuf n TYR 240 N 4.53 1.02 -2.07 4.92 4.01 -1.26 -5.01 117.16 123.30 1nuf n TYR 240 Ca -0.16 -1.76 -0.37 0.00 -0.16 0.00 0.00 57.90 55.45 1nuf n TYR 240 Cb 0.45 -0.34 0.02 0.00 -0.31 0.00 0.00 39.34 39.15 1nuf n TYR 240 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1nuf s THR 241 N -3.66 2.71 0.00 -0.72 2.01 -1.26 -2.38 115.64 112.34 1nuf s THR 241 Ca 0.43 0.50 0.00 0.00 0.31 0.00 0.00 61.69 62.94 1nuf s THR 241 Cb 0.39 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.66 1nuf s THR 241 CO -0.03 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.47 1nuf n GLY 242 N 0.52 2.00 0.00 4.40 0.00 -1.26 -4.95 105.19 105.90 1nuf n GLY 242 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1nuf n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nuf n GLY 243 N -2.00 4.75 3.41 -0.02 0.00 -1.00 -4.95 105.19 105.38 1nuf n GLY 243 Ca 0.00 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 1nuf n GLY 243 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nuf s ARG 244 N 3.31 1.70 0.02 1.61 0.52 0.55 -4.85 118.95 121.81 1nuf s ARG 244 Ca 0.00 -1.19 -0.30 0.00 -0.52 0.00 0.00 55.73 53.72 1nuf s ARG 244 Cb 0.00 -2.01 -0.08 0.00 0.52 0.00 0.00 34.95 33.38 1nuf s ARG 244 CO 0.00 0.49 1.76 0.34 0.02 0.00 0.00 175.30 177.91 1nuf s ASP 245 N -1.73 6.56 0.39 0.23 3.68 -1.26 -1.72 116.67 122.83 1nuf s ASP 245 Ca 0.14 2.48 0.21 0.00 2.13 0.00 0.00 52.55 57.51 1nuf s ASP 245 Cb -0.10 -2.54 1.23 0.00 -1.45 0.00 0.00 42.92 40.06 1nuf s ASP 245 CO 0.05 -0.96 1.67 -0.65 0.13 0.00 0.00 175.17 175.41 1nuf h PRO 246 N 9.44 0.23 0.00 4.34 0.11 -1.93 0.16 132.00 144.34 1nuf h PRO 246 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1nuf h PRO 246 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1nuf h PRO 246 CO 0.94 0.15 0.00 0.54 -0.21 0.00 0.00 178.00 179.42 1nuf n ARG 247 N -4.84 0.18 0.14 1.05 1.74 -1.26 -3.38 116.66 110.28 1nuf n ARG 247 Ca 0.33 0.12 0.08 0.00 -0.77 0.00 0.00 57.85 57.61 1nuf n ARG 247 Cb 1.14 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 31.13 1nuf n ARG 247 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1nuf h SER 248 N 0.00 0.00 -4.04 0.55 4.64 -1.03 -3.46 113.55 110.21 1nuf h SER 248 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1nuf h SER 248 Cb 0.25 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 62.52 1nuf h SER 248 CO 0.00 0.17 0.28 0.79 -0.87 0.00 0.00 176.83 177.20 1nuf n TRP 249 N -2.94 1.17 -0.02 4.77 7.02 -1.22 -4.88 117.44 121.33 1nuf n TRP 249 Ca 0.00 0.40 0.00 0.00 -1.02 0.00 0.00 57.50 56.88 1nuf n TRP 249 Cb 0.62 -2.12 0.00 0.00 -2.42 0.00 0.00 31.31 27.38 1nuf n TRP 249 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1nuf n ASP 250 N -2.52 0.03 -2.52 -0.99 8.00 -1.26 -5.08 116.55 112.21 1nuf n ASP 250 Ca 0.14 -0.33 -0.06 0.00 0.71 0.00 0.00 54.79 55.24 1nuf n ASP 250 Cb 0.50 0.55 0.02 0.00 -0.02 0.00 0.00 41.12 42.17 1nuf n ASP 250 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nuf n GLY 251 N 0.55 1.09 0.07 0.44 0.00 -1.26 -0.20 105.19 105.88 1nuf n GLY 251 Ca 0.00 -1.19 0.11 0.00 0.00 0.00 0.00 46.02 44.94 1nuf n GLY 251 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nuf n SER 252 N -1.38 0.49 0.41 1.61 7.64 -0.07 -4.37 113.62 117.96 1nuf n SER 252 Ca -0.06 0.16 -0.19 0.00 1.01 0.00 0.00 58.87 59.78 1nuf n SER 252 Cb 0.48 1.09 -0.10 0.00 -1.01 0.00 0.00 64.21 64.67 1nuf n SER 252 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1nuf h VAL 253 N 0.00 0.02 0.00 0.44 2.07 -1.73 -0.44 116.25 116.61 1nuf h VAL 253 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1nuf h VAL 253 Cb 0.98 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1nuf h VAL 253 CO 0.00 0.00 0.00 -0.33 0.02 0.00 0.00 177.57 177.26 1nuf h GLU 254 N -1.17 0.00 0.08 1.57 4.39 -1.94 -2.15 114.58 115.36 1nuf h GLU 254 Ca -0.10 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1nuf h GLU 254 Cb 0.95 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 1nuf h GLU 254 CO 0.08 0.00 -0.04 0.82 -1.16 0.00 0.00 179.01 178.71 1nuf h ILE 255 N 0.00 1.20 -0.62 3.13 2.04 -1.70 -1.50 117.51 120.06 1nuf h ILE 255 Ca 0.00 -1.14 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 1nuf h ILE 255 Cb 0.57 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1nuf h ILE 255 CO 0.00 0.27 0.06 -0.07 0.00 0.00 0.00 178.15 178.41 1nuf h LEU 256 N -0.63 1.02 -0.46 1.44 3.38 -1.02 -1.97 115.31 117.07 1nuf h LEU 256 Ca -0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1nuf h LEU 256 Cb 0.53 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1nuf h LEU 256 CO 0.02 1.05 0.14 0.11 0.09 0.00 0.00 178.44 179.85 1nuf h LYS 257 N 0.96 0.71 -0.65 1.13 1.57 -1.45 -2.38 116.57 116.47 1nuf h LYS 257 Ca 0.18 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1nuf h LYS 257 Cb 0.49 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1nuf h LYS 257 CO 0.02 0.69 0.35 -0.91 -0.57 0.00 0.00 179.45 179.03 1nuf h ASN 258 N 0.60 0.80 0.25 0.86 2.35 -1.14 -0.10 115.58 119.20 1nuf h ASN 258 Ca 0.15 -0.06 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1nuf h ASN 258 Cb 0.27 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.40 1nuf h ASN 258 CO -0.00 0.64 -0.47 -0.25 -1.65 0.00 0.00 177.43 175.70 1nuf h TRP 259 N 0.90 -1.33 0.61 1.19 7.01 -0.86 0.13 115.95 123.61 1nuf h TRP 259 Ca 0.23 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.23 1nuf h TRP 259 Cb 0.02 0.55 -0.01 0.00 -2.10 0.00 0.00 29.16 27.62 1nuf h TRP 259 CO 0.01 -0.59 -0.46 -0.22 -2.79 0.00 0.00 178.44 174.39 1nuf h LYS 260 N -0.79 -1.00 -1.00 2.65 3.64 -1.09 -0.15 116.57 118.83 1nuf h LYS 260 Ca -0.01 0.07 0.30 0.00 -1.27 0.00 0.00 60.65 59.73 1nuf h LYS 260 Cb 0.76 0.23 -0.14 0.00 -0.41 0.00 0.00 32.23 32.66 1nuf h LYS 260 CO -0.19 -0.66 0.56 -0.22 -2.27 0.00 0.00 179.45 176.66 1nuf h LYS 261 N -1.03 0.37 0.00 1.90 3.64 -0.90 0.58 116.57 121.13 1nuf h LYS 261 Ca -0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1nuf h LYS 261 Cb 0.86 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1nuf h LYS 261 CO 0.03 0.24 0.00 -1.13 -2.27 0.00 0.00 179.45 176.32 1nuf n SER 262 N -5.02 0.00 -0.94 4.20 3.41 0.45 -4.86 113.62 110.86 1nuf n SER 262 Ca 0.30 -1.86 -0.08 0.00 -0.26 0.00 0.00 58.87 56.97 1nuf n SER 262 Cb 0.91 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1nuf n SER 262 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nuf n GLY 263 N 0.52 0.09 2.14 5.00 0.00 0.20 -3.24 105.19 109.90 1nuf n GLY 263 Ca 0.02 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.44 1nuf n GLY 263 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nuf n LEU 264 N -1.19 -0.69 -4.76 0.99 4.77 -0.09 -5.02 117.00 111.01 1nuf n LEU 264 Ca -0.08 0.09 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 1nuf n LEU 264 Cb 0.56 -1.12 -0.05 0.00 -2.33 0.00 0.00 43.42 40.48 1nuf n LEU 264 CO 0.12 -0.20 0.33 -0.55 -1.33 0.00 0.00 177.39 175.76 1nuf s SER 265 N -2.88 7.02 -0.18 -1.43 0.15 -1.20 -4.86 113.70 110.32 1nuf s SER 265 Ca 0.00 1.22 -0.42 0.00 0.70 0.00 0.00 55.95 57.45 1nuf s SER 265 Cb 0.00 -2.39 -0.20 0.00 -1.71 0.00 0.00 66.02 61.73 1nuf s SER 265 CO 0.00 0.08 1.25 -2.65 1.20 0.00 0.00 173.24 173.12 1nuf n PRO 266 N 2.77 0.00 -2.85 5.44 -0.02 -1.26 -4.74 135.00 134.34 1nuf n PRO 266 Ca -0.06 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.02 1nuf n PRO 266 Cb 0.51 -1.48 -0.04 0.00 -0.02 0.00 0.00 33.50 32.47 1nuf n PRO 266 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nuf s VAL 267 N 1.11 4.73 -0.07 -1.45 1.01 -0.33 -4.85 120.40 120.54 1nuf s VAL 267 Ca 0.95 1.84 0.05 0.00 0.00 0.00 0.00 61.98 64.83 1nuf s VAL 267 Cb -1.34 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 30.82 1nuf s VAL 267 CO 0.65 0.29 -0.24 -0.13 0.00 0.00 0.00 175.10 175.67 1nuf s ARG 268 N 0.31 2.57 0.20 2.72 0.52 -1.26 -1.50 118.95 122.51 1nuf s ARG 268 Ca 0.44 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.83 1nuf s ARG 268 Cb -0.21 -2.12 -0.05 0.00 0.52 0.00 0.00 34.95 33.09 1nuf s ARG 268 CO 0.26 0.32 -0.05 0.71 0.02 0.00 0.00 175.30 176.55 1nuf s TYR 269 N -0.02 1.47 0.21 -0.53 2.02 -0.70 -0.33 117.35 119.47 1nuf s TYR 269 Ca -0.07 -0.83 0.07 0.00 -0.37 0.00 0.00 57.07 55.87 1nuf s TYR 269 Cb -0.15 -0.81 -0.05 0.00 -0.40 0.00 0.00 41.96 40.56 1nuf s TYR 269 CO 0.05 0.05 -0.12 0.20 -1.57 0.00 0.00 175.55 174.16 1nuf s GLY 270 N -3.26 1.44 0.28 0.71 0.00 0.38 -3.85 107.32 103.01 1nuf s GLY 270 Ca 0.24 -1.68 0.02 0.00 0.00 0.00 0.00 44.72 43.30 1nuf s GLY 270 CO 0.06 -1.74 0.08 1.20 0.00 0.00 0.00 173.10 172.70 1nuf s GLN 271 N -3.69 1.47 0.32 2.90 -0.21 -1.26 -1.72 119.66 117.48 1nuf s GLN 271 Ca 0.23 -1.80 0.07 0.00 0.02 0.00 0.00 55.36 53.88 1nuf s GLN 271 Cb 0.01 -0.46 0.89 0.00 1.00 0.00 0.00 33.01 34.45 1nuf s GLN 271 CO 0.07 -0.25 1.61 0.00 -2.12 0.00 0.00 175.29 174.60 1nuf h TRP 273 N 0.10 0.00 -0.38 0.00 0.09 -1.98 -1.68 115.95 112.11 1nuf h TRP 273 Ca 0.65 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 59.51 1nuf h TRP 273 Cb 1.44 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.67 1nuf h TRP 273 CO -0.27 0.22 -0.23 0.28 0.09 0.00 0.00 178.44 178.53 1nuf h VAL 274 N 0.00 1.27 0.05 0.12 2.07 -0.93 0.16 116.25 118.99 1nuf h VAL 274 Ca -0.00 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 1nuf h VAL 274 Cb 0.42 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1nuf h VAL 274 CO 0.03 0.45 -0.02 -0.26 0.02 0.00 0.00 177.57 177.78 1nuf h PHE 275 N 0.66 -0.06 -0.74 1.57 0.04 -1.20 -1.89 116.94 115.32 1nuf h PHE 275 Ca 0.09 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.88 1nuf h PHE 275 Cb 0.74 0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.87 1nuf h PHE 275 CO 0.04 0.32 0.47 0.00 -0.60 0.00 0.00 178.31 178.54 1nuf h ALA 276 N 0.46 0.96 -0.33 2.45 0.00 -1.23 0.32 119.26 121.88 1nuf h ALA 276 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1nuf h ALA 276 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1nuf h ALA 276 CO 0.01 0.29 0.12 0.78 0.00 0.00 0.00 179.25 180.45 1nuf h GLY 277 N 0.94 0.53 1.28 0.00 0.00 -0.66 0.20 103.07 105.36 1nuf h GLY 277 Ca 0.29 -0.29 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 1nuf h GLY 277 CO -0.09 0.28 -0.41 -0.84 0.00 0.00 0.00 176.54 175.47 1nuf h THR 278 N 0.38 1.28 -0.40 4.70 2.02 -1.04 -2.70 112.91 117.15 1nuf h THR 278 Ca 0.11 -1.59 -0.04 0.00 0.77 0.00 0.00 66.41 65.65 1nuf h THR 278 Cb 0.20 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 1nuf h THR 278 CO -0.01 0.52 0.08 0.25 0.37 0.00 0.00 175.52 176.73 1nuf h LEU 279 N 0.64 0.63 -0.68 2.58 5.85 -0.26 -2.64 115.31 121.42 1nuf h LEU 279 Ca 0.05 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.62 1nuf h LEU 279 Cb 0.97 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 1nuf h LEU 279 CO 0.09 0.71 0.31 -1.13 -0.34 0.00 0.00 178.44 178.08 1nuf h ASN 280 N 0.51 0.37 -0.52 1.25 -0.73 -0.83 0.12 115.58 115.75 1nuf h ASN 280 Ca 0.12 0.07 0.02 0.00 1.87 0.00 0.00 56.30 58.39 1nuf h ASN 280 Cb 0.34 0.01 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 1nuf h ASN 280 CO 0.00 0.21 0.31 0.74 -0.37 0.00 0.00 177.43 178.33 1nuf h THR 281 N 0.53 1.05 -0.48 -3.57 2.02 -1.25 0.16 112.91 111.36 1nuf h THR 281 Ca 0.34 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.26 1nuf h THR 281 Cb 0.39 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1nuf h THR 281 CO -0.29 0.11 0.13 0.00 0.37 0.00 0.00 175.52 175.84 1nuf h ALA 282 N 1.23 0.63 0.65 6.16 0.00 -0.93 -0.71 119.26 126.30 1nuf h ALA 282 Ca 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1nuf h ALA 282 Cb 0.02 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1nuf h ALA 282 CO -0.10 0.31 -0.31 -0.07 0.00 0.00 0.00 179.25 179.08 1nuf h LEU 283 N 0.65 -0.74 -1.23 0.00 3.38 -0.26 -2.85 115.31 114.26 1nuf h LEU 283 Ca 0.15 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1nuf h LEU 283 Cb 0.31 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 1nuf h LEU 283 CO -0.00 -0.47 0.53 0.03 0.09 0.00 0.00 178.44 178.63 1nuf h ARG 284 N -0.97 0.98 -0.78 1.13 3.08 -0.69 -1.87 114.38 115.26 1nuf h ARG 284 Ca -0.09 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 1nuf h ARG 284 Cb 0.70 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 1nuf h ARG 284 CO 0.15 0.65 0.36 0.66 -1.07 0.00 0.00 179.97 180.71 1nuf h SER 285 N 1.01 1.03 1.30 7.04 4.64 -1.10 -2.66 113.55 124.81 1nuf h SER 285 Ca 0.32 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1nuf h SER 285 Cb 0.02 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 1nuf h SER 285 CO -0.09 0.89 0.00 -0.07 -0.87 0.00 0.00 176.83 176.69 1nuf h LEU 286 N 1.11 0.00 0.00 5.97 4.07 -1.21 -3.47 115.31 121.77 1nuf h LEU 286 Ca 0.26 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1nuf h LEU 286 Cb 0.15 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.89 1nuf h LEU 286 CO -0.03 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.94 1nuf n GLY 287 N 0.63 1.36 3.47 0.83 0.00 -0.98 -1.92 105.19 108.58 1nuf n GLY 287 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1nuf n GLY 287 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nuf s ILE 288 N -2.00 5.21 0.06 -0.61 1.01 -0.74 -4.30 121.20 119.83 1nuf s ILE 288 Ca 0.00 -0.56 -0.35 0.00 0.00 0.00 0.00 60.65 59.74 1nuf s ILE 288 Cb 0.00 -3.96 -0.15 0.00 0.01 0.00 0.00 42.46 38.37 1nuf s ILE 288 CO 0.00 -0.34 1.57 -2.65 0.00 0.00 0.00 174.94 173.52 1nuf n PRO 289 N 5.29 1.77 -3.79 2.79 -0.02 -1.26 -3.56 135.00 136.23 1nuf n PRO 289 Ca -0.10 0.64 -0.12 0.00 -2.02 0.00 0.00 63.50 61.91 1nuf n PRO 289 Cb 0.47 -2.38 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 1nuf n PRO 289 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1nuf s SER 290 N 1.49 -0.09 0.04 2.55 1.04 -0.22 -1.21 113.70 117.31 1nuf s SER 290 Ca 0.84 -0.19 -0.05 0.00 0.48 0.00 0.00 55.95 57.04 1nuf s SER 290 Cb -0.80 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 65.63 1nuf s SER 290 CO 0.45 -0.55 0.08 0.00 0.98 0.00 0.00 173.24 174.20 1nuf s ARG 291 N -2.25 0.57 -0.04 4.02 1.70 -1.16 -4.61 118.95 117.19 1nuf s ARG 291 Ca -0.07 -0.77 -0.21 0.00 -0.47 0.00 0.00 55.73 54.21 1nuf s ARG 291 Cb -0.02 0.22 -0.05 0.00 -0.57 0.00 0.00 34.95 34.53 1nuf s ARG 291 CO -0.02 -0.14 0.62 0.08 -1.08 0.00 0.00 175.30 174.76 1nuf s VAL 292 N -2.60 4.98 -0.08 4.99 1.01 -1.26 -2.59 120.40 124.85 1nuf s VAL 292 Ca -0.05 1.28 0.03 0.00 0.00 0.00 0.00 61.98 63.24 1nuf s VAL 292 Cb -0.01 -3.96 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 1nuf s VAL 292 CO -0.05 0.35 -0.17 -0.63 0.00 0.00 0.00 175.10 174.61 1nuf s ILE 293 N 0.22 2.80 -0.13 2.22 -1.09 0.77 -4.38 121.20 121.61 1nuf s ILE 293 Ca 0.33 -0.79 0.02 0.00 -2.23 0.00 0.00 60.65 57.98 1nuf s ILE 293 Cb -0.18 -2.11 0.01 0.00 -1.58 0.00 0.00 42.46 38.60 1nuf s ILE 293 CO 0.17 0.56 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.34 1nuf s THR 294 N -0.20 1.94 -0.19 2.92 2.01 0.20 -0.59 115.64 121.73 1nuf s THR 294 Ca -0.01 -0.91 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 1nuf s THR 294 Cb -0.13 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1nuf s THR 294 CO 0.03 0.53 -0.08 