#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nud s ALA 2 N 0.00 3.26 0.21 0.00 0.00 -1.26 -4.98 121.76 118.98 1nud s ALA 2 Ca 0.00 0.55 -0.31 0.00 0.00 0.00 0.00 51.96 52.20 1nud s ALA 2 Cb 0.00 -3.19 -0.10 0.00 0.00 0.00 0.00 23.12 19.83 1nud s ALA 2 CO 0.00 0.19 1.48 -1.17 0.00 0.00 0.00 175.76 176.26 1nud s LEU 3 N -1.75 4.38 0.16 0.00 2.96 -1.26 -4.98 118.68 118.19 1nud s LEU 3 Ca 0.47 2.62 -0.11 0.00 -0.22 0.00 0.00 54.13 56.89 1nud s LEU 3 Cb -0.21 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.87 1nud s LEU 3 CO 0.26 -0.74 0.33 -0.83 -1.32 0.00 0.00 176.35 174.05 1nud s GLY 4 N 0.70 0.30 -0.28 7.98 0.00 -1.26 -4.93 107.32 109.83 1nud s GLY 4 Ca 0.64 -0.69 -0.21 0.00 0.00 0.00 0.00 44.72 44.45 1nud s GLY 4 CO 0.38 -0.69 0.66 0.14 0.00 0.00 0.00 173.10 173.59 1nud s VAL 5 N -3.93 4.93 -0.02 1.40 1.01 -1.26 -1.11 120.40 121.42 1nud s VAL 5 Ca 0.14 1.07 -0.22 0.00 0.00 0.00 0.00 61.98 62.98 1nud s VAL 5 Cb 0.02 -4.00 -0.24 0.00 0.00 0.00 0.00 36.38 32.17 1nud s VAL 5 CO -0.02 -0.08 1.06 -0.61 0.00 0.00 0.00 175.10 175.45 1nud h GLN 6 N 8.01 0.32 -2.57 2.72 4.15 -0.56 -3.46 115.11 123.72 1nud h GLN 6 Ca -0.26 -0.35 0.13 0.00 0.77 0.00 0.00 58.65 58.93 1nud h GLN 6 Cb 1.12 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 28.83 1nud h GLN 6 CO 0.80 1.05 0.39 -1.54 -1.93 0.00 0.00 178.83 177.61 1nud s SER 7 N -6.61 -0.25 -0.02 -0.69 1.04 -0.91 -5.02 113.70 101.24 1nud s SER 7 Ca -0.14 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 55.90 1nud s SER 7 Cb 0.02 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.72 1nud s SER 7 CO 0.79 -1.01 0.01 -0.51 0.98 0.00 0.00 173.24 173.51 1nud s ILE 8 N -3.48 0.06 -0.38 -1.02 2.07 -1.26 -1.90 121.20 115.29 1nud s ILE 8 Ca 0.10 0.10 -0.07 0.00 -1.41 0.00 0.00 60.65 59.38 1nud s ILE 8 Cb -0.03 -0.15 0.07 0.00 0.13 0.00 0.00 42.46 42.48 1nud s ILE 8 CO 0.01 0.09 0.18 0.21 -1.91 0.00 0.00 174.94 173.53 1nud s ASN 9 N 0.77 5.42 0.00 4.50 3.84 0.79 -4.97 114.94 125.29 1nud s ASN 9 Ca -0.07 -1.44 0.20 0.00 0.21 0.00 0.00 52.86 51.76 1nud s ASN 9 Cb -0.10 -1.91 0.95 0.00 -0.55 0.00 0.00 41.25 39.64 1nud s ASN 9 CO -0.02 -0.45 1.64 0.79 -2.79 0.00 0.00 177.10 176.28 1nud n TRP 10 N 4.81 0.00 -4.18 0.43 7.02 -1.26 -1.36 117.44 122.90 1nud n TRP 10 Ca -0.10 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.08 1nud n TRP 10 Cb 0.43 -0.39 -0.06 0.00 -2.42 0.00 0.00 31.31 28.87 1nud n TRP 10 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1nud n GLN 11 N -1.39 -2.05 -0.21 -0.99 6.02 -1.26 -4.75 117.38 112.75 1nud n GLN 11 Ca 0.07 0.24 -0.02 0.00 -0.01 0.00 0.00 57.00 57.29 1nud n GLN 11 Cb 0.20 -4.14 0.05 0.00 1.02 0.00 0.00 30.24 27.37 1nud n GLN 11 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1nud h THR 12 N -1.74 0.31 0.31 5.09 2.02 -1.92 -1.57 112.91 115.41 1nud h THR 12 Ca -0.64 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1nud h THR 12 Cb 1.39 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1nud h THR 12 CO 0.69 0.00 -0.48 0.00 0.37 0.00 0.00 175.52 176.10 1nud h ALA 13 N 1.47 -1.05 0.12 6.16 0.00 -1.97 0.23 119.26 124.21 1nud h ALA 13 Ca 0.29 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1nud h ALA 13 Cb 0.49 0.77 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1nud h ALA 13 CO -0.66 -1.12 -0.37 0.35 0.00 0.00 0.00 179.25 177.44 1nud h PHE 14 N -0.82 -1.08 -0.43 0.00 3.04 -1.86 -0.54 116.94 115.24 1nud h PHE 14 Ca -0.04 0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.02 1nud h PHE 14 Cb 0.76 0.46 -0.07 0.00 2.56 0.00 0.00 35.95 39.65 1nud h PHE 14 CO -0.33 -0.43 -0.02 -0.91 -2.02 0.00 0.00 178.31 174.60 1nud h ASN 15 N -0.56 -0.22 -0.79 0.41 2.35 -1.30 -0.25 115.58 115.24 1nud h ASN 15 Ca -0.01 0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 1nud h ASN 15 Cb 0.55 0.20 -0.05 0.00 0.05 0.00 0.00 38.32 39.06 1nud h ASN 15 CO -0.19 -0.07 0.49 0.03 -1.65 0.00 0.00 177.43 176.05 1nud h ARG 16 N 0.09 0.92 -0.40 0.81 3.08 -0.76 0.60 114.38 118.72 1nud h ARG 16 Ca 0.21 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 1nud h ARG 16 Cb 0.32 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1nud h ARG 16 CO -0.37 0.61 0.17 0.37 -1.07 0.00 0.00 179.97 179.68 1nud h GLN 17 N 0.95 0.60 0.00 0.04 4.15 -0.40 -0.05 115.11 120.40 1nud h GLN 17 Ca 0.32 -0.10 -0.05 0.00 0.77 0.00 0.00 58.65 59.59 1nud h GLN 17 Cb 0.05 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1nud h GLN 17 CO -0.13 0.55 -0.24 0.00 -1.93 0.00 0.00 178.83 177.09 1nud h ALA 18 N 1.02 1.25 -0.61 3.38 0.00 -0.18 -2.20 119.26 121.92 1nud h ALA 18 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1nud h ALA 18 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1nud h ALA 18 CO -0.01 0.29 0.00 0.72 0.00 0.00 0.00 179.25 180.25 1nud n HIS 19 N -3.74 0.85 -3.98 0.00 8.25 0.20 -4.95 115.22 111.85 1nud n HIS 19 Ca -0.01 -0.41 -0.28 0.00 -0.26 0.00 0.00 57.72 56.76 1nud n HIS 19 Cb 0.34 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.42 1nud n HIS 19 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1nud n HIS 20 N 1.26 -1.75 -1.26 4.41 -0.00 -0.28 -4.70 115.22 112.89 1nud n HIS 20 Ca 0.20 0.78 0.02 0.00 -0.00 0.00 0.00 57.72 58.73 1nud n HIS 20 Cb 0.53 -3.66 0.03 0.00 -0.00 0.00 0.00 29.99 26.89 1nud n HIS 20 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1nud n THR 21 N -4.41 0.58 0.28 1.59 -2.24 -0.19 -4.80 114.28 105.09 1nud n THR 21 Ca -0.20 -0.67 0.14 0.00 -2.27 0.00 0.00 64.05 61.05 1nud n THR 21 Cb 0.63 0.45 0.40 0.00 -2.10 0.00 0.00 70.33 69.70 1nud n THR 21 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1nud h ASP 22 N 0.00 0.00 0.41 3.42 2.03 -1.86 -3.22 116.42 117.20 1nud h ASP 22 Ca 0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.27 1nud h ASP 22 Cb 1.09 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.58 1nud h ASP 22 CO 0.00 0.00 -0.15 0.11 -1.03 0.00 0.00 179.24 178.17 1nud h LYS 23 N 0.00 0.00 -6.97 4.15 1.57 -1.91 -3.44 116.57 109.96 1nud h LYS 23 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1nud h LYS 23 Cb 0.77 0.00 0.10 0.00 0.08 0.00 0.00 32.23 33.18 1nud h LYS 23 CO 0.00 0.15 0.65 -0.06 -0.57 0.00 0.00 179.45 179.62 1nud s PHE 24 N -4.16 2.62 0.21 -1.35 0.40 -1.22 -4.86 117.98 109.61 1nud s PHE 24 Ca -0.03 1.34 0.11 0.00 -0.60 0.00 0.00 56.93 57.75 1nud s PHE 24 Cb 0.13 -3.79 0.26 0.00 0.51 0.00 0.00 43.02 40.13 1nud s PHE 24 CO 0.60 -2.53 1.55 0.66 0.70 0.00 0.00 175.22 176.20 1nud h SER 25 N 2.42 0.00 -2.62 1.36 4.64 -1.70 -3.46 113.55 114.19 1nud h SER 25 Ca -0.50 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.28 1nud h SER 25 Cb 1.26 0.00 0.23 0.00 -0.31 0.00 0.00 62.40 63.58 1nud h SER 25 CO 0.61 0.67 -1.28 -0.24 -0.87 0.00 0.00 176.83 175.73 1nud n SER 26 N -3.65 -3.97 -0.00 4.97 2.88 -1.26 -4.91 113.62 107.67 1nud n SER 26 Ca -0.01 0.23 0.09 0.00 -1.33 0.00 0.00 58.87 57.85 1nud n SER 26 Cb 0.68 -0.96 -0.11 0.00 -0.75 0.00 0.00 64.21 63.06 1nud n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nud n GLN 27 N 0.39 0.95 -0.55 -1.46 1.13 -1.26 -5.01 117.38 111.56 1nud n GLN 27 Ca 0.02 -0.06 -0.29 0.00 -1.94 0.00 0.00 57.00 54.73 1nud n GLN 27 Cb 0.56 -1.37 0.27 0.00 0.11 0.00 0.00 30.24 29.81 1nud n GLN 27 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1nud s GLU 28 N -2.88 -1.87 -0.52 -1.09 2.02 -1.26 -4.95 118.70 108.15 1nud s GLU 28 Ca 0.02 0.39 -0.21 0.00 0.02 0.00 0.00 54.97 55.19 1nud s GLU 28 Cb 0.13 -1.48 0.05 0.00 0.10 0.00 0.00 34.13 32.93 1nud s GLU 28 CO 0.74 -4.24 0.75 -1.17 0.02 0.00 0.00 175.26 171.36 1nud s LEU 29 N -7.46 4.59 -0.28 1.80 2.96 -1.26 -5.00 118.68 114.04 1nud s LEU 29 Ca 0.69 -0.66 -0.09 0.00 -0.22 0.00 0.00 54.13 53.85 1nud s LEU 29 Cb -0.18 -2.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.87 1nud s LEU 29 CO 0.60 -1.02 0.12 -0.63 -1.32 0.00 0.00 176.35 174.10 1nud s ILE 30 N 3.17 4.58 0.33 6.68 1.01 -1.26 0.28 121.20 135.98 1nud s ILE 30 Ca 0.22 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.69 1nud s ILE 30 Cb -0.16 -3.22 -0.06 0.00 0.01 0.00 0.00 42.46 39.02 1nud s ILE 30 CO 0.15 0.22 0.04 -0.76 0.00 0.00 0.00 174.94 174.59 1nud s LEU 31 N 1.64 2.30 -0.06 2.97 1.43 0.20 -4.61 118.68 122.55 1nud s LEU 31 Ca 0.06 -1.36 0.05 0.00 -1.03 0.00 0.00 54.13 51.85 1nud s LEU 31 Cb -0.16 -0.47 -0.00 0.00 0.03 0.00 0.00 46.19 45.59 1nud s LEU 31 CO 0.06 -0.56 -0.21 -0.13 0.23 0.00 0.00 176.35 175.74 1nud s ARG 32 N -3.85 2.20 0.65 1.70 0.52 -1.26 0.68 118.95 119.59 1nud s ARG 32 Ca 0.36 -0.74 -0.17 0.00 -0.52 0.00 0.00 55.73 54.66 1nud s ARG 32 Cb 0.08 -1.85 -0.03 0.00 0.52 0.00 0.00 34.95 33.67 1nud s ARG 32 CO 0.15 0.27 0.89 2.89 0.02 0.00 0.00 175.30 179.53 1nud n ARG 33 N 3.16 0.68 -1.01 3.54 1.85 0.17 -3.36 116.66 121.68 1nud n ARG 33 Ca -0.18 0.28 -0.00 0.00 -1.00 0.00 0.00 57.85 56.94 1nud n ARG 33 Cb 0.52 -2.12 -0.00 0.00 -1.05 0.00 0.00 32.46 29.81 1nud n ARG 33 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nud n GLY 34 N 1.31 0.47 3.23 2.89 0.00 -1.19 -4.59 105.19 107.31 1nud n GLY 34 Ca 0.13 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 1nud n GLY 34 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nud s GLN 35 N -0.58 0.98 0.41 1.61 0.74 -1.21 -4.78 119.66 116.83 1nud s GLN 35 Ca 0.00 -1.07 -0.14 0.00 0.05 0.00 0.00 55.36 54.20 1nud s GLN 35 Cb 0.00 -1.13 -0.08 0.00 1.10 0.00 0.00 33.01 32.90 1nud s GLN 35 CO 0.00 0.26 0.83 -0.80 -0.55 0.00 0.00 175.29 175.03 1nud s ASN 36 N -1.83 6.67 -0.08 6.67 -0.87 -1.26 -4.02 114.94 120.21 1nud s ASN 36 Ca 0.02 1.35 -0.07 0.00 -1.57 0.00 0.00 52.86 52.59 1nud s ASN 36 Cb -0.10 -2.41 0.03 0.00 -0.02 0.00 0.00 41.25 38.75 1nud s ASN 36 CO 0.03 -0.38 0.22 0.72 -2.57 0.00 0.00 177.10 175.12 1nud s PHE 37 N -2.30 -0.25 -0.13 2.20 -0.71 -0.57 -4.97 117.98 111.25 1nud s PHE 37 Ca 0.55 0.61 -0.07 0.00 -1.04 0.00 0.00 56.93 56.99 1nud s PHE 37 Cb -0.10 0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 1nud s PHE 37 CO 0.25 -0.14 0.11 -1.14 -1.34 0.00 0.00 175.22 172.96 1nud s GLN 38 N 0.36 3.48 0.12 1.99 0.74 -1.26 -1.35 119.66 123.73 1nud s GLN 38 Ca -0.02 -0.20 0.06 0.00 0.05 0.00 0.00 55.36 55.25 1nud s GLN 38 Cb -0.03 -3.15 -0.04 0.00 1.10 0.00 0.00 33.01 30.89 1nud s GLN 38 CO -0.01 0.68 -0.14 0.14 -0.55 0.00 0.00 175.29 175.41 1nud s VAL 39 N -0.77 1.29 -0.21 1.34 -7.23 -0.49 -4.58 120.40 109.75 1nud s VAL 39 Ca 0.13 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.55 1nud s VAL 39 Cb -0.12 -1.51 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 1nud s VAL 39 CO 0.03 -0.42 -0.00 -0.76 -0.31 0.00 0.00 175.10 173.63 1nud s LEU 40 N -2.44 3.18 -0.34 1.32 1.02 -0.47 -1.87 118.68 119.09 1nud s LEU 40 Ca 0.08 -0.26 0.03 0.00 0.02 0.00 0.00 54.13 54.01 1nud s LEU 40 Cb -0.05 -1.82 0.10 0.00 0.02 0.00 0.00 46.19 44.44 1nud s LEU 40 CO 0.03 0.02 0.05 -0.32 0.02 0.00 0.00 176.35 176.15 1nud s MET 41 N 1.24 1.59 -0.43 1.70 1.75 0.22 -0.15 119.30 125.21 1nud s MET 41 Ca 0.03 -1.83 -0.28 0.00 -1.25 0.00 0.00 55.69 52.37 1nud s MET 41 Cb -0.15 -3.22 0.02 0.00 2.84 0.00 0.00 34.83 34.33 1nud s MET 41 CO 0.01 -0.92 1.05 0.42 -0.65 0.00 0.00 175.02 174.92 1nud s ILE 42 N 0.94 4.37 0.46 10.11 1.01 -0.80 0.12 121.20 137.42 1nud s ILE 42 Ca 0.09 1.19 -0.04 0.00 0.00 0.00 0.00 60.65 61.89 1nud s ILE 42 Cb -0.19 -4.50 -0.03 0.00 0.01 0.00 0.00 42.46 37.75 1nud s ILE 42 CO -0.07 -0.82 0.74 -0.04 0.00 0.00 0.00 174.94 174.75 1nud s MET 43 N 4.03 3.47 0.57 2.79 -1.94 0.19 0.14 119.30 128.54 1nud s MET 43 Ca 0.44 0.05 0.35 0.00 -1.71 0.00 0.00 55.69 54.82 1nud s MET 43 Cb -0.09 -2.43 1.58 0.00 2.01 0.00 0.00 34.83 35.90 1nud s MET 43 CO 0.26 -0.18 2.07 -2.95 -0.01 0.00 0.00 175.02 174.21 1nud h ASN 44 N 0.30 0.00 -1.89 3.03 -1.07 -1.41 -3.43 115.58 111.12 1nud h ASN 44 Ca -0.47 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 55.86 1nud h ASN 44 Cb 1.21 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.45 1nud h ASN 44 CO 0.61 0.02 -0.02 2.29 0.07 0.00 0.00 177.43 180.40 1nud n LYS 45 N -3.13 0.10 -2.99 4.14 2.85 -1.26 -5.03 118.16 112.84 1nud n LYS 45 Ca -0.00 -0.40 -0.29 0.00 -1.05 0.00 0.00 58.31 56.57 1nud n LYS 45 Cb 0.26 0.39 -0.03 0.00 -0.65 0.00 0.00 35.03 35.00 1nud n LYS 45 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1nud s GLY 46 N -1.31 1.81 0.18 2.58 0.00 -1.26 -4.70 107.32 104.62 1nud s GLY 46 Ca 0.04 -0.39 -0.30 0.00 0.00 0.00 0.00 44.72 44.07 1nud s GLY 46 CO 0.03 -0.24 1.05 -2.27 0.00 0.00 0.00 173.10 171.67 1nud s LEU 47 N -3.93 4.51 0.06 0.66 2.96 -1.26 -5.05 118.68 116.63 1nud s LEU 47 Ca 0.48 2.02 0.00 0.00 -0.22 0.00 0.00 54.13 56.41 1nud s LEU 47 Cb -0.10 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1nud s LEU 47 CO 0.33 -0.14 0.19 -0.83 -1.32 0.00 0.00 176.35 174.58 1nud s GLY 48 N -0.27 2.16 0.62 7.98 0.00 -1.26 -4.98 107.32 111.57 1nud s GLY 48 Ca 0.47 -0.86 0.41 0.00 0.00 0.00 0.00 44.72 44.74 1nud s GLY 48 CO 0.34 -0.83 2.24 1.48 0.00 0.00 0.00 173.10 176.33 1nud h SER 49 N 3.19 0.00 -0.31 1.64 4.64 -2.02 -1.63 113.55 119.06 1nud h SER 49 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1nud h SER 49 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1nud h SER 49 CO 0.74 0.00 0.00 -3.20 -0.87 0.00 0.00 176.83 173.50 1nud n ASN 50 N -3.02 3.61 -4.73 4.97 5.15 -1.26 -4.99 115.26 114.99 1nud n ASN 50 Ca -0.02 -2.62 -0.23 0.00 -0.60 0.00 0.00 54.58 51.11 1nud n ASN 50 Cb 0.12 -0.43 -0.06 0.00 -0.53 0.00 0.00 39.78 38.88 1nud n ASN 50 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1nud s GLU 51 N -2.12 2.52 -0.07 1.20 2.02 -0.61 -4.83 118.70 116.80 1nud s GLU 51 Ca 0.36 -1.35 -0.10 0.00 0.02 0.00 0.00 54.97 53.90 1nud s GLU 51 Cb 0.26 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 32.22 1nud s GLU 51 CO 0.12 0.28 0.26 0.50 0.02 0.00 0.00 175.26 176.45 1nud s ARG 52 N -3.79 0.40 -0.19 1.61 3.52 -0.15 -4.84 118.95 115.51 1nud s ARG 52 Ca 0.34 0.18 0.01 0.00 -0.13 0.00 0.00 55.73 56.14 1nud s ARG 52 Cb -0.06 0.19 0.03 0.00 -1.56 0.00 0.00 34.95 33.55 1nud s ARG 52 CO 0.22 -0.07 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.95 1nud s LEU 53 N -0.31 2.30 -0.22 -0.88 1.43 -1.26 0.10 118.68 119.84 1nud s LEU 53 Ca -0.04 -0.75 -0.06 0.00 -1.03 0.00 0.00 54.13 52.25 1nud s LEU 53 Cb -0.03 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 1nud s LEU 53 CO 0.01 -0.03 0.02 -1.61 0.23 0.00 0.00 176.35 174.97 1nud s GLU 54 N 1.28 3.60 0.12 1.70 0.41 0.91 -1.69 118.70 125.01 1nud s GLU 54 Ca 0.03 -0.52 -0.21 0.00 -0.41 0.00 0.00 54.97 53.86 1nud s GLU 54 Cb -0.14 -3.16 -0.07 0.00 -1.78 0.00 0.00 34.13 28.98 1nud s GLU 54 CO -0.12 -0.09 0.64 -0.06 -0.49 0.00 0.00 175.26 175.14 1nud s PHE 55 N 1.29 3.81 -0.14 1.61 0.40 0.16 -0.21 117.98 124.91 1nud s PHE 55 Ca 0.04 1.37 -0.01 0.00 -0.60 0.00 0.00 56.93 57.73 1nud s PHE 55 Cb -0.15 -2.57 0.04 0.00 0.51 0.00 0.00 43.02 40.85 1nud s PHE 55 CO 0.02 0.54 -0.02 0.42 0.70 0.00 0.00 175.22 176.87 1nud s ILE 56 N -1.18 0.77 0.07 0.64 1.01 0.33 -0.64 121.20 122.20 1nud s ILE 56 Ca 0.33 -0.35 0.09 0.00 0.00 0.00 0.00 60.65 60.72 1nud s ILE 56 Cb -0.20 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 1nud s ILE 56 CO 0.21 0.14 -0.23 0.68 0.00 0.00 0.00 174.94 175.74 1nud s VAL 57 N 1.79 2.47 0.06 2.92 -7.23 -0.01 0.60 120.40 121.01 1nud s VAL 57 Ca 0.02 -1.39 -0.15 0.00 -1.81 0.00 0.00 61.98 58.65 1nud s VAL 57 Cb -0.14 -2.04 0.03 0.00 0.56 0.00 0.00 36.38 34.79 1nud s VAL 57 CO -0.07 0.28 0.36 -0.94 -0.31 0.00 0.00 175.10 174.41 1nud s SER 58 N -1.55 -0.19 0.02 4.85 1.04 -0.74 -0.44 113.70 116.69 1nud s SER 58 Ca 0.14 -0.19 -0.03 0.00 0.48 0.00 0.00 55.95 56.35 1nud s SER 58 Cb -0.10 0.41 -0.01 0.00 0.10 0.00 0.00 66.02 66.41 1nud s SER 58 CO 0.05 -0.69 0.04 0.28 0.98 0.00 0.00 173.24 173.90 1nud s THR 59 N -2.90 0.12 0.18 2.02 -1.32 0.28 -1.57 115.64 112.44 1nud s THR 59 Ca -0.03 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.44 1nud s THR 59 Cb 0.00 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.37 1nud s THR 59 CO -0.05 -0.56 0.00 0.61 -2.21 0.00 0.00 174.62 172.41 1nud n GLY 60 N 1.16 -2.09 0.00 6.08 0.00 -1.26 -3.84 105.19 105.24 1nud n GLY 60 Ca -0.21 -1.36 0.07 0.00 0.00 0.00 0.00 46.02 44.53 1nud n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nud n PRO 61 N -3.03 0.12 -2.93 1.61 -0.04 -1.26 -3.94 135.00 125.54 1nud n PRO 61 Ca -0.01 0.19 -0.13 0.00 -0.04 0.00 0.00 63.50 63.50 1nud n PRO 61 Cb 0.26 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.22 1nud n PRO 61 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1nud n TYR 62 N -1.38 0.19 -1.28 0.54 4.01 -1.26 -5.04 117.16 112.94 1nud n TYR 62 Ca 0.06 -3.22 -0.58 0.00 -0.16 0.00 0.00 57.90 54.00 1nud n TYR 62 Cb 0.14 -0.16 -0.11 0.00 -0.31 0.00 0.00 39.34 38.91 1nud n TYR 62 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1nud n PRO 63 N 0.11 0.16 -4.80 -0.72 -0.02 -1.25 -4.89 135.00 123.59 1nud n PRO 63 Ca 0.16 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.36 1nud n PRO 63 Cb 0.73 -1.64 -0.17 0.00 -0.02 0.00 0.00 33.50 32.41 1nud n PRO 63 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nud s SER 64 N 6.23 3.05 0.12 2.55 0.15 -1.26 -4.75 113.70 119.80 1nud s SER 64 Ca 1.19 -0.58 -0.18 0.00 0.70 0.00 0.00 55.95 57.08 1nud s SER 64 Cb -1.40 -1.41 -0.03 0.00 -1.71 0.00 0.00 66.02 61.46 1nud s SER 64 CO 0.63 0.10 1.69 1.05 1.20 0.00 0.00 173.24 177.91 1nud h GLU 65 N 7.17 0.47 0.00 5.44 9.09 -1.91 -1.16 114.58 133.68 1nud h GLU 65 Ca -0.29 -0.07 0.00 0.00 0.05 0.00 0.00 59.36 59.05 1nud h GLU 65 Cb 1.20 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 1nud h GLU 65 CO 0.53 0.44 0.00 -1.13 0.05 0.00 0.00 179.01 178.90 1nud n SER 66 N -4.75 0.00 -1.05 3.06 3.41 -1.26 -1.90 113.62 111.13 1nud n SER 66 Ca -0.01 0.37 0.10 0.00 -0.26 0.00 0.00 58.87 59.07 1nud n SER 66 Cb 0.11 -0.44 0.21 0.00 -0.26 0.00 0.00 64.21 63.83 1nud n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nud n ALA 67 N -1.44 2.38 -0.99 7.33 0.00 -0.94 -4.93 120.51 121.91 1nud n ALA 67 Ca 0.06 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.45 1nud n ALA 67 Cb 0.20 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1nud n ALA 67 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nud n MET 68 N 1.30 -1.48 0.00 0.00 2.81 -0.80 -4.76 117.12 114.19 1nud n MET 68 Ca 0.18 0.37 0.14 0.00 -1.81 0.00 0.00 57.70 56.58 1nud n MET 68 Cb 0.55 -4.52 0.48 0.00 -0.71 0.00 0.00 33.22 29.02 1nud n MET 68 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1nud n THR 69 N -2.22 0.00 -3.79 2.03 -2.24 -0.51 -4.50 114.28 103.05 1nud n THR 69 Ca 0.00 -0.21 -0.13 0.00 -2.27 0.00 0.00 64.05 61.44 1nud n THR 69 Cb 0.37 0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 68.97 1nud n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1nud s LYS 70 N -2.15 0.46 -0.12 -0.78 2.20 -0.78 -0.56 119.74 118.01 1nud s LYS 70 Ca 0.34 0.07 -0.11 0.00 -0.36 0.00 0.00 55.97 55.90 1nud s LYS 70 Cb 0.20 0.21 0.03 0.00 -1.51 0.00 0.00 37.83 36.77 1nud s LYS 70 CO 0.39 -0.10 0.32 0.00 -0.36 0.00 0.00 175.35 175.60 1nud s ALA 71 N -0.59 -0.80 -0.20 3.13 0.00 0.41 -4.10 121.76 119.61 1nud s ALA 71 Ca -0.07 0.92 -0.01 0.00 0.00 0.00 0.00 51.96 52.81 1nud s ALA 71 Cb -0.04 -0.54 0.05 0.00 0.00 0.00 0.00 23.12 22.59 1nud s ALA 71 CO 0.02 -0.16 -0.03 0.08 0.00 0.00 0.00 175.76 175.68 1nud s VAL 72 N 0.22 1.11 -0.01 0.00 1.01 -1.26 -0.83 120.40 120.65 1nud s VAL 72 Ca -0.00 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.18 1nud s VAL 72 Cb -0.03 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1nud s VAL 72 CO -0.00 -0.06 -0.15 0.72 0.00 0.00 0.00 175.10 175.61 1nud s PHE 73 N 1.60 1.30 0.60 5.22 -0.71 0.19 -4.92 117.98 121.27 1nud s PHE 73 Ca -0.02 -0.25 -0.14 0.00 -1.04 0.00 0.00 56.93 55.48 1nud s PHE 73 Cb -0.17 -0.83 -0.04 0.00 -1.21 0.00 0.00 43.02 40.76 1nud s PHE 73 CO -0.07 -0.02 1.03 -2.14 -1.34 0.00 0.00 175.22 172.68 1nud s PRO 74 N -0.40 3.49 -0.46 1.99 0.02 -1.26 0.38 135.00 138.76 1nud s PRO 74 Ca 0.05 0.96 -0.24 0.00 0.02 0.00 0.00 61.00 61.80 1nud s PRO 74 Cb -0.06 -2.07 0.03 0.00 0.02 0.00 0.00 34.50 32.42 1nud s PRO 74 CO -0.00 -0.65 0.83 -1.17 -0.33 0.00 0.00 177.00 175.68 1nud s LEU 75 N -4.78 4.18 0.00 -5.54 2.96 -0.68 -3.68 118.68 111.14 1nud s LEU 75 Ca 0.59 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.42 1nud s LEU 75 Cb -0.12 -3.01 0.00 0.00 0.50 0.00 0.00 46.19 43.55 1nud s LEU 75 CO 0.44 -0.98 0.00 -1.20 -1.32 0.00 0.00 176.35 173.29 1nud n SER 76 N 6.90 1.24 -0.03 3.68 7.64 -0.43 -4.84 113.62 127.77 1nud n SER 76 Ca 0.03 -0.95 0.01 0.00 1.01 0.00 0.00 58.87 58.98 1nud n SER 76 Cb 0.48 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.57 1nud n SER 76 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1nud n ASN 77 N -1.67 1.64 -0.96 6.43 3.02 -1.26 -0.21 115.26 122.26 1nud n ASN 77 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1nud n ASN 77 Cb 0.00 1.31 0.00 0.00 -0.61 0.00 0.00 39.78 40.48 1nud n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nud n GLY 78 N 1.88 2.75 3.15 7.41 0.00 -1.26 -4.80 105.19 114.32 1nud n GLY 78 Ca -0.11 -2.09 -0.18 0.00 0.00 0.00 0.00 46.02 43.64 1nud n GLY 78 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nud s SER 79 N -0.79 1.59 -0.06 1.61 0.15 -1.26 -4.66 113.70 110.27 1nud s SER 79 Ca 0.00 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.14 1nud s SER 79 Cb 0.00 -0.06 -0.00 0.00 -1.71 0.00 0.00 66.02 64.25 1nud s SER 79 CO 0.00 -0.05 -0.18 -0.44 1.20 0.00 0.00 173.24 173.77 1nud s SER 80 N -1.51 2.36 0.46 5.45 0.01 -1.26 -5.11 113.70 114.10 1nud s SER 80 Ca -0.01 -0.40 -0.21 0.00 1.31 0.00 0.00 55.95 56.64 1nud s SER 80 Cb -0.09 -0.81 -0.12 0.00 0.21 0.00 0.00 66.02 65.20 1nud s SER 80 CO 0.02 0.14 0.42 0.61 0.41 0.00 0.00 173.24 174.84 1nud n GLY 81 N 3.31 -1.81 6.49 3.44 0.00 -1.26 -4.47 105.19 110.90 1nud n GLY 81 Ca -0.19 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1nud n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nud n GLY 82 N 1.92 -0.60 3.77 -0.02 0.00 -1.26 -4.82 105.19 104.17 1nud n GLY 82 Ca 0.11 -1.21 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 1nud n GLY 82 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nud s TRP 83 N 0.00 2.88 -0.19 1.61 0.52 -1.25 -4.08 118.94 118.44 1nud s TRP 83 Ca 0.00 1.43 -0.30 0.00 0.02 0.00 0.00 56.10 57.25 1nud s TRP 83 Cb 0.00 -3.63 0.14 0.00 -1.15 0.00 0.00 33.47 28.83 1nud s TRP 83 CO 0.00 -1.95 1.11 -1.54 0.02 0.00 0.00 176.95 174.59 1nud s SER 84 N -0.76 -0.26 -0.06 2.95 1.04 -0.39 -4.82 113.70 111.41 1nud s SER 84 Ca 0.56 0.23 0.04 0.00 0.48 0.00 0.00 55.95 57.26 1nud s SER 84 Cb -0.37 0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.97 1nud s SER 84 CO 0.48 -0.27 -0.18 0.00 0.98 0.00 0.00 173.24 174.26 1nud s ALA 85 N -1.37 1.60 -0.12 5.32 0.00 -1.24 -0.59 121.76 125.36 1nud s ALA 85 Ca 0.03 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.31 1nud s ALA 85 Cb -0.01 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.55 1nud s ALA 85 CO -0.02 0.25 -0.15 0.08 0.00 0.00 0.00 175.76 175.91 1nud s VAL 86 N 0.22 1.56 -0.80 0.00 1.01 0.52 -1.32 120.40 121.59 1nud s VAL 86 Ca -0.09 -0.66 -0.26 0.00 0.00 0.00 0.00 61.98 60.98 1nud s VAL 86 Cb -0.14 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1nud s VAL 86 CO 0.04 0.45 1.61 -0.22 0.00 0.00 0.00 175.10 176.98 1nud s LEU 87 N 1.15 3.27 0.10 3.92 2.96 0.71 -0.84 118.68 129.95 1nud s LEU 87 Ca -0.03 -0.48 -0.09 0.00 -0.22 0.00 0.00 54.13 53.31 1nud s LEU 87 Cb -0.14 -2.55 -0.18 0.00 0.50 0.00 0.00 46.19 43.81 1nud s LEU 87 CO -0.05 -2.10 1.22 1.56 -1.32 0.00 0.00 176.35 175.67 1nud h GLN 88 N 11.63 0.53 -2.42 1.98 4.20 -1.47 -3.45 115.11 126.11 1nud h GLN 88 Ca -0.10 -0.61 -0.08 0.00 0.06 0.00 0.00 58.65 57.92 1nud h GLN 88 Cb 1.06 0.18 -0.20 0.00 0.30 0.00 0.00 27.48 28.83 1nud h GLN 88 CO 1.28 1.23 -0.01 0.00 -0.67 0.00 0.00 178.83 180.66 1nud s ALA 89 N -3.19 -1.37 -0.15 3.87 0.00 -1.05 -5.03 121.76 114.84 1nud s ALA 89 Ca -0.07 0.99 