0.21 -0.69 0.00 0.00 174.62 174.62 1nuf s ASN 295 N 0.82 4.19 0.07 3.53 2.47 -0.33 -0.27 114.94 125.43 1nuf s ASN 295 Ca -0.08 -0.37 -0.17 0.00 0.42 0.00 0.00 52.86 52.66 1nuf s ASN 295 Cb -0.16 -1.69 -0.06 0.00 -1.45 0.00 0.00 41.25 37.89 1nuf s ASN 295 CO -0.01 0.05 0.53 -0.36 -3.72 0.00 0.00 177.10 173.58 1nuf s PHE 296 N 1.07 3.75 -1.09 0.43 0.40 -0.89 -1.35 117.98 120.30 1nuf s PHE 296 Ca 0.01 1.16 -0.01 0.00 -0.60 0.00 0.00 56.93 57.49 1nuf s PHE 296 Cb -0.15 -2.42 -0.01 0.00 0.51 0.00 0.00 43.02 40.95 1nuf s PHE 296 CO -0.01 0.57 0.91 0.09 0.70 0.00 0.00 175.22 177.48 1nuf n ASN 297 N 1.54 -2.93 -4.70 1.36 3.02 -0.47 -0.91 115.26 112.17 1nuf n ASN 297 Ca -0.10 -0.59 -0.42 0.00 -0.03 0.00 0.00 54.58 53.44 1nuf n ASN 297 Cb 0.51 -4.82 -0.03 0.00 -0.61 0.00 0.00 39.78 34.83 1nuf n ASN 297 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1nuf s SER 298 N -4.08 7.26 -0.06 6.41 0.15 -0.41 -1.94 113.70 121.02 1nuf s SER 298 Ca 0.09 1.53 -0.07 0.00 0.70 0.00 0.00 55.95 58.20 1nuf s SER 298 Cb -0.01 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.71 1nuf s SER 298 CO 0.68 -0.35 0.20 0.00 1.20 0.00 0.00 173.24 174.97 1nuf s ALA 299 N 1.55 3.87 -0.73 5.45 0.00 -1.15 0.20 121.76 130.95 1nuf s ALA 299 Ca 0.48 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.83 1nuf s ALA 299 Cb -0.19 -2.02 0.18 0.00 0.00 0.00 0.00 23.12 21.09 1nuf s ALA 299 CO 0.21 0.63 0.56 -1.58 0.00 0.00 0.00 175.76 175.59 1nuf s HIS 300 N -1.14 3.58 -0.74 0.00 5.04 0.43 -4.06 115.29 118.40 1nuf s HIS 300 Ca 0.20 -2.94 -0.26 0.00 -1.54 0.00 0.00 55.06 50.53 1nuf s HIS 300 Cb -0.13 -3.13 -0.00 0.00 0.04 0.00 0.00 32.58 29.36 1nuf s HIS 300 CO 0.10 -0.76 1.66 0.34 -2.34 0.00 0.00 174.74 173.74 1nuf s ASP 301 N 0.05 5.64 0.43 9.88 3.68 -1.26 -4.84 116.67 130.25 1nuf s ASP 301 Ca 0.22 -0.25 0.10 0.00 2.13 0.00 0.00 52.55 54.75 1nuf s ASP 301 Cb -0.14 -2.55 0.96 0.00 -1.45 0.00 0.00 42.92 39.75 1nuf s ASP 301 CO -0.08 -2.19 2.06 0.74 0.13 0.00 0.00 175.17 175.84 1nuf h THR 302 N 6.69 1.05 -3.22 1.71 2.02 -1.95 -3.40 112.91 115.82 1nuf h THR 302 Ca -0.16 -0.15 -0.62 0.00 0.77 0.00 0.00 66.41 66.25 1nuf h THR 302 Cb 1.09 0.58 -0.35 0.00 -1.74 0.00 0.00 68.15 67.74 1nuf h THR 302 CO 1.26 0.08 -0.85 1.51 0.37 0.00 0.00 175.52 177.89 1nuf s ASP 303 N -6.68 2.74 -0.59 4.18 1.47 -1.26 -5.08 116.67 111.45 1nuf s ASP 303 Ca -0.08 -0.51 -0.26 0.00 1.18 0.00 0.00 52.55 52.89 1nuf s ASP 303 Cb 0.18 -1.24 -0.10 0.00 -0.34 0.00 0.00 42.92 41.42 1nuf s ASP 303 CO 0.72 0.03 2.43 0.54 0.68 0.00 0.00 175.17 179.57 1nuf n ARG 304 N 4.24 0.87 -0.32 2.11 1.74 -1.26 -4.32 116.66 119.71 1nuf n ARG 304 Ca -0.19 -0.23 0.00 0.00 -0.77 0.00 0.00 57.85 56.65 1nuf n ARG 304 Cb 0.51 -3.43 0.00 0.00 -1.02 0.00 0.00 32.46 28.52 1nuf n ARG 304 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nuf n ASN 305 N 16.45 0.00 -4.15 0.55 0.23 -1.26 -4.78 115.26 122.30 1nuf n ASN 305 Ca 0.41 -0.83 -0.31 0.00 -0.53 0.00 0.00 54.58 53.32 1nuf n ASN 305 Cb 0.50 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.16 1nuf n ASN 305 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1nuf n LEU 306 N 0.00 -1.74 -3.66 -4.53 4.32 -1.26 -4.93 117.00 105.20 1nuf n LEU 306 Ca 0.00 -1.07 -0.07 0.00 -0.02 0.00 0.00 56.01 54.85 1nuf n LEU 306 Cb 0.42 -2.03 -0.08 0.00 -1.62 0.00 0.00 43.42 40.11 1nuf n LEU 306 CO 0.00 0.37 0.18 -0.55 -1.22 0.00 0.00 177.39 176.17 1nuf s SER 307 N -3.94 -0.72 0.03 -1.43 0.15 -1.26 -0.96 113.70 105.57 1nuf s SER 307 Ca 0.30 1.25 0.06 0.00 0.70 0.00 0.00 55.95 58.25 1nuf s SER 307 Cb -0.17 1.42 -0.03 0.00 -1.71 0.00 0.00 66.02 65.53 1nuf s SER 307 CO 0.93 -0.22 -0.13 0.68 1.20 0.00 0.00 173.24 175.70 1nuf s VAL 308 N 2.09 3.19 -0.04 4.45 -7.23 -0.68 -4.87 120.40 117.31 1nuf s VAL 308 Ca -0.07 -1.03 0.05 0.00 -1.81 0.00 0.00 61.98 59.12 1nuf s VAL 308 Cb -0.09 -2.38 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 1nuf s VAL 308 CO -0.16 0.34 -0.18 -1.81 -0.31 0.00 0.00 175.10 172.97 1nuf s ASP 309 N -1.51 3.71 -0.01 4.85 1.01 -1.26 -1.64 116.67 121.81 1nuf s ASP 309 Ca 0.16 -0.29 0.05 0.00 0.71 0.00 0.00 52.55 53.19 1nuf s ASP 309 Cb -0.11 -0.70 -0.01 0.00 1.01 0.00 0.00 42.92 43.11 1nuf s ASP 309 CO 0.07 0.33 -0.16 0.68 0.21 0.00 0.00 175.17 176.30 1nuf s VAL 310 N -0.67 1.27 0.32 -1.27 -7.23 -0.80 -4.54 120.40 107.47 1nuf s VAL 310 Ca 0.11 -0.69 0.10 0.00 -1.81 0.00 0.00 61.98 59.69 1nuf s VAL 310 Cb -0.11 -1.06 -0.06 0.00 0.56 0.00 0.00 36.38 35.72 1nuf s VAL 310 CO 0.00 0.36 -0.11 -0.31 -0.31 0.00 0.00 175.10 174.73 1nuf s TYR 311 N -0.36 2.40 0.13 2.82 1.51 -1.24 -1.09 117.35 121.53 1nuf s TYR 311 Ca 0.06 -0.41 -0.12 0.00 -1.01 0.00 0.00 57.07 55.58 1nuf s TYR 311 Cb -0.06 -1.24 0.01 0.00 -0.11 0.00 0.00 41.96 40.56 1nuf s TYR 311 CO -0.01 0.62 0.33 0.71 -1.11 0.00 0.00 175.55 176.09 1nuf s TYR 312 N -2.54 0.05 0.23 2.71 1.51 -0.57 -2.34 117.35 116.39 1nuf s TYR 312 Ca 0.32 -0.42 0.08 0.00 -1.01 0.00 0.00 57.07 56.04 1nuf s TYR 312 Cb -0.01 0.11 -0.04 0.00 -0.11 0.00 0.00 41.96 41.90 1nuf s TYR 312 CO 0.17 -0.69 0.03 0.16 -1.11 0.00 0.00 175.55 174.11 1nuf s ASP 313 N -2.87 4.79 0.48 2.29 1.47 -0.67 -0.58 116.67 121.59 1nuf s ASP 313 Ca 0.08 -0.49 0.16 0.00 1.18 0.00 0.00 52.55 53.47 1nuf s ASP 313 Cb 0.03 -1.00 0.85 0.00 -0.34 0.00 0.00 42.92 42.46 1nuf s ASP 313 CO -0.08 0.03 1.41 -0.65 0.68 0.00 0.00 175.17 176.56 1nuf h PRO 314 N 2.12 0.00 -0.01 2.11 0.11 -1.91 0.16 132.00 134.58 1nuf h PRO 314 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1nuf h PRO 314 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1nuf h PRO 314 CO 0.59 0.00 -0.00 -1.33 -0.21 0.00 0.00 178.00 177.05 1nuf n MET 315 N -2.36 1.46 -0.58 1.05 2.81 -1.26 -4.72 117.12 113.52 1nuf n MET 315 Ca -0.01 -0.68 0.00 0.00 -1.81 0.00 0.00 57.70 55.20 1nuf n MET 315 Cb 0.48 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 1nuf n MET 315 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nuf n GLY 316 N 1.13 0.71 3.76 3.03 0.00 0.55 -3.80 105.19 110.56 1nuf n GLY 316 Ca 0.20 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1nuf n GLY 316 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nuf s ASN 317 N -2.03 7.06 0.20 1.61 0.01 -1.24 -4.03 114.94 116.52 1nuf s ASN 317 Ca 0.00 1.27 -0.30 0.00 -0.71 0.00 0.00 52.86 53.12 1nuf s ASN 317 Cb 0.00 -2.40 -0.08 0.00 0.41 0.00 0.00 41.25 39.18 1nuf s ASN 317 CO 0.00 0.07 0.96 -2.84 -1.51 0.00 0.00 177.10 173.78 1nuf s PRO 318 N -0.14 4.79 0.23 -0.60 0.02 -1.26 -1.67 135.00 136.37 1nuf s PRO 318 Ca 0.34 1.51 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1nuf s PRO 318 Cb -0.19 -3.30 -0.04 0.00 0.02 0.00 0.00 34.50 30.99 1nuf s PRO 318 CO 0.19 0.39 0.41 -0.51 -0.33 0.00 0.00 177.00 177.16 1nuf s LEU 319 N -0.82 4.20 0.17 -5.54 1.02 -0.99 -4.94 118.68 111.79 1nuf s LEU 319 Ca 0.43 0.36 -0.06 0.00 0.02 0.00 0.00 54.13 54.88 1nuf s LEU 319 Cb -0.26 -3.14 0.05 0.00 0.02 0.00 0.00 46.19 42.86 1nuf s LEU 319 CO 0.32 -0.09 1.48 0.44 0.02 0.00 0.00 176.35 178.52 1nuf h ASP 320 N 1.65 0.74 -0.28 2.29 5.19 -1.96 -3.36 116.42 120.70 1nuf h ASP 320 Ca -0.49 -0.39 -0.08 0.00 -0.62 0.00 0.00 57.03 55.45 1nuf h ASP 320 Cb 1.20 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.48 1nuf h ASP 320 CO 0.66 1.13 0.42 1.17 -3.12 0.00 0.00 179.24 179.50 1nuf n LYS 321 N -3.98 0.45 -1.42 3.56 4.81 -1.26 -2.30 118.16 118.02 1nuf n LYS 321 Ca -0.03 -0.68 0.00 0.00 -0.87 0.00 0.00 58.31 56.73 1nuf n LYS 321 Cb 0.61 -3.16 0.00 0.00 0.02 0.00 0.00 35.03 32.50 1nuf n LYS 321 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nuf n GLY 322 N 6.55 0.19 0.00 3.14 0.00 -1.26 -3.85 105.19 109.96 1nuf n GLY 322 Ca 0.51 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1nuf n GLY 322 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nuf n SER 323 N -1.12 0.41 -0.82 1.61 3.41 -0.97 -3.59 113.62 112.54 1nuf n SER 323 Ca 0.00 -0.89 0.03 0.00 -0.26 0.00 0.00 58.87 57.75 1nuf n SER 323 Cb 0.47 0.07 0.04 0.00 -0.26 0.00 0.00 64.21 64.53 1nuf n SER 323 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1nuf n ASP 324 N -0.07 0.77 0.01 4.04 3.85 -1.26 -4.04 116.55 119.85 1nuf n ASP 324 Ca 0.00 -2.29 0.11 0.00 -0.71 0.00 0.00 54.79 51.90 1nuf n ASP 324 Cb 0.11 -0.29 0.10 0.00 -1.35 0.00 0.00 41.12 39.69 1nuf n ASP 324 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1nuf n SER 325 N -0.08 0.66 -3.63 -1.12 7.64 -1.26 -4.57 113.62 111.26 1nuf n SER 325 Ca 0.06 -0.42 -0.29 0.00 1.01 0.00 0.00 58.87 59.23 1nuf n SER 325 Cb 0.85 0.56 -0.13 0.00 -1.01 0.00 0.00 64.21 64.48 1nuf n SER 325 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1nuf s VAL 326 N -3.05 0.88 0.37 0.44 1.01 -1.26 0.16 120.40 118.95 1nuf s VAL 326 Ca 0.08 -2.05 -0.27 0.00 0.00 0.00 0.00 61.98 59.74 1nuf s VAL 326 Cb 0.16 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.82 1nuf s VAL 326 CO 0.77 -0.88 1.29 0.26 0.00 0.00 0.00 175.10 176.53 1nuf s TRP 327 N 0.83 2.96 0.54 5.22 0.52 0.13 -4.75 118.94 124.39 1nuf s TRP 327 Ca 0.16 1.43 0.23 0.00 0.02 0.00 0.00 56.10 57.95 1nuf s TRP 327 Cb -0.23 -3.64 1.40 0.00 -1.15 0.00 0.00 33.47 29.86 1nuf s TRP 327 CO -0.05 -1.88 2.05 -0.91 0.02 0.00 0.00 176.95 176.18 1nuf h ASN 328 N 2.99 0.00 -3.78 2.95 2.35 -1.39 -1.05 115.58 117.65 1nuf h ASN 328 Ca -0.49 0.00 0.11 0.00 -0.55 0.00 0.00 56.30 55.37 1nuf h ASN 328 Cb 1.24 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.36 1nuf h ASN 328 CO 0.64 0.00 0.61 0.72 -1.65 0.00 0.00 177.43 177.75 1nuf s PHE 329 N -4.97 -0.32 0.00 1.19 -0.12 -1.26 -1.37 117.98 111.14 1nuf s PHE 329 Ca -0.05 0.59 0.00 0.00 -0.05 0.00 0.00 56.93 57.42 1nuf s PHE 329 Cb 0.18 0.45 -0.00 0.00 -0.63 0.00 0.00 43.02 43.02 1nuf s PHE 329 CO 0.69 -0.27 -0.02 -1.58 -0.05 0.00 0.00 175.22 173.99 1nuf s HIS 330 N -0.88 0.16 0.02 3.49 2.46 -0.46 -4.82 115.29 115.25 1nuf s HIS 330 Ca 0.01 -0.09 0.05 0.00 0.47 0.00 0.00 55.06 55.50 1nuf s HIS 330 Cb -0.01 -0.10 -0.03 0.00 -0.13 0.00 0.00 32.58 32.30 1nuf s HIS 330 CO -0.01 -0.02 -0.13 0.08 -2.47 0.00 0.00 174.74 172.18 1nuf s VAL 331 N -0.23 3.15 0.00 0.89 1.01 -1.26 -1.19 120.40 122.77 1nuf s VAL 331 Ca -0.02 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1nuf s VAL 331 Cb -0.02 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 34.02 1nuf s VAL 331 CO -0.00 0.38 0.00 -2.67 0.00 0.00 0.00 175.10 172.81 1nuf n TRP 332 N 1.61 -0.35 -4.53 5.22 2.14 0.24 -4.67 117.44 117.10 1nuf n TRP 332 Ca -0.16 0.00 -0.25 0.00 2.07 0.00 0.00 57.50 59.16 1nuf n TRP 332 Cb 0.52 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 30.93 1nuf n TRP 332 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 1nuf s ASN 333 N -0.52 2.90 -0.03 -0.67 -0.87 -0.08 -0.16 114.94 115.51 1nuf s ASN 333 Ca 0.00 -1.54 -0.01 0.00 -1.57 0.00 0.00 52.86 49.74 1nuf s ASN 333 Cb 0.00 0.23 0.03 0.00 -0.02 0.00 0.00 41.25 41.49 1nuf s ASN 333 CO 0.00 -0.77 0.05 -1.61 -2.57 0.00 0.00 177.10 172.21 1nuf s GLU 334 N -3.80 -0.03 0.04 -0.60 2.02 -1.07 -1.10 118.70 114.17 1nuf s GLU 334 Ca 0.27 0.26 0.01 0.00 0.02 0.00 0.00 54.97 55.52 1nuf s GLU 334 Cb 0.05 -0.29 -0.04 0.00 0.10 0.00 0.00 34.13 33.96 1nuf s GLU 334 CO 0.13 -0.20 0.12 0.20 0.02 0.00 0.00 175.26 175.54 1nuf s GLY 335 N 1.32 2.08 -0.34 -1.39 0.00 0.18 -2.97 107.32 106.20 1nuf s GLY 335 Ca -0.06 -0.91 -0.08 0.00 0.00 0.00 0.00 44.72 43.67 1nuf s GLY 335 CO -0.03 -0.85 0.13 0.86 0.00 0.00 0.00 173.10 173.21 1nuf s TRP 336 N -1.36 3.22 -0.17 1.90 -0.11 -0.35 0.25 118.94 122.32 1nuf s TRP 336 Ca 0.29 -1.15 -0.31 0.00 1.22 0.00 0.00 56.10 56.14 1nuf s TRP 336 Cb -0.12 -2.32 0.14 0.00 -1.50 0.00 0.00 33.47 29.67 1nuf s TRP 336 CO 0.21 -0.66 1.13 -0.59 -4.62 0.00 0.00 176.95 172.42 1nuf s PHE 337 N 1.48 -0.22 0.72 5.86 -0.12 -0.98 -4.49 117.98 120.22 1nuf s PHE 337 Ca 0.01 0.27 -0.13 0.00 -0.05 0.00 0.00 56.93 57.02 1nuf s PHE 337 Cb -0.19 0.49 0.03 0.00 -0.63 0.00 0.00 43.02 42.73 1nuf s PHE 337 CO 0.04 -0.26 1.12 0.14 -0.05 0.00 0.00 175.22 176.20 1nuf s VAL 338 N -1.83 3.09 -0.66 -2.49 -7.23 -0.74 -2.94 120.40 107.60 1nuf s VAL 338 Ca 0.05 0.45 0.04 0.00 -1.81 0.00 0.00 61.98 60.71 1nuf s VAL 338 Cb -0.01 -2.93 0.16 0.00 0.56 0.00 0.00 36.38 34.16 1nuf s VAL 338 CO -0.04 -0.37 0.45 -0.13 -0.31 0.00 0.00 175.10 174.70 1nuf s ARG 339 N -4.36 2.38 0.58 4.82 1.81 -1.26 -4.91 118.95 118.01 1nuf s ARG 339 Ca 0.66 -3.13 0.28 0.00 -1.72 0.00 0.00 55.73 51.81 1nuf s ARG 339 Cb -0.21 -3.44 1.73 0.00 -0.45 0.00 0.00 34.95 32.59 1nuf s ARG 339 CO 0.47 -1.23 2.23 0.66 -0.68 0.00 0.00 175.30 176.75 1nuf h SER 340 N 5.77 0.00 1.73 0.23 4.64 -1.95 0.33 113.55 124.30 1nuf h SER 340 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1nuf h SER 340 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1nuf h SER 340 CO 0.72 0.00 -0.19 -2.24 -0.87 0.00 0.00 176.83 174.24 1nuf h ASP 341 N 0.00 0.00 0.00 4.97 2.03 -2.02 -3.37 116.42 118.03 1nuf h ASP 341 Ca 0.01 -0.01 -0.27 0.00 -0.73 0.00 0.00 57.03 56.03 1nuf h ASP 341 Cb 0.05 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.50 1nuf h ASP 341 CO -0.00 0.00 -2.02 0.18 -1.03 0.00 0.00 179.24 176.38 1nuf n LEU 342 N -2.90 1.89 0.00 0.15 4.77 0.21 -5.07 117.00 116.04 1nuf n LEU 342 Ca 0.03 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1nuf n LEU 342 Cb 0.52 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1nuf n LEU 342 CO 0.35 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1nuf n GLY 343 N 2.44 1.39 0.15 -0.72 0.00 0.93 -4.80 105.19 104.59 1nuf n GLY 343 Ca -0.29 -2.02 -0.02 0.00 0.00 0.00 0.00 46.02 43.70 1nuf n GLY 343 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1nuf h PRO 344 N 0.00 0.06 0.00 1.61 0.11 -1.95 -3.16 132.00 128.67 1nuf h PRO 344 Ca 0.00 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.99 1nuf h PRO 344 Cb 0.00 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1nuf h PRO 344 CO 0.00 0.63 -0.37 0.77 -0.21 0.00 0.00 178.00 178.82 1nuf h SER 345 N 0.04 0.00 -0.59 -2.05 0.02 -1.94 -3.25 113.55 105.78 1nuf h SER 345 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1nuf h SER 345 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1nuf h SER 345 CO 0.08 0.37 0.00 -1.22 -1.14 0.00 0.00 176.83 174.92 1nuf n TYR 346 N -3.74 1.62 -1.73 3.45 4.02 -1.19 -4.91 117.16 114.67 1nuf n TYR 346 Ca -0.01 -0.61 -0.30 0.00 -0.01 0.00 0.00 57.90 56.98 1nuf n TYR 346 Cb 0.46 -0.33 0.20 0.00 -0.02 0.00 0.00 39.34 39.65 1nuf n TYR 346 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1nuf s GLY 347 N -0.81 1.74 0.00 2.72 0.00 -1.23 -4.51 107.32 105.22 1nuf s GLY 347 Ca 0.49 -1.15 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1nuf s GLY 347 CO 0.20 -0.35 0.00 0.61 0.00 0.00 0.00 173.10 173.56 1nuf n GLY 348 N -3.12 0.72 3.71 0.20 0.00 -1.15 -4.86 105.19 100.69 1nuf n GLY 348 Ca 0.15 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1nuf n GLY 348 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nuf s TRP 349 N 0.00 3.14 -0.11 1.61 0.52 -1.26 -2.32 118.94 120.52 1nuf s TRP 349 Ca 0.00 0.97 0.03 0.00 0.02 0.00 0.00 56.10 57.12 1nuf s TRP 349 Cb 0.00 -3.62 0.00 0.00 -1.15 0.00 0.00 33.47 28.70 1nuf s TRP 349 CO 0.00 -2.19 -0.22 -0.65 0.02 0.00 0.00 176.95 173.91 1nuf s GLN 350 N 1.56 3.09 -0.08 4.98 -1.52 0.14 -2.10 119.66 125.72 1nuf s GLN 350 Ca 0.63 -0.85 -0.30 0.00 -1.95 0.00 0.00 55.36 52.89 1nuf s GLN 350 Cb -0.33 -2.37 -0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1nuf s GLN 350 CO 0.29 0.14 1.20 0.08 -0.25 0.00 0.00 175.29 176.75 1nuf s VAL 351 N 0.45 4.29 -0.12 1.09 1.01 -0.30 0.48 120.40 127.30 1nuf s VAL 351 Ca -0.15 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1nuf s VAL 351 Cb -0.17 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.20 1nuf s VAL 351 CO 0.06 -0.03 -0.11 -0.76 0.00 0.00 0.00 175.10 174.26 1nuf s LEU 352 N 2.50 1.44 -0.25 3.92 1.43 -0.25 -2.91 118.68 124.56 1nuf s LEU 352 Ca 0.55 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1nuf s LEU 352 Cb -0.24 -0.97 0.07 0.00 0.03 0.00 0.00 46.19 45.08 1nuf s LEU 352 CO 0.20 -0.07 -0.02 -0.62 0.23 0.00 0.00 176.35 176.06 1nuf s ASP 353 N 1.45 3.94 0.00 2.29 -1.08 -1.02 -0.90 116.67 121.35 1nuf s ASP 353 Ca 0.02 -1.31 0.30 0.00 -0.52 0.00 0.00 52.55 51.03 1nuf s ASP 353 Cb -0.13 -1.18 1.46 0.00 -1.46 0.00 0.00 42.92 41.61 1nuf s ASP 353 CO -0.07 -0.27 1.98 0.00 0.52 0.00 0.00 175.17 177.33 1nuf n ALA 354 N 4.66 2.67 -2.49 3.66 0.00 -1.26 -3.66 120.51 124.08 1nuf n ALA 354 Ca -0.09 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.63 1nuf n ALA 354 Cb 0.44 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 1nuf n ALA 354 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1nuf s THR 355 N -2.14 4.29 -0.60 0.00 2.01 -1.26 -4.47 115.64 113.47 1nuf s THR 355 Ca 0.39 1.49 -0.26 0.00 0.31 0.00 0.00 61.69 63.62 1nuf s THR 355 Cb 0.21 -4.22 -0.07 0.00 0.01 0.00 0.00 72.50 68.44 1nuf s THR 355 CO 0.39 -0.42 2.25 -2.16 -0.69 0.00 0.00 174.62 174.00 1nuf s PRO 356 N 3.88 2.16 0.00 4.92 0.04 -1.26 -4.50 135.00 140.23 1nuf s PRO 356 Ca 0.52 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.52 1nuf s PRO 356 Cb -0.16 -4.61 0.00 0.00 0.04 0.00 0.00 34.50 29.77 1nuf s PRO 356 CO 0.19 -3.36 0.00 1.04 0.04 0.00 0.00 177.00 174.91 1nuf n GLN 357 N 9.01 0.00 -4.52 4.56 6.02 -1.26 -5.07 117.38 126.12 1nuf n GLN 357 Ca 0.35 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 57.12 1nuf n GLN 357 Cb 0.52 -0.70 -0.16 0.00 1.02 0.00 0.00 30.24 30.92 1nuf n GLN 357 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1nuf s GLU 358 N -1.79 1.17 0.13 -1.09 2.56 -1.26 -5.12 118.70 113.30 1nuf s GLU 358 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 54.97 54.27 1nuf s GLU 358 Cb 0.00 -1.07 -0.07 0.00 2.00 0.00 0.00 34.13 34.99 1nuf s GLU 358 CO 0.00 0.17 1.13 1.03 -0.56 0.00 0.00 175.26 177.03 1nuf s ARG 359 N 0.09 4.53 -0.12 4.30 0.52 -1.26 -4.38 118.95 122.62 1nuf s ARG 359 Ca -0.02 1.73 0.01 0.00 -0.52 0.00 0.00 55.73 56.93 1nuf s ARG 359 Cb -0.09 -3.30 0.02 0.00 0.52 0.00 0.00 34.95 32.10 1nuf s ARG 359 CO 0.01 -0.05 -0.15 0.45 0.02 0.00 0.00 175.30 175.58 1nuf s SER 360 N 0.32 2.56 -1.26 0.23 0.15 0.54 -4.66 113.70 111.58 1nuf s SER 360 Ca 0.53 -0.46 -0.05 0.00 0.70 0.00 0.00 55.95 56.67 1nuf s SER 360 Cb -0.29 -1.13 0.03 0.00 -1.71 0.00 0.00 66.02 62.92 1nuf s SER 360 CO 0.33 -0.01 0.32 0.00 1.20 0.00 0.00 173.24 175.08 1nuf n GLN 361 N 4.42 -3.20 0.00 5.44 6.02 -1.26 0.29 117.38 129.09 1nuf n GLN 361 Ca -0.18 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1nuf n GLN 361 Cb 0.51 -5.30 0.00 0.00 1.02 0.00 0.00 30.24 26.47 1nuf n GLN 361 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nuf n GLY 362 N -1.10 2.53 3.70 1.08 0.00 -1.26 -5.02 105.19 105.12 1nuf n GLY 362 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 1nuf n GLY 362 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nuf s VAL 363 N -2.32 3.58 -1.19 1.61 1.01 0.14 -5.01 120.40 118.22 1nuf s VAL 363 Ca 0.00 -1.78 -0.15 0.00 0.00 0.00 0.00 61.98 60.06 1nuf s VAL 363 Cb 0.00 -2.98 0.16 0.00 0.00 0.00 0.00 36.38 33.56 1nuf s VAL 363 CO 0.00 -0.34 1.43 -0.36 0.00 0.00 0.00 175.10 175.83 1nuf s PHE 364 N -2.30 3.40 0.14 5.22 0.40 -1.26 0.20 117.98 123.78 1nuf s PHE 364 Ca 0.33 -2.02 -0.00 0.00 -0.60 0.00 0.00 56.93 54.64 1nuf s PHE 364 Cb -0.06 -4.35 -0.04 0.00 0.51 0.00 0.00 43.02 39.08 1nuf s PHE 364 CO 0.21 -1.44 0.04 1.14 0.70 0.00 0.00 175.22 175.88 1nuf s GLN 365 N 1.92 0.98 -0.28 0.44 -2.07 -1.26 -4.18 119.66 115.21 1nuf s GLN 365 Ca 0.43 -1.47 -0.17 0.00 -1.82 0.00 0.00 55.36 52.33 1nuf s GLN 365 Cb -0.02 0.11 0.09 0.00 -1.09 0.00 0.00 33.01 32.10 1nuf s GLN 365 CO -0.00 -0.23 0.75 0.00 -1.32 0.00 0.00 175.29 174.49 1nuf n GLY 367 N 4.09 0.33 3.73 0.00 0.00 -1.26 -2.44 105.19 109.64 1nuf n GLY 367 Ca -0.19 -1.87 -0.40 0.00 0.00 0.00 0.00 46.02 43.56 1nuf n GLY 367 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nuf s PRO 368 N -1.88 4.47 -0.10 1.61 0.04 -1.26 -4.52 135.00 133.36 1nuf s PRO 368 Ca 0.00 1.02 0.03 0.00 0.04 0.00 0.00 61.00 62.09 1nuf s PRO 368 Cb 0.00 -3.40 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 1nuf s PRO 368 CO 0.00 0.19 -0.20 0.00 0.04 0.00 0.00 177.00 177.03 1nuf s ALA 369 N 0.30 2.34 0.11 8.56 0.00 -1.15 -0.44 121.76 131.48 1nuf s ALA 369 Ca 0.39 -0.95 -0.31 0.00 0.00 0.00 0.00 51.96 51.09 1nuf s ALA 369 Cb -0.20 -0.93 -0.09 0.00 0.00 0.00 0.00 23.12 21.90 1nuf s ALA 369 CO 0.22 0.31 1.68 0.45 0.00 0.00 0.00 175.76 178.42 1nuf s SER 370 N 0.22 6.55 0.17 0.00 0.15 -1.26 -1.15 113.70 118.38 1nuf s SER 370 Ca -0.13 2.59 -0.10 0.00 0.70 0.00 0.00 55.95 59.02 1nuf s SER 370 Cb -0.16 -2.57 0.04 0.00 -1.71 0.00 0.00 66.02 61.62 1nuf s SER 370 CO 0.07 -0.91 1.60 0.58 1.20 0.00 0.00 173.24 175.78 1nuf h VAL 371 N 4.58 1.27 -0.45 4.45 2.07 -1.75 0.09 116.25 126.51 1nuf h VAL 371 Ca -0.43 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 65.82 1nuf h VAL 371 Cb 1.21 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1nuf h VAL 371 CO 0.93 0.45 0.20 0.40 0.02 0.00 0.00 177.57 179.57 1nuf h ILE 372 N 0.93 1.16 -0.14 4.57 2.04 -1.81 -1.78 117.51 122.47 1nuf h ILE 372 Ca 0.15 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1nuf h ILE 372 Cb 0.66 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1nuf h ILE 372 CO 0.05 0.19 -0.02 1.23 0.00 0.00 0.00 178.15 179.60 1nuf h GLY 373 N 0.76 0.29 1.03 5.37 0.00 -1.71 -2.84 103.07 105.97 1nuf h GLY 373 Ca 0.16 -0.23 0.11 0.00 0.00 0.00 0.00 47.33 47.37 1nuf h GLY 373 CO -0.02 0.21 0.38 -2.08 0.00 0.00 0.00 176.54 175.04 1nuf h VAL 374 N -0.02 0.84 0.00 4.60 2.07 -0.39 0.17 116.25 123.53 1nuf h VAL 374 Ca 0.04 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1nuf h VAL 374 Cb 0.42 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1nuf h VAL 374 CO 0.01 0.05 0.00 -0.09 0.02 0.00 0.00 177.57 177.56 1nuf h ARG 375 N 0.27 0.00 -0.18 1.57 2.43 -1.11 -3.14 114.38 114.22 1nuf h ARG 375 Ca 0.27 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1nuf h ARG 375 Cb 0.68 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1nuf h ARG 375 CO -0.06 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 178.79 1nuf n GLU 376 N -2.55 1.69 -1.19 0.20 -0.58 0.55 -4.61 120.64 114.15 1nuf n GLU 376 Ca 0.03 -1.63 -0.06 0.00 -0.42 0.00 0.00 57.16 55.07 1nuf n GLU 376 Cb 0.33 -1.27 -0.03 0.00 -0.57 0.00 0.00 31.44 29.91 1nuf n GLU 376 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nuf n GLY 377 N 0.67 0.75 1.90 0.62 0.00 -0.86 -4.82 105.19 103.45 1nuf n GLY 377 Ca 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 1nuf n GLY 377 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nuf n ASP 378 N -0.56 3.94 0.00 1.61 8.00 -1.15 -4.34 116.55 124.05 1nuf n ASP 378 Ca -0.06 -2.15 0.00 0.00 0.71 0.00 0.00 54.79 53.29 1nuf n ASP 378 Cb 0.41 -0.96 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1nuf n ASP 378 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1nuf n VAL 379 N 2.18 1.05 1.19 2.53 0.24 -1.26 -2.37 118.33 121.90 1nuf n VAL 379 Ca 0.18 0.35 0.14 0.00 -2.04 0.00 0.00 64.34 62.96 1nuf n VAL 379 Cb 0.55 -1.35 0.57 0.00 -1.47 0.00 0.00 33.84 32.14 1nuf n VAL 379 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nuf n GLN 380 N -1.23 0.28 -2.06 7.34 -0.00 -1.26 -4.03 117.38 116.43 1nuf n GLN 380 Ca 0.00 -0.07 -0.29 0.00 -0.00 0.00 0.00 57.00 56.64 1nuf n GLN 380 Cb 0.09 -1.50 0.03 0.00 -0.00 0.00 0.00 30.24 28.86 1nuf n GLN 380 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1nuf s LEU 381 N -2.77 3.09 0.26 2.61 1.43 -1.00 -5.07 118.68 117.23 1nuf s LEU 381 Ca 0.20 1.07 -0.09 0.00 -1.03 0.00 0.00 54.13 54.28 1nuf s LEU 381 Cb 0.19 -3.92 -0.07 0.00 0.03 0.00 0.00 46.19 42.42 1nuf s LEU 381 CO 0.53 -1.14 0.57 0.20 0.23 0.00 0.00 176.35 176.74 1nuf s ASN 382 N -4.30 6.57 0.18 2.29 0.02 -1.26 -4.29 114.94 114.16 1nuf s ASN 382 Ca 0.56 0.89 0.10 0.00 -1.02 0.00 0.00 52.86 53.39 1nuf s ASN 382 Cb -0.11 -2.21 -0.04 0.00 0.02 0.00 0.00 41.25 38.90 1nuf s ASN 382 CO 0.50 -0.13 -0.21 -0.36 0.02 0.00 0.00 177.10 176.91 1nuf s PHE 383 N -1.93 2.08 -1.67 2.20 0.40 0.41 -4.47 117.98 115.00 1nuf s PHE 383 Ca 0.47 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 56.26 1nuf s PHE 383 Cb -0.11 -1.03 0.13 0.00 0.51 0.00 0.00 43.02 42.51 1nuf s PHE 383 CO 0.24 0.43 0.57 -0.25 0.70 0.00 0.00 175.22 176.91 1nuf n ASP 384 N 0.27 -1.83 -0.00 1.36 8.00 -1.26 -4.03 116.55 119.06 1nuf n ASP 384 Ca -0.13 -1.10 -0.12 0.00 0.71 0.00 0.00 54.79 54.15 1nuf n ASP 384 Cb 0.56 -2.38 -0.08 0.00 -0.02 0.00 0.00 41.12 39.20 1nuf n ASP 384 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 1nuf h MET 385 N -1.46 0.05 -0.75 -1.24 2.86 -1.79 -2.92 114.93 109.68 1nuf h MET 385 Ca -0.61 -0.02 0.16 0.00 -2.06 0.00 0.00 59.70 57.17 1nuf h MET 385 Cb 1.39 -0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.94 1nuf h MET 385 CO 0.77 0.33 0.25 -1.35 1.06 0.00 0.00 176.91 177.97 1nuf h PRO 386 N -0.23 0.35 0.24 -0.22 0.11 -1.90 -0.04 132.00 130.31 1nuf h PRO 386 Ca 0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 1nuf h PRO 386 Cb 0.31 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1nuf h PRO 386 CO 0.00 0.23 -0.12 0.35 -0.21 0.00 0.00 178.00 178.25 1nuf h PHE 387 N 0.36 -0.30 -0.23 0.65 3.57 -1.95 -2.61 116.94 116.44 1nuf h PHE 387 Ca 0.42 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.85 1nuf h PHE 387 Cb 0.70 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1nuf h PHE 387 CO -0.21 -0.11 -0.15 0.82 -2.23 0.00 0.00 178.31 176.44 1nuf h ILE 388 N -0.43 1.22 0.02 1.41 2.04 -1.26 -1.92 117.51 118.58 1nuf h ILE 388 Ca -0.03 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 1nuf h ILE 388 Cb 0.33 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1nuf h ILE 388 CO 0.05 0.31 -0.01 0.15 0.00 0.00 0.00 178.15 178.66 1nuf h PHE 389 N 0.35 -0.02 0.00 1.37 3.57 -0.99 -2.63 116.94 118.59 1nuf h PHE 389 Ca 0.07 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1nuf h PHE 389 Cb 0.47 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1nuf h PHE 389 CO 0.01 0.27 -0.10 0.00 -2.23 0.00 0.00 178.31 176.26 1nuf h ALA 390 N 0.67 1.71 0.00 2.41 0.00 -1.37 0.10 119.26 122.77 1nuf h ALA 390 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1nuf h ALA 390 Cb 0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1nuf h ALA 390 CO 0.00 0.13 -0.03 1.49 0.00 0.00 0.00 179.25 180.84 1nuf h GLU 391 N 0.00 0.00 0.00 0.00 4.81 -0.97 -2.06 114.58 116.36 1nuf h GLU 391 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1nuf h GLU 391 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1nuf h GLU 391 CO 0.01 0.03 -0.00 1.33 -0.73 0.00 0.00 179.01 179.65 1nuf n VAL 392 N -3.48 0.00 -0.06 0.32 0.24 -0.25 -2.93 118.33 112.18 1nuf n VAL 392 Ca -0.02 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 1nuf n VAL 392 Cb 0.13 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 1nuf n VAL 392 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1nuf n ASN 393 N -0.90 0.12 -4.57 -1.34 4.13 0.19 -4.11 115.26 108.78 1nuf n ASN 393 Ca 0.00 -0.45 -0.40 0.00 1.68 0.00 0.00 54.58 55.41 1nuf n ASN 393 Cb 0.00 0.55 0.02 0.00 -1.54 0.00 0.00 39.78 38.81 1nuf n ASN 393 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1nuf n ALA 394 N -0.55 -0.20 -1.97 5.41 0.00 -0.78 -4.97 120.51 117.44 1nuf n ALA 394 Ca 0.00 0.13 -0.40 0.00 0.00 0.00 0.00 53.44 53.17 1nuf n ALA 394 Cb 0.01 -2.02 -0.06 0.00 0.00 0.00 0.00 19.45 17.39 1nuf n ALA 394 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1nuf s ASP 395 N -0.95 7.46 -0.23 0.00 1.01 -0.14 -4.61 116.67 119.22 1nuf s ASP 395 Ca 0.67 1.74 -0.11 0.00 0.71 0.00 0.00 52.55 55.56 1nuf s ASP 395 Cb -0.51 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 40.83 1nuf s ASP 395 CO 0.54 0.15 0.16 -0.60 0.21 0.00 0.00 175.17 175.63 1nuf s ARG 396 N -0.96 4.11 -0.18 8.23 3.52 0.19 -1.68 118.95 132.18 1nuf s ARG 396 Ca 0.39 -0.24 0.01 0.00 -0.13 0.00 0.00 55.73 55.76 1nuf s ARG 396 Cb -0.24 -3.50 0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1nuf s ARG 396 CO 0.28 0.13 -0.14 0.42 -0.81 0.00 0.00 175.30 175.18 1nuf s ILE 397 N 0.86 1.72 0.22 4.11 1.01 -0.65 -0.48 121.20 127.98 1nuf s ILE 397 Ca 0.08 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 1nuf s ILE 397 Cb -0.13 -1.67 -0.08 0.00 0.01 0.00 0.00 42.46 40.59 1nuf s ILE 397 CO 0.03 0.36 0.64 -0.89 0.00 0.00 0.00 174.94 175.08 1nuf s THR 398 N 1.40 4.75 0.02 2.92 2.01 -0.32 -1.91 115.64 124.51 1nuf s THR 398 Ca 0.02 0.92 0.00 0.00 0.31 0.00 0.00 61.69 62.94 1nuf s THR 398 Cb -0.14 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 1nuf s THR 398 CO -0.10 0.08 -0.03 0.26 -0.69 0.00 0.00 174.62 174.14 1nuf s TRP 399 N -1.67 0.23 -0.11 4.92 0.52 -0.25 -0.83 118.94 121.76 1nuf s TRP 399 Ca 0.45 -0.42 -0.02 0.00 0.02 0.00 0.00 56.10 56.13 1nuf s TRP 399 Cb -0.14 -0.17 -0.03 0.00 -1.15 0.00 0.00 33.47 31.99 1nuf s TRP 399 CO 0.20 -0.14 -0.02 -0.51 0.02 0.00 0.00 176.95 176.49 1nuf s LEU 400 N -1.16 3.42 -0.06 2.99 2.01 -0.18 -1.52 118.68 124.19 1nuf s LEU 400 Ca -0.12 0.02 0.02 0.00 0.01 0.00 0.00 54.13 54.06 1nuf s LEU 400 Cb -0.08 -1.79 0.02 0.00 0.01 0.00 0.00 46.19 44.34 1nuf s LEU 400 CO -0.01 0.29 -0.09 -0.47 1.01 0.00 0.00 176.35 177.09 1nuf s TYR 401 N -0.38 1.13 -0.28 0.29 6.04 0.26 -1.06 117.35 123.35 1nuf s TYR 401 Ca 0.07 -0.38 -0.09 0.00 0.04 0.00 0.00 57.07 56.71 1nuf s TYR 401 Cb -0.12 -0.88 -0.03 0.00 -1.04 0.00 0.00 41.96 39.89 1nuf s TYR 401 CO 0.02 -0.24 0.12 0.34 -1.54 0.00 0.00 175.55 174.26 1nuf s ASP 402 N 0.77 5.46 0.12 4.32 -1.08 -0.91 -4.29 116.67 121.06 1nuf s ASP 402 Ca -0.13 -0.26 -0.17 0.00 -0.52 0.00 0.00 52.55 51.47 1nuf s ASP 402 Cb -0.15 -1.99 -0.03 0.00 -1.46 0.00 0.00 42.92 39.29 1nuf s ASP 402 CO 0.02 -0.09 1.63 0.78 0.52 0.00 0.00 175.17 178.03 1nuf h ASN 403 N 8.30 0.52 0.56 -0.34 2.35 -1.92 0.13 115.58 125.19 1nuf h ASN 403 Ca -0.36 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.15 1nuf h ASN 403 Cb 1.17 -0.14 0.01 0.00 0.05 0.00 0.00 38.32 39.41 1nuf h ASN 403 CO 0.58 0.60 -0.27 0.71 -1.65 0.00 0.00 177.43 177.40 1nuf h THR 404 N 0.42 0.00 0.00 2.81 1.35 -1.96 -3.15 112.91 112.38 1nuf h THR 404 Ca 0.11 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1nuf