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1nud s ALA 89 Cb 0.08 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.15 1nud s ALA 89 CO 0.90 -0.32 -0.04 0.45 0.00 0.00 0.00 175.76 176.75 1nud s SER 90 N -1.06 2.60 -0.05 0.00 0.15 -1.26 -0.56 113.70 113.52 1nud s SER 90 Ca -0.11 -0.56 -0.00 0.00 0.70 0.00 0.00 55.95 55.98 1nud s SER 90 Cb -0.02 -0.81 0.03 0.00 -1.71 0.00 0.00 66.02 63.50 1nud s SER 90 CO 0.07 -0.19 -0.01 0.20 1.20 0.00 0.00 173.24 174.51 1nud s ASN 91 N 1.71 0.99 1.46 5.45 0.01 -0.86 -5.04 114.94 118.67 1nud s ASN 91 Ca 0.02 -0.07 0.00 0.00 -0.71 0.00 0.00 52.86 52.10 1nud s ASN 91 Cb -0.15 -0.35 0.00 0.00 0.41 0.00 0.00 41.25 41.16 1nud s ASN 91 CO -0.07 -0.13 0.00 0.61 -1.51 0.00 0.00 177.10 176.00 1nud n GLY 92 N 4.51 3.02 0.97 0.66 0.00 -1.26 -0.99 105.19 112.10 1nud n GLY 92 Ca -0.18 -0.28 0.10 0.00 0.00 0.00 0.00 46.02 45.65 1nud n GLY 92 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nud n ASN 93 N 3.56 3.21 -4.70 1.61 3.02 -1.26 -4.78 115.26 115.92 1nud n ASN 93 Ca 0.00 -1.92 -0.40 0.00 -0.03 0.00 0.00 54.58 52.23 1nud n ASN 93 Cb 0.00 -0.24 -0.05 0.00 -0.61 0.00 0.00 39.78 38.88 1nud n ASN 93 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1nud s THR 94 N -1.24 5.02 -0.20 3.41 2.01 -0.16 0.55 115.64 125.04 1nud s THR 94 Ca 0.33 1.40 -0.06 0.00 0.31 0.00 0.00 61.69 63.67 1nud s THR 94 Cb 0.19 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 1nud s THR 94 CO 0.26 0.20 0.03 -0.76 -0.69 0.00 0.00 174.62 173.65 1nud s LEU 95 N 1.20 3.44 -0.52 4.42 1.43 0.12 -2.02 118.68 126.75 1nud s LEU 95 Ca 0.35 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 53.15 1nud s LEU 95 Cb -0.17 -1.88 0.08 0.00 0.03 0.00 0.00 46.19 44.25 1nud s LEU 95 CO 0.15 0.08 0.59 -0.89 0.23 0.00 0.00 176.35 176.52 1nud s THR 96 N 0.92 4.95 -0.10 5.49 2.01 0.28 -0.61 115.64 128.58 1nud s THR 96 Ca 0.02 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.24 1nud s THR 96 Cb -0.14 -4.32 -0.02 0.00 0.01 0.00 0.00 72.50 68.03 1nud s THR 96 CO 0.02 -0.84 -0.12 -0.63 -0.69 0.00 0.00 174.62 172.35 1nud s ILE 97 N 2.39 3.17 -0.29 1.82 1.01 -0.78 -1.21 121.20 127.30 1nud s ILE 97 Ca 0.11 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 60.02 1nud s ILE 97 Cb -0.22 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 1nud s ILE 97 CO 0.09 0.55 0.14 -0.55 0.00 0.00 0.00 174.94 175.17 1nud s SER 98 N -0.10 5.55 0.04 3.58 0.15 -0.02 -1.40 113.70 121.49 1nud s SER 98 Ca -0.01 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.27 1nud s SER 98 Cb -0.14 -2.01 -0.04 0.00 -1.71 0.00 0.00 66.02 62.13 1nud s SER 98 CO 0.03 -0.14 0.08 -0.63 1.20 0.00 0.00 173.24 173.78 1nud s ILE 99 N 1.64 4.64 -0.00 6.45 1.01 -0.46 -0.36 121.20 134.12 1nud s ILE 99 Ca 0.05 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 1nud s ILE 99 Cb -0.16 -3.18 -0.00 0.00 0.01 0.00 0.00 42.46 39.13 1nud s ILE 99 CO 0.07 0.24 0.02 -0.94 0.00 0.00 0.00 174.94 174.33 1nud s SER 100 N -2.05 0.02 0.37 3.58 1.04 0.24 -1.51 113.70 115.40 1nud s SER 100 Ca 0.26 -0.05 0.08 0.00 0.48 0.00 0.00 55.95 56.71 1nud s SER 100 Cb -0.12 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 1nud s SER 100 CO 0.18 -0.08 0.28 -0.94 0.98 0.00 0.00 173.24 173.67 1nud s SER 101 N -0.30 5.00 0.16 7.02 1.04 -1.26 -1.27 113.70 124.09 1nud s SER 101 Ca -0.03 -0.70 -0.22 0.00 0.48 0.00 0.00 55.95 55.48 1nud s SER 101 Cb -0.02 -0.73 -0.08 0.00 0.10 0.00 0.00 66.02 65.29 1nud s SER 101 CO -0.00 -0.47 0.70 -2.16 0.98 0.00 0.00 173.24 172.29 1nud s PRO 102 N -4.01 4.36 0.26 4.02 0.04 -1.26 -3.19 135.00 135.23 1nud s PRO 102 Ca 0.43 0.94 0.14 0.00 0.04 0.00 0.00 61.00 62.55 1nud s PRO 102 Cb -0.03 -3.13 0.75 0.00 0.04 0.00 0.00 34.50 32.12 1nud s PRO 102 CO 0.26 0.53 1.36 0.00 0.04 0.00 0.00 177.00 179.19 1nud n ALA 103 N 1.34 0.82 -1.06 8.56 0.00 -1.26 -1.24 120.51 127.66 1nud n ALA 103 Ca -0.06 0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.58 1nud n ALA 103 Cb 0.50 -0.99 0.24 0.00 0.00 0.00 0.00 19.45 19.20 1nud n ALA 103 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nud n SER 104 N -2.00 3.57 -4.83 0.00 3.41 -1.26 -4.75 113.62 107.77 1nud n SER 104 Ca -0.01 -3.12 -0.32 0.00 -0.26 0.00 0.00 58.87 55.16 1nud n SER 104 Cb 0.17 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1nud n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nud s ALA 105 N -2.89 2.88 0.32 7.33 0.00 -0.38 -4.83 121.76 124.19 1nud s ALA 105 Ca 0.42 0.21 -0.28 0.00 0.00 0.00 0.00 51.96 52.30 1nud s ALA 105 Cb 0.34 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 20.21 1nud s ALA 105 CO 0.07 -0.69 1.07 -2.14 0.00 0.00 0.00 175.76 174.08 1nud s PRO 106 N -4.40 4.50 0.82 0.00 0.02 -1.26 -4.48 135.00 130.20 1nud s PRO 106 Ca 0.60 1.69 -0.12 0.00 0.02 0.00 0.00 61.00 63.19 1nud s PRO 106 Cb -0.13 -2.99 0.08 0.00 0.02 0.00 0.00 34.50 31.49 1nud s PRO 106 CO 0.41 0.12 1.16 0.96 -0.33 0.00 0.00 177.00 179.31 1nud s ILE 107 N -1.32 2.24 -1.18 2.83 -4.36 -0.41 -4.87 121.20 114.13 1nud s ILE 107 Ca 0.48 0.08 0.00 0.00 -0.26 0.00 0.00 60.65 60.95 1nud s ILE 107 Cb -0.28 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.42 1nud s ILE 107 CO 0.36 -0.10 0.00 0.61 0.24 0.00 0.00 174.94 176.05 1nud n GLY 108 N -2.96 0.51 3.72 6.27 0.00 0.12 -4.89 105.19 107.96 1nud n GLY 108 Ca 0.07 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 1nud n GLY 108 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nud s ARG 109 N -0.59 4.59 0.38 1.61 0.52 -1.26 -0.21 118.95 124.00 1nud s ARG 109 Ca 0.00 1.35 0.08 0.00 -0.52 0.00 0.00 55.73 56.64 1nud s ARG 109 Cb 0.00 -3.42 -0.07 0.00 0.52 0.00 0.00 34.95 31.98 1nud s ARG 109 CO 0.00 0.09 -0.02 0.71 0.02 0.00 0.00 175.30 176.10 1nud s TYR 110 N 0.52 2.45 -0.05 -0.53 1.51 -0.20 -4.23 117.35 116.82 1nud s TYR 110 Ca 0.48 -0.63 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1nud s TYR 110 Cb -0.22 -1.63 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 1nud s TYR 110 CO 0.27 0.46 -0.08 0.99 -1.11 0.00 0.00 175.55 176.09 1nud s THR 111 N -2.71 0.80 -0.14 -0.71 2.01 -0.61 -2.96 115.64 111.32 1nud s THR 111 Ca 0.34 -0.28 -0.01 0.00 0.31 0.00 0.00 61.69 62.05 1nud s THR 111 Cb 0.08 -0.77 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 1nud s THR 111 CO 0.17 0.28 -0.09 -0.32 -0.69 0.00 0.00 174.62 173.97 1nud s MET 112 N 0.79 3.47 0.24 4.92 1.75 0.10 -1.79 119.30 128.77 1nud s MET 112 Ca -0.13 -0.62 0.07 0.00 -1.25 0.00 0.00 55.69 53.76 1nud s MET 112 Cb -0.15 -2.73 -0.05 0.00 2.84 0.00 0.00 34.83 34.74 1nud s MET 112 CO 0.02 0.24 -0.09 0.00 -0.65 0.00 0.00 175.02 174.54 1nud s ALA 113 N 0.31 2.12 -0.04 4.11 0.00 0.20 0.94 121.76 129.40 1nud s ALA 113 Ca -0.08 -1.77 0.05 0.00 0.00 0.00 0.00 51.96 50.17 1nud s ALA 113 Cb -0.15 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1nud s ALA 113 CO 0.05 -0.03 -0.20 -1.17 0.00 0.00 0.00 175.76 174.41 1nud s LEU 114 N -3.36 1.98 -0.21 0.00 2.96 0.44 -0.52 118.68 119.98 1nud s LEU 114 Ca 0.26 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 1nud s LEU 114 Cb 0.02 -1.07 0.01 0.00 0.50 0.00 0.00 46.19 45.64 1nud s LEU 114 CO 0.09 0.20 -0.11 -1.58 -1.32 0.00 0.00 176.35 173.63 1nud s GLN 115 N -0.13 3.17 -0.18 1.98 0.74 0.70 -0.84 119.66 125.11 1nud s GLN 115 Ca -0.01 -0.74 -0.03 0.00 0.05 0.00 0.00 55.36 54.63 1nud s GLN 115 Cb -0.11 -2.83 -0.02 0.00 1.10 0.00 0.00 33.01 31.15 1nud s GLN 115 CO 0.02 -0.22 -0.05 0.42 -0.55 0.00 0.00 175.29 174.90 1nud s ILE 116 N 1.39 3.58 -0.47 -2.34 1.01 -0.06 -0.06 121.20 124.25 1nud s ILE 116 Ca 0.05 -0.45 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 1nud s ILE 116 Cb -0.14 -2.58 0.08 0.00 0.01 0.00 0.00 42.46 39.82 1nud s ILE 116 CO -0.07 0.47 0.39 -0.36 0.00 0.00 0.00 174.94 175.37 1nud s PHE 117 N 0.78 3.25 -0.03 3.97 0.08 0.29 -1.47 117.98 124.86 1nud s PHE 117 Ca -0.02 -0.97 -0.09 0.00 0.12 0.00 0.00 56.93 55.97 1nud s PHE 117 Cb -0.15 -3.19 0.01 0.00 -0.57 0.00 0.00 43.02 39.13 1nud s PHE 117 CO 0.02 -0.81 0.19 0.45 -0.10 0.00 0.00 175.22 174.97 1nud s SER 118 N 2.62 -0.09 -1.07 1.36 0.15 -0.90 -0.97 113.70 114.79 1nud s SER 118 Ca 0.04 0.05 -0.10 0.00 0.70 0.00 0.00 55.95 56.64 1nud s SER 118 Cb -0.24 0.30 0.01 0.00 -1.71 0.00 0.00 66.02 64.38 1nud s SER 118 CO 0.06 -0.29 0.19 0.00 1.20 0.00 0.00 173.24 174.40 1nud n GLN 119 N 1.89 -0.75 0.00 5.44 6.02 -1.26 -0.34 117.38 128.38 1nud n GLN 119 Ca -0.19 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.80 1nud n GLN 119 Cb 0.57 -2.28 0.00 0.00 1.02 0.00 0.00 30.24 29.55 1nud n GLN 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nud n GLY 120 N -2.06 3.00 2.79 1.08 0.00 -1.26 -4.99 105.19 103.75 1nud n GLY 120 Ca -0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 1nud n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nud n GLY 121 N -2.00 2.94 2.74 -0.02 0.00 0.54 -5.14 105.19 104.25 1nud n GLY 121 Ca 0.00 -2.27 -0.17 0.00 0.00 0.00 0.00 46.02 43.58 1nud n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nud s ILE 122 N -2.05 -0.05 0.40 -0.61 1.01 -1.26 -2.12 121.20 116.51 1nud s ILE 122 Ca 0.20 0.28 0.06 0.00 0.00 0.00 0.00 60.65 61.19 1nud s ILE 122 Cb -0.02 -0.13 -0.07 0.00 0.01 0.00 0.00 42.46 42.26 1nud s ILE 122 CO 0.13 0.13 0.02 -0.94 0.00 0.00 0.00 174.94 174.28 1nud s SER 123 N 1.45 3.53 -0.04 3.58 1.04 -0.54 -4.96 113.70 117.76 1nud s SER 123 Ca -0.04 -1.40 -0.09 0.00 0.48 0.00 0.00 55.95 54.90 1nud s SER 123 Cb -0.13 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 65.77 1nud s SER 123 CO -0.03 -0.53 0.21 -0.44 0.98 0.00 0.00 173.24 173.43 1nud s SER 124 N -3.67 -0.13 -0.14 7.02 0.01 -1.26 -0.88 113.70 114.65 1nud s SER 124 Ca 0.33 0.15 -0.10 0.00 1.31 0.00 0.00 55.95 57.64 1nud s SER 124 Cb 0.09 0.34 0.05 0.00 0.21 0.00 0.00 66.02 66.71 1nud s SER 124 CO 0.16 -0.25 0.36 0.54 0.41 0.00 0.00 173.24 174.46 1nud s VAL 125 N -0.68 -0.02 0.14 3.43 0.11 -0.02 -4.97 120.40 118.39 1nud s VAL 125 Ca -0.08 0.06 -0.31 0.00 -2.93 0.00 0.00 61.98 58.73 1nud s VAL 125 Cb -0.04 -0.52 -0.08 0.00 -1.53 0.00 0.00 36.38 34.20 1nud s VAL 125 CO 0.01 0.02 1.32 -0.75 -3.33 0.00 0.00 175.10 172.38 1nud s LYS 126 N 0.82 4.37 -0.19 1.54 2.20 -1.26 -0.42 119.74 126.80 1nud s LYS 126 Ca -0.05 2.01 0.16 0.00 -0.36 0.00 0.00 55.97 57.73 1nud s LYS 126 Cb -0.06 -3.25 -0.24 0.00 -1.51 0.00 0.00 37.83 32.77 1nud s LYS 126 CO -0.06 -0.33 0.12 1.28 -0.36 0.00 0.00 175.35 176.00 1nud n LEU 127 N 3.44 0.27 0.00 5.43 4.77 0.27 -4.89 117.00 126.29 1nud n LEU 127 Ca 0.09 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1nud n LEU 127 Cb 0.43 0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1nud n LEU 127 CO 0.58 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.76 1nud n GLY 128 N 1.76 -0.64 3.03 -0.72 0.00 -0.86 -4.98 105.19 102.78 1nud n GLY 128 Ca -0.32 -1.32 -0.08 0.00 0.00 0.00 0.00 46.02 44.30 1nud n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nud s THR 129 N -2.89 0.17 0.06 2.61 -4.23 -1.26 0.01 115.64 110.10 1nud s THR 129 Ca 0.00 -1.28 -0.16 0.00 -1.18 0.00 0.00 61.69 59.07 1nud s THR 129 Cb 0.00 -0.78 0.03 0.00 1.34 0.00 0.00 72.50 73.09 1nud s THR 129 CO 0.00 -0.70 0.38 0.72 -0.54 0.00 0.00 174.62 174.48 1nud s PHE 130 N -2.45 -0.20 -0.12 3.99 -0.71 -1.16 -4.43 117.98 112.90 1nud s PHE 130 Ca -0.07 0.06 -0.08 0.00 -1.04 0.00 0.00 56.93 55.81 1nud s PHE 130 Cb -0.03 0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 41.93 1nud s PHE 130 CO -0.05 -0.58 0.15 0.42 -1.34 0.00 0.00 175.22 173.82 1nud s ILE 131 N -2.85 5.48 -0.11 -4.49 1.01 0.14 -1.04 121.20 119.35 1nud s ILE 131 Ca -0.03 0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.88 1nud s ILE 131 Cb 0.00 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.04 1nud s ILE 131 CO -0.05 0.60 -0.18 -0.22 0.00 0.00 0.00 174.94 175.09 1nud s LEU 132 N -0.91 2.44 0.45 2.97 2.96 0.71 -0.62 118.68 126.68 1nud s LEU 132 Ca 0.15 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.67 1nud s LEU 132 Cb -0.12 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 