h THR 404 Cb 0.27 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.69 1nuf h THR 404 CO -0.00 0.00 0.00 0.71 -0.25 0.00 0.00 175.52 175.98 1nuf h THR 405 N -0.95 0.00 0.00 6.82 1.35 -2.00 -3.45 112.91 114.68 1nuf h THR 405 Ca -0.08 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1nuf h THR 405 Cb 0.58 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1nuf h THR 405 CO 0.13 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.01 1nuf n GLY 406 N -0.33 1.73 3.71 5.82 0.00 0.03 -4.96 105.19 111.18 1nuf n GLY 406 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1nuf n GLY 406 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nuf s LYS 407 N 0.00 1.53 -0.06 1.61 1.02 -1.24 -4.79 119.74 117.81 1nuf s LYS 407 Ca 0.00 1.50 -0.02 0.00 0.02 0.00 0.00 55.97 57.47 1nuf s LYS 407 Cb 0.00 -1.79 0.04 0.00 -0.52 0.00 0.00 37.83 35.56 1nuf s LYS 407 CO 0.00 -2.24 0.12 -1.14 -0.92 0.00 0.00 175.35 171.17 1nuf s GLN 408 N -4.57 0.06 -0.02 1.68 0.74 -1.26 -2.15 119.66 114.15 1nuf s GLN 408 Ca 0.67 0.35 -0.00 0.00 0.05 0.00 0.00 55.36 56.43 1nuf s GLN 408 Cb -0.23 -0.20 0.02 0.00 1.10 0.00 0.00 33.01 33.70 1nuf s GLN 408 CO 0.55 -0.18 0.02 1.67 -0.55 0.00 0.00 175.29 176.80 1nuf s TRP 409 N 1.24 0.02 0.17 1.67 -2.14 -0.22 -4.99 118.94 114.68 1nuf s TRP 409 Ca -0.08 0.10 -0.32 0.00 2.66 0.00 0.00 56.10 58.46 1nuf s TRP 409 Cb -0.12 -0.17 -0.11 0.00 -3.10 0.00 0.00 33.47 29.97 1nuf s TRP 409 CO -0.05 -0.07 1.77 0.21 -2.66 0.00 0.00 176.95 176.15 1nuf s LYS 410 N 0.79 4.13 -0.22 3.25 2.20 -1.26 -1.01 119.74 127.62 1nuf s LYS 410 Ca -0.07 2.60 -0.06 0.00 -0.36 0.00 0.00 55.97 58.08 1nuf s LYS 410 Cb -0.09 -3.31 -0.11 0.00 -1.51 0.00 0.00 37.83 32.80 1nuf s LYS 410 CO -0.02 -0.79 -0.25 -1.71 -0.36 0.00 0.00 175.35 172.22 1nuf n ASN 411 N 4.75 1.88 -3.53 1.43 2.85 -0.01 -4.90 115.26 117.73 1nuf n ASN 411 Ca 0.17 0.13 -0.13 0.00 -0.11 0.00 0.00 54.58 54.63 1nuf n ASN 411 Cb 0.37 -0.54 -0.05 0.00 1.24 0.00 0.00 39.78 40.80 1nuf n ASN 411 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1nuf s SER 412 N -6.66 -0.51 -0.02 1.20 1.04 -1.23 -4.99 113.70 102.52 1nuf s SER 412 Ca -0.30 0.44 0.08 0.00 0.48 0.00 0.00 55.95 56.64 1nuf s SER 412 Cb 0.10 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 1nuf s SER 412 CO 0.43 -0.56 -0.25 -0.69 0.98 0.00 0.00 173.24 173.16 1nuf s VAL 413 N -1.70 1.96 -0.08 5.02 1.01 -1.26 -1.17 120.40 124.18 1nuf s VAL 413 Ca -0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.84 1nuf s VAL 413 Cb -0.00 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.79 1nuf s VAL 413 CO 0.02 0.55 0.17 0.21 0.00 0.00 0.00 175.10 176.05 1nuf s ASN 414 N -0.58 0.24 -0.19 3.32 3.04 0.37 -4.99 114.94 116.14 1nuf s ASN 414 Ca 0.10 0.35 0.14 0.00 0.04 0.00 0.00 52.86 53.49 1nuf s ASN 414 Cb -0.10 0.27 0.41 0.00 -1.54 0.00 0.00 41.25 40.29 1nuf s ASN 414 CO -0.01 -0.19 1.28 -1.54 -3.04 0.00 0.00 177.10 173.59 1nuf n SER 415 N 4.72 2.42 0.00 -4.21 3.41 -1.26 0.53 113.62 119.22 1nuf n SER 415 Ca -0.17 -3.47 0.00 0.00 -0.26 0.00 0.00 58.87 54.98 1nuf n SER 415 Cb 0.51 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1nuf n SER 415 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1nuf n HIS 416 N -1.14 0.00 -0.29 7.33 8.25 -1.26 -4.81 115.22 123.30 1nuf n HIS 416 Ca 0.21 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.62 1nuf n HIS 416 Cb 0.77 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.95 1nuf n HIS 416 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1nuf h THR 417 N 0.00 1.26 -3.69 1.59 1.35 -1.93 -3.44 112.91 108.06 1nuf h THR 417 Ca 0.00 -0.80 -0.50 0.00 -0.55 0.00 0.00 66.41 64.56 1nuf h THR 417 Cb 0.31 0.29 -0.02 0.00 -1.73 0.00 0.00 68.15 67.00 1nuf h THR 417 CO 0.00 0.33 0.37 -0.63 -0.25 0.00 0.00 175.52 175.33 1nuf s ILE 418 N -5.59 4.17 -0.10 6.82 1.01 -1.26 -4.44 121.20 121.81 1nuf s ILE 418 Ca -0.12 2.03 -0.02 0.00 0.00 0.00 0.00 60.65 62.54 1nuf s ILE 418 Cb 0.16 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.33 1nuf s ILE 418 CO 0.84 0.43 0.12 0.61 0.00 0.00 0.00 174.94 176.93 1nuf n GLY 419 N 1.74 -0.70 3.10 6.18 0.00 -0.82 -4.64 105.19 110.05 1nuf n GLY 419 Ca -0.00 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1nuf n GLY 419 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nuf s ARG 420 N -1.85 0.75 -1.35 1.61 0.52 -0.08 -4.86 118.95 113.69 1nuf s ARG 420 Ca 0.03 -0.69 -0.11 0.00 -0.52 0.00 0.00 55.73 54.45 1nuf s ARG 420 Cb -0.01 -0.70 0.01 0.00 0.52 0.00 0.00 34.95 34.77 1nuf s ARG 420 CO 0.14 0.17 0.45 0.66 0.02 0.00 0.00 175.30 176.74 1nuf n TYR 421 N 1.91 -1.57 -1.96 -0.53 4.02 -1.26 -2.10 117.16 115.67 1nuf n TYR 421 Ca -0.19 0.53 -0.42 0.00 -0.01 0.00 0.00 57.90 57.81 1nuf n TYR 421 Cb 0.55 -3.31 -0.03 0.00 -0.02 0.00 0.00 39.34 36.54 1nuf n TYR 421 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1nuf s ILE 422 N -3.88 3.50 0.29 -0.72 1.01 -1.26 -4.45 121.20 115.69 1nuf s ILE 422 Ca 0.19 0.59 0.11 0.00 0.00 0.00 0.00 60.65 61.54 1nuf s ILE 422 Cb -0.08 -3.44 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 1nuf s ILE 422 CO 0.92 -0.11 -0.13 -0.44 0.00 0.00 0.00 174.94 175.18 1nuf s SER 423 N 4.10 3.86 -0.07 3.58 0.01 0.63 -0.68 113.70 125.13 1nuf s SER 423 Ca 0.77 -0.97 -0.27 0.00 1.31 0.00 0.00 55.95 56.78 1nuf s SER 423 Cb -0.32 -0.44 0.06 0.00 0.21 0.00 0.00 66.02 65.53 1nuf s SER 423 CO 0.31 -0.03 0.61 0.28 0.41 0.00 0.00 173.24 174.83 1nuf s THR 424 N -2.49 0.01 0.55 1.44 -1.32 -0.83 -0.63 115.64 112.37 1nuf s THR 424 Ca 0.31 -0.08 -0.21 0.00 -1.21 0.00 0.00 61.69 60.50 1nuf s THR 424 Cb -0.04 -0.92 -0.05 0.00 -1.51 0.00 0.00 72.50 69.99 1nuf s THR 424 CO 0.17 -0.04 1.33 -0.75 -2.21 0.00 0.00 174.62 173.11 1nuf s LYS 425 N -0.99 3.13 0.43 7.08 2.20 -1.26 -1.19 119.74 129.14 1nuf s LYS 425 Ca -0.10 2.16 -0.12 0.00 -0.36 0.00 0.00 55.97 57.56 1nuf s LYS 425 Cb -0.02 -2.22 -0.07 0.00 -1.51 0.00 0.00 37.83 34.02 1nuf s LYS 425 CO 0.08 -1.18 0.81 0.00 -0.36 0.00 0.00 175.35 174.70 1nuf s ALA 426 N -1.34 3.29 -0.45 3.13 0.00 -0.75 -4.70 121.76 120.94 1nuf s ALA 426 Ca 0.72 -0.13 -0.27 0.00 0.00 0.00 0.00 51.96 52.28 1nuf s ALA 426 Cb -0.39 -2.78 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 1nuf s ALA 426 CO 0.45 -0.06 1.90 0.08 0.00 0.00 0.00 175.76 178.13 1nuf s VAL 427 N -2.43 3.37 0.00 0.00 1.01 -1.26 -2.80 120.40 118.29 1nuf s VAL 427 Ca 0.53 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.82 1nuf s VAL 427 Cb -0.10 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1nuf s VAL 427 CO 0.32 -0.55 0.00 0.61 0.00 0.00 0.00 175.10 175.47 1nuf n GLY 428 N 5.60 0.52 3.72 4.51 0.00 -1.26 -5.05 105.19 113.23 1nuf n GLY 428 Ca 0.24 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 1nuf n GLY 428 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nuf s SER 429 N -2.85 0.08 -0.15 1.61 1.04 -1.12 -5.02 113.70 107.29 1nuf s SER 429 Ca 0.00 -1.03 0.09 0.00 0.48 0.00 0.00 55.95 55.48 1nuf s SER 429 Cb 0.00 0.74 0.51 0.00 0.10 0.00 0.00 66.02 67.37 1nuf s SER 429 CO 0.00 -1.43 1.28 0.59 0.98 0.00 0.00 173.24 174.66 1nuf n ASN 430 N -0.97 3.94 -4.74 7.02 3.02 -1.26 -3.59 115.26 118.69 1nuf n ASN 430 Ca -0.04 -2.58 -0.30 0.00 -0.03 0.00 0.00 54.58 51.62 1nuf n ASN 430 Cb 0.60 -0.62 0.13 0.00 -0.61 0.00 0.00 39.78 39.28 1nuf n ASN 430 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nuf s ALA 431 N -2.10 1.71 -0.35 5.41 0.00 -1.26 -4.83 121.76 120.34 1nuf s ALA 431 Ca 0.34 -0.07 -0.11 0.00 0.00 0.00 0.00 51.96 52.12 1nuf s ALA 431 Cb 0.26 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 20.21 1nuf s ALA 431 CO 0.10 -2.21 0.19 0.50 0.00 0.00 0.00 175.76 174.34 1nuf s ARG 432 N -4.97 3.04 -0.25 0.00 3.52 -1.26 -1.81 118.95 117.22 1nuf s ARG 432 Ca 0.63 -0.93 -0.18 0.00 -0.13 0.00 0.00 55.73 55.12 1nuf s ARG 432 Cb -0.17 -3.68 -0.03 0.00 -1.56 0.00 0.00 34.95 29.51 1nuf s ARG 432 CO 0.56 -0.59 0.51 1.41 -0.81 0.00 0.00 175.30 176.39 1nuf s MET 433 N 1.59 4.09 -0.24 5.12 -2.45 -0.33 -4.93 119.30 122.14 1nuf s MET 433 Ca 0.03 0.33 -0.18 0.00 -1.25 0.00 0.00 55.69 54.63 1nuf s MET 433 Cb -0.18 -3.64 -0.03 0.00 1.25 0.00 0.00 34.83 32.23 1nuf s MET 433 CO 0.07 -0.32 0.51 0.34 1.05 0.00 0.00 175.02 176.67 1nuf s ASP 434 N 1.48 6.47 -0.29 1.11 -1.08 -1.26 -1.97 116.67 121.12 1nuf s ASP 434 Ca 0.22 0.56 0.08 0.00 -0.52 0.00 0.00 52.55 52.88 1nuf s ASP 434 Cb -0.16 -2.28 0.45 0.00 -1.46 0.00 0.00 42.92 39.48 1nuf s ASP 434 CO 0.09 -0.24 1.27 1.33 0.52 0.00 0.00 175.17 178.14 1nuf n VAL 435 N 4.93 2.52 -0.15 1.11 0.24 0.15 -4.72 118.33 122.40 1nuf n VAL 435 Ca -0.05 -3.79 -0.09 0.00 -2.04 0.00 0.00 64.34 58.38 1nuf n VAL 435 Cb 0.50 -0.85 -0.00 0.00 -1.47 0.00 0.00 33.84 32.01 1nuf n VAL 435 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1nuf h THR 436 N 1.73 1.21 0.00 3.34 2.02 -1.94 -2.28 112.91 116.99 1nuf h THR 436 Ca 0.28 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1nuf h THR 436 Cb 1.37 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 1nuf h THR 436 CO 0.59 0.25 0.01 -0.90 0.37 0.00 0.00 175.52 175.85 1nuf n ASP 437 N -4.58 0.00 -0.06 4.18 5.75 -1.26 -1.32 116.55 119.25 1nuf n ASP 437 Ca 0.00 0.23 -0.11 0.00 -0.01 0.00 0.00 54.79 54.90 1nuf n ASP 437 Cb 0.17 -0.23 -0.15 0.00 -1.03 0.00 0.00 41.12 39.89 1nuf n ASP 437 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1nuf n LYS 438 N -1.21 0.67 -0.01 0.11 4.76 -0.86 -4.46 118.16 117.16 1nuf n LYS 438 Ca 0.00 0.15 -0.09 0.00 -2.87 0.00 0.00 58.31 55.50 1nuf n LYS 438 Cb 0.01 -1.64 -0.14 0.00 -1.84 0.00 0.00 35.03 31.42 1nuf n LYS 438 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1nuf h TYR 439 N 0.01 0.03 -3.04 2.13 -1.99 -1.27 -3.41 116.97 109.42 1nuf h TYR 439 Ca -0.44 -0.02 -0.07 0.00 2.00 0.00 0.00 58.73 60.20 1nuf h TYR 439 Cb 2.10 -0.00 -0.16 0.00 2.00 0.00 0.00 36.73 40.67 1nuf h TYR 439 CO 0.01 1.04 -0.08 -1.59 -0.00 0.00 0.00 178.16 177.54 1nuf s LYS 440 N -2.61 0.96 0.56 4.88 -2.85 -0.99 -3.06 119.74 116.62 1nuf s LYS 440 Ca -0.05 -0.39 -0.19 0.00 -1.00 0.00 0.00 55.97 54.34 1nuf s LYS 440 Cb 0.08 0.43 -0.05 0.00 -2.06 0.00 0.00 37.83 36.23 1nuf s LYS 440 CO 0.82 -0.34 1.12 0.71 0.10 0.00 0.00 175.35 177.76 1nuf s TYR 441 N -2.66 2.70 -0.07 1.78 1.51 -1.26 -4.33 117.35 115.02 1nuf s TYR 441 Ca -0.04 1.55 -0.39 0.00 -1.01 0.00 0.00 57.07 57.17 1nuf s TYR 441 Cb -0.00 -3.24 -0.18 0.00 -0.11 0.00 0.00 41.96 38.42 1nuf s TYR 441 CO -0.04 -1.51 1.36 -2.30 -1.11 0.00 0.00 175.55 171.96 1nuf n PRO 442 N -1.45 0.68 -1.41 -1.71 -0.02 -1.26 -4.65 135.00 125.19 1nuf n PRO 442 Ca 0.11 0.25 -0.36 0.00 -2.02 0.00 0.00 63.50 61.48 1nuf n PRO 442 Cb 0.51 -1.84 0.08 0.00 -0.02 0.00 0.00 33.50 32.24 1nuf n PRO 442 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1nuf n GLU 443 N 2.90 0.59 -2.85 -0.52 0.28 -1.26 -3.34 120.64 116.44 1nuf n GLU 443 Ca 0.22 0.26 -0.11 0.00 -0.16 0.00 0.00 57.16 57.36 1nuf n GLU 443 Cb 0.12 -2.27 0.05 0.00 1.43 0.00 0.00 31.44 30.78 1nuf n GLU 443 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1nuf n GLY 444 N 1.06 -0.59 3.47 -1.84 0.00 -1.26 -5.04 105.19 100.99 1nuf n GLY 444 Ca 0.13 0.32 -0.11 0.00 0.00 0.00 0.00 46.02 46.36 1nuf n GLY 444 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nuf s SER 445 N -3.39 -0.50 0.11 1.61 1.04 -1.21 -5.04 113.70 106.32 1nuf s SER 445 Ca 0.30 -0.12 -0.22 0.00 0.48 0.00 0.00 55.95 56.40 1nuf s SER 445 Cb -0.04 0.61 -0.10 0.00 0.10 0.00 0.00 66.02 66.59 1nuf s SER 445 CO 0.55 -1.01 1.73 0.44 0.98 0.00 0.00 173.24 175.93 1nuf h ASP 446 N 2.03 -0.03 -0.80 7.02 3.45 -1.96 -2.58 116.42 123.55 1nuf h ASP 446 Ca -0.32 0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.22 1nuf h ASP 446 Cb 1.30 0.03 -0.05 0.00 -0.56 0.00 0.00 39.33 40.05 1nuf h ASP 446 CO 0.37 -0.00 0.53 1.56 -1.57 0.00 0.00 179.24 180.12 1nuf h GLN 447 N 0.03 0.85 0.06 3.56 7.50 -1.97 -0.07 115.11 125.08 1nuf h GLN 447 Ca 0.04 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.14 1nuf h GLN 447 Cb 0.05 -0.19 -0.00 0.00 0.05 0.00 0.00 27.48 27.38 1nuf h GLN 447 CO -0.07 0.56 -0.06 1.49 -1.50 0.00 0.00 178.83 179.25 1nuf h GLU 448 N 0.87 -0.12 0.00 1.46 4.57 -1.68 0.44 114.58 120.12 1nuf h GLU 448 Ca 0.35 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.52 1nuf h GLU 448 Cb 0.24 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1nuf h GLU 448 CO -0.12 -0.08 -0.09 0.07 -1.18 0.00 0.00 179.01 177.61 1nuf h ARG 449 N -0.13 0.00 0.51 1.92 0.11 -1.47 -0.17 114.38 115.16 1nuf h ARG 449 Ca -0.01 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.05 1nuf h ARG 449 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 1nuf h ARG 449 CO -0.01 0.09 -0.24 1.96 0.10 0.00 0.00 179.97 181.87 1nuf h GLN 450 N 0.00 -0.66 -0.96 0.08 4.20 -0.79 0.69 115.11 117.68 1nuf h GLN 450 Ca -0.00 0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.80 1nuf h GLN 450 Cb 0.20 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.07 1nuf h GLN 450 CO 0.01 -0.35 0.62 0.28 -0.67 0.00 0.00 178.83 178.72 1nuf h VAL 451 N -1.01 1.13 -0.40 -0.54 2.07 -0.71 0.29 116.25 117.07 1nuf h VAL 451 Ca -0.07 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 1nuf h VAL 451 Cb 0.61 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1nuf h VAL 451 CO 0.11 0.21 -0.04 0.15 0.02 0.00 0.00 177.57 178.03 1nuf h PHE 452 N 1.17 0.71 -0.11 1.57 3.57 -0.99 0.24 116.94 123.10 1nuf h PHE 452 Ca 0.40 -0.10 -0.09 0.00 3.53 0.00 0.00 57.97 61.71 1nuf h PHE 452 Cb 0.07 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.62 1nuf h PHE 452 CO -0.01 0.69 -0.27 1.96 -2.23 0.00 0.00 178.31 178.45 1nuf h GLN 453 N 0.62 0.38 -0.57 1.11 1.08 0.28 -1.41 115.11 116.60 1nuf h GLN 453 Ca 0.12 -0.26 0.08 0.00 -1.45 0.00 0.00 58.65 57.14 1nuf h GLN 453 Cb 0.45 0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 27.85 1nuf h GLN 453 CO 0.02 0.87 0.20 -0.22 -0.95 0.00 0.00 178.83 178.75 1nuf h LYS 454 N -0.05 0.37 0.59 1.46 3.64 -0.20 0.89 116.57 123.27 1nuf h LYS 454 Ca -0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1nuf h LYS 454 Cb 0.87 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1nuf h LYS 454 CO 0.06 0.25 -0.28 0.00 -2.27 0.00 0.00 179.45 177.20 1nuf h ALA 455 N 1.39 -0.79 -0.37 5.00 0.00 -0.49 -1.79 119.26 122.19 1nuf h ALA 455 Ca 0.28 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1nuf h ALA 455 Cb 0.33 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1nuf h ALA 455 CO -0.28 -0.88 0.26 1.25 0.00 0.00 0.00 179.25 179.59 1nuf h LEU 456 N -0.93 0.18 -0.44 0.00 5.85 -0.97 0.04 115.31 119.04 1nuf h LEU 456 Ca -0.08 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.47 1nuf h LEU 456 Cb 0.65 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 1nuf h LEU 456 CO 0.13 0.11 -0.78 1.23 -0.34 0.00 0.00 178.44 178.80 1nuf h GLY 457 N 0.20 0.02 1.84 3.75 0.00 -0.69 0.15 103.07 108.34 1nuf h GLY 457 Ca 0.17 -0.03 -0.23 0.00 0.00 0.00 0.00 47.33 47.24 1nuf h GLY 457 CO -0.03 0.03 -1.04 1.70 0.00 0.00 0.00 176.54 177.20 1nuf h LYS 458 N 0.01 0.13 0.00 4.80 3.64 -0.38 -3.30 116.57 121.47 1nuf h LYS 458 Ca -0.01 