1nud s LEU 132 CO 0.04 0.18 0.04 -0.76 -1.32 0.00 0.00 176.35 174.53 1nud s LEU 133 N 0.22 2.29 0.65 -0.68 1.43 0.21 0.12 118.68 122.92 1nud s LEU 133 Ca -0.12 -1.59 -0.14 0.00 -1.03 0.00 0.00 54.13 51.25 1nud s LEU 133 Cb -0.16 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.49 1nud s LEU 133 CO 0.06 -0.79 1.08 -0.36 0.23 0.00 0.00 176.35 176.57 1nud s PHE 134 N -2.97 2.82 -0.59 0.29 0.08 -0.68 -0.66 117.98 116.26 1nud s PHE 134 Ca 0.17 1.52 0.04 0.00 0.12 0.00 0.00 56.93 58.79 1nud s PHE 134 Cb 0.04 -3.06 0.16 0.00 -0.57 0.00 0.00 43.02 39.59 1nud s PHE 134 CO 0.09 -1.41 0.41 1.21 -0.10 0.00 0.00 175.22 175.41 1nud s ASN 135 N -2.86 3.88 0.11 1.36 3.84 -1.26 -4.65 114.94 115.35 1nud s ASN 135 Ca 0.64 -3.45 0.07 0.00 0.21 0.00 0.00 52.86 50.33 1nud s ASN 135 Cb -0.18 -1.29 0.37 0.00 -0.55 0.00 0.00 41.25 39.60 1nud s ASN 135 CO 0.42 -0.14 1.19 -2.65 -2.79 0.00 0.00 177.10 173.13 1nud n PRO 136 N 2.47 0.04 0.08 0.43 -0.02 -1.26 -0.79 135.00 135.95 1nud n PRO 136 Ca 0.19 0.53 0.02 0.00 -2.02 0.00 0.00 63.50 62.22 1nud n PRO 136 Cb 0.37 -1.67 -0.04 0.00 -0.02 0.00 0.00 33.50 32.15 1nud n PRO 136 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1nud h TRP 137 N 0.00 0.00 -3.48 6.00 6.55 -1.89 -0.74 115.95 122.39 1nud h TRP 137 Ca 0.00 0.00 -0.59 0.00 0.95 0.00 0.00 58.89 59.25 1nud h TRP 137 Cb 0.06 0.00 -0.09 0.00 -0.86 0.00 0.00 29.16 28.27 1nud h TRP 137 CO 0.00 0.47 0.66 -1.17 -1.05 0.00 0.00 178.44 177.35 1nud s LEU 138 N -5.93 3.96 0.66 -4.49 0.20 0.03 -4.93 118.68 108.20 1nud s LEU 138 Ca -0.00 0.63 0.28 0.00 0.69 0.00 0.00 54.13 55.73 1nud s LEU 138 Cb 0.08 -3.32 1.52 0.00 -0.43 0.00 0.00 46.19 44.04 1nud s LEU 138 CO 0.79 -0.89 1.86 -0.55 -0.29 0.00 0.00 176.35 177.27 1nud h ASN 139 N 8.48 0.00 -0.32 3.68 7.08 -1.87 -0.25 115.58 132.38 1nud h ASN 139 Ca -0.23 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.99 1nud h ASN 139 Cb 1.07 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.31 1nud h ASN 139 CO 1.00 0.00 0.00 1.33 -2.08 0.00 0.00 177.43 177.68 1nud n VAL 140 N -2.92 0.49 -2.10 6.14 0.24 -1.26 -4.89 118.33 114.03 1nud n VAL 140 Ca -0.01 -0.74 -0.30 0.00 -2.04 0.00 0.00 64.34 61.25 1nud n VAL 140 Cb 0.44 0.97 0.01 0.00 -1.47 0.00 0.00 33.84 33.79 1nud n VAL 140 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1nud s ASP 141 N -1.34 6.15 0.32 -1.34 2.15 -0.11 -4.92 116.67 117.59 1nud s ASP 141 Ca 0.32 1.24 0.06 0.00 0.43 0.00 0.00 52.55 54.60 1nud s ASP 141 Cb 0.19 -2.34 0.55 0.00 -0.30 0.00 0.00 42.92 41.02 1nud s ASP 141 CO 0.26 -0.84 1.78 0.28 -0.17 0.00 0.00 175.17 176.49 1nud h SER 142 N -0.19 0.33 -0.28 -0.34 0.02 -1.88 -3.01 113.55 108.21 1nud h SER 142 Ca -0.45 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 1nud h SER 142 Cb 1.20 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1nud h SER 142 CO 0.62 0.59 0.00 1.33 -1.14 0.00 0.00 176.83 178.22 1nud n VAL 143 N -4.15 0.37 -1.55 2.27 0.24 -1.26 -1.61 118.33 112.64 1nud n VAL 143 Ca -0.01 -0.47 -0.52 0.00 -2.04 0.00 0.00 64.34 61.31 1nud n VAL 143 Cb 0.37 0.42 -0.05 0.00 -1.47 0.00 0.00 33.84 33.11 1nud n VAL 143 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1nud n PHE 144 N 0.61 1.06 -3.68 6.34 7.35 -1.14 -4.48 117.46 123.53 1nud n PHE 144 Ca 0.16 0.77 -0.28 0.00 -0.76 0.00 0.00 57.45 57.34 1nud n PHE 144 Cb 0.37 -2.23 -0.16 0.00 0.35 0.00 0.00 39.48 37.82 1nud n PHE 144 CO 0.00 0.00 0.00 1.41 -0.76 0.00 0.00 176.76 177.41 1nud s MET 145 N -0.16 0.48 0.20 -4.13 -2.45 -0.28 -4.92 119.30 108.04 1nud s MET 145 Ca 0.79 -0.51 -0.11 0.00 -1.25 0.00 0.00 55.69 54.61 1nud s MET 145 Cb -0.97 -1.87 0.13 0.00 1.25 0.00 0.00 34.83 33.37 1nud s MET 145 CO 0.52 -0.78 1.82 0.78 1.05 0.00 0.00 175.02 178.42 1nud h GLY 146 N 8.27 1.04 -4.94 2.11 0.00 -1.94 -3.44 103.07 104.17 1nud h GLY 146 Ca -0.16 -0.46 -0.55 0.00 0.00 0.00 0.00 47.33 46.17 1nud h GLY 146 CO 0.37 0.44 0.88 0.21 0.00 0.00 0.00 176.54 178.44 1nud s ASN 147 N -5.99 6.82 0.08 0.19 3.84 -1.26 -4.97 114.94 113.66 1nud s ASN 147 Ca -0.13 2.11 -0.32 0.00 0.21 0.00 0.00 52.86 54.73 1nud s ASN 147 Cb 0.14 -2.55 -0.17 0.00 -0.55 0.00 0.00 41.25 38.12 1nud s ASN 147 CO 0.79 -0.76 1.62 -0.74 -2.79 0.00 0.00 177.10 175.22 1nud h HIS 148 N 8.11 -0.91 -0.81 0.43 -0.00 -2.00 -1.28 115.15 118.70 1nud h HIS 148 Ca -0.37 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 60.09 1nud h HIS 148 Cb 1.17 0.32 -0.06 0.00 -0.00 0.00 0.00 27.41 28.85 1nud h HIS 148 CO 0.77 -0.52 0.53 0.00 -0.00 0.00 0.00 177.93 178.71 1nud h ALA 149 N -0.48 1.77 0.07 5.26 0.00 -1.99 -1.65 119.26 122.24 1nud h ALA 149 Ca -0.07 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nud h ALA 149 Cb 0.70 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1nud h ALA 149 CO 0.07 0.05 -0.03 0.93 0.00 0.00 0.00 179.25 180.27 1nud h GLU 150 N 0.73 -0.09 -0.80 0.00 5.08 -1.94 -2.78 114.58 114.78 1nud h GLU 150 Ca 0.38 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.81 1nud h GLU 150 Cb 0.49 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1nud h GLU 150 CO -0.15 0.39 0.47 -0.09 -1.00 0.00 0.00 179.01 178.63 1nud h ARG 151 N -0.62 0.83 -0.81 2.33 2.43 -0.94 0.18 114.38 117.77 1nud h ARG 151 Ca -0.01 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1nud h ARG 151 Cb 0.52 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1nud h ARG 151 CO 0.02 0.55 0.54 0.93 -1.51 0.00 0.00 179.97 180.49 1nud h GLU 152 N 0.85 1.04 0.03 0.20 4.39 -1.36 0.22 114.58 119.94 1nud h GLU 152 Ca 0.36 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 1nud h GLU 152 Cb 0.21 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1nud h GLU 152 CO -0.19 0.69 -0.01 1.49 -1.16 0.00 0.00 179.01 179.82 1nud h GLU 153 N 1.07 -0.04 -0.22 2.33 4.57 -0.85 0.19 114.58 121.62 1nud h GLU 153 Ca 0.30 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1nud h GLU 153 Cb -0.08 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1nud h GLU 153 CO -0.07 0.53 0.00 0.66 -1.18 0.00 0.00 179.01 178.95 1nud n TYR 154 N -4.82 0.29 0.00 0.92 4.01 0.48 -3.83 117.16 114.21 1nud n TYR 154 Ca -0.09 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 1nud n TYR 154 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1nud n TYR 154 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1nud n VAL 155 N 0.23 0.00 0.14 -0.72 0.31 0.74 -1.25 118.33 117.77 1nud n VAL 155 Ca 0.12 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.56 1nud n VAL 155 Cb 0.25 -0.31 -0.01 0.00 -0.91 0.00 0.00 33.84 32.86 1nud n VAL 155 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nud n GLN 156 N -2.11 0.58 -2.64 5.55 1.13 -0.92 -4.75 117.38 114.22 1nud n GLN 156 Ca 0.00 0.07 -0.43 0.00 -1.94 0.00 0.00 57.00 54.70 1nud n GLN 156 Cb 0.01 -1.77 -0.02 0.00 0.11 0.00 0.00 30.24 28.57 1nud n GLN 156 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1nud s GLU 157 N -3.37 4.35 0.00 -1.09 2.56 0.01 -4.91 118.70 116.24 1nud s GLU 157 Ca -0.01 1.42 0.21 0.00 0.00 0.00 0.00 54.97 56.59 1nud s GLU 157 Cb 0.11 -3.59 0.56 0.00 2.00 0.00 0.00 34.13 33.21 1nud s GLU 157 CO 0.80 -0.46 1.47 -0.40 -0.56 0.00 0.00 175.26 176.11 1nud n ASP 158 N 5.58 3.72 -4.19 -1.70 5.75 -1.26 -4.91 116.55 119.53 1nud n ASP 158 Ca 0.10 -1.99 -0.26 0.00 -0.01 0.00 0.00 54.79 52.63 1nud n ASP 158 Cb 0.47 -0.42 -0.15 0.00 -1.03 0.00 0.00 41.12 39.99 1nud n ASP 158 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nud s ALA 159 N -1.05 1.59 0.32 2.12 0.00 -1.26 -2.00 121.76 121.48 1nud s ALA 159 Ca 0.43 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.61 1nud s ALA 159 Cb 0.23 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 1nud s ALA 159 CO 0.30 0.39 0.20 0.20 0.00 0.00 0.00 175.76 176.85 1nud s GLY 160 N -0.45 2.20 -0.06 0.00 0.00 0.04 -4.92 107.32 104.13 1nud s GLY 160 Ca 0.07 -1.79 -0.00 0.00 0.00 0.00 0.00 44.72 43.00 1nud s GLY 160 CO -0.01 -1.56 -0.02 -0.42 0.00 0.00 0.00 173.10 171.09 1nud s ILE 161 N -3.53 0.47 -0.18 0.90 -1.09 -1.26 -2.24 121.20 114.27 1nud s ILE 161 Ca 0.36 -0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.78 1nud s ILE 161 Cb 0.04 -0.57 0.01 0.00 -1.58 0.00 0.00 42.46 40.36 1nud s ILE 161 CO 0.21 0.25 -0.17 -0.63 -1.23 0.00 0.00 174.94 173.37 1nud s ILE 162 N 1.49 2.36 0.27 2.92 1.01 -0.80 -4.25 121.20 124.20 1nud s ILE 162 Ca -0.02 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.49 1nud s ILE 162 Cb -0.13 -2.00 -0.09 0.00 0.01 0.00 0.00 42.46 40.24 1nud s ILE 162 CO -0.03 0.52 0.97 -0.36 0.00 0.00 0.00 174.94 176.04 1nud s PHE 163 N 1.25 3.84 0.08 3.97 0.40 -1.26 -1.26 117.98 125.00 1nud s PHE 163 Ca 0.03 1.85 0.01 0.00 -0.60 0.00 0.00 56.93 58.23 1nud s PHE 163 Cb -0.14 -3.03 -0.00 0.00 0.51 0.00 0.00 43.02 40.36 1nud s PHE 163 CO -0.09 0.20 0.08 1.33 0.70 0.00 0.00 175.22 177.43 1nud n VAL 164 N 1.24 0.00 0.00 -0.44 0.24 0.35 -4.80 118.33 114.91 1nud n VAL 164 Ca -0.01 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 1nud n VAL 164 Cb 0.47 0.28 0.00 0.00 -1.47 0.00 0.00 33.84 33.12 1nud n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1nud n GLY 165 N -0.14 0.72 3.33 7.63 0.00 -1.26 0.71 105.19 116.16 1nud n GLY 165 Ca 0.01 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 1nud n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nud s SER 166 N -4.00 0.08 0.33 1.61 1.04 -0.54 -4.46 113.70 107.76 1nud s SER 166 Ca 0.00 -1.13 0.21 0.00 0.48 0.00 0.00 55.95 55.51 1nud s SER 166 Cb 0.00 0.44 1.15 0.00 0.10 0.00 0.00 66.02 67.71 1nud s SER 166 CO 0.00 -0.92 1.64 0.35 0.98 0.00 0.00 173.24 175.29 1nud n THR 167 N -0.26 0.97 0.92 2.02 -2.24 -1.26 -0.05 114.28 114.38 1nud n THR 167 Ca -0.02 0.75 0.11 0.00 -2.27 0.00 0.00 64.05 62.62 1nud n THR 167 Cb 0.64 -1.75 0.07 0.00 -2.10 0.00 0.00 70.33 67.19 1nud n THR 167 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1nud n ASN 168 N -2.25 0.71 -3.15 3.42 5.03 -1.26 -4.84 115.26 112.91 1nud n ASN 168 Ca -0.01 -0.53 0.05 0.00 0.87 0.00 0.00 54.58 54.96 1nud n ASN 168 Cb 0.06 0.64 -0.01 0.00 -1.02 0.00 0.00 39.78 39.45 1nud n ASN 168 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1nud s ARG 169 N -3.04 0.30 -0.05 3.52 3.52 0.93 -5.15 118.95 118.99 1nud s ARG 169 Ca 0.09 0.47 -0.19 0.00 -0.13 0.00 0.00 55.73 55.96 1nud s ARG 169 Cb 0.16 0.25 -0.05 0.00 -1.56 0.00 0.00 34.95 33.76 1nud s ARG 169 CO 0.78 -0.40 0.55 0.42 -0.81 0.00 0.00 175.30 175.84 1nud s ILE 170 N 2.92 5.03 0.09 4.11 1.01 -1.20 -1.47 121.20 131.68 1nud s ILE 170 Ca 0.10 1.13 0.00 0.00 0.00 0.00 0.00 60.65 61.88 1nud s ILE 170 Cb -0.10 -3.88 -0.00 0.00 0.01 0.00 0.00 42.46 38.49 1nud s ILE 170 CO -0.17 0.39 0.01 0.61 0.00 0.00 0.00 174.94 175.78 1nud n GLY 171 N 2.73 4.02 3.33 6.18 0.00 0.22 -4.96 105.19 116.71 1nud n GLY 171 Ca -0.07 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.71 1nud n GLY 171 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1nud s MET 172 N -2.32 0.91 0.01 1.61 0.23 -1.26 -0.49 119.30 117.98 1nud s MET 172 Ca 0.02 -0.29 0.02 0.00 -1.03 0.00 0.00 55.69 54.41 1nud s MET 172 Cb 0.00 0.41 -0.01 0.00 -1.53 0.00 0.00 34.83 33.70 1nud s MET 172 CO 0.01 -0.30 -0.07 0.96 -2.03 0.00 0.00 175.02 173.59 1nud s ILE 173 N -2.23 0.51 0.43 3.16 -4.36 -0.38 -4.89 121.20 113.42 1nud s ILE 173 Ca -0.07 -0.53 -0.21 0.00 -0.26 0.00 0.00 60.65 59.58 1nud s ILE 173 Cb -0.01 -0.48 -0.11 0.00 1.25 0.00 0.00 42.46 43.11 1nud s ILE 173 CO -0.01 -0.03 0.96 -0.83 0.24 0.00 0.00 174.94 175.27 1nud s GLY 174 N -0.61 2.44 -0.05 6.27 0.00 -1.26 -1.90 107.32 112.20 1nud s GLY 174 Ca -0.01 0.43 -0.02 0.00 0.00 0.00 0.00 44.72 45.12 1nud s GLY 174 CO 0.00 0.73 0.11 0.86 0.00 0.00 0.00 173.10 174.81 1nud s TRP 175 N -2.11 -0.11 -0.54 1.90 -0.11 -0.95 -4.84 118.94 112.19 1nud s TRP 175 Ca 0.61 0.40 -0.21 0.00 1.22 0.00 0.00 56.10 58.12 1nud s TRP 175 Cb -0.11 -0.16 0.05 0.00 -1.50 0.00 0.00 33.47 31.76 1nud s TRP 175 CO 0.15 -0.16 0.77 1.21 -4.62 0.00 0.00 176.95 174.29 1nud s ASN 176 N 1.31 6.26 0.14 5.86 2.47 0.15 -0.78 114.94 130.35 1nud s ASN 176 Ca -0.07 -0.74 -0.11 0.00 0.42 0.00 0.00 52.86 52.36 1nud s ASN 176 Cb -0.12 -2.35 -0.06 0.00 -1.45 0.00 0.00 41.25 37.27 1nud s ASN 176 CO -0.05 -1.06 1.46 -0.26 -3.72 0.00 0.00 177.10 173.46 1nud h PHE 177 N 9.16 1.12 -5.98 0.43 0.05 -1.72 0.93 116.94 120.92 1nud h PHE 177 Ca -0.27 -0.35 -0.42 0.00 3.82 0.00 0.00 57.97 60.74 1nud h PHE 177 Cb 1.09 -0.23 -0.15 0.00 2.00 0.00 0.00 35.95 38.66 1nud h PHE 177 CO 0.83 1.18 -0.63 0.41 -0.18 0.00 0.00 178.31 179.93 1nud n GLY 178 N 0.19 -0.47 0.33 -1.45 0.00 -1.06 -4.40 105.19 98.34 1nud n GLY 178 Ca -0.03 0.09 0.22 0.00 0.00 0.00 0.00 46.02 46.31 1nud n GLY 178 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1nud h GLN 179 N -1.02 0.00 -0.02 1.61 -0.00 -1.87 -1.95 115.11 111.86 1nud h GLN 179 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1nud h GLN 179 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.78 1nud h GLN 179 CO 0.60 0.00 -0.26 1.19 -0.00 0.00 0.00 178.83 180.36 1nud n PHE 180 N -3.09 0.00 -1.45 0.06 3.72 -1.26 -4.20 117.46 111.24 1nud n PHE 180 Ca -0.03 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 1nud n PHE 180 Cb 0.09 -0.02 0.08 0.00 -0.94 0.00 0.00 39.48 38.70 1nud n PHE 180 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1nud s GLU 181 N -2.30 2.40 0.23 -1.08 0.41 -0.73 -2.06 118.70 115.57 1nud s GLU 181 Ca 0.24 0.93 -0.32 0.00 -0.41 0.00 0.00 54.97 55.41 1nud s GLU 181 Cb 0.19 -1.93 -0.13 0.00 -1.78 0.00 0.00 34.13 30.48 1nud s GLU 181 CO 0.46 -1.47 1.59 0.39 -0.49 0.00 0.00 175.26 175.74 1nud n GLU 182 N -3.38 2.49 -0.29 1.61 1.02 -1.26 -2.48 120.64 118.36 1nud n GLU 182 Ca 0.08 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 1nud n GLU 182 Cb 0.54 -2.