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.10 1nuf h LYS 458 Cb 1.38 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.26 1nuf h LYS 458 CO 0.10 1.05 -0.43 1.25 -2.27 0.00 0.00 179.45 179.15 1nuf h LEU 459 N 0.05 0.00 -7.46 5.20 5.85 -1.01 -3.41 115.31 114.53 1nuf h LEU 459 Ca -0.06 -0.77 -0.75 0.00 0.84 0.00 0.00 57.88 57.15 1nuf h LEU 459 Cb 1.76 0.00 -0.32 0.00 0.37 0.00 0.00 40.66 42.47 1nuf h LEU 459 CO 0.15 1.14 0.11 -0.75 -0.34 0.00 0.00 178.44 178.75 1nuf s LYS 460 N -2.24 3.61 0.00 1.25 2.47 0.52 -5.06 119.74 120.28 1nuf s LYS 460 Ca -0.21 -3.16 0.00 0.00 -1.56 0.00 0.00 55.97 51.04 1nuf s LYS 460 Cb 0.00 -4.20 0.00 0.00 -1.46 0.00 0.00 37.83 32.17 1nuf s LYS 460 CO 0.62 -1.25 0.06 -2.30 0.16 0.00 0.00 175.35 172.64 1nuf n PRO 461 N 2.65 0.00 0.00 4.03 -0.02 -1.24 -4.59 135.00 135.83 1nuf n PRO 461 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1nuf n PRO 461 Cb 0.39 -0.79 0.00 0.00 -0.02 0.00 0.00 33.50 33.07 1nuf n PRO 461 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1nuf n GLU 479 N 1.58 0.00 0.00 -0.52 1.02 -1.26 -4.98 120.64 116.48 1nuf n GLU 479 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1nuf n GLU 479 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1nuf n GLU 479 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1nuf n PRO 480 N -1.62 0.00 0.00 3.49 -0.02 -1.26 -4.94 135.00 130.64 1nuf n PRO 480 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1nuf n PRO 480 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1nuf n PRO 480 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nuf n SER 481 N 0.00 0.00 -4.20 2.55 2.88 -1.26 -4.95 113.62 108.64 1nuf n SER 481 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 1nuf n SER 481 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1nuf n SER 481 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1nuf s ILE 482 N 0.00 1.39 -0.14 2.46 1.09 -1.26 -0.48 121.20 124.26 1nuf s ILE 482 Ca 0.00 -1.14 0.01 0.00 -1.10 0.00 0.00 60.65 58.41 1nuf s ILE 482 Cb 0.00 -1.24 -0.01 0.00 -1.06 0.00 0.00 42.46 40.16 1nuf s ILE 482 CO 0.00 0.07 -0.16 0.27 -0.10 0.00 0.00 174.94 175.02 1nuf s ILE 483 N -0.88 2.74 0.05 2.92 -4.36 -1.04 -4.95 121.20 115.68 1nuf s ILE 483 Ca 0.04 -0.76 0.05 0.00 -0.26 0.00 0.00 60.65 59.72 1nuf s ILE 483 Cb -0.09 -2.14 -0.04 0.00 1.25 0.00 0.00 42.46 41.45 1nuf s ILE 483 CO 0.02 0.52 -0.06 -0.83 0.24 0.00 0.00 174.94 174.83 1nuf s GLY 484 N 0.56 1.80 -0.30 6.27 0.00 -1.26 -3.01 107.32 111.39 1nuf s GLY 484 Ca -0.10 -1.11 -0.09 0.00 0.00 0.00 0.00 44.72 43.43 1nuf s GLY 484 CO 0.04 -1.04 0.70 0.54 0.00 0.00 0.00 173.10 173.34 1nuf s LYS 485 N -1.87 0.53 0.11 2.90 1.02 -0.63 -4.95 119.74 116.84 1nuf s LYS 485 Ca 0.20 1.23 -0.19 0.00 0.02 0.00 0.00 55.97 57.23 1nuf s LYS 485 Cb -0.11 0.73 -0.07 0.00 -0.52 0.00 0.00 37.83 37.85 1nuf s LYS 485 CO 0.12 -0.28 0.60 -0.51 -0.92 0.00 0.00 175.35 174.36 1nuf s LEU 486 N 2.83 4.48 -0.04 3.17 1.43 -1.26 -0.36 118.68 128.94 1nuf s LEU 486 Ca 0.01 1.28 -0.04 0.00 -1.03 0.00 0.00 54.13 54.35 1nuf s LEU 486 Cb -0.12 -3.07 0.01 0.00 0.03 0.00 0.00 46.19 43.05 1nuf s LEU 486 CO -0.19 0.22 0.11 -0.54 0.23 0.00 0.00 176.35 176.17 1nuf s LYS 487 N -1.35 0.12 0.48 1.70 1.02 -0.61 -4.97 119.74 116.14 1nuf s LYS 487 Ca 0.32 0.15 -0.22 0.00 0.02 0.00 0.00 55.97 56.25 1nuf s LYS 487 Cb -0.19 0.05 -0.07 0.00 -0.52 0.00 0.00 37.83 37.11 1nuf s LYS 487 CO 0.20 -0.02 1.19 0.08 -0.92 0.00 0.00 175.35 175.88 1nuf s VAL 488 N 0.10 2.93 -0.44 3.17 1.01 -1.26 -1.72 120.40 124.18 1nuf s VAL 488 Ca -0.00 0.69 0.07 0.00 0.00 0.00 0.00 61.98 62.73 1nuf s VAL 488 Cb -0.01 -3.34 0.23 0.00 0.00 0.00 0.00 36.38 33.25 1nuf s VAL 488 CO -0.00 -0.02 0.64 0.00 0.00 0.00 0.00 175.10 175.71 1nuf n ALA 489 N -0.68 0.67 0.00 5.51 0.00 -0.82 -4.86 120.51 120.33 1nuf n ALA 489 Ca 0.08 -2.38 0.00 0.00 0.00 0.00 0.00 53.44 51.14 1nuf n ALA 489 Cb 0.48 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1nuf n ALA 489 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nuf n GLY 490 N 1.94 3.81 3.57 0.00 0.00 -1.26 -4.61 105.19 108.64 1nuf n GLY 490 Ca 0.18 -1.40 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 1nuf n GLY 490 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1nuf s MET 491 N -2.56 3.09 0.08 1.61 1.75 -1.26 -4.95 119.30 117.05 1nuf s MET 491 Ca 0.00 0.44 -0.31 0.00 -1.25 0.00 0.00 55.69 54.58 1nuf s MET 491 Cb 0.00 -4.22 -0.08 0.00 2.84 0.00 0.00 34.83 33.37 1nuf s MET 491 CO 0.00 -2.20 1.59 -0.51 -0.65 0.00 0.00 175.02 173.24 1nuf s LEU 492 N 6.95 4.36 -0.19 4.11 1.43 -1.26 -4.97 118.68 129.11 1nuf s LEU 492 Ca 0.55 2.45 -0.28 0.00 -1.03 0.00 0.00 54.13 55.83 1nuf s LEU 492 Cb -0.12 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.64 1nuf s LEU 492 CO 0.23 -0.84 0.88 0.00 0.23 0.00 0.00 176.35 176.85 1nuf s ALA 493 N 2.22 -1.88 -0.02 4.21 0.00 -1.26 -2.46 121.76 122.57 1nuf s ALA 493 Ca 0.71 1.70 -0.30 0.00 0.00 0.00 0.00 51.96 54.08 1nuf s ALA 493 Cb -0.39 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 21.79 1nuf s ALA 493 CO 0.31 -0.31 1.92 0.08 0.00 0.00 0.00 175.76 177.76 1nuf s VAL 494 N -0.43 3.16 0.00 0.00 1.01 0.11 -1.08 120.40 123.17 1nuf s VAL 494 Ca -0.02 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1nuf s VAL 494 Cb -0.03 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1nuf s VAL 494 CO 0.01 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1nuf n GLY 495 N 4.58 1.37 3.94 4.51 0.00 -1.26 -4.65 105.19 113.68 1nuf n GLY 495 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 1nuf n GLY 495 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nuf s LYS 496 N -0.06 3.49 0.45 1.61 1.02 -0.24 -4.78 119.74 121.23 1nuf s LYS 496 Ca 0.00 -0.44 -0.22 0.00 0.02 0.00 0.00 55.97 55.32 1nuf s LYS 496 Cb 0.00 -2.86 -0.08 0.00 -0.52 0.00 0.00 37.83 34.37 1nuf s LYS 496 CO 0.00 0.41 1.10 -1.83 -0.92 0.00 0.00 175.35 174.10 1nuf s GLU 497 N -3.47 3.88 -0.55 1.68 -1.05 -1.26 -4.42 118.70 113.50 1nuf s GLU 497 Ca 0.37 1.59 -0.21 0.00 -0.15 0.00 0.00 54.97 56.57 1nuf s GLU 497 Cb -0.11 -2.36 0.06 0.00 -0.44 0.00 0.00 34.13 31.29 1nuf s GLU 497 CO 0.30 -0.41 0.75 0.08 0.95 0.00 0.00 175.26 176.92 1nuf s VAL 498 N -1.69 4.69 -0.24 1.83 1.01 0.25 -4.83 120.40 121.43 1nuf s VAL 498 Ca 0.63 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 62.10 1nuf s VAL 498 Cb -0.23 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.66 1nuf s VAL 498 CO 0.29 -1.01 0.16 0.20 0.00 0.00 0.00 175.10 174.73 1nuf s ASN 499 N 3.02 6.07 0.21 3.32 0.01 -1.26 -1.34 114.94 124.97 1nuf s ASN 499 Ca 0.18 0.10 0.02 0.00 -0.71 0.00 0.00 52.86 52.45 1nuf s ASN 499 Cb -0.18 -2.10 -0.05 0.00 0.41 0.00 0.00 41.25 39.33 1nuf s ASN 499 CO 0.12 0.06 0.04 -0.76 -1.51 0.00 0.00 177.10 175.05 1nuf s LEU 500 N 1.08 1.95 -0.04 0.60 1.43 0.14 -1.95 118.68 121.90 1nuf s LEU 500 Ca 0.07 -1.26 -0.01 0.00 -1.03 0.00 0.00 54.13 51.90 1nuf s LEU 500 Cb -0.14 -0.06 0.03 0.00 0.03 0.00 0.00 46.19 46.06 1nuf s LEU 500 CO 0.05 -0.62 0.06 -0.69 0.23 0.00 0.00 176.35 175.38 1nuf s VAL 501 N -3.66 -0.08 -0.19 -1.59 1.01 -0.70 0.68 120.40 115.87 1nuf s VAL 501 Ca 0.30 0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.37 1nuf s VAL 501 Cb 0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 36.28 1nuf s VAL 501 CO 0.08 0.11 0.45 -0.22 0.00 0.00 0.00 175.10 175.52 1nuf s LEU 502 N 1.37 4.16 -0.16 3.92 2.96 0.17 -1.57 118.68 129.55 1nuf s LEU 502 Ca -0.06 0.60 -0.05 0.00 -0.22 0.00 0.00 54.13 54.40 1nuf s LEU 502 Cb -0.13 -2.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 1nuf s LEU 502 CO -0.04 -0.10 0.03 -0.76 -1.32 0.00 0.00 176.35 174.16 1nuf s LEU 503 N 1.35 3.66 0.06 -0.68 1.02 0.52 -0.88 118.68 123.72 1nuf s LEU 503 Ca 0.21 0.06 0.01 0.00 0.02 0.00 0.00 54.13 54.43 1nuf s LEU 503 Cb -0.15 -1.90 -0.03 0.00 0.02 0.00 0.00 46.19 44.13 1nuf s LEU 503 CO 0.09 0.22 -0.06 -0.76 0.02 0.00 0.00 176.35 175.86 1nuf s LEU 504 N 0.08 2.37 -0.29 1.79 1.43 -1.10 -1.60 118.68 121.35 1nuf s LEU 504 Ca 0.03 -0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 52.24 1nuf s LEU 504 Cb -0.13 -0.04 0.11 0.00 0.03 0.00 0.00 46.19 46.16 1nuf s LEU 504 CO 0.01 -0.36 0.75 -0.75 0.23 0.00 0.00 176.35 176.24 1nuf s LYS 505 N -2.59 0.59 0.33 1.70 2.20 -1.16 -1.01 119.74 119.79 1nuf s LYS 505 Ca -0.02 1.15 -0.27 0.00 -0.36 0.00 0.00 55.97 56.47 1nuf s LYS 505 Cb -0.03 0.33 -0.09 0.00 -1.51 0.00 0.00 37.83 36.53 1nuf s LYS 505 CO -0.03 -0.15 1.08 1.21 -0.36 0.00 0.00 175.35 177.10 1nuf s ASN 506 N 1.95 7.04 -0.11 1.43 3.04 -1.18 -2.51 114.94 124.61 1nuf s ASN 506 Ca -0.08 2.17 0.13 0.00 0.04 0.00 0.00 52.86 55.11 1nuf s ASN 506 Cb -0.07 -2.61 -0.18 0.00 -1.54 0.00 0.00 41.25 36.86 1nuf s ASN 506 CO -0.19 -0.30 0.10 0.18 -3.04 0.00 0.00 177.10 173.85 1nuf n LEU 507 N 0.64 0.00 -4.82 3.21 4.77 0.37 -2.48 117.00 118.69 1nuf n LEU 507 Ca 0.02 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.70 1nuf n LEU 507 Cb 0.47 0.27 0.09 0.00 -2.33 0.00 0.00 43.42 41.92 1nuf n LEU 507 CO 0.50 0.27 0.73 -0.94 -1.33 0.00 0.00 177.39 176.62 1nuf s SER 508 N -4.50 4.45 -0.87 -1.43 1.04 -1.26 -4.72 113.70 106.42 1nuf s SER 508 Ca -0.06 1.15 -0.19 0.00 0.48 0.00 0.00 55.95 57.33 1nuf s SER 508 Cb 0.05 -1.84 0.13 0.00 0.10 0.00 0.00 66.02 64.46 1nuf s SER 508 CO 0.57 -1.98 1.05 -0.13 0.98 0.00 0.00 173.24 173.73 1nuf s ARG 509 N -5.26 3.51 0.00 4.02 0.52 -1.26 -4.23 118.95 116.25 1nuf s ARG 509 Ca 0.61 -1.69 0.00 0.00 -0.52 0.00 0.00 55.73 54.13 1nuf s ARG 509 Cb -0.14 -4.75 0.00 0.00 0.52 0.00 0.00 34.95 30.58 1nuf s ARG 509 CO 0.53 -1.72 0.00 -3.47 0.02 0.00 0.00 175.30 170.66 1nuf n ASP 510 N 6.44 0.00 -4.15 0.23 -0.08 -1.26 -5.00 116.55 112.73 1nuf n ASP 510 Ca 0.18 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 53.11 1nuf n ASP 510 Cb 0.48 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.80 1nuf n ASP 510 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1nuf s THR 511 N -2.00 2.93 0.19 5.18 2.01 -1.26 -1.75 115.64 120.94 1nuf s THR 511 Ca 0.00 -1.53 0.00 0.00 0.31 0.00 0.00 61.69 60.47 1nuf s THR 511 Cb 0.00 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.72 1nuf s THR 511 CO 0.00 -0.20 0.36 -0.54 -0.69 0.00 0.00 174.62 173.55 1nuf s LYS 512 N 1.21 3.49 -0.28 4.92 -0.14 -1.09 -4.92 119.74 122.93 1nuf s LYS 512 Ca -0.03 -0.43 -0.10 0.00 -1.36 0.00 0.00 55.97 54.05 1nuf s LYS 512 Cb -0.20 -2.88 -0.04 0.00 -1.68 0.00 0.00 37.83 33.03 1nuf s LYS 512 CO -0.02 0.44 0.17 0.99 -0.76 0.00 0.00 175.35 176.16 1nuf s THR 513 N -1.83 5.06 -0.22 2.17 2.01 -1.26 -2.68 115.64 118.88 1nuf s THR 513 Ca 0.37 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.42 1nuf s THR 513 Cb -0.11 -3.43 0.03 0.00 0.01 0.00 0.00 72.50 69.01 1nuf s THR 513 CO 0.29 0.24 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.64 1nuf s VAL 514 N 1.72 2.34 -0.11 3.82 1.01 0.63 -4.06 120.40 125.75 1nuf s VAL 514 Ca 0.07 -1.16 -0.17 0.00 0.00 0.00 0.00 61.98 60.71 1nuf s VAL 514 Cb -0.16 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1nuf s VAL 514 CO 0.09 0.28 0.45 -0.89 0.00 0.00 0.00 175.10 175.03 1nuf s THR 515 N 1.25 5.18 -0.17 3.92 2.01 -0.67 -0.85 115.64 126.32 1nuf s THR 515 Ca -0.00 0.90 0.00 0.00 0.31 0.00 0.00 61.69 62.90 1nuf s THR 515 Cb -0.16 -3.79 0.03 0.00 0.01 0.00 0.00 72.50 68.59 1nuf s THR 515 CO -0.08 0.35 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.39 1nuf s VAL 516 N 0.47 1.58 -0.27 3.82 1.01 0.12 -1.29 120.40 125.83 1nuf s VAL 516 Ca 0.25 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1nuf s VAL 516 Cb -0.15 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1nuf s VAL 516 CO 0.10 0.35 0.14 0.20 0.00 0.00 0.00 175.10 175.88 1nuf s ASN 517 N 1.46 5.58 0.09 3.32 0.02 -0.41 -1.86 114.94 123.14 1nuf s ASN 517 Ca 0.03 -0.16 0.08 0.00 -1.02 0.00 0.00 52.86 51.78 1nuf s ASN 517 Cb -0.14 -2.02 -0.03 0.00 0.02 0.00 0.00 41.25 39.08 1nuf s ASN 517 CO -0.10 -0.07 -0.21 -0.04 0.02 0.00 0.00 177.10 176.70 1nuf s MET 518 N 1.68 1.24 0.08 -0.60 -1.94 0.89 -1.03 119.30 119.62 1nuf s MET 518 Ca 0.06 -1.11 -0.05 0.00 -1.71 0.00 0.00 55.69 52.89 1nuf s MET 518 Cb -0.16 -1.48 -0.02 0.00 2.01 0.00 0.00 34.83 35.18 1nuf s MET 518 CO 0.07 0.36 0.09 0.95 -0.01 0.00 0.00 175.02 176.48 1nuf s THR 519 N -1.04 0.17 -0.04 2.05 -4.23 -0.98 -0.60 115.64 110.97 1nuf s THR 519 Ca 0.07 -1.52 -0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1nuf s THR 519 Cb -0.10 -1.51 0.03 0.00 1.34 0.00 0.00 72.50 72.26 1nuf s THR 519 CO 0.04 -0.76 0.03 0.00 -0.54 0.00 0.00 174.62 173.38 1nuf s ALA 520 N -3.91 0.37 0.05 3.99 0.00 0.22 -1.82 121.76 120.67 1nuf s ALA 520 Ca 0.08 0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.22 1nuf s ALA 520 Cb 0.06 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 1nuf s ALA 520 CO -0.09 -0.34 -0.20 -1.58 0.00 0.00 0.00 175.76 173.56 1nuf s TRP 521 N 1.72 1.73 0.20 0.00 0.52 -0.10 -0.80 118.94 122.21 1nuf s TRP 521 Ca -0.00 -0.38 -0.20 0.00 0.02 0.00 0.00 56.10 55.54 1nuf s TRP 521 Cb -0.13 -1.02 -0.08 0.00 -1.15 0.00 0.00 33.47 31.09 1nuf s TRP 521 CO -0.03 0.10 0.72 0.95 0.02 0.00 0.00 176.95 178.70 1nuf s THR 522 N -0.85 4.56 0.29 2.01 -4.23 -0.28 0.12 115.64 117.26 1nuf s THR 522 Ca 0.06 1.33 0.01 0.00 -1.18 0.00 0.00 61.69 61.92 1nuf s THR 522 Cb -0.09 -3.90 -0.02 0.00 1.34 0.00 0.00 72.50 69.83 1nuf s THR 522 CO 0.02 0.28 0.31 0.27 -0.54 0.00 0.00 174.62 174.96 1nuf s ILE 523 N -1.44 0.00 0.17 2.99 -4.36 -0.91 -1.05 121.20 116.60 1nuf s ILE 523 Ca 0.41 -1.85 0.04 0.00 -0.26 0.00 0.00 60.65 58.99 1nuf s ILE 523 Cb -0.18 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 40.98 1nuf s ILE 523 CO 0.22 0.00 0.24 -0.63 0.24 0.00 0.00 174.94 175.00 1nuf s ILE 524 N -3.57 5.00 0.55 8.37 -1.09 -0.93 -4.42 121.20 125.11 1nuf s ILE 524 Ca 0.36 -0.88 0.29 0.00 -2.23 0.00 0.00 60.65 58.19 1nuf s ILE 524 Cb 0.03 -3.59 0.43 0.00 -1.58 0.00 0.00 42.46 37.75 1nuf s ILE 524 CO 0.20 -0.13 1.93 0.10 -1.23 0.00 0.00 174.94 175.81 1nuf h TYR 525 N 2.11 0.00 0.00 3.97 -0.00 -1.93 0.16 116.97 121.28 1nuf h TYR 525 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.25 1nuf h TYR 525 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.93 1nuf h TYR 525 CO 0.54 0.00 0.00 -2.95 -0.00 0.00 0.00 178.16 175.75 1nuf h ASN 526 N 0.00 0.00 0.00 0.10 -0.00 -1.93 -0.95 115.58 112.80 1nuf h ASN 526 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.61 1nuf h ASN 526 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.65 1nuf h ASN 526 CO -0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.43 178.04 1nuf n GLY 527 N 0.73 1.49 3.67 9.14 0.00 0.04 -3.86 105.19 116.40 1nuf n GLY 527 Ca 0.03 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.58 1nuf n GLY 527 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1nuf n THR 528 N 0.00 0.29 -2.64 2.61 -1.04 -1.25 -4.18 114.28 108.07 1nuf n THR 528 Ca 0.00 -0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1nuf n THR 528 Cb 0.00 -1.66 -0.03 0.00 -1.82 0.00 0.00 70.33 66.82 1nuf n THR 528 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1nuf s LEU 529 N 2.47 4.33 -0.13 -4.42 1.43 -1.26 -2.19 118.68 118.91 1nuf s LEU 529 Ca 0.86 1.69 -0.12 0.00 -1.03 0.00 0.00 54.13 55.54 1nuf s LEU 529 Cb -0.71 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 1nuf s LEU 529 CO 0.46 -0.37 -0.24 0.52 0.23 0.00 0.00 176.35 176.95 1nuf n VAL 530 N 4.14 1.18 -3.57 -1.59 0.31 -0.21 -4.99 118.33 113.60 1nuf n VAL 530 Ca 0.08 0.23 -0.09 0.00 -0.01 0.00 0.00 64.34 64.55 1nuf n VAL 530 Cb 0.49 -2.20 -0.04 0.00 -0.91 0.00 0.00 33.84 31.18 1nuf n VAL 530 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1nuf s HIS 531 N -2.36 -0.32 0.00 3.52 2.46 -1.21 -4.97 115.29 112.42 1nuf s HIS 531 Ca -0.19 0.47 -0.30 0.00 0.47 0.00 0.00 55.06 55.51 1nuf s HIS 531 Cb 0.03 0.47 -0.03 0.00 -0.13 0.00 0.00 32.58 32.92 1nuf s HIS 531 CO 0.29 -0.34 0.96 -2.00 -2.47 0.00 0.00 174.74 171.18 1nuf s GLU 532 N -1.54 4.56 -0.00 2.88 2.12 -1.26 -1.12 118.70 124.33 1nuf s GLU 532 Ca 0.01 1.39 0.03 0.00 0.36 0.00 0.00 54.97 56.75 1nuf s GLU 532 Cb -0.01 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 1nuf s GLU 532 CO -0.01 -0.02 0.11 1.33 -0.54 0.00 0.00 175.26 176.12 1nuf n VAL 533 N 3.82 0.00 -3.58 3.70 0.24 0.02 -4.97 118.33 117.57 1nuf n VAL 533 Ca 0.05 -0.44 -0.12 0.00 -2.04 0.00 0.00 64.34 61.80 1nuf n VAL 533 Cb 0.51 1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 33.82 1nuf n VAL 533 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1nuf s TRP 534 N -1.25 -0.43 0.11 6.34 -0.00 -1.15 -4.72 118.94 117.84 1nuf s TRP 534 Ca 0.01 0.79 -0.25 0.00 -0.00 0.00 0.00 56.10 56.65 1nuf s TRP 534 Cb 0.02 0.43 0.07 0.00 -0.00 0.00 0.00 33.47 33.99 1nuf s TRP 534 CO 0.11 -0.37 0.64 -1.59 -0.00 0.00 0.00 176.95 175.74 1nuf s LYS 535 N -0.95 1.20 -0.26 5.86 -2.85 -1.26 0.73 119.74 122.21 1nuf s LYS 535 Ca -0.03 -0.35 -0.35 0.00 -1.00 0.00 0.00 55.97 54.24 1nuf s LYS 535 Cb -0.01 0.56 0.16 0.00 -2.06 0.00 0.00 37.83 36.48 1nuf s LYS 535 CO 0.02 -0.51 1.32 0.34 0.10 0.00 0.00 175.35 176.62 1nuf s ASP 536 N -2.50 -0.06 0.09 0.03 2.15 0.23 -4.95 116.67 111.65 1nuf s ASP 536 Ca -0.00 0.02 0.04 0.00 0.43 0.00 0.00 52.55 53.04 1nuf s ASP 536 Cb -0.01 0.06 -0.03 0.00 -0.30 0.00 0.00 42.92 42.64 1nuf s ASP 536 CO -0.09 -0.09 -0.11 -0.44 -0.17 0.00 0.00 175.17 174.26 1nuf s SER 537 N -1.73 1.50 0.16 -0.34 0.01 -1.26 -0.08 113.70 111.96 1nuf s SER 537 Ca 0.10 -0.72 -0.22 0.00 1.31 0.00 0.00 55.95 56.41 1nuf s SER 537 Cb -0.01 -0.01 0.07 0.00 0.21 0.00 0.00 66.02 66.27 1nuf s SER 537 CO -0.04 -0.19 0.59 0.00 0.41 0.00 0.00 173.24 174.01 1nuf s ALA 538 N -1.94 -1.55 -0.03 1.44 0.00 -0.78 -5.00 121.76 113.90 1nuf s ALA 538 Ca 0.02 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.45 1nuf s ALA 538 Cb -0.06 0.88 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 1nuf s ALA 538 CO 0.01 -0.76 -0.13 0.99 0.00 0.00 0.00 175.76 175.87 1nuf s THR 539 N -3.76 1.06 -0.15 0.00 2.01 -1.26 0.10 115.64 113.65 1nuf s THR 539 Ca 0.01 -0.53 -0.13 0.00 0.31 0.00 0.00 61.69 61.36 1nuf s THR 539 Cb -0.01 -0.91 0.04 0.00 0.01 0.00 0.00 72.50 71.63 1nuf s THR 539 CO -0.13 0.31 0.39 0.00 -0.69 0.00 0.00 174.62 174.50 1nuf s MET 540 N 0.02 0.44 -0.19 4.92 0.23 -0.03 -4.97 119.30 119.73 1nuf s MET 540 Ca -0.01 0.57 -0.02 0.00 -1.03 0.00 0.00 55.69 55.19 1nuf s MET 540 Cb -0.09 0.19 -0.01 0.00 -1.53 0.00 0.00 34.83 33.39 1nuf s MET 540 CO 0.01 -0.07 -0.09 -1.12 -2.03 0.00 0.00 175.02 171.72 1nuf s SER 541 N 0.36 4.04 0.15 -1.18 0.01 -1.26 -0.27 113.70 115.56 1nuf s SER 541 Ca -0.01 -0.41 0.07 0.00 1.31 0.00 0.00 55.95 56.91 1nuf s SER 541 Cb -0.03 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.49 1nuf s SER 541 CO -0.01 0.04 -0.01 -0.76 0.41 0.00 0.00 173.24 172.91 1nuf s LEU 542 N 1.12 3.32 0.61 2.44 1.02 -1.09 -4.95 118.68 121.15 1nuf s LEU 542 Ca 0.01 -0.35 -0.04 0.00 0.02 0.00 0.00 54.13 53.77 1nuf s LEU 542 Cb -0.14 -2.01 0.03 0.00 0.02 0.00 0.00 46.19 44.09 1nuf s LEU 542 CO -0.02 0.12 0.89 -1.81 0.02 0.00 0.00 176.35 175.55 1nuf s ASP 543 N -2.74 5.29 0.05 2.29 1.01 -1.26 -2.66 116.67 118.65 1nuf s ASP 543 Ca 0.26 0.46 -0.38 0.00 0.71 0.00 0.00 52.55 53.60 1nuf s ASP 543 Cb -0.10 -1.34 -0.19 0.00 1.01 0.00 0.00 42.92 42.31 1nuf s ASP 543 CO 0.18 -1.22 1.14 -2.65 0.21 0.00 0.00 175.17 172.83 1nuf n PRO 544 N -2.61 0.46 -0.97 8.23 -0.02 -0.71 0.64 135.00 140.02 1nuf n PRO 544 Ca 0.06 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1nuf n PRO 544 Cb 0.59 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1nuf n PRO 544 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1nuf n GLU 545 N 1.84 -1.83 -2.37 -0.52 4.71 -1.03 -4.94 120.64 116.49 1nuf n GLU 545 Ca 0.19 0.46 -0.39 0.00 -0.01 0.00 0.00 57.16 57.41 1nuf n GLU 545 Cb 0.13 -4.92 -0.03 0.00 -1.01 0.00 0.00 31.44 25.61 1nuf n GLU 545 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1nuf s GLU 546 N -1.89 4.37 -0.25 3.49 2.12 0.21 -4.81 118.70 121.94 1nuf s GLU 546 Ca 0.00 1.85 -0.03 0.00 0.36 0.00 0.00 54.97 57.15 1nuf s GLU 546 Cb 0.00 -2.94 0.02 0.00 0.26 0.00 0.00 34.13 31.46 1nuf s GLU 546 CO 0.00 -0.05 -0.04 -1.21 -0.54 0.00 0.00 175.26 173.42 1nuf s GLU 547 N -1.87 3.00 0.20 4.30 2.02 -1.26 -3.08 118.70 122.00 1nuf s GLU 547 Ca 0.50 -0.88 0.02 0.00 0.02 0.00 0.00 54.97 54.64 1nuf s GLU 547 Cb -0.32 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 30.84 1nuf s GLU 547 CO 0.41 -0.36 0.34 0.00 0.02 0.00 0.00 175.26 175.67 1nuf s ALA 548 N 1.39 3.91 -0.39 5.21 0.00 -0.18 -4.98 121.76 126.72 1nuf s ALA 548 Ca 0.02 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.96 1nuf s ALA 548 Cb -0.16 -1.83 0.13 0.00 0.00 0.00 0.00 23.12 21.25 1nuf s ALA 548 CO -0.03 0.40 0.20 -1.21 0.00 0.00 0.00 175.76 175.12 1nuf s GLU 549 N -3.52 0.94 -0.37 0.00 2.02 -1.26 -2.72 118.70 113.79 1nuf s GLU 549 Ca 0.36 -1.59 -0.21 0.00 0.02 0.00 0.00 54.97 53.55 1nuf s GLU 549 Cb -0.10 -1.95 0.01 0.00 0.10 0.00 0.00 34.13 32.19 1nuf s GLU 549 CO 0.29 -1.14 0.64 -1.58 0.02 0.00 0.00 175.26 173.50 1nuf s HIS 550 N 0.85 3.13 0.11 1.61 5.65 -0.05 -4.87 115.29 121.72 1nuf s HIS 550 Ca 0.16 0.28 -0.30 0.00 0.25 0.00 0.00 55.06 55.45 1nuf s HIS 550 Cb -0.22 -3.19 -0.06 0.00 -1.18 0.00 0.00 32.58 27.92 1nuf s HIS 550 CO -0.05 -0.68 1.13 -1.25 -0.65 0.00 0.00 174.74 173.24 1nuf s PRO 551 N 2.75 4.52 -0.20 2.88 0.04 -1.26 0.45 135.00 144.17 1nuf s PRO 551 Ca 0.24 1.71 -0.02 0.00 0.04 0.00 0.00 61.00 62.97 1nuf s PRO 551 Cb -0.14 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1nuf s PRO 551 CO 0.16 -0.07 -0.10 0.42 0.04 0.00 0.00 177.00 177.44 1nuf s ILE 552 N 0.42 2.91 -0.17 0.56 1.01 0.22 -4.93 121.20 121.22 1nuf s ILE 552 Ca 0.53 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1nuf s ILE 552 Cb -0.29 -2.30 0.03 0.00 0.01 0.00 0.00 42.46 39.92 1nuf s ILE 552 CO 0.32 0.47 -0.10 -0.75 0.00 0.00 0.00 174.94 174.87 1nuf s LYS 553 N 1.39 1.92 -0.19 2.79 2.20 -1.26 0.24 119.74 126.83 1nuf s LYS 553 Ca 0.05 -0.62 -0.01 0.00 -0.36 0.00 0.00 55.97 55.04 1nuf s LYS 553 Cb -0.14 -2.14 0.01 0.00 -1.51 0.00 0.00 37.83 34.05 1nuf s LYS 553 CO -0.06 -0.35 -0.15 0.42 -0.36 0.00 0.00 175.35 174.85 1nuf s ILE 554 N 1.51 2.53 0.71 5.43 1.01 -0.45 -4.98 121.20 126.96 1nuf s ILE 554 Ca 0.02 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 59.77 1nuf s ILE 554 Cb -0.15 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.24 1nuf s ILE 554 CO -0.09 0.50 1.09 -0.94 0.00 0.00 0.00 174.94 175.50 1nuf s SER 555 N 1.32 5.42 0.09 3.58 1.04 -1.26 0.87 113.70 124.75 1nuf s SER 555 Ca 0.04 1.23 -0.23 0.00 0.48 0.00 0.00 55.95 57.47 1nuf s SER 555 Cb -0.14 -2.06 -0.14 0.00 0.10 0.00 0.00 66.02 63.78 1nuf s SER 555 CO -0.09 -1.37 1.72 0.22 0.98 0.00 0.00 173.24 174.70 1nuf h TYR 556 N -0.67 0.03 -0.93 5.02 3.20 -1.87 -1.82 116.97 119.93 1nuf h TYR 556 Ca -0.45 0.00 0.16 0.00 3.14 0.00 0.00 58.73 61.58 1nuf h TYR 556 Cb 1.24 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.43 1nuf h TYR 556 CO 0.53 0.04 0.59 0.00 -1.64 0.00 0.00 178.16 177.68 1nuf h ALA 557 N 0.98 1.84 -0.23 1.82 0.00 -1.94 0.55 119.26 122.28 1nuf h ALA 557 Ca 0.01 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1nuf h ALA 557 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1nuf h ALA 557 CO -0.00 -0.12 -0.26 1.96 0.00 0.00 0.00 179.25 180.83 1nuf h GLN 558 N 0.68 0.45 0.00 0.00 4.20 -1.69 -3.38 115.11 115.37 1nuf h GLN 558 Ca 0.48 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.87 1nuf h GLN 558 Cb 0.81 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.54 1nuf h GLN 558 CO -0.24 0.68 -1.58 2.48 -0.67 0.00 0.00 178.83 179.50 1nuf n TYR 559 N -4.12 0.00 -0.40 2.96 0.18 -0.45 -4.66 117.16 110.67 1nuf n TYR 559 Ca -0.00 0.00 0.36 0.00 1.88 0.00 0.00 57.90 60.13 1nuf n TYR 559 Cb 0.41 -0.41 0.69 0.00 -0.38 0.00 0.00 39.34 39.65 1nuf n TYR 559 CO 0.00 0.00 0.00 1.05 -2.08 0.00 0.00 176.86 175.83 1nuf h GLU 560 N 0.00 0.10 -0.63 -3.48 -0.00 -0.14 0.12 114.58 110.55 1nuf h GLU 560 Ca -0.22 -0.01 -0.06 0.00 -0.00 0.00 0.00 59.36 59.07 1nuf h GLU 560 Cb 1.50 -0.02 -0.03 0.00 -0.00 0.00 0.00 28.75 30.20 1nuf h GLU 560 CO 0.01 0.06 0.15 -0.09 -0.00 0.00 0.00 179.01 179.15 1nuf h ARG 561 N 0.10 1.01 -0.17 1.06 2.43 -1.79 -3.27 114.38 113.75 1nuf h ARG 561 Ca 0.67 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 1nuf h ARG 561 Cb 2.38 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 31.80 1nuf h ARG 561 CO -0.14 0.91 0.00 0.66 -1.51 0.00 0.00 179.97 179.89 1nuf n TYR 562 N -4.32 0.21 -2.47 2.20 4.02 0.21 -4.99 117.16 112.03 1nuf n TYR 562 Ca 0.04 -0.25 -0.41 0.00 -0.01 0.00 0.00 57.90 57.27 1nuf n TYR 562 Cb 0.25 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.51 1nuf n TYR 562 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1nuf s LEU 563 N -0.93 4.46 0.53 7.72 2.96 0.00 -4.80 118.68 128.63 1nuf s LEU 563 Ca 0.17 2.11 0.07 0.00 -0.22 0.00 0.00 54.13 56.26 1nuf s LEU 563 Cb 0.10 -3.60 0.04 0.00 0.50 0.00 0.00 46.19 43.23 1nuf s LEU 563 CO 0.14 -0.30 0.50 -0.54 -1.32 0.00 0.00 176.35 174.83 1nuf s LYS 564 N -0.11 2.32 0.48 1.98 -0.14 -1.26 -4.97 119.74 118.04 1nuf s LYS 564 Ca 0.52 -1.83 0.25 0.00 -1.36 0.00 0.00 55.97 53.54 1nuf s LYS 564 Cb -0.30 -2.29 1.35 0.00 -1.68 0.00 0.00 37.83 34.91 1nuf s LYS 564 CO 0.34 -0.61 1.73 0.66 -0.76 0.00 0.00 175.35 176.72 1nuf h SER 565 N 0.65 0.00 0.27 2.83 4.64 -1.92 0.13 113.55 120.15 1nuf h SER 565 Ca -0.36 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.90 1nuf h SER 565 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1nuf h SER 565 CO 0.53 0.00 -0.29 0.44 -0.87 0.00 0.00 176.83 176.64 1nuf h ASP 566 N 0.00 0.04 -5.66 4.97 3.32 -1.94 -3.47 116.42 113.69 1nuf h ASP 566 Ca 0.00 -0.01 -0.42 0.00 0.02 0.00 0.00 57.03 56.62 1nuf h ASP 566 Cb 0.40 -0.01 0.08 0.00 0.22 0.00 0.00 39.33 40.01 1nuf h ASP 566 CO 0.00 0.33 -0.68 0.59 -1.72 0.00 0.00 179.24 177.77 1nuf n ASN 567 N -4.18 -5.91 -4.34 6.45 5.03 0.46 -4.82 115.26 107.95 1nuf n ASN 567 Ca -0.02 -0.54 -0.30 0.00 0.87 0.00 0.00 54.58 54.59 1nuf n ASN 567 Cb 0.35 -4.69 -0.15 0.00 -1.02 0.00 0.00 39.78 34.27 1nuf n ASN 567 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1nuf s MET 568 N -6.25 1.91 -0.05 3.52 -1.94 -1.26 -0.92 119.30 114.30 1nuf s MET 568 Ca 0.54 -1.05 0.01 0.00 -1.71 0.00 0.00 55.69 53.48 1nuf s MET 568 Cb -0.25 -2.01 0.02 0.00 2.01 0.00 0.00 34.83 34.60 1nuf s MET 568 CO 0.67 0.53 -0.04 0.42 -0.01 0.00 0.00 175.02 176.59 1nuf s ILE 569 N -0.76 0.56 -0.16 2.53 1.01 -0.92 -2.15 121.20 121.31 1nuf s ILE 569 Ca 0.11 -0.12 -0.25 0.00 0.00 0.00 0.00 60.65 60.40 1nuf s ILE 569 Cb -0.10 -0.59 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1nuf s ILE 569 CO 0.01 0.24 0.80 -0.60 0.00 0.00 0.00 174.94 175.39 1nuf s ARG 570 N 1.03 4.31 -0.18 2.79 6.06 0.32 -1.02 118.95 132.25 1nuf s ARG 570 Ca -0.09 0.96 -0.01 0.00 -2.50 0.00 0.00 55.73 54.09 1nuf s ARG 570 Cb -0.14 -3.56 0.00 0.00 0.06 0.00 0.00 34.95 31.31 1nuf s ARG 570 CO -0.01 -0.27 -0.13 0.42 -2.50 0.00 0.00 175.30 172.81 1nuf s ILE 571 N 1.94 2.71 0.10 4.11 -1.09 -0.18 -0.93 121.20 127.86 1nuf s ILE 571 Ca 0.37 -0.73 0.08 0.00 -2.23 0.00 0.00 60.65 58.14 1nuf s ILE 571 Cb -0.17 -2.17 -0.04 0.00 -1.58 0.00 0.00 42.46 38.51 1nuf s ILE 571 CO 0.13 0.50 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.23 1nuf s THR 572 N 1.14 1.74 -0.23 2.92 2.01 -0.76 -1.66 115.64 120.81 1nuf s THR 572 Ca 0.01 -1.55 -0.04 0.00 0.31 0.00 0.00 61.69 60.42 1nuf s THR 572 Cb -0.14 -1.58 0.09 0.00 0.01 0.00 0.00 72.50 70.88 1nuf s THR 572 CO -0.05 -0.05 0.18 0.00 -0.69 0.00 0.00 174.62 174.01 1nuf s ALA 573 N -1.15 0.08 -0.46 7.40 0.00 -0.05 -2.32 121.76 125.25 1nuf s ALA 573 Ca 0.07 -0.28 -0.18 0.00 0.00 0.00 0.00 51.96 51.57 1nuf s ALA 573 Cb -0.10 -1.34 0.04 0.00 0.00 0.00 0.00 23.12 21.73 1nuf s ALA 573 CO 0.04 -1.38 0.52 0.08 0.00 0.00 0.00 175.76 175.03 1nuf s VAL 574 N 2.23 5.00 0.02 0.00 1.01 -0.20 -0.81 120.40 127.66 1nuf s VAL 574 Ca 0.06 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.59 1nuf s VAL 574 Cb -0.16 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 1nuf s VAL 574 CO -0.20 -0.60 0.12 0.00 0.00 0.00 0.00 175.10 174.42 1nuf s LYS 576 N -2.06 0.52 0.02 0.00 2.20 -0.41 0.26 119.74 120.27 1nuf s LYS 576 Ca 0.27 0.24 0.04 0.00 -0.36 0.00 0.00 55.97 56.17 1nuf s LYS 576 Cb -0.12 0.24 -0.03 0.00 -1.51 0.00 0.00 37.83 36.41 1nuf s LYS 576 CO 0.19 -0.10 -0.10 0.08 -0.36 0.00 0.00 175.35 175.06 1nuf s VAL 577 N -0.38 3.39 0.10 4.02 1.01 -1.26 -1.67 120.40 125.61 1nuf s VAL 577 Ca -0.05 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1nuf s VAL 577 Cb -0.03 -2.47 0.14 0.00 0.00 0.00 0.00 36.38 34.01 1nuf s VAL 577 CO 0.02 0.37 0.50 -2.65 0.00 0.00 0.00 175.10 173.34 1nuf n PRO 578 N 1.51 -0.03 -1.28 2.72 -0.02 -1.26 -1.18 135.00 135.47 1nuf n PRO 578 Ca -0.15 0.48 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1nuf n PRO 578 Cb 0.52 -0.76 0.11 0.00 -0.02 0.00 0.00 33.50 33.35 1nuf n PRO 578 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nuf n ASP 579 N -4.29 1.75 -2.25 2.55 2.03 -1.26 -5.09 116.55 110.00 1nuf n ASP 579 Ca 0.07 -3.01 -0.06 0.00 0.52 0.00 0.00 54.79 52.31 1nuf n ASP 579 Cb 0.24 -0.42 -0.02 0.00 -0.72 0.00 0.00 41.12 40.20 1nuf n ASP 579 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1nuf n GLU 580 N -0.42 1.21 -3.53 -0.67 1.02 -0.33 -5.14 120.64 112.78 1nuf n GLU 580 Ca 0.16 -0.80 -0.35 0.00 -0.02 0.00 0.00 57.16 56.15 1nuf n GLU 580 Cb 0.90 0.34 -0.05 0.00 -0.02 0.00 0.00 31.44 32.61 1nuf n GLU 580 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1nuf s SER 581 N -1.59 6.68 0.30 1.62 0.01 -1.26 -4.66 113.70 114.80 1nuf s SER 581 Ca 0.03 0.85 -0.29 0.00 1.31 0.00 0.00 55.95 57.84 1nuf s SER 581 Cb 0.00 -2.20 -0.10 0.00 0.21 0.00 0.00 66.02 63.93 1nuf s SER 581 CO 0.02 0.16 1.41 -1.61 0.41 0.00 0.00 173.24 173.63 1nuf s GLU 582 N -1.90 4.27 -0.40 12.44 8.01 -1.26 -4.67 118.70 135.18 1nuf s GLU 582 Ca 0.34 2.33 -0.13 0.00 0.01 0.00 0.00 54.97 57.51 1nuf s GLU 582 Cb -0.14 -3.07 0.03 0.00 -4.31 0.00 0.00 34.13 26.64 1nuf s GLU 582 CO 0.18 -0.36 0.27 0.08 0.01 0.00 0.00 175.26 175.44 1nuf s VAL 583 N -0.59 4.92 -0.28 2.63 1.01 