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 1nud n GLU 182 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1nud n ASP 183 N 2.92 0.00 -0.09 1.62 4.64 -1.26 -4.87 116.55 119.50 1nud n ASP 183 Ca 0.13 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.42 1nud n ASP 183 Cb 0.34 -0.60 -0.04 0.00 -1.04 0.00 0.00 41.12 39.77 1nud n ASP 183 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 1nud h ILE 184 N 0.00 1.30 -0.57 5.18 1.08 -1.80 0.20 117.51 122.91 1nud h ILE 184 Ca 0.00 -1.23 -0.10 0.00 -0.39 0.00 0.00 64.86 63.14 1nud h ILE 184 Cb 0.00 1.53 -0.02 0.00 -3.07 0.00 0.00 36.82 35.26 1nud h ILE 184 CO 0.00 0.39 -0.04 0.25 -0.69 0.00 0.00 178.15 178.05 1nud h LEU 185 N 0.30 1.00 -0.10 1.44 5.85 -1.76 -2.04 115.31 120.00 1nud h LEU 185 Ca 0.06 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1nud h LEU 185 Cb 0.65 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 1nud h LEU 185 CO 0.04 1.07 0.05 -1.28 -0.34 0.00 0.00 178.44 177.98 1nud h SER 186 N 0.92 0.13 -0.48 1.25 0.87 -1.92 -0.44 113.55 113.88 1nud h SER 186 Ca 0.16 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1nud h SER 186 Cb 0.59 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 1nud h SER 186 CO 0.04 0.22 0.31 0.40 -0.53 0.00 0.00 176.83 177.27 1nud h ILE 187 N 0.04 1.11 0.41 2.23 2.04 -0.87 0.20 117.51 122.67 1nud h ILE 187 Ca 0.04 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1nud h ILE 187 Cb 0.12 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1nud h ILE 187 CO -0.00 0.12 -0.23 0.00 0.00 0.00 0.00 178.15 178.03 1nud h LEU 189 N -0.60 0.43 -0.22 0.00 3.38 -0.58 0.44 115.31 118.16 1nud h LEU 189 Ca -0.05 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1nud h LEU 189 Cb 0.48 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1nud h LEU 189 CO 0.07 0.09 0.00 -1.54 0.09 0.00 0.00 178.44 177.15 1nud n SER 190 N -4.60 0.70 -0.04 -0.43 3.41 0.67 -3.26 113.62 110.06 1nud n SER 190 Ca 0.25 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 59.34 1nud n SER 190 Cb 0.88 -0.77 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 1nud n SER 190 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1nud h ILE 191 N 0.00 1.23 -0.18 -1.33 2.04 0.12 -2.42 117.51 116.98 1nud h ILE 191 Ca 0.00 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.15 1nud h ILE 191 Cb 0.59 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1nud h ILE 191 CO 0.00 0.22 0.32 -0.07 0.00 0.00 0.00 178.15 178.63 1nud h LEU 192 N -0.01 0.00 -1.41 1.44 3.38 -1.58 0.66 115.31 117.80 1nud h LEU 192 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1nud h LEU 192 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1nud h LEU 192 CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 1nud n ASP 193 N -3.38 2.13 -0.00 -0.43 8.00 -0.92 -3.94 116.55 118.01 1nud n ASP 193 Ca 0.02 -1.76 0.01 0.00 0.71 0.00 0.00 54.79 53.78 1nud n ASP 193 Cb 0.43 -0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.41 1nud n ASP 193 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1nud n ARG 194 N 0.63 4.01 -0.67 -1.24 5.12 0.22 -4.86 116.66 119.88 1nud n ARG 194 Ca 0.17 -0.01 -0.31 0.00 -1.93 0.00 0.00 57.85 55.77 1nud n ARG 194 Cb 0.42 -0.78 0.17 0.00 -1.16 0.00 0.00 32.46 31.11 1nud n ARG 194 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1nud n SER 195 N -1.25 -0.67 0.08 0.55 3.41 -0.83 -4.84 113.62 110.07 1nud n SER 195 Ca 0.00 0.28 -0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1nud n SER 195 Cb 0.06 -1.36 0.30 0.00 -0.26 0.00 0.00 64.21 62.95 1nud n SER 195 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1nud h LEU 196 N -1.96 0.31 -0.30 1.04 3.38 -1.94 -2.88 115.31 112.95 1nud h LEU 196 Ca -0.47 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.45 1nud h LEU 196 Cb 1.29 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1nud h LEU 196 CO 0.41 0.54 0.09 0.78 0.09 0.00 0.00 178.44 180.35 1nud h ASN 197 N 0.29 0.09 -0.66 -0.43 4.21 -1.94 0.28 115.58 117.42 1nud h ASN 197 Ca 0.05 0.04 -0.06 0.00 1.21 0.00 0.00 56.30 57.54 1nud h ASN 197 Cb 0.55 0.03 -0.03 0.00 -1.12 0.00 0.00 38.32 37.75 1nud h ASN 197 CO 0.04 0.09 0.19 0.15 -1.29 0.00 0.00 177.43 176.60 1nud h PHE 198 N 0.22 1.08 0.00 1.19 3.04 -1.78 -1.59 116.94 119.10 1nud h PHE 198 Ca 0.14 -0.12 -0.06 0.00 3.98 0.00 0.00 57.97 61.91 1nud h PHE 198 Cb 0.12 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.31 1nud h PHE 198 CO -0.14 0.88 -0.26 0.00 -2.02 0.00 0.00 178.31 176.76 1nud h ARG 199 N 0.97 0.00 0.00 1.11 3.08 -1.25 0.35 114.38 118.64 1nud h ARG 199 Ca 0.21 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.12 1nud h ARG 199 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1nud h ARG 199 CO -0.00 0.26 -0.72 -0.09 -1.07 0.00 0.00 179.97 178.35 1nud h ARG 200 N 0.00 0.00 -0.26 0.04 2.43 -0.48 -3.43 114.38 112.69 1nud h ARG 200 Ca -0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1nud h ARG 200 Cb 0.68 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.08 1nud h ARG 200 CO 0.03 0.58 -0.15 0.34 -1.51 0.00 0.00 179.97 179.27 1nud s ASP 201 N -6.44 -0.37 0.30 -3.80 -1.08 -0.64 -5.04 116.67 99.60 1nud s ASP 201 Ca 0.03 -0.42 0.05 0.00 -0.52 0.00 0.00 52.55 51.68 1nud s ASP 201 Cb 0.08 0.49 0.70 0.00 -1.46 0.00 0.00 42.92 42.73 1nud s ASP 201 CO 0.77 -0.02 1.79 0.00 0.52 0.00 0.00 175.17 178.24 1nud h ALA 202 N 4.37 1.64 0.27 3.66 0.00 -0.53 0.76 119.26 129.43 1nud h ALA 202 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1nud h ALA 202 Cb 1.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1nud h ALA 202 CO -0.10 0.02 -0.13 0.00 0.00 0.00 0.00 179.25 179.03 1nud h ALA 203 N 1.62 -0.37 -0.08 0.00 0.00 -1.94 -0.86 119.26 117.63 1nud h ALA 203 Ca 0.56 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 55.26 1nud h ALA 203 Cb 0.80 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1nud h ALA 203 CO -0.35 -0.71 -0.52 1.15 0.00 0.00 0.00 179.25 178.82 1nud h THR 204 N -0.37 1.36 0.59 0.00 2.02 -1.84 -2.87 112.91 111.80 1nud h THR 204 Ca -0.04 -1.80 -0.03 0.00 0.77 0.00 0.00 66.41 65.32 1nud h THR 204 Cb 0.29 1.88 0.01 0.00 -1.74 0.00 0.00 68.15 68.58 1nud h THR 204 CO 0.06 0.53 -0.28 -0.78 0.37 0.00 0.00 175.52 175.42 1nud h ASP 205 N 0.18 -0.67 -0.34 4.18 3.58 -0.62 -2.06 116.42 120.66 1nud h ASP 205 Ca 0.00 -0.03 0.10 0.00 0.42 0.00 0.00 57.03 57.53 1nud h ASP 205 Cb 0.99 0.17 -0.01 0.00 1.72 0.00 0.00 39.33 42.19 1nud h ASP 205 CO 0.08 -0.37 0.27 0.58 -2.88 0.00 0.00 179.24 176.92 1nud h VAL 206 N -0.96 0.74 0.00 2.25 2.07 -1.20 0.17 116.25 119.32 1nud h VAL 206 Ca -0.08 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 1nud h VAL 206 Cb 0.66 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1nud h VAL 206 CO 0.13 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 177.36 1nud h ALA 207 N 1.79 0.93 -0.01 1.67 0.00 -1.26 -3.03 119.26 119.35 1nud h ALA 207 Ca 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1nud h ALA 207 Cb 0.69 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1nud h ALA 207 CO -0.00 0.45 -0.02 0.43 0.00 0.00 0.00 179.25 180.11 1nud n SER 208 N -3.42 1.02 -0.10 0.00 7.64 0.59 -4.06 113.62 115.29 1nud n SER 208 Ca 0.00 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.61 1nud n SER 208 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1nud n SER 208 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1nud n ARG 209 N -0.25 0.89 -0.10 1.43 1.74 -1.13 -2.20 116.66 117.03 1nud n ARG 209 Ca 0.20 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.39 1nud n ARG 209 Cb 0.29 -1.09 0.16 0.00 -1.02 0.00 0.00 32.46 30.80 1nud n ARG 209 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nud n ASN 210 N -0.39 3.21 -4.05 0.55 0.23 -1.26 -1.29 115.26 112.27 1nud n ASN 210 Ca 0.00 -1.97 -0.31 0.00 -0.53 0.00 0.00 54.58 51.76 1nud n ASN 210 Cb 0.04 -0.14 -0.16 0.00 -2.08 0.00 0.00 39.78 37.45 1nud n ASN 210 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1nud s ASP 211 N -1.67 3.17 0.47 0.53 2.15 -0.94 -4.86 116.67 115.53 1nud s ASP 211 Ca 0.33 -0.73 0.13 0.00 0.43 0.00 0.00 52.55 52.72 1nud s ASP 211 Cb 0.21 -1.31 1.11 0.00 -0.30 0.00 0.00 42.92 42.62 1nud s ASP 211 CO 0.30 -0.08 2.08 1.55 -0.17 0.00 0.00 175.17 178.86 1nud h PRO 212 N 7.97 0.24 -0.31 4.34 0.13 -1.88 -0.64 132.00 141.85 1nud h PRO 212 Ca -0.36 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1nud h PRO 212 Cb 1.12 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 1nud h PRO 212 CO 0.54 0.16 0.20 0.87 -0.23 0.00 0.00 178.00 179.54 1nud h LYS 213 N 0.24 0.41 0.01 0.86 1.57 -1.94 0.32 116.57 118.05 1nud h LYS 213 Ca 0.11 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1nud h LYS 213 Cb 0.13 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1nud h LYS 213 CO -0.02 0.28 -0.01 -0.92 -0.57 0.00 0.00 179.45 178.22 1nud h TYR 214 N 0.41 -0.02 -0.69 -1.35 3.20 -1.59 -1.68 116.97 115.26 1nud h TYR 214 Ca 0.11 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 1nud h TYR 214 Cb -0.03 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 1nud h TYR 214 CO -0.05 0.32 0.42 0.28 -1.64 0.00 0.00 178.16 177.48 1nud h VAL 215 N -0.35 1.19 -0.52 1.81 2.07 -1.01 -0.12 116.25 119.33 1nud h VAL 215 Ca -0.00 -0.42 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 1nud h VAL 215 Cb 0.34 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1nud h VAL 215 CO 0.00 0.20 -0.04 1.23 0.02 0.00 0.00 177.57 178.98 1nud h GLY 216 N 0.93 1.02 1.83 2.17 0.00 -0.36 -1.46 103.07 107.20 1nud h GLY 216 Ca 0.25 -0.78 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 1nud h GLY 216 CO -0.05 0.72 -0.28 -0.09 0.00 0.00 0.00 176.54 176.84 1nud h ARG 217 N 0.80 0.20 -0.21 4.80 2.43 -1.02 -1.04 114.38 120.35 1nud h ARG 217 Ca 0.14 -0.07 -0.19 0.00 -0.81 0.00 0.00 59.98 59.05 1nud h ARG 217 Cb 0.58 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1nud h ARG 217 CO 0.03 0.47 -0.63 0.28 -1.51 0.00 0.00 179.97 178.61 1nud h VAL 218 N 0.18 1.30 -0.41 0.20 2.07 -0.72 -3.19 116.25 115.68 1nud h VAL 218 Ca 0.03 -1.86 -0.14 0.00 0.82 0.00 0.00 66.70 65.55 1nud h VAL 218 Cb 0.59 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1nud h VAL 218 CO 0.04 0.59 -0.30 -0.07 0.02 0.00 0.00 177.57 177.85 1nud h LEU 219 N 0.54 0.95 -2.58 2.57 3.38 -0.90 -0.81 115.31 118.47 1nud h LEU 219 Ca -0.01 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1nud h LEU 219 Cb 1.23 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1nud h LEU 219 CO 0.13 1.17 0.13 0.77 0.09 0.00 0.00 178.44 180.74 1nud h SER 220 N 0.76 0.00 0.03 -0.43 4.64 -1.19 0.65 113.55 118.02 1nud h SER 220 Ca 0.08 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.02 1nud h SER 220 Cb 0.88 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.91 1nud h SER 220 CO 0.08 0.00 -2.37 0.00 -0.87 0.00 0.00 176.83 173.67 1nud n ALA 221 N -2.04 1.33 0.49 5.18 0.00 -0.98 -4.27 120.51 120.22 1nud n ALA 221 Ca -0.02 -1.01 0.13 0.00 0.00 0.00 0.00 53.44 52.54 1nud n ALA 221 Cb 0.20 -0.23 0.37 0.00 0.00 0.00 0.00 19.45 19.79 1nud n ALA 221 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1nud h MET 222 N 0.02 0.00 0.00 0.00 2.07 -0.07 -3.22 114.93 113.72 1nud h MET 222 Ca -0.54 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.09 1nud h MET 222 Cb 1.94 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.67 1nud h MET 222 CO -0.05 0.00 0.00 0.82 1.07 0.00 0.00 176.91 178.75 1nud h ILE 223 N 0.00 0.00 -3.33 -1.22 1.08 -1.15 -2.05 117.51 110.85 1nud h ILE 223 Ca 0.00 -0.61 -0.68 0.00 -0.39 0.00 0.00 64.86 63.18 1nud h ILE 223 Cb 0.75 1.57 -0.15 0.00 -3.07 0.00 0.00 36.82 35.91 1nud h ILE 223 CO 0.00 0.00 -0.62 0.54 -0.69 0.00 0.00 178.15 177.38 1nud s ASN 224 N -5.19 5.22 0.44 1.72 2.20 -1.22 -0.52 114.94 117.58 1nud s ASN 224 Ca 0.07 0.14 0.31 0.00 -0.94 0.00 0.00 52.86 52.44 1nud s ASN 224 Cb 0.09 -1.46 1.51 0.00 -2.00 0.00 0.00 41.25 39.39 1nud s ASN 224 CO 0.58 0.38 1.93 0.77 -2.94 0.00 0.00 177.10 177.81 1nud h SER 225 N 5.16 0.00 -3.75 3.54 4.64 0.63 -3.26 113.55 120.51 1nud h SER 225 Ca -0.51 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.26 1nud h SER 225 Cb 1.19 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 63.40 1nud h SER 225 CO 0.54 0.00 0.63 0.59 -0.87 0.00 0.00 176.83 177.72 1nud n ASN 226 N -2.63 3.13 0.00 4.97 4.13 -1.26 -2.80 115.26 120.80 1nud n ASN 226 Ca -0.01 1.15 0.00 0.00 1.68 0.00 0.00 54.58 57.40 1nud n ASN 226 Cb 0.14 -1.56 0.00 0.00 -1.54 0.00 0.00 39.78 36.81 1nud n ASN 226 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1nud n ASP 227 N 0.20 0.00 -0.67 6.41 8.00 -1.26 -4.44 116.55 124.79 1nud n ASP 227 Ca 0.05 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.57 1nud n ASP 227 Cb 0.40 -0.17 0.03 0.00 -0.02 0.00 0.00 41.12 41.35 1nud n ASP 227 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1nud n ASP 228 N 0.05 0.54 -3.51 -2.24 5.68 -1.24 -4.98 116.55 110.86 1nud n ASP 228 Ca 0.00 -2.20 -0.24 0.00 -0.50 0.00 0.00 54.79 51.85 1nud n ASP 228 Cb 0.00 -0.26 0.07 0.00 -1.14 0.00 0.00 41.12 39.79 1nud n ASP 228 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1nud n ASN 229 N -0.10 -6.28 -3.02 -1.12 5.03 -1.12 -4.87 115.26 103.79 1nud n ASN 229 Ca 0.04 -0.51 -0.12 0.00 0.87 0.00 0.00 54.58 54.86 1nud n ASN 229 Cb 0.79 -4.96 0.11 0.00 -1.02 0.00 0.00 39.78 34.70 1nud n ASN 229 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nud n GLY 230 N -1.91 -3.26 0.08 7.41 0.00 -1.16 -4.84 105.19 101.52 1nud n GLY 230 Ca -0.01 -1.35 -0.11 0.00 0.00 0.00 0.00 46.02 44.54 1nud n GLY 230 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nud h VAL 231 N -2.37 1.27 -3.28 1.61 2.07 -1.39 -3.36 116.25 110.80 1nud h VAL 231 Ca -0.17 -1.66 -0.64 0.00 0.82 0.00 0.00 66.70 65.05 1nud h VAL 231 Cb 0.53 2.28 -0.17 0.00 -1.52 0.00 0.00 31.29 32.41 1nud h VAL 231 CO 0.10 0.38 -0.61 -0.76 0.02 0.00 0.00 177.57 176.71 1nud s LEU 232 N -8.64 3.59 -0.25 2.57 1.43 0.32 -0.76 118.68 116.93 1nud s LEU 232 Ca -0.15 0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 52.84 1nud s LEU 232 Cb -0.01 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1nud s LEU 232 CO 0.55 0.25 0.43 0.00 0.23 0.00 0.00 176.35 177.82 1nud s ALA 233 N -0.09 3.57 0.54 4.21 0.00 -0.67 0.11 121.76 129.43 1nud s ALA 233 Ca 0.04 -0.68 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 1nud s ALA 233 Cb -0.13 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1nud s ALA 233 CO 0.02 -0.62 0.95 0.20 0.00 0.00 0.00 175.76 176.31 1nud s GLY 234 N 1.49 1.80 -0.30 0.00 0.00 -1.26 -0.64 107.32 108.40 1nud s GLY 234 Ca 0.18 -0.08 -0.09 0.00 0.00 0.00 0.00 44.72 44.73 1nud s GLY 234 CO 0.09 0.17 0.80 0.21 0.00 0.00 0.00 173.10 174.37 1nud s ASN 235 N -3.70 -0.94 -0.20 1.64 3.04 -1.08 -4.81 114.94 108.89 1nud s ASN 235 Ca 0.55 0.96 0.13 0.00 0.04 0.00 0.00 52.86 54.53 1nud s ASN 235 Cb -0.10 1.94 0.43 0.00 -1.54 0.00 0.00 41.25 41.97 1nud s ASN 235 CO 0.43 -0.18 1.21 0.79 -3.04 0.00 0.00 177.10 176.31 1nud n TRP 236 N 5.32 0.40 0.28 0.43 8.01 -1.26 -4.75 117.44 125.86 1nud n TRP 236 Ca -0.07 -1.49 0.12 0.00 -1.31 0.00 0.00 57.50 54.75 1nud n TRP 236 Cb 0.51 -0.25 0.14 0.00 -2.01 0.00 0.00 31.31 29.70 1nud n TRP 236 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1nud h SER 237 N 1.20 0.00 0.00 -0.99 4.64 -1.99 -3.46 113.55 112.94 1nud h SER 237 Ca 0.02 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1nud h SER 237 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1nud h SER 237 CO 0.12 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 1nud n GLY 238 N 1.19 1.09 2.85 -0.77 0.00 -1.26 -5.00 105.19 103.29 1nud n GLY 238 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1nud n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nud s THR 239 N -2.64 0.87 -0.26 2.61 2.01 -1.26 -4.88 115.64 112.10 1nud s THR 239 Ca 0.00 -0.36 0.09 0.00 0.31 0.00 0.00 61.69 61.73 1nud s THR 239 Cb 0.00 -1.03 0.44 0.00 0.01 0.00 0.00 72.50 71.92 1nud s THR 239 CO 0.00 0.20 1.24 -1.22 -0.69 0.00 0.00 174.62 174.14 1nud n TYR 240 N 4.97 1.36 -1.33 4.92 4.02 -1.26 -5.00 117.16 124.84 1nud n TYR 240 Ca -0.11 -1.86 -0.36 0.00 -0.01 0.00 0.00 57.90 55.56 1nud n TYR 240 Cb 0.49 -0.33 0.07 0.00 -0.02 0.00 0.00 39.34 39.56 1nud n TYR 240 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1nud n THR 241 N -0.93 2.33 -1.13 -0.72 -1.04 -1.26 -1.98 114.28 109.55 1nud n THR 241 Ca 0.32 -0.40 -0.04 0.00 -2.04 0.00 0.00 64.05 61.89 1nud n THR 241 Cb 0.84 -0.90 -0.02 0.00 -1.82 0.00 0.00 70.33 68.42 1nud n THR 241 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nud n GLY 242 N 1.41 0.69 0.00 3.41 0.00 -1.26 -4.92 105.19 104.52 1nud n GLY 242 Ca 0.12 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1nud n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nud n GLY 243 N -1.77 1.45 3.51 -0.02 0.00 -0.84 -4.91 105.19 102.62 1nud n GLY 243 Ca -0.04 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 1nud n GLY 243 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nud s ARG 244 N -0.57 3.36 -0.03 1.61 0.52 -0.42 -4.85 118.95 118.56 1nud s ARG 244 Ca 0.00 -0.54 -0.39 0.00 -0.52 0.00 0.00 55.73 54.28 1nud s ARG 244 Cb 0.00 -2.78 -0.18 0.00 0.52 0.00 0.00 34.95 32.51 1nud s ARG 244 CO 0.00 0.37 1.34 -3.47 0.02 0.00 0.00 175.30 173.56 1nud n ASP 245 N 3.11 1.24 -0.24 0.23 4.64 -1.26 -2.49 116.55 121.79 1nud n ASP 245 Ca -0.18 1.13 0.30 0.00 -1.38 0.00 0.00 54.79 54.66 1nud n ASP 245 Cb 0.53 -1.08 0.71 0.00 -1.04 0.00 0.00 41.12 40.23 1nud n ASP 245 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1nud h PRO 246 N 4.51 0.04 -0.00 -0.67 0.11 -1.91 -0.59 132.00 133.48 1nud h PRO 246 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1nud h PRO 246 Cb 1.36 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.46 1nud h PRO 246 CO 0.78 0.03 0.00 0.54 -0.21 0.00 0.00 178.00 179.14 1nud n ARG 247 N -4.27 1.19 0.10 1.05 1.74 -1.26 -3.96 116.66 111.24 1nud n ARG 247 Ca 0.21 -0.28 0.07 0.00 -0.77 0.00 0.00 57.85 57.09 1nud n ARG 247 Cb 1.04 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.98 1nud n ARG 247 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1nud h SER 248 N 0.67 0.00 -4.13 0.55 4.64 -1.44 -3.46 113.55 110.38 1nud h SER 248 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1nud h SER 248 Cb 0.14 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 62.37 1nud h SER 248 CO 0.00 0.24 0.45 0.26 -0.87 0.00 0.00 176.83 176.91 1nud s TRP 249 N -3.16 2.22 0.00 4.77 0.52 -1.25 -4.86 118.94 117.18 1nud s TRP 249 Ca -0.00 1.54 0.00 0.00 0.02 0.00 0.00 56.10 57.66 1nud s TRP 249 Cb 0.09 -3.50 0.00 0.00 -1.15 0.00 0.00 33.47 28.90 1nud s TRP 249 CO 0.78 -2.46 0.05 -0.25 0.02 0.00 0.00 176.95 175.08 1nud n ASP 250 N -2.08 0.09 -2.13 2.95 8.00 -1.26 -5.06 116.55 117.06 1nud n ASP 250 Ca 0.14 -0.47 -0.03 0.00 0.71 0.00 0.00 54.79 55.14 1nud n ASP 250 Cb 0.50 0.71 0.01 0.00 -0.02 0.00 0.00 41.12 42.33 1nud n ASP 250 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nud n GLY 251 N 0.71 1.16 0.00 0.44 0.00 -1.26 0.32 105.19 106.57 1nud n GLY 251 Ca 0.00 -1.10 0.10 0.00 0.00 0.00 0.00 46.02 45.03 1nud n GLY 251 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nud n SER 252 N -1.13 0.82 -0.11 1.61 7.64 0.32 -4.45 113.62 118.32 1nud n SER 252 Ca -0.03 -0.77 -0.11 0.00 1.01 0.00 0.00 58.87 58.97 1nud n SER 252 Cb 0.33 1.03 -0.03 0.00 -1.01 0.00 0.00 64.21 64.52 1nud n SER 252 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1nud h VAL 253 N 0.00 1.28 0.00 0.44 2.07 -1.77 -1.94 116.25 116.33 1nud h VAL 253 Ca 0.00 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1nud h VAL 253 Cb 0.57 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1nud h VAL 253 CO 0.00 0.36 -0.11 -0.33 0.02 0.00 0.00 177.57 177.51 1nud h GLU 254 N 0.41 0.00 -0.10 1.57 4.39 -1.95 -2.69 114.58 116.21 1nud h GLU 254 Ca 0.08 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.62 1nud h GLU 254 Cb 0.56 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.21 1nud h GLU 254 CO 0.03 0.00 -0.56 0.82 -1.16 0.00 0.00 179.01 178.14 1nud h ILE 255 N 0.00 1.35 -0.01 3.13 2.04 -1.75 -2.28 117.51 120.00 1nud h ILE 255 Ca 0.00 -1.87 -0.22 0.00 1.00 0.00 0.00 64.86 63.76 1nud h ILE 255 Cb 0.96 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1nud h ILE 255 CO 0.00 0.57 -0.92 -0.07 0.00 0.00 0.00 178.15 177.72 1nud h LEU 256 N 0.18 0.54 -0.26 1.44 3.38 -1.41 -2.58 115.31 116.60 1nud h LEU 256 Ca -0.04 -0.43 -0.21 0.00 0.09 0.00 0.00 57.88 57.29 1nud h LEU 256 Cb 1.21 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1nud h LEU 256 CO 0.12 1.22 -0.82 0.11 0.09 0.00 0.00 178.44 179.16 1nud h LYS 257 N 0.24 0.52 -0.52 1.13 1.57 -1.57 -2.26 116.57 115.69 1nud h LYS 257 Ca -0.08 -0.47 -0.07 0.00 -1.87 0.00 0.00 60.65 58.17 1nud h LYS 257 Cb 1.56 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.95 1nud h LYS 257 CO 0.16 1.10 0.06 -0.91 -0.57 0.00 0.00 179.45 179.29 1nud h ASN 258 N 0.34 0.79 0.59 0.86 4.21 -1.47 0.26 115.58 121.16 1nud h ASN 258 Ca -0.06 -0.17 -0.03 0.00 1.21 0.00 0.00 56.30 57.26 1nud h ASN 258 Cb 1.42 -0.21 0.00 0.00 -1.12 0.00 0.00 38.32 38.42 1nud h ASN 258 CO 0.15 0.82 -0.31 -0.25 -1.29 0.00 0.00 177.43 176.56 1nud h TRP 259 N 0.79 -0.80 -0.70 1.19 7.01 -1.28 -0.10 115.95 122.06 1nud h TRP 259 Ca 0.16 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.12 1nud h TRP 259 Cb 0.39 0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 27.69 1nud h TRP 259 CO 0.02 -0.49 0.34 -0.22 -2.79 0.00 0.00 178.44 175.31 1nud h LYS 260 N -0.83 0.98 -0.70 2.65 3.64 -1.21 -0.23 116.57 120.88 1nud h LYS 260 Ca -0.08 -0.13 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 1nud h LYS 260 Cb 0.65 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1nud h LYS 260 CO 0.12 0.75 0.23 -0.22 -2.27 0.00 0.00 179.45 178.06 1nud h LYS 261 N 0.98 1.09 -0.92 1.90 3.64 -0.23 -2.94 116.57 120.09 1nud h LYS 261 Ca 0.24 -0.23 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1nud h LYS 261 Cb 0.08 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 31.70 1nud h LYS 261 CO -0.03 0.93 0.10 -1.13 -2.27 0.00 0.00 179.45 177.05 1nud n SER 262 N -4.31 2.92 -3.01 4.20 3.41 -0.07 -4.84 113.62 111.92 1nud n SER 262 Ca 0.05 -2.43 -0.15 0.00 -0.26 0.00 0.00 