0.14 -4.91 120.40 123.31 1nuf s VAL 583 Ca 0.55 -0.84 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 1nuf s VAL 583 Cb -0.42 -3.78 -0.00 0.00 0.00 0.00 0.00 36.38 32.18 1nuf s VAL 583 CO 0.50 -0.33 0.83 -0.69 0.00 0.00 0.00 175.10 175.41 1nuf s VAL 584 N 1.61 4.79 -0.25 2.92 1.01 -1.26 -1.66 120.40 127.55 1nuf s VAL 584 Ca 0.04 1.37 -0.05 0.00 0.00 0.00 0.00 61.98 63.34 1nuf s VAL 584 Cb -0.20 -4.16 -0.00 0.00 0.00 0.00 0.00 36.38 32.02 1nuf s VAL 584 CO 0.08 -0.20 0.01 -0.69 0.00 0.00 0.00 175.10 174.29 1nuf s VAL 585 N 2.97 3.64 0.12 2.92 1.01 0.01 -4.98 120.40 126.09 1nuf s VAL 585 Ca 0.34 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.87 1nuf s VAL 585 Cb -0.14 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 1nuf s VAL 585 CO 0.11 0.29 -0.23 -1.83 0.00 0.00 0.00 175.10 173.44 1nuf s GLU 586 N 1.49 1.26 -0.30 2.72 -1.05 -1.26 -0.88 118.70 120.69 1nuf s GLU 586 Ca 0.04 -1.27 -0.14 0.00 -0.15 0.00 0.00 54.97 53.45 1nuf s GLU 586 Cb -0.15 -1.61 0.15 0.00 -0.44 0.00 0.00 34.13 32.08 1nuf s GLU 586 CO -0.01 0.37 0.90 0.50 0.95 0.00 0.00 175.26 177.97 1nuf s ARG 587 N -2.08 0.39 -0.11 -4.83 6.06 -0.66 -4.85 118.95 112.87 1nuf s ARG 587 Ca 0.11 0.91 -0.15 0.00 -2.50 0.00 0.00 55.73 54.10 1nuf s ARG 587 Cb -0.10 0.49 -0.05 0.00 0.06 0.00 0.00 34.95 35.35 1nuf s ARG 587 CO 0.05 -0.12 0.38 -0.51 -2.50 0.00 0.00 175.30 172.60 1nuf s ASP 588 N 2.39 6.61 0.31 -2.12 1.11 -1.26 -1.02 116.67 122.68 1nuf s ASP 588 Ca -0.04 0.72 0.09 0.00 0.18 0.00 0.00 52.55 53.49 1nuf s ASP 588 Cb -0.07 -2.23 -0.05 0.00 1.07 0.00 0.00 42.92 41.64 1nuf s ASP 588 CO -0.18 0.13 0.04 0.27 1.18 0.00 0.00 175.17 176.61 1nuf s ILE 589 N 0.11 3.11 -0.08 0.77 -4.36 -0.19 -4.96 121.20 115.59 1nuf s ILE 589 Ca 0.21 -1.88 0.02 0.00 -0.26 0.00 0.00 60.65 58.75 1nuf s ILE 589 Cb -0.15 -2.86 0.01 0.00 1.25 0.00 0.00 42.46 40.72 1nuf s ILE 589 CO 0.08 -0.28 -0.12 -0.63 0.24 0.00 0.00 174.94 174.23 1nuf s ILE 590 N -2.40 1.19 -0.18 8.37 1.01 -1.26 -2.18 121.20 125.75 1nuf s ILE 590 Ca 0.34 -0.49 -0.08 0.00 0.00 0.00 0.00 60.65 60.42 1nuf s ILE 590 Cb -0.04 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 1nuf s ILE 590 CO 0.20 0.37 0.10 -0.76 0.00 0.00 0.00 174.94 174.85 1nuf s LEU 591 N 0.86 4.03 0.46 2.97 1.02 -0.10 -4.79 118.68 123.13 1nuf s LEU 591 Ca -0.11 0.19 -0.20 0.00 0.02 0.00 0.00 54.13 54.03 1nuf s LEU 591 Cb -0.15 -2.02 -0.10 0.00 0.02 0.00 0.00 46.19 43.94 1nuf s LEU 591 CO 0.01 0.21 0.99 -1.81 0.02 0.00 0.00 176.35 175.78 1nuf s ASP 592 N 0.14 6.64 0.39 2.29 1.01 -1.03 -4.60 116.67 121.51 1nuf s ASP 592 Ca 0.07 1.79 -0.10 0.00 0.71 0.00 0.00 52.55 55.01 1nuf s ASP 592 Cb -0.12 -2.55 -0.06 0.00 1.01 0.00 0.00 42.92 41.20 1nuf s ASP 592 CO -0.00 -0.57 0.75 0.20 0.21 0.00 0.00 175.17 175.76 1nuf s ASN 593 N -2.17 6.52 0.62 0.27 0.01 -1.26 -0.71 114.94 118.22 1nuf s ASN 593 Ca 0.64 1.10 -0.19 0.00 -0.71 0.00 0.00 52.86 53.70 1nuf s ASN 593 Cb -0.12 -2.31 -0.02 0.00 0.41 0.00 0.00 41.25 39.21 1nuf s ASN 593 CO 0.18 -0.38 1.30 -2.16 -1.51 0.00 0.00 177.10 174.52 1nuf s PRO 594 N -3.81 2.73 0.45 -0.60 0.04 -1.26 -4.90 135.00 127.65 1nuf s PRO 594 Ca 0.51 2.07 -0.24 0.00 0.04 0.00 0.00 61.00 63.37 1nuf s PRO 594 Cb -0.10 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1nuf s PRO 594 CO 0.31 -1.46 1.29 0.99 0.04 0.00 0.00 177.00 178.17 1nuf s THR 595 N -1.40 2.60 -0.11 1.26 2.01 -1.26 -5.02 115.64 113.73 1nuf s THR 595 Ca 0.80 0.50 0.03 0.00 0.31 0.00 0.00 61.69 63.32 1nuf s THR 595 Cb -0.37 -3.28 0.01 0.00 0.01 0.00 0.00 72.50 68.87 1nuf s THR 595 CO 0.40 0.04 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.96 1nuf s LEU 596 N -2.80 1.95 0.01 4.42 2.96 -1.26 -4.29 118.68 119.67 1nuf s LEU 596 Ca 0.61 -0.51 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 1nuf s LEU 596 Cb -0.36 -1.28 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 1nuf s LEU 596 CO 0.46 0.08 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.45 1nuf s THR 597 N 0.72 2.43 -0.08 3.68 2.01 0.18 -4.74 115.64 119.85 1nuf s THR 597 Ca -0.11 -1.14 0.04 0.00 0.31 0.00 0.00 61.69 60.80 1nuf s THR 597 Cb -0.16 -1.93 -0.01 0.00 0.01 0.00 0.00 72.50 70.40 1nuf s THR 597 CO 0.02 0.46 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.43 1nuf s LEU 598 N -1.00 2.25 -0.03 4.42 1.43 -1.26 -0.23 118.68 124.26 1nuf s LEU 598 Ca 0.12 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 1nuf s LEU 598 Cb -0.10 -1.44 0.03 0.00 0.03 0.00 0.00 46.19 44.71 1nuf s LEU 598 CO 0.02 0.23 0.00 -1.61 0.23 0.00 0.00 176.35 175.22 1nuf s GLU 599 N -0.04 0.28 0.07 1.70 2.02 -0.48 -4.97 118.70 117.27 1nuf s GLU 599 Ca -0.06 0.09 -0.23 0.00 0.02 0.00 0.00 54.97 54.79 1nuf s GLU 599 Cb -0.15 -0.49 -0.06 0.00 0.10 0.00 0.00 34.13 33.54 1nuf s GLU 599 CO 0.05 -0.15 0.70 0.08 0.02 0.00 0.00 175.26 175.96 1nuf s VAL 600 N 1.09 4.68 -2.02 2.63 1.01 -1.26 -1.17 120.40 125.36 1nuf s VAL 600 Ca -0.09 1.50 0.21 0.00 0.00 0.00 0.00 61.98 63.60 1nuf s VAL 600 Cb -0.13 -4.04 0.53 0.00 0.00 0.00 0.00 36.38 32.73 1nuf s VAL 600 CO -0.02 0.45 1.45 0.18 0.00 0.00 0.00 175.10 177.16 1nuf n LEU 601 N 2.31 3.66 -3.80 3.92 4.77 -0.40 -4.98 117.00 122.48 1nuf n LEU 601 Ca -0.06 -1.81 -0.02 0.00 -0.03 0.00 0.00 56.01 54.09 1nuf n LEU 601 Cb 0.50 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1nuf n LEU 601 CO 0.45 0.87 0.82 0.54 -1.33 0.00 0.00 177.39 178.74 1nuf s ASN 602 N -1.16 -0.08 0.27 -1.43 4.22 -1.26 -4.95 114.94 110.55 1nuf s ASN 602 Ca 0.42 -0.47 -0.29 0.00 -2.14 0.00 0.00 52.86 50.38 1nuf s ASN 602 Cb 0.23 0.44 -0.10 0.00 1.28 0.00 0.00 41.25 43.10 1nuf s ASN 602 CO 0.31 -0.84 1.30 -0.70 -2.04 0.00 0.00 177.10 175.12 1nuf s GLU 603 N -2.68 4.39 -0.15 3.55 2.12 -1.26 -4.97 118.70 119.70 1nuf s GLU 603 Ca 0.17 2.12 -0.18 0.00 0.36 0.00 0.00 54.97 57.43 1nuf s GLU 603 Cb -0.01 -3.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.21 1nuf s GLU 603 CO 0.03 -0.18 0.49 0.00 -0.54 0.00 0.00 175.26 175.05 1nuf s ALA 604 N -0.58 3.50 0.03 6.30 0.00 -1.26 -4.93 121.76 124.82 1nuf s ALA 604 Ca 0.52 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 52.17 1nuf s ALA 604 Cb -0.38 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 1nuf s ALA 604 CO 0.45 -0.19 0.02 1.03 0.00 0.00 0.00 175.76 177.07 1nuf s ARG 605 N 1.05 0.45 0.38 0.00 0.52 -1.26 -0.12 118.95 119.97 1nuf s ARG 605 Ca 0.25 -0.73 -0.27 0.00 -0.52 0.00 0.00 55.73 54.46 1nuf s ARG 605 Cb -0.15 0.17 -0.11 0.00 0.52 0.00 0.00 34.95 35.38 1nuf s ARG 605 CO 0.10 -0.09 1.39 0.28 0.02 0.00 0.00 175.30 177.00 1nuf n VAL 606 N 1.13 2.18 -0.78 3.52 0.31 -0.39 -2.08 118.33 122.23 1nuf n VAL 606 Ca -0.21 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.62 1nuf n VAL 606 Cb 0.57 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1nuf n VAL 606 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1nuf n ARG 607 N 0.33 -1.70 -3.89 5.55 1.74 -0.62 -4.92 116.66 113.14 1nuf n ARG 607 Ca 0.03 0.36 -0.36 0.00 -0.77 0.00 0.00 57.85 57.12 1nuf n ARG 607 Cb 0.38 -4.51 -0.13 0.00 -1.02 0.00 0.00 32.46 27.18 1nuf n ARG 607 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1nuf s LYS 608 N -1.56 3.55 0.26 5.56 1.02 -0.88 -4.98 119.74 122.71 1nuf s LYS 608 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.15 1nuf s LYS 608 Cb 0.00 -3.15 -0.11 0.00 -0.52 0.00 0.00 37.83 34.05 1nuf s LYS 608 CO 0.00 -0.14 1.51 -2.14 -0.92 0.00 0.00 175.35 173.66 1nuf s PRO 609 N 1.41 4.21 -0.12 -1.68 0.02 -1.26 -4.36 135.00 133.21 1nuf s PRO 609 Ca 0.05 2.42 0.01 0.00 0.02 0.00 0.00 61.00 63.49 1nuf s PRO 609 Cb -0.15 -3.08 0.02 0.00 0.02 0.00 0.00 34.50 31.32 1nuf s PRO 609 CO 0.01 -0.52 -0.12 0.54 -0.33 0.00 0.00 177.00 176.58 1nuf s VAL 610 N 0.06 1.33 0.20 3.83 0.11 -0.79 -4.98 120.40 120.16 1nuf s VAL 610 Ca 0.62 -0.50 -0.30 0.00 -2.93 0.00 0.00 61.98 58.87 1nuf s VAL 610 Cb -0.44 -1.27 -0.08 0.00 -1.53 0.00 0.00 36.38 33.06 1nuf s VAL 610 CO 0.44 0.41 1.05 0.21 -3.33 0.00 0.00 175.10 173.89 1nuf s ASN 611 N 1.39 7.38 0.13 3.54 3.84 -1.26 -2.41 114.94 127.55 1nuf s ASN 611 Ca 0.01 2.06 0.07 0.00 0.21 0.00 0.00 52.86 55.22 1nuf s ASN 611 Cb -0.13 -2.61 -0.04 0.00 -0.55 0.00 0.00 41.25 37.92 1nuf s ASN 611 CO -0.07 -0.11 -0.17 -0.69 -2.79 0.00 0.00 177.10 173.28 1nuf s VAL 612 N -0.60 1.58 -0.05 -5.21 1.01 0.09 -1.28 120.40 115.94 1nuf s VAL 612 Ca 0.46 -1.73 0.05 0.00 0.00 0.00 0.00 61.98 60.76 1nuf s VAL 612 Cb -0.28 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 1nuf s VAL 612 CO 0.35 -0.29 -0.20 -1.10 0.00 0.00 0.00 175.10 173.86 1nuf s GLN 613 N -2.49 2.07 -0.23 2.72 -0.21 -0.32 -1.44 119.66 119.77 1nuf s GLN 613 Ca 0.10 -0.71 -0.06 0.00 0.02 0.00 0.00 55.36 54.72 1nuf s GLN 613 Cb -0.07 -1.77 -0.02 0.00 1.00 0.00 0.00 33.01 32.15 1nuf s GLN 613 CO 0.05 0.28 0.02 1.41 -2.12 0.00 0.00 175.29 174.93 1nuf s MET 614 N -0.00 3.59 -0.09 2.91 -2.45 0.74 -1.38 119.30 122.62 1nuf s MET 614 Ca -0.05 -0.52 0.04 0.00 -1.25 0.00 0.00 55.69 53.92 1nuf s MET 614 Cb -0.13 -3.17 -0.00 0.00 1.25 0.00 0.00 34.83 32.78 1nuf s MET 614 CO 0.03 -0.11 -0.23 -0.51 1.05 0.00 0.00 175.02 175.25 1nuf s LEU 615 N 1.35 2.15 -0.03 4.11 1.43 0.68 -1.31 118.68 127.06 1nuf s LEU 615 Ca 0.05 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.58 1nuf s LEU 615 Cb -0.15 -1.42 0.01 0.00 0.03 0.00 0.00 46.19 44.66 1nuf s LEU 615 CO 0.01 0.18 0.12 0.12 0.23 0.00 0.00 176.35 177.02 1nuf s PHE 616 N 0.20 -0.07 -0.12 0.29 5.36 -0.52 -0.64 117.98 122.48 1nuf s PHE 616 Ca -0.14 0.18 0.02 0.00 -0.96 0.00 0.00 56.93 56.03 1nuf s PHE 616 Cb -0.17 0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.54 1nuf s PHE 616 CO 0.07 -0.13 -0.16 -1.12 -1.46 0.00 0.00 175.22 172.42 1nuf s SER 617 N -0.36 2.56 -0.53 6.13 0.01 -1.26 0.88 113.70 121.13 1nuf s SER 617 Ca -0.04 -0.46 -0.28 0.00 1.31 0.00 0.00 55.95 56.48 1nuf s SER 617 Cb -0.03 -1.15 0.03 0.00 0.21 0.00 0.00 66.02 65.08 1nuf s SER 617 CO 0.00 0.02 1.13 0.21 0.41 0.00 0.00 173.24 175.02 1nuf s ASN 618 N 0.98 6.51 0.11 2.44 2.47 -0.42 -4.85 114.94 122.19 1nuf s ASN 618 Ca -0.06 0.21 0.24 0.00 0.42 0.00 0.00 52.86 53.67 1nuf s ASN 618 Cb -0.15 -2.53 0.94 0.00 -1.45 0.00 0.00 41.25 38.06 1nuf s ASN 618 CO -0.02 -1.34 1.76 -0.81 -3.72 0.00 0.00 177.10 172.96 1nuf n PRO 619 N 8.04 0.12 -1.51 0.43 -0.04 -1.26 -0.03 135.00 140.74 1nuf n PRO 619 Ca 0.09 0.19 -0.29 0.00 -0.04 0.00 0.00 63.50 63.45 1nuf n PRO 619 Cb 0.49 -1.66 0.11 0.00 -0.04 0.00 0.00 33.50 32.40 1nuf n PRO 619 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nuf s LEU 620 N -3.75 2.34 0.36 1.53 1.43 -1.26 -4.71 118.68 114.62 1nuf s LEU 620 Ca 0.10 1.20 0.22 0.00 -1.03 0.00 0.00 54.13 54.62 1nuf s LEU 620 Cb 0.13 -3.68 0.22 0.00 0.03 0.00 0.00 46.19 42.89 1nuf s LEU 620 CO 0.48 -2.26 1.44 0.44 0.23 0.00 0.00 176.35 176.68 1nuf h ASP 621 N -1.29 0.00 -2.57 2.29 3.32 -1.97 -3.18 116.42 113.02 1nuf h ASP 621 Ca -0.49 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 55.99 1nuf h ASP 621 Cb 1.29 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.76 1nuf h ASP 621 CO 0.60 0.06 -0.61 -1.83 -1.72 0.00 0.00 179.24 175.73 1nuf s GLU 622 N -3.22 2.57 0.78 3.56 -1.05 -1.26 -4.68 118.70 115.40 1nuf s GLU 622 Ca 0.05 -1.12 -0.12 0.00 -0.15 0.00 0.00 54.97 53.63 1nuf s GLU 622 Cb 0.06 -2.40 0.06 0.00 -0.44 0.00 0.00 34.13 31.41 1nuf s GLU 622 CO 0.71 0.43 1.12 -1.25 0.95 0.00 0.00 175.26 177.22 1nuf s PRO 623 N -3.30 2.23 -0.11 -4.83 0.04 -1.26 -4.31 135.00 123.45 1nuf s PRO 623 Ca 0.30 0.43 -0.01 0.00 0.04 0.00 0.00 61.00 61.77 1nuf s PRO 623 Cb -0.09 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 1nuf s PRO 623 CO 0.21 -1.48 -0.09 0.14 0.04 0.00 0.00 177.00 175.83 1nuf s VAL 624 N -3.32 3.49 0.39 -0.36 -7.23 -0.89 -4.94 120.40 107.53 1nuf s VAL 624 Ca 0.60 -0.52 0.03 0.00 -1.81 0.00 0.00 61.98 60.28 1nuf s VAL 624 Cb -0.13 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.37 1nuf s VAL 624 CO 0.52 0.54 0.22 0.54 -0.31 0.00 0.00 175.10 176.61 1nuf n ARG 625 N 3.08 0.96 -4.17 4.82 1.74 -1.26 -2.43 116.66 119.39 1nuf n ARG 625 Ca -0.18 -2.53 -0.39 0.00 -0.77 0.00 0.00 57.85 53.98 1nuf n ARG 625 Cb 0.53 0.38 -0.03 0.00 -1.02 0.00 0.00 32.46 32.31 1nuf n ARG 625 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1nuf n ASP 626 N -1.71 -1.82 -4.75 0.55 8.00 -1.26 -2.25 116.55 113.30 1nuf n ASP 626 Ca -0.05 -1.28 -0.39 0.00 0.71 0.00 0.00 54.79 53.78 1nuf n ASP 626 Cb 0.46 -1.70 -0.05 0.00 -0.02 0.00 0.00 41.12 39.80 1nuf n ASP 626 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nuf s VAL 628 N 0.00 0.13 -0.22 0.00 1.01 -0.41 -0.56 120.40 120.36 1nuf s VAL 628 Ca 0.35 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 62.27 1nuf s VAL 628 Cb -0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 1nuf s VAL 628 CO 0.20 0.07 0.03 -0.22 0.00 0.00 0.00 175.10 175.18 1nuf s LEU 629 N 0.35 3.34 -0.25 3.92 0.20 0.19 -2.10 118.68 124.31 1nuf s LEU 629 Ca -0.03 -0.20 -0.03 0.00 0.69 0.00 0.00 54.13 54.56 1nuf s LEU 629 Cb -0.05 -1.86 0.02 0.00 -0.43 0.00 0.00 46.19 43.86 1nuf s LEU 629 CO -0.01 0.03 -0.03 -0.32 -0.29 0.00 0.00 176.35 175.73 1nuf s MET 630 N 1.20 2.97 0.06 1.98 1.75 0.26 -0.74 119.30 126.78 1nuf s MET 630 Ca 0.04 -0.90 0.07 0.00 -1.25 0.00 0.00 55.69 53.65 1nuf s MET 630 Cb -0.14 -3.07 -0.03 0.00 2.84 0.00 0.00 34.83 34.43 1nuf s MET 630 CO 0.02 -0.38 -0.20 0.08 -0.65 0.00 0.00 175.02 173.89 1nuf s VAL 631 N 1.39 1.63 0.34 10.11 1.01 -0.14 -0.47 120.40 134.26 1nuf s VAL 631 Ca 0.02 -1.26 -0.17 0.00 0.00 0.00 0.00 61.98 60.56 1nuf s VAL 631 Cb -0.16 -1.43 0.06 0.00 0.00 0.00 0.00 36.38 34.84 1nuf s VAL 631 CO -0.03 0.13 0.84 -1.83 0.00 0.00 0.00 175.10 174.21 1nuf s GLU 632 N -1.34 2.02 0.00 2.72 -1.05 -0.53 -0.33 118.70 120.20 1nuf s GLU 632 Ca 0.07 -1.29 0.00 0.00 -0.15 0.00 0.00 54.97 53.59 1nuf s GLU 632 Cb -0.09 0.57 0.00 0.00 -0.44 0.00 0.00 34.13 34.17 1nuf s GLU 632 CO 0.02 -0.95 0.00 0.41 0.95 0.00 0.00 175.26 175.69 1nuf n GLY 633 N -0.56 2.43 3.67 -3.83 0.00 -1.26 -1.40 105.19 104.24 1nuf n GLY 633 Ca -0.07 0.07 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 1nuf n GLY 633 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nuf n SER 634 N 0.00 2.80 0.00 1.61 7.64 -1.26 -1.08 113.62 123.33 1nuf n SER 634 Ca 0.00 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.02 1nuf n SER 634 Cb 0.00 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 1nuf n SER 634 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nuf n GLY 635 N 2.15 3.06 0.14 0.23 0.00 -1.26 -4.62 105.19 104.90 1nuf n GLY 635 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1nuf n GLY 635 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nuf n LEU 636 N 0.00 2.70 -4.28 0.99 4.77 -0.39 -0.12 117.00 120.68 1nuf n LEU 636 Ca 0.00 -0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.79 1nuf n LEU 636 Cb 0.00 -0.63 -0.10 0.00 -2.33 0.00 0.00 43.42 40.36 1nuf n LEU 636 CO 0.00 0.74 -0.32 -0.76 -1.33 0.00 0.00 177.39 175.72 1nuf s LEU 637 N -6.24 2.07 -0.39 2.23 1.43 -0.24 -2.39 118.68 115.15 1nuf s LEU 637 Ca -0.25 -1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 51.54 1nuf s LEU 637 Cb 0.07 -0.11 0.06 0.00 0.03 0.00 0.00 46.19 46.24 1nuf s LEU 637 CO 0.41 -0.57 0.21 -0.22 0.23 0.00 0.00 176.35 176.41 1nuf s LEU 638 N -3.23 4.86 0.00 1.79 2.96 -1.26 -4.52 118.68 119.28 1nuf s LEU 638 Ca 0.27 -1.28 0.00 0.00 -0.22 0.00 0.00 54.13 52.90 1nuf s LEU 638 Cb 0.06 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.77 1nuf s LEU 638 CO 0.07 -0.45 0.00 0.61 -1.32 0.00 0.00 176.35 175.26 1nuf n GLY 639 N 4.92 -0.08 3.84 7.98 0.00 -1.26 -4.84 105.19 115.75 1nuf n GLY 639 Ca -0.11 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 1nuf n GLY 639 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1nuf s ASN 640 N -4.00 5.95 -0.26 1.61 3.84 -1.26 -4.45 114.94 116.37 1nuf s ASN 640 Ca 0.00 0.19 -0.00 0.00 0.21 0.00 0.00 52.86 53.26 1nuf s ASN 640 Cb 0.00 -1.76 0.04 0.00 -0.55 0.00 0.00 41.25 38.98 1nuf s ASN 640 CO 0.00 0.23 -0.07 -0.22 -2.79 0.00 0.00 177.10 174.26 1nuf s LEU 641 N -2.04 3.37 -0.19 3.21 2.96 0.56 -4.97 118.68 121.57 1nuf s LEU 641 Ca 0.27 -1.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.01 1nuf s LEU 641 Cb -0.12 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.89 1nuf s LEU 641 CO 0.19 -0.17 0.08 -0.75 -1.32 0.00 0.00 176.35 174.38 1nuf s LYS 642 N 1.25 3.98 -0.06 1.98 2.20 -1.26 -0.97 119.74 126.86 1nuf s LYS 642 Ca -0.03 -0.34 0.00 0.00 -0.36 0.00 0.00 55.97 55.24 1nuf s LYS 642 Cb -0.18 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 32.90 1nuf s LYS 642 CO -0.04 0.23 -0.04 0.42 -0.36 0.00 0.00 175.35 175.55 1nuf s ILE 643 N 0.51 0.57 -0.11 5.43 1.01 0.08 -4.97 121.20 123.73 1nuf s ILE 643 Ca 0.04 -0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.30 1nuf s ILE 643 Cb -0.13 -0.63 -0.01 0.00 0.01 0.00 0.00 42.46 41.71 1nuf s ILE 643 CO 0.01 0.25 1.02 -1.81 0.00 0.00 0.00 174.94 174.41 1nuf s ASP 644 N 1.24 7.23 -0.17 3.58 1.01 -1.26 0.53 116.67 128.83 1nuf s ASP 644 Ca -0.06 1.54 -0.07 0.00 0.71 0.00 0.00 52.55 54.68 1nuf s ASP 644 Cb -0.14 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 1nuf s ASP 644 CO -0.02 -0.46 0.05 -0.69 0.21 0.00 0.00 175.17 174.26 1nuf s VAL 645 N 2.06 4.65 0.80 -1.27 1.01 0.27 -4.95 120.40 122.99 1nuf s VAL 645 Ca 0.49 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 62.24 1nuf s VAL 645 Cb -0.18 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.14 1nuf s VAL 645 CO 0.18 0.47 0.84 -2.65 0.00 0.00 0.00 175.10 173.94 1nuf n PRO 646 N 3.46 0.15 -1.71 2.72 -0.02 -1.26 -3.80 135.00 134.54 1nuf n PRO 646 Ca -0.17 0.11 -0.43 0.00 -2.02 0.00 0.00 63.50 60.99 1nuf n PRO 646 Cb 0.52 -2.14 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 1nuf n PRO 646 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1nuf n THR 647 N -3.03 1.09 -3.83 3.45 -1.04 -1.26 -4.81 114.28 104.85 1nuf n THR 647 Ca 0.11 -0.27 -0.36 0.00 -2.04 0.00 0.00 64.05 61.49 1nuf n THR 647 Cb 0.51 -1.70 -0.13 0.00 -1.82 0.00 0.00 70.33 67.19 1nuf n THR 647 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1nuf s LEU 648 N -0.27 3.55 1.18 -4.42 2.96 -1.02 -5.01 118.68 115.65 1nuf s LEU 648 Ca 0.65 -0.70 -0.13 0.00 -0.22 0.00 0.00 54.13 53.73 1nuf s LEU 648 Cb -0.58 -1.81 0.29 0.00 0.50 0.00 0.00 46.19 44.59 1nuf s LEU 648 CO 0.50 -0.15 1.03 -0.83 -1.32 0.00 0.00 176.35 175.58 1nuf s GLY 649 N 1.45 1.53 0.49 7.98 0.00 -1.26 -2.10 107.32 115.41 1nuf s GLY 649 Ca 0.02 -0.22 -0.24 0.00 0.00 0.00 0.00 44.72 44.28 1nuf s GLY 649 CO 0.00 0.52 1.38 -1.55 0.00 0.00 0.00 173.10 173.45 1nuf n PRO 650 N -4.92 1.99 -0.64 2.90 -0.04 -1.26 -2.44 135.00 130.58 1nuf n PRO 650 Ca 0.03 0.72 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 1nuf n PRO 650 Cb 0.55 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1nuf n PRO 650 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1nuf n LYS 651 N -0.48 -1.62 -2.30 0.54 4.76 0.95 -4.93 118.16 115.09 1nuf n LYS 651 Ca 0.07 0.29 -0.26 0.00 -2.87 0.00 0.00 58.31 55.54 1nuf n LYS 651 Cb 0.42 -4.12 0.05 0.00 -1.84 0.00 0.00 35.03 29.55 1nuf n LYS 651 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1nuf s GLU 652 N -1.28 2.49 0.10 1.97 2.02 -1.02 -4.78 118.70 118.20 1nuf s GLU 652 Ca 0.00 -0.19 0.10 0.00 0.02 0.00 0.00 54.97 54.89 1nuf s GLU 652 Cb 0.00 -2.23 -0.04 0.00 0.10 0.00 0.00 34.13 31.97 1nuf s GLU 652 CO 0.00 -1.00 -0.23 0.50 0.02 0.00 0.00 175.26 174.54 1nuf s ARG 653 N -5.12 1.65 -0.12 1.61 3.52 -1.26 -1.30 118.95 117.94 1nuf s ARG 653 Ca 0.58 -1.22 0.03 0.00 -0.13 0.00 0.00 55.73 54.99 1nuf s ARG 653 Cb -0.11 -2.01 0.01 0.00 -1.56 0.00 0.00 34.95 31.29 1nuf s ARG 653 CO 0.44 0.48 -0.21 0.45 -0.81 0.00 0.00 175.30 175.65 1nuf s SER 654 N -1.86 2.95 -0.19 -2.12 0.15 0.26 -4.97 113.70 107.91 1nuf s SER 654 Ca 0.15 -0.55 0.01 0.00 0.70 0.00 0.00 55.95 56.25 1nuf s SER 654 Cb -0.10 -1.36 0.03 0.00 -1.71 0.00 0.00 66.02 62.88 1nuf s SER 654 CO 0.06 0.09 -0.15 -0.60 1.20 0.00 0.00 173.24 173.84 1nuf s ARG 655 N 0.72 2.44 -0.09 5.44 3.52 -1.26 -1.44 118.95 128.29 1nuf s ARG 655 Ca -0.10 -0.82 0.04 0.00 -0.13 0.00 0.00 55.73 54.72 1nuf s ARG 655 Cb -0.16 -2.44 -0.00 0.00 -1.56 0.00 0.00 34.95 30.79 1nuf s ARG 655 CO 0.01 -0.32 -0.23 0.08 -0.81 0.00 0.00 175.30 174.03 1nuf s VAL 656 N 1.35 2.18 -0.03 7.11 1.01 -0.43 -4.96 120.40 126.64 1nuf s VAL 656 Ca 0.02 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1nuf s VAL 656 Cb -0.15 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1nuf s VAL 656 CO -0.10 0.56 -0.07 -0.13 0.00 0.00 0.00 175.10 175.36 1nuf s ARG 657 N 0.18 2.62 -0.06 2.72 0.52 -1.26 -0.18 118.95 123.49 1nuf s ARG 657 Ca -0.13 -0.65 -0.19 0.00 -0.52 0.00 0.00 55.73 54.23 1nuf s ARG 657 Cb -0.16 -2.53 0.04 0.00 0.52 0.00 0.00 34.95 32.81 1nuf s ARG 657 CO 0.07 0.63 0.43 -0.59 0.02 0.00 0.00 175.30 175.86 1nuf s PHE 658 N -0.91 -0.36 -0.04 -0.53 -0.12 -0.52 -4.99 117.98 110.51 1nuf s PHE 658 Ca 0.15 0.68 -0.05 0.00 -0.05 0.00 0.00 56.93 57.66 1nuf s PHE 658 Cb -0.11 0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.43 1nuf s PHE 658 CO 0.05 -0.41 0.20 -0.51 -0.05 0.00 0.00 175.22 174.49 1nuf s ASP 659 N -0.96 6.42 0.10 1.98 -0.00 -1.26 -0.73 116.67 122.21 1nuf s ASP 659 Ca -0.10 0.45 0.07 0.00 -0.00 0.00 0.00 52.55 52.96 1nuf s ASP 659 Cb -0.04 -2.05 -0.03 0.00 -0.00 0.00 0.00 42.92 40.80 1nuf s ASP 659 CO 0.05 0.30 -0.17 0.27 -0.00 0.00 0.00 175.17 175.62 1nuf s ILE 660 N -1.23 1.40 -0.31 0.77 -4.36 -1.01 -4.98 121.20 111.48 1nuf s ILE 660 Ca 0.24 -1.49 0.02 0.00 -0.26 0.00 0.00 60.65 59.16 1nuf s ILE 660 Cb -0.13 -1.36 0.09 0.00 1.25 0.00 0.00 42.46 42.32 1nuf s ILE 660 CO 0.14 -0.20 0.03 -0.22 0.24 0.00 0.00 174.94 174.93 1nuf s LEU 661 N -1.96 3.80 0.55 0.37 2.96 -1.01 -1.89 118.68 121.49 1nuf s LEU 661 Ca 0.04 -1.84 -0.21 0.00 -0.22 0.00 0.00 54.13 51.89 1nuf s LEU 661 Cb -0.09 -1.39 -0.06 0.00 0.50 0.00 0.00 46.19 45.15 1nuf s LEU 661 CO 0.03 -0.35 1.18 -2.65 -1.32 0.00 0.00 176.35 173.24 1nuf n PRO 662 N 4.45 1.37 0.00 0.98 -0.02 -1.23 -4.47 135.00 136.08 1nuf n PRO 662 Ca -0.01 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1nuf n PRO 662 Cb 0.42 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1nuf n PRO 662 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1nuf n SER 663 N -0.73 4.63 -4.27 2.55 3.41 0.83 -1.60 113.62 118.44 1nuf n SER 663 Ca 0.12 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.47 1nuf n SER 663 Cb 0.45 0.42 -0.13 0.00 -0.26 0.00 0.00 64.21 64.68 1nuf n SER 663 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1nuf s ARG 664 N -1.95 1.28 0.56 4.33 3.52 -1.23 -4.84 118.95 120.62 1nuf s ARG 664 Ca 0.00 -1.05 -0.01 0.00 -0.13 0.00 0.00 55.73 54.54 1nuf s ARG 664 Cb 0.00 -1.48 0.03 0.00 -1.56 0.00 0.00 34.95 31.94 1nuf s ARG 664 CO 0.00 0.36 0.81 -1.54 -0.81 0.00 0.00 175.30 174.12 1nuf s SER 665 N -1.53 5.35 0.00 -2.12 1.04 -1.26 -4.85 113.70 110.33 1nuf s SER 665 Ca 0.07 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1nuf s SER 665 Cb -0.09 -1.14 0.00 0.00 0.10 0.00 0.00 66.02 64.89 1nuf s SER 665 CO 0.03 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.74 1nuf n GLY 666 N -2.41 -0.47 3.65 7.32 0.00 -0.49 -4.93 105.19 107.86 1nuf n GLY 666 Ca 0.06 -2.23 -0.43 0.00 0.00 0.00 0.00 46.02 43.43 1nuf n GLY 666 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nuf s THR 667 N -0.07 4.71 0.28 2.61 -4.23 -1.26 -0.88 115.64 116.80 1nuf s THR 667 Ca 0.00 1.79 0.10 0.00 -1.18 0.00 0.00 61.69 62.40 1nuf s THR 667 Cb 0.00 -4.26 -0.04 0.00 1.34 0.00 0.00 72.50 69.54 1nuf s THR 667 CO 0.00 -0.20 -0.00 -0.54 -0.54 0.00 0.00 174.62 173.34 1nuf s LYS 668 N 3.14 2.24 -0.28 3.99 -0.14 0.38 -4.95 119.74 124.12 1nuf s LYS 668 Ca 0.41 -1.48 0.00 0.00 -1.36 0.00 0.00 55.97 53.54 1nuf s LYS 668 Cb -0.15 -2.12 0.05 0.00 -1.68 0.00 0.00 37.83 33.94 1nuf s LYS 668 CO 0.08 0.32 -0.06 -1.14 -0.76 0.00 0.00 175.35 173.79 1nuf s GLN 669 N -3.68 2.39 -0.28 1.68 0.74 -1.26 -0.90 119.66 118.34 1nuf s GLN 669 Ca 0.32 -1.27 -0.19 0.00 0.05 0.00 0.00 55.36 54.28 1nuf s GLN 669 Cb -0.05 -3.02 -0.02 0.00 1.10 0.00 0.00 33.01 31.01 1nuf s GLN 669 CO 0.20 -0.57 0.55 -1.17 -0.55 0.00 0.00 175.29 173.75 1nuf s LEU 670 N 1.19 4.11 0.00 3.68 2.96 -0.59 -4.40 118.68 125.63 1nuf s LEU 670 Ca -0.06 0.45 0.04 0.00 -0.22 0.00 0.00 54.13 54.35 1nuf s LEU 670 Cb -0.19 -2.71 -0.03 0.00 0.50 0.00 0.00 46.19 43.76 1nuf s LEU 670 CO -0.03 -0.36 -0.11 -0.76 -1.32 0.00 0.00 176.35 173.76 1nuf s LEU 671 N 2.41 2.93 0.06 -0.68 1.43 -0.49 -1.18 118.68 123.16 1nuf s LEU 671 Ca 0.22 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 1nuf s LEU 671 Cb -0.15 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 1nuf s LEU 671 CO 0.10 0.29 -0.07 0.00 0.23 0.00 0.00 176.35 176.91 1nuf s ALA 672 N -0.92 0.67 -0.03 4.21 0.00 -0.20 -1.46 121.76 124.03 1nuf s ALA 672 Ca 0.15 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1nuf s ALA 672 Cb -0.11 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.15 1nuf s ALA 672 CO 0.05 -0.14 -0.02 0.34 0.00 0.00 0.00 175.76 176.00 1nuf s ASP 673 N -2.21 0.60 -0.17 0.00 2.15 0.38 -1.73 116.67 115.69 1nuf s ASP 673 Ca -0.01 -0.07 0.00 0.00 0.43 0.00 0.00 52.55 52.90 1nuf s ASP 673 Cb -0.03 -0.30 0.01 0.00 -0.30 0.00 0.00 42.92 42.30 1nuf s ASP 673 CO -0.02 -0.08 -0.16 0.12 -0.17 0.00 0.00 175.17 174.86 1nuf s PHE 674 N 0.92 2.79 -0.04 -5.34 5.36 0.18 -0.57 117.98 121.28 1nuf s PHE 674 Ca -0.10 -1.32 0.03 0.00 -0.96 0.00 0.00 56.93 54.58 1nuf s PHE 674 Cb -0.14 -1.93 0.00 0.00 -0.34 0.00 0.00 43.02 40.62 1nuf s PHE 674 CO -0.01 -0.65 -0.14 -1.12 -1.46 0.00 0.00 175.22 171.85 1nuf s SER 675 N 1.13 1.82 0.07 6.13 0.01 -0.89 -1.29 113.70 120.67 1nuf s SER 675 Ca 0.01 -0.30 -0.09 0.00 1.31 0.00 0.00 55.95 56.88 1nuf s SER 675 Cb -0.14 -0.58 0.00 0.00 0.21 0.00 0.00 66.02 65.50 1nuf s SER 675 CO -0.06 0.10 0.19 0.00 0.41 0.00 0.00 173.24 173.88 1nuf h ASN 677 N 3.08 0.46 1.14 0.00 -1.07 -1.62 0.21 115.58 117.79 1nuf h ASN 677 Ca -0.33 0.16 -0.08 0.00 0.07 0.00 0.00 56.30 56.12 1nuf h ASN 677 Cb 1.19 0.11 -0.01 0.00 -2.07 0.00 0.00 38.32 37.54 1nuf h ASN 677 CO 0.53 -0.09 -0.89 0.11 0.07 0.00 0.00 177.43 177.15 1nuf h LYS 678 N 0.31 0.00 -2.84 4.14 6.56 -1.92 -3.42 116.57 119.39 1nuf h LYS 678 Ca 0.72 0.00 -0.60 0.00 -1.06 0.00 0.00 60.65 59.71 1nuf h LYS 678 Cb 1.79 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 33.05 1nuf h LYS 678 CO -0.51 0.19 -0.78 -0.06 -2.06 0.00 0.00 179.45 176.23 1nuf s PHE 679 N -3.12 1.72 0.37 -1.35 0.40 0.06 -5.10 117.98 110.96 1nuf s PHE 679 Ca 0.01 -2.30 -0.25 0.00 -0.60 0.00 0.00 56.93 53.78 1nuf s PHE 679 Cb 0.08 -1.63 -0.09 0.00 0.51 0.00 0.00 43.02 41.89 1nuf s PHE 679 CO 0.77 -0.78 1.06 -1.25 0.70 0.00 0.00 175.22 175.72 1nuf s PRO 680 N 0.36 4.29 -0.69 0.24 0.04 -1.22 -2.29 135.00 135.73 1nuf s PRO 680 Ca 0.20 1.59 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 1nuf s PRO 680 Cb -0.20 -2.72 0.02 0.00 0.04 0.00 0.00 34.50 31.64 1nuf s PRO 680 CO -0.03 -0.05 0.64 0.00 0.04 0.00 0.00 177.00 177.60 1nuf n ALA 681 N 0.27 -2.65 -2.69 8.56 0.00 -1.25 -4.88 120.51 117.88 1nuf n ALA 681 Ca 0.03 0.05 -0.36 0.00 0.00 0.00 0.00 53.44 53.16 1nuf n ALA 681 Cb 0.48 -1.49 -0.10 0.00 0.00 0.00 0.00 19.45 18.35 1nuf n ALA 681 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nuf s ILE 682 N -2.59 5.28 0.29 0.00 1.01 -0.41 -4.92 121.20 119.85 1nuf s ILE 682 Ca 0.12 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.93 1nuf s ILE 682 Cb -0.02 -3.46 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 1nuf s ILE 682 CO 0.86 0.35 0.47 -0.54 0.00 0.00 0.00 174.94 176.08 1nuf s LYS 683 N 1.05 3.48 -0.05 2.79 -0.14 -1.26 -0.65 119.74 124.96 1nuf s LYS 683 Ca 0.07 -0.44 -0.15 0.00 -1.36 0.00 0.00 55.97 54.09 1nuf s LYS 683 Cb -0.14 -2.75 0.03 0.00 -1.68 0.00 0.00 37.83 33.29 1nuf s LYS 683 CO 0.04 0.27 0.35 0.00 -0.76 0.00 0.00 175.35 175.26 1nuf s ALA 684 N -2.14 -0.89 -0.10 5.17 0.00 -0.71 -4.62 121.76 118.47 1nuf s ALA 684 Ca 0.38 0.61 -0.10 0.00 0.00 0.00 0.00 51.96 52.85 1nuf s ALA 684 Cb -0.10 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1nuf s ALA 684 CO 0.33 -0.24 0.28 1.41 0.00 0.00 0.00 175.76 177.53 1nuf s MET 685 N -0.86 0.36 -0.12 0.00 0.00 -1.26 -1.04 119.30 116.37 1nuf s MET 685 Ca -0.09 0.33 -0.05 0.00 0.00 0.00 0.00 55.69 55.88 1nuf s MET 685 Cb -0.04 0.17 0.06 0.00 0.00 0.00 0.00 34.83 35.02 1nuf s MET 685 CO 0.04 -0.05 0.25 -1.17 0.00 0.00 0.00 175.02 174.09 1nuf s LEU 686 N 0.01 -0.27 -0.05 4.11 2.96 -0.32 -4.90 118.68 120.21 1nuf s LEU 686 Ca -0.01 0.57 -0.30 0.00 -0.22 0.00 0.00 54.13 54.17 1nuf s LEU 686 Cb -0.02 0.66 -0.03 0.00 0.50 0.00 0.00 46.19 47.30 1nuf s LEU 686 CO 0.01 -0.24 1.09 -0.55 -1.32 0.00 0.00 176.35 175.34 1nuf s SER 687 N 2.39 7.18 -0.09 3.68 0.15 -1.26 -1.54 113.70 124.20 1nuf s SER 687 Ca 0.01 1.71 0.03 0.00 0.70 0.00 0.00 55.95 58.41 1nuf s SER 687 Cb -0.12 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1nuf s SER 687 CO -0.08 -0.46 -0.21 -0.63 1.20 0.00 0.00 173.24 173.06 1nuf s ILE 688 N 1.79 1.80 -0.36 6.45 1.01 -0.08 -4.97 121.20 126.84 1nuf s ILE 688 Ca 0.53 -0.87 -0.21 0.00 0.00 0.00 0.00 60.65 60.10 1nuf s ILE 688 Cb -0.22 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.67 1nuf s ILE 688 CO 0.22 0.50 0.65 -1.81 0.00 0.00 0.00 174.94 174.51 1nuf s ASP 689 N 0.46 6.43 -0.34 3.58 1.01 -1.26 -0.47 116.67 126.08 1nuf s ASP 689 Ca -0.17 0.14 -0.15 0.00 0.71 0.00 0.00 52.55 53.08 1nuf s ASP 689 Cb -0.17 -2.33 -0.01 0.00 1.01 0.00 0.00 42.92 41.41 1nuf s ASP 689 CO 0.07 -0.61 0.35 -0.69 0.21 0.00 0.00 175.17 174.49 1nuf s VAL 690 N 2.74 5.18 0.56 -1.27 1.01 -0.06 -4.27 120.40 124.30 1nuf s VAL 690 Ca 0.25 -0.00 -0.18 0.00 0.00 0.00 0.00 61.98 62.05 1nuf s VAL 690 Cb -0.14 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1nuf s VAL 690 CO 0.15 -0.09 1.09 0.00 0.00 0.00 0.00 175.10 176.25 1nuf s ALA 691 N 1.98 2.70 -2.00 5.51 0.00 0.83 -1.39 121.76 129.39 1nuf s ALA 691 Ca 0.11 0.65 0.15 0.00 0.00 0.00 0.00 51.96 52.87 1nuf s ALA 691 Cb -0.17 -3.31 0.88 0.00 0.00 0.00 0.00 23.12 20.52 1nuf s ALA 691 CO 0.12 -0.77 1.29 -1.91 0.00 0.00 0.00 175.76 174.49