58.87 56.08 1nud n SER 262 Cb 0.22 -0.59 0.07 0.00 -0.26 0.00 0.00 64.21 63.65 1nud n SER 262 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nud n GLY 263 N 0.09 -0.23 3.76 5.00 0.00 -1.11 -3.07 105.19 109.64 1nud n GLY 263 Ca 0.15 0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1nud n GLY 263 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nud n LEU 264 N -3.70 -2.97 -4.91 0.99 4.77 -0.11 -4.98 117.00 106.08 1nud n LEU 264 Ca -0.19 -0.76 -0.32 0.00 -0.03 0.00 0.00 56.01 54.71 1nud n LEU 264 Cb 0.62 -2.69 -0.04 0.00 -2.33 0.00 0.00 43.42 38.98 1nud n LEU 264 CO 0.51 0.46 -0.13 -0.55 -1.33 0.00 0.00 177.39 176.35 1nud s SER 265 N -3.81 6.38 0.11 -1.43 0.15 -1.17 -4.86 113.70 109.06 1nud s SER 265 Ca 0.34 0.33 -0.36 0.00 0.70 0.00 0.00 55.95 56.96 1nud s SER 265 Cb -0.17 -1.99 -0.16 0.00 -1.71 0.00 0.00 66.02 62.00 1nud s SER 265 CO 0.81 0.18 1.40 -2.65 1.20 0.00 0.00 173.24 174.17 1nud n PRO 266 N 0.43 1.43 -2.97 5.44 -0.02 -1.26 -4.71 135.00 133.33 1nud n PRO 266 Ca -0.06 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.52 1nud n PRO 266 Cb 0.51 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1nud n PRO 266 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nud s VAL 267 N 0.56 4.82 -0.18 -1.45 1.01 0.06 -4.87 120.40 120.36 1nud s VAL 267 Ca 0.82 1.13 -0.06 0.00 0.00 0.00 0.00 61.98 63.87 1nud s VAL 267 Cb -0.87 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 31.36 1nud s VAL 267 CO 0.45 -0.23 0.02 -0.13 0.00 0.00 0.00 175.10 175.21 1nud s ARG 268 N 2.89 3.83 0.16 2.72 0.52 -1.26 -1.67 118.95 126.13 1nud s ARG 268 Ca 0.31 -0.43 0.01 0.00 -0.52 0.00 0.00 55.73 55.11 1nud s ARG 268 Cb -0.14 -3.10 -0.04 0.00 0.52 0.00 0.00 34.95 32.19 1nud s ARG 268 CO 0.12 0.23 0.01 0.71 0.02 0.00 0.00 175.30 176.39 1nud s TYR 269 N 0.44 1.11 0.25 -0.53 2.02 -1.04 -1.30 117.35 118.31 1nud s TYR 269 Ca 0.00 -1.06 0.01 0.00 -0.37 0.00 0.00 57.07 55.66 1nud s TYR 269 Cb -0.13 -0.63 -0.05 0.00 -0.40 0.00 0.00 41.96 40.74 1nud s TYR 269 CO 0.02 -0.27 0.08 0.20 -1.57 0.00 0.00 175.55 174.01 1nud s GLY 270 N -3.14 1.70 0.26 0.71 0.00 0.18 -4.07 107.32 102.97 1nud s GLY 270 Ca 0.23 -1.85 0.02 0.00 0.00 0.00 0.00 44.72 43.12 1nud s GLY 270 CO 0.03 -1.60 0.14 1.20 0.00 0.00 0.00 173.10 172.87 1nud s GLN 271 N -4.02 1.44 0.25 2.90 -0.21 -1.26 -2.65 119.66 116.12 1nud s GLN 271 Ca 0.36 -1.80 -0.06 0.00 0.02 0.00 0.00 55.36 53.88 1nud s GLN 271 Cb 0.08 0.00 0.44 0.00 1.00 0.00 0.00 33.01 34.52 1nud s GLN 271 CO 0.13 -0.41 1.39 0.00 -2.12 0.00 0.00 175.29 174.28 1nud h TRP 273 N 0.00 0.00 -0.14 0.00 0.09 -1.98 -0.10 115.95 113.83 1nud h TRP 273 Ca 0.44 0.00 -0.08 0.00 0.09 0.00 0.00 58.89 59.33 1nud h TRP 273 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.93 1nud h TRP 273 CO -0.66 0.34 -0.25 0.28 0.09 0.00 0.00 178.44 178.24 1nud h VAL 274 N 0.00 1.37 -0.11 0.12 2.07 -0.86 -0.27 116.25 118.58 1nud h VAL 274 Ca -0.00 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.03 1nud h VAL 274 Cb 0.69 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 1nud h VAL 274 CO 0.04 0.44 -0.01 -0.26 0.02 0.00 0.00 177.57 177.81 1nud h PHE 275 N 0.01 -0.02 -0.91 1.57 0.04 -1.03 -1.48 116.94 115.12 1nud h PHE 275 Ca 0.01 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.82 1nud h PHE 275 Cb 0.83 0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.95 1nud h PHE 275 CO 0.10 -0.02 0.60 0.00 -0.60 0.00 0.00 178.31 178.39 1nud h ALA 276 N 1.09 1.41 -0.42 2.45 0.00 -0.99 0.13 119.26 122.94 1nud h ALA 276 Ca 0.05 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1nud h ALA 276 Cb 0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1nud h ALA 276 CO -0.09 0.50 -0.05 0.78 0.00 0.00 0.00 179.25 180.39 1nud h GLY 277 N 1.15 0.85 0.78 0.00 0.00 -0.58 0.50 103.07 105.78 1nud h GLY 277 Ca 0.36 -0.67 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 1nud h GLY 277 CO -0.11 0.61 -0.17 -0.84 0.00 0.00 0.00 176.54 176.04 1nud h THR 278 N 0.61 1.34 -0.52 4.70 2.02 -0.89 -1.80 112.91 118.38 1nud h THR 278 Ca 0.11 -1.33 0.01 0.00 0.77 0.00 0.00 66.41 65.97 1nud h THR 278 Cb 0.57 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 1nud h THR 278 CO 0.03 0.40 0.34 0.25 0.37 0.00 0.00 175.52 176.91 1nud h LEU 279 N 0.06 0.58 -0.63 2.58 5.85 -0.71 0.27 115.31 123.32 1nud h LEU 279 Ca 0.03 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1nud h LEU 279 Cb 0.71 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1nud h LEU 279 CO 0.04 0.41 -0.22 -1.13 -0.34 0.00 0.00 178.44 177.20 1nud h ASN 280 N 0.68 0.00 0.11 1.25 -0.73 -0.72 -2.48 115.58 113.68 1nud h ASN 280 Ca 0.19 0.00 -0.28 0.00 1.87 0.00 0.00 56.30 58.08 1nud h ASN 280 Cb -0.05 0.00 0.03 0.00 0.27 0.00 0.00 38.32 38.57 1nud h ASN 280 CO -0.04 0.22 -1.18 0.74 -0.37 0.00 0.00 177.43 176.80 1nud h THR 281 N 0.00 1.30 -0.64 -3.57 2.02 -0.12 -2.69 112.91 109.21 1nud h THR 281 Ca -0.00 -2.42 -0.02 0.00 0.77 0.00 0.00 66.41 64.74 1nud h THR 281 Cb 0.94 2.69 -0.03 0.00 -1.74 0.00 0.00 68.15 70.01 1nud h THR 281 CO 0.03 0.73 0.33 0.00 0.37 0.00 0.00 175.52 176.98 1nud h ALA 282 N 0.28 1.37 0.07 6.16 0.00 -1.04 -2.30 119.26 123.80 1nud h ALA 282 Ca -0.18 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1nud h ALA 282 Cb 1.86 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1nud h ALA 282 CO 0.23 0.50 -0.03 -0.07 0.00 0.00 0.00 179.25 179.88 1nud h LEU 283 N 0.90 -0.07 -1.95 0.00 3.38 -1.47 -2.78 115.31 113.31 1nud h LEU 283 Ca 0.22 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1nud h LEU 283 Cb 0.06 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1nud h LEU 283 CO -0.03 0.60 -0.06 0.03 0.09 0.00 0.00 178.44 179.07 1nud h ARG 284 N -0.84 0.00 -0.14 1.13 3.08 -1.50 0.26 114.38 116.37 1nud h ARG 284 Ca -0.01 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 1nud h ARG 284 Cb 0.63 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.68 1nud h ARG 284 CO 0.01 0.06 -0.77 0.66 -1.07 0.00 0.00 179.97 178.87 1nud h SER 285 N 0.00 0.85 0.92 7.04 4.64 -1.48 -3.07 113.55 122.46 1nud h SER 285 Ca -0.00 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1nud h SER 285 Cb 0.11 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1nud h SER 285 CO 0.01 1.35 0.00 0.18 -0.87 0.00 0.00 176.83 177.50 1nud n LEU 286 N -3.92 0.01 0.00 5.97 4.77 -0.78 -4.89 117.00 118.16 1nud n LEU 286 Ca -0.07 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1nud n LEU 286 Cb 0.74 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1nud n LEU 286 CO 0.52 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1nud n GLY 287 N 1.25 1.06 3.56 -0.72 0.00 -0.68 -1.69 105.19 107.98 1nud n GLY 287 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1nud n GLY 287 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nud s ILE 288 N -2.00 5.12 0.28 -0.61 1.01 -0.01 -4.32 121.20 120.67 1nud s ILE 288 Ca 0.00 0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 1nud s ILE 288 Cb 0.00 -3.84 -0.13 0.00 0.01 0.00 0.00 42.46 38.50 1nud s ILE 288 CO 0.00 -0.07 1.38 -2.65 0.00 0.00 0.00 174.94 173.60 1nud n PRO 289 N 5.50 2.11 -3.47 2.79 -0.02 -1.26 -3.46 135.00 137.18 1nud n PRO 289 Ca -0.07 0.75 -0.14 0.00 -2.02 0.00 0.00 63.50 62.01 1nud n PRO 289 Cb 0.50 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 1nud n PRO 289 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1nud s SER 290 N 0.11 -0.59 0.13 2.55 1.04 -0.38 -0.49 113.70 116.07 1nud s SER 290 Ca 0.64 0.33 -0.07 0.00 0.48 0.00 0.00 55.95 57.33 1nud s SER 290 Cb -0.61 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1nud s SER 290 CO 0.54 -0.77 0.21 0.00 0.98 0.00 0.00 173.24 174.19 1nud s ARG 291 N -2.50 1.01 -0.11 4.02 1.70 -1.09 -4.56 118.95 117.41 1nud s ARG 291 Ca -0.04 -1.16 -0.09 0.00 -0.47 0.00 0.00 55.73 53.97 1nud s ARG 291 Cb -0.01 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.67 1nud s ARG 291 CO -0.02 -0.34 0.18 0.08 -1.08 0.00 0.00 175.30 174.12 1nud s VAL 292 N -3.95 5.43 -0.07 4.99 1.01 -1.26 -2.43 120.40 124.12 1nud s VAL 292 Ca 0.14 0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.47 1nud s VAL 292 Cb 0.05 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1nud s VAL 292 CO -0.03 0.59 -0.19 -0.63 0.00 0.00 0.00 175.10 174.84 1nud s ILE 293 N -0.83 2.64 -0.16 2.22 -1.09 0.42 -4.30 121.20 120.10 1nud s ILE 293 Ca 0.15 -0.86 0.01 0.00 -2.23 0.00 0.00 60.65 57.73 1nud s ILE 293 Cb -0.13 -2.02 0.02 0.00 -1.58 0.00 0.00 42.46 38.75 1nud s ILE 293 CO 0.05 0.57 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.25 1nud s THR 294 N -0.31 1.92 -0.23 2.92 2.01 0.72 -1.18 115.64 121.50 1nud s THR 294 Ca 0.02 -0.87 -0.05 0.00 0.31 0.00 0.00 61.69 61.10 1nud s THR 294 Cb -0.13 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 1nud s THR 294 CO 0.03 0.52 -0.01 0.21 -0.69 0.00 0.00 174.62 174.68 1nud s ASN 295 N 1.19 4.57 0.03 3.53 2.47 -0.37 0.25 114.94 126.62 1nud s ASN 295 Ca 0.01 -0.33 -0.17 0.00 0.42 0.00 0.00 52.86 52.79 1nud s ASN 295 Cb -0.14 -1.80 -0.06 0.00 -1.45 0.00 0.00 41.25 37.80 1nud s ASN 295 CO -0.09 -0.02 0.49 -0.36 -3.72 0.00 0.00 177.10 173.40 1nud s PHE 296 N 1.52 3.76 -0.72 0.43 0.40 -0.94 -0.66 117.98 121.77 1nud s PHE 296 Ca 0.06 1.13 -0.03 0.00 -0.60 0.00 0.00 56.93 57.49 1nud s PHE 296 Cb -0.14 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 1nud s PHE 296 CO -0.01 0.60 0.62 0.09 0.70 0.00 0.00 175.22 177.22 1nud n ASN 297 N 1.83 -4.50 -4.70 1.36 4.13 -0.02 -1.91 115.26 111.45 1nud n ASN 297 Ca -0.12 -0.46 -0.40 0.00 1.68 0.00 0.00 54.58 55.28 1nud n ASN 297 Cb 0.52 -3.62 -0.05 0.00 -1.54 0.00 0.00 39.78 35.09 1nud n ASN 297 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1nud s SER 298 N -3.38 6.94 0.05 6.41 0.15 -0.47 -2.02 113.70 121.37 1nud s SER 298 Ca 0.25 1.13 -0.06 0.00 0.70 0.00 0.00 55.95 57.97 1nud s SER 298 Cb -0.03 -2.41 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 1nud s SER 298 CO 0.49 -0.20 0.29 0.00 1.20 0.00 0.00 173.24 175.03 1nud s ALA 299 N 1.25 3.85 -0.62 5.45 0.00 -1.07 -0.42 121.76 130.19 1nud s ALA 299 Ca 0.36 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.76 1nud s ALA 299 Cb -0.17 -2.06 0.15 0.00 0.00 0.00 0.00 23.12 21.04 1nud s ALA 299 CO 0.16 0.67 0.40 -1.58 0.00 0.00 0.00 175.76 175.41 1nud s HIS 300 N -1.41 3.39 -0.05 0.00 5.04 0.62 -3.54 115.29 119.34 1nud s HIS 300 Ca 0.32 -3.16 -0.30 0.00 -1.54 0.00 0.00 55.06 50.38 1nud s HIS 300 Cb -0.13 -2.87 -0.03 0.00 0.04 0.00 0.00 32.58 29.60 1nud s HIS 300 CO 0.20 -0.69 1.12 0.34 -2.34 0.00 0.00 174.74 173.37 1nud s ASP 301 N -0.54 7.14 -0.18 9.88 3.68 -1.26 -3.12 116.67 132.27 1nud s ASP 301 Ca 0.20 1.74 0.14 0.00 2.13 0.00 0.00 52.55 56.76 1nud s ASP 301 Cb -0.17 -2.56 -0.21 0.00 -1.45 0.00 0.00 42.92 38.53 1nud s ASP 301 CO -0.07 -0.50 0.03 0.41 0.13 0.00 0.00 175.17 175.18 1nud n THR 302 N 4.44 1.24 -1.17 1.71 -1.04 -1.26 -4.50 114.28 113.70 1nud n THR 302 Ca 0.10 -0.73 -0.24 0.00 -2.04 0.00 0.00 64.05 61.14 1nud n THR 302 Cb 0.47 -0.61 0.17 0.00 -1.82 0.00 0.00 70.33 68.54 1nud n THR 302 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1nud n ASP 303 N -2.72 3.90 -3.85 8.00 5.68 -1.26 -4.96 116.55 121.34 1nud n ASP 303 Ca -0.30 -3.57 -0.26 0.00 -0.50 0.00 0.00 54.79 50.15 1nud n ASP 303 Cb 1.07 -0.84 -0.03 0.00 -1.14 0.00 0.00 41.12 40.18 1nud n ASP 303 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1nud n ARG 304 N -1.09 -0.72 -0.06 0.11 1.74 -1.26 -4.82 116.66 110.56 1nud n ARG 304 Ca 0.58 -0.04 0.02 0.00 -0.77 0.00 0.00 57.85 57.64 1nud n ARG 304 Cb 1.60 -1.86 0.03 0.00 -1.02 0.00 0.00 32.46 31.21 1nud n ARG 304 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nud n ASN 305 N -1.48 1.46 -2.80 0.55 0.23 -1.26 -4.95 115.26 107.01 1nud n ASN 305 Ca -0.15 -2.00 -0.20 0.00 -0.53 0.00 0.00 54.58 51.70 1nud n ASN 305 Cb 0.42 -0.10 0.01 0.00 -2.08 0.00 0.00 39.78 38.03 1nud n ASN 305 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1nud n LEU 306 N -0.53 -2.00 -3.81 -4.53 4.32 -1.26 -4.97 117.00 104.23 1nud n LEU 306 Ca 0.03 -0.14 -0.13 0.00 -0.02 0.00 0.00 56.01 55.76 1nud n LEU 306 Cb 0.42 -2.67 -0.13 0.00 -1.62 0.00 0.00 43.42 39.43 1nud n LEU 306 CO 0.00 0.03 -0.18 -0.55 -1.22 0.00 0.00 177.39 175.47 1nud s SER 307 N -2.40 -0.17 -0.00 -1.43 0.15 -1.26 -0.81 113.70 107.78 1nud s SER 307 Ca 0.18 0.34 0.07 0.00 0.70 0.00 0.00 55.95 57.24 1nud s SER 307 Cb -0.08 0.33 -0.02 0.00 -1.71 0.00 0.00 66.02 64.54 1nud s SER 307 CO 0.22 -0.07 -0.23 0.68 1.20 0.00 0.00 173.24 175.04 1nud s VAL 308 N 0.22 1.82 -0.10 4.45 -7.23 0.52 -4.80 120.40 115.29 1nud s VAL 308 Ca -0.01 -1.06 -0.02 0.00 -1.81 0.00 0.00 61.98 59.08 1nud s VAL 308 Cb -0.02 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.36 1nud s VAL 308 CO -0.01 0.44 -0.00 -1.81 -0.31 0.00 0.00 175.10 173.41 1nud s ASP 309 N -0.72 5.19 -0.06 4.85 1.01 -1.26 -1.19 116.67 124.48 1nud s ASP 309 Ca 0.09 0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.47 1nud s ASP 309 Cb -0.09 -1.51 0.02 0.00 1.01 0.00 0.00 42.92 42.35 1nud s ASP 309 CO -0.00 0.35 -0.06 0.68 0.21 0.00 0.00 175.17 176.35 1nud s VAL 310 N -0.70 0.73 0.25 -1.27 -7.23 -0.87 -4.57 120.40 106.73 1nud s VAL 310 Ca 0.11 -0.20 0.08 0.00 -1.81 0.00 0.00 61.98 60.16 1nud s VAL 310 Cb -0.12 -0.75 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 1nud s VAL 310 CO 0.02 0.28 0.11 -0.31 -0.31 0.00 0.00 175.10 174.90 1nud s TYR 311 N 1.15 2.96 0.14 2.82 1.51 -1.26 -0.45 117.35 124.21 1nud s TYR 311 Ca -0.07 -0.15 -0.08 0.00 -1.01 0.00 0.00 57.07 55.76 1nud s TYR 311 Cb -0.14 -1.33 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1nud s TYR 311 CO -0.01 0.56 0.25 0.71 -1.11 0.00 0.00 175.55 175.94 1nud s TYR 312 N -2.16 0.35 0.42 2.71 1.51 -0.76 -1.72 117.35 117.70 1nud s TYR 312 Ca 0.32 -0.73 0.07 0.00 -1.01 0.00 0.00 57.07 55.71 1nud s TYR 312 Cb -0.08 -0.08 -0.05 0.00 -0.11 0.00 0.00 41.96 41.65 1nud s TYR 312 CO 0.23 -0.66 0.18 0.16 -1.11 0.00 0.00 175.55 174.35 1nud s ASP 313 N -2.94 4.40 0.63 2.29 1.47 -1.04 -1.07 116.67 120.41 1nud s ASP 313 Ca 0.14 -1.12 0.38 0.00 1.18 0.00 0.00 52.55 53.13 1nud s ASP 313 Cb 0.04 -0.39 2.09 0.00 -0.34 0.00 0.00 42.92 44.31 1nud s ASP 313 CO -0.03 -0.58 2.17 -0.65 0.68 0.00 0.00 175.17 176.76 1nud h PRO 314 N 1.40 0.00 -0.00 2.11 0.11 -1.93 -0.88 132.00 132.80 1nud h PRO 314 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1nud h PRO 314 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1nud h PRO 314 CO 0.70 0.00 -0.14 -1.33 -0.21 0.00 0.00 178.00 177.02 1nud n MET 315 N -2.94 0.60 -0.86 1.05 2.81 -1.26 -4.77 117.12 111.75 1nud n MET 315 Ca -0.03 -0.22 0.00 0.00 -1.81 0.00 0.00 57.70 55.64 1nud n MET 315 Cb 0.16 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 1nud n MET 315 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nud n GLY 316 N 1.32 0.91 3.86 3.03 0.00 -0.33 -3.95 105.19 110.03 1nud n GLY 316 Ca 0.13 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 1nud n GLY 316 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nud s ASN 317 N -2.55 6.59 0.59 1.61 0.01 -1.26 -4.01 114.94 115.92 1nud s ASN 317 Ca 0.00 0.71 -0.16 0.00 -0.71 0.00 0.00 52.86 52.69 1nud s ASN 317 Cb 0.00 -2.16 -0.04 0.00 0.41 0.00 0.00 41.25 39.47 1nud s ASN 317 CO 0.00 0.36 1.07 -2.84 -1.51 0.00 0.00 177.10 174.18 1nud s PRO 318 N -1.09 3.28 0.00 -0.60 0.02 -1.26 -2.51 135.00 132.85 1nud s PRO 318 Ca 0.20 1.29 0.04 0.00 0.02 0.00 0.00 61.00 62.55 1nud s PRO 318 Cb -0.14 -2.02 -0.01 0.00 0.02 0.00 0.00 34.50 32.34 1nud s PRO 318 CO 0.09 -0.85 -0.14 -0.51 -0.33 0.00 0.00 177.00 175.26 1nud s LEU 319 N -4.40 2.07 -1.01 -5.54 1.43 -0.70 -4.87 118.68 105.66 1nud s LEU 319 Ca 0.65 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 53.42 1nud s LEU 319 Cb -0.17 -0.66 0.30 0.00 0.03 0.00 0.00 46.19 45.69 1nud s LEU 319 CO 0.35 0.12 1.36 -0.67 0.23 0.00 0.00 176.35 177.74 1nud n ASP 320 N 2.49 5.99 -0.01 2.29 -0.08 -1.26 -4.26 116.55 121.72 1nud n ASP 320 Ca -0.15 -3.41 0.07 0.00 -1.51 0.00 0.00 54.79 49.79 1nud n ASP 320 Cb 0.55 -1.18 -0.11 0.00 2.34 0.00 0.00 41.12 42.72 1nud n ASP 320 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1nud n LYS 321 N 1.28 0.70 -4.00 -0.67 4.81 -1.26 -5.01 118.16 114.03 1nud n LYS 321 Ca 0.26 -0.11 -0.34 0.00 -0.87 0.00 0.00 58.31 57.25 1nud n LYS 321 Cb 0.34 -1.32 -0.06 0.00 0.02 0.00 0.00 35.03 34.02 1nud n LYS 321 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1nud s GLY 322 N -3.47 2.10 0.53 3.14 0.00 -1.26 -4.97 107.32 103.38 1nud s GLY 322 Ca -0.04 -0.76 0.34 0.00 0.00 0.00 0.00 44.72 44.26 1nud s GLY 322 CO 0.59 -0.60 2.01 1.48 0.00 0.00 0.00 173.10 176.58 1nud h SER 323 N 4.33 0.00 -3.47 1.64 4.64 -1.95 -3.43 113.55 115.31 1nud h SER 323 Ca -0.51 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.36 1nud h SER 323 Cb 1.20 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.37 1nud h SER 323 CO 0.63 0.00 0.21 -1.81 -0.87 0.00 0.00 176.83 174.99 1nud s ASP 324 N -5.36 4.60 -0.11 4.97 1.11 -1.26 -4.80 116.67 115.81 1nud s ASP 324 Ca 0.00 0.29 -0.30 0.00 0.18 0.00 0.00 52.55 52.72 1nud s ASP 324 Cb 0.10 -0.85 0.12 0.00 1.07 0.00 0.00 42.92 43.35 1nud s ASP 324 CO 0.49 -1.72 0.97 -0.94 1.18 0.00 0.00 175.17 175.15 1nud s SER 325 N -4.58 -0.36 -0.27 0.27 1.04 -1.18 -4.85 113.70 103.77 1nud s SER 325 Ca 0.62 0.26 0.02 0.00 0.48 0.00 0.00 55.95 57.34 1nud s SER 325 Cb -0.09 0.32 0.06 0.00 0.10 0.00 0.00 66.02 66.41 1nud s SER 325 CO 0.45 -0.42 -0.09 -0.69 0.98 0.00 0.00 173.24 173.46 1nud s VAL 326 N -1.80 2.29 0.37 5.02 1.01 -1.26 -0.28 120.40 125.75 1nud s VAL 326 Ca 0.01 -1.61 -0.21 0.00 0.00 0.00 0.00 61.98 60.17 1nud s VAL 326 Cb -0.01 -2.34 -0.10 0.00 0.00 0.00 0.00 36.38 33.93 1nud s VAL 326 CO -0.02 -0.04 0.90 0.26 0.00 0.00 0.00 175.10 176.20 1nud s TRP 327 N 1.12 3.44 0.39 5.22 0.52 0.45 -4.49 118.94 125.58 1nud s TRP 327 Ca -0.08 1.58 0.21 0.00 0.02 0.00 0.00 56.10 57.82 1nud s TRP 327 Cb -0.20 -2.80 1.13 0.00 -1.15 0.00 0.00 33.47 30.45 1nud s TRP 327 CO -0.04 0.03 1.98 -0.91 0.02 0.00 0.00 176.95 178.03 1nud h ASN 328 N 2.39 0.00 -4.13 2.95 2.35 -1.35 -1.21 115.58 116.57 1nud h ASN 328 Ca -0.48 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.36 1nud h ASN 328 Cb 1.18 0.00 -0.22 0.00 0.05 0.00 0.00 38.32 39.33 1nud h ASN 328 CO 0.63 0.20 0.56 0.72 -1.65 0.00 0.00 177.43 177.90 1nud s PHE 329 N -4.25 -0.35 -0.01 1.19 -0.12 -1.26 -0.84 117.98 112.34 1nud s PHE 329 Ca -0.03 0.56 0.00 0.00 -0.05 0.00 0.00 56.93 57.42 1nud s PHE 329 Cb 0.14 0.46 0.01 0.00 -0.63 0.00 0.00 43.02 43.00 1nud s PHE 329 CO 0.65 -0.34 -0.00 -1.58 -0.05 0.00 0.00 175.22 173.89 1nud s HIS 330 N -1.31 0.11 -0.07 3.49 2.46 0.17 -4.83 115.29 115.31 1nud s HIS 330 Ca -0.01 0.01 0.03 0.00 0.47 0.00 0.00 55.06 55.56 1nud s HIS 330 Cb -0.01 -0.14 -0.02 0.00 -0.13 0.00 0.00 32.58 32.28 1nud s HIS 330 CO 0.00 -0.03 -0.14 0.08 -2.47 0.00 0.00 174.74 172.18 1nud s VAL 331 N 0.32 3.08 0.00 0.89 1.01 -1.26 -1.23 120.40 123.21 1nud s VAL 331 Ca -0.03 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 1nud s VAL 331 Cb -0.04 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1nud s VAL 331 CO -0.01 0.57 0.00 -2.67 0.00 0.00 0.00 175.10 173.00 1nud n TRP 332 N 2.61 -0.53 -4.43 5.22 2.14 -0.32 -4.48 117.44 117.65 1nud n TRP 332 Ca -0.17 -0.01 -0.27 0.00 2.07 0.00 0.00 57.50 59.12 1nud n TRP 332 Cb 0.52 0.00 -0.10 0.00 -0.81 0.00 0.00 31.31 30.93 1nud n TRP 332 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 1nud s ASN 333 N -1.01 4.08 -0.14 -0.67 -0.87 0.12 -0.44 114.94 116.01 1nud s ASN 333 Ca 0.00 -1.23 -0.04 0.00 -1.57 0.00 0.00 52.86 50.02 1nud s ASN 333 Cb -0.00 -0.43 0.06 0.00 -0.02 0.00 0.00 41.25 40.85 1nud s ASN 333 CO 0.00 -0.45 0.11 -1.61 -2.57 0.00 0.00 177.10 172.58 1nud s GLU 334 N -3.77 0.05 0.26 -0.60 2.02 -1.02 -0.89 118.70 114.75 1nud s GLU 334 Ca 0.37 0.09 -0.02 0.00 0.02 0.00 0.00 54.97 55.43 1nud s GLU 334 Cb 0.07 -1.39 -0.04 0.00 0.10 0.00 0.00 34.13 32.87 1nud s GLU 334 CO 0.20 -0.58 0.48 0.20 0.02 0.00 0.00 175.26 175.58 1nud s GLY 335 N 2.18 1.71 -0.23 -1.39 0.00 0.82 -2.67 107.32 107.74 1nud s GLY 335 Ca 0.03 -0.76 -0.04 0.00 0.00 0.00 0.00 44.72 43.96 1nud s GLY 335 CO -0.08 -0.69 -0.04 0.86 0.00 0.00 0.00 173.10 173.15 1nud s TRP 336 N -2.04 2.97 -0.25 1.90 -0.11 0.35 0.36 118.94 122.12 1nud s TRP 336 Ca 0.41 -1.01 -0.31 0.00 1.22 0.00 0.00 56.10 56.41 1nud s TRP 336 Cb -0.11 -2.10 0.17 0.00 -1.50 0.00 0.00 33.47 29.93 1nud s TRP 336 CO 0.31 -0.57 1.29 -0.59 -4.62 0.00 0.00 176.95 172.76 1nud s PHE 337 N 1.46 -0.10 0.08 5.86 -0.12 -1.07 -4.35 117.98 119.75 1nud s PHE 337 Ca 0.05 0.14 -0.31 0.00 -0.05 0.00 0.00 56.93 56.77 1nud s PHE 337 Cb -0.15 0.49 -0.06 0.00 -0.63 0.00 0.00 43.02 42.68 1nud s PHE 337 CO -0.03 -0.10 1.22 0.14 -0.05 0.00 0.00 175.22 176.39 1nud s VAL 338 N -1.34 3.92 -0.89 -2.49 -7.23 -0.63 -2.93 120.40 108.82 1nud s VAL 338 Ca 0.08 1.40 -0.17 0.00 -1.81 0.00 0.00 61.98 61.47 1nud s VAL 338 Cb -0.01 -3.90 0.16 0.00 0.56 0.00 0.00 36.38 33.20 1nud s VAL 338 CO -0.06 0.12 0.99 -0.13 -0.31 0.00 0.00 175.10 175.72 1nud s ARG 339 N 0.96 3.59 0.00 4.82 1.81 -1.26 -4.83 118.95 124.04 1nud s ARG 339 Ca 0.59 -2.00 0.20 0.00 -1.72 0.00 0.00 55.73 52.81 1nud s ARG 339 Cb -0.30 -4.73 1.07 0.00 -0.45 0.00 0.00 34.95 30.53 1nud s ARG 339 CO 0.30 -1.60 1.64 -1.13 -0.68 0.00 0.00 175.30 173.83 1nud n SER 340 N 5.64 0.00 -0.02 0.23 3.41 -1.26 -1.66 113.62 119.96 1nud n SER 340 Ca 0.20 -0.11 0.04 0.00 -0.26 0.00 0.00 58.87 58.74 1nud n SER 340 Cb 0.48 -0.24 -0.14 0.00 -0.26 0.00 0.00 64.21 64.05 1nud n SER 340 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1nud n ASP 341 N -1.24 0.19 -0.10 4.04 5.75 -1.26 -4.52 116.55 119.41 1nud n ASP 341 Ca 0.11 0.08 -0.12 0.00 -0.01 0.00 0.00 54.79 54.84 1nud n ASP 341 Cb 0.15 1.36 -0.15 0.00 -1.03 0.00 0.00 41.12 41.45 1nud n ASP 341 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1nud n LEU 342 N -2.51 0.90 0.00 -2.12 4.77 -0.95 -5.09 117.00 112.00 1nud n LEU 342 Ca -0.12 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1nud n LEU 342 Cb 0.76 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 1nud n LEU 342 CO 0.44 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.74 1nud n GLY 343 N 1.89 3.77 0.46 -0.72 0.00 -0.66 -4.85 105.19 105.07 1nud n GLY 343 Ca -0.36 -1.70 0.28 0.00 0.00 0.00 0.00 46.02 44.24 1nud n GLY 343 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nud h PRO 344 N 0.00 0.12 -0.00 1.61 0.13 -1.96 -1.37 132.00 130.53 1nud h PRO 344 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1nud h PRO 344 Cb 0.00 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.10 1nud h PRO 344 CO 0.00 0.08 -0.03 -1.13 -0.23 0.00 0.00 178.00 176.68 1nud n SER 345 N -4.34 0.08 -0.89 1.44 3.41 -1.26 -3.65 113.62 108.41 1nud n SER 345 Ca 0.22 -0.09 0.08 0.00 -0.26 0.00 0.00 58.87 58.82 1nud n SER 345 Cb 0.99 -0.28 0.24 0.00 -0.26 0.00 0.00 64.21 64.89 1nud n SER 345 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1nud n TYR 346 N -1.29 0.86 -1.79 7.33 4.02 -0.51 -4.88 117.16 120.90 1nud n TYR 346 Ca 0.13 -0.72 -0.23 0.00 -0.01 0.00 0.00 57.90 57.07 1nud n TYR 346 Cb 0.27 -0.22 0.15 0.00 -0.02 0.00 0.00 39.34 39.52 1nud n TYR 346 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nud n GLY 347 N 0.00 -1.24 0.00 2.72 0.00 -1.24 -4.45 105.19 100.97 1nud n GLY 347 Ca 0.19 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1nud n GLY 347 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nud n GLY 348 N -1.72 0.35 3.71 -0.02 0.00 -1.15 -4.86 105.19 101.50 1nud n GLY 348 Ca 0.13 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 1nud n GLY 348 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nud s TRP 349 N 0.00 2.75 0.10 1.61 0.23 -1.26 -2.60 118.94 119.77 1nud s TRP 349 Ca 0.00 0.44 0.09 0.00 -2.03 0.00 0.00 56.10 54.60 1nud s TRP 349 Cb 0.00 -3.98 -0.04 0.00 0.03 0.00 0.00 33.47 29.48 1nud s TRP 349 CO 0.00 -3.78 -0.22 -0.65 0.96 0.00 0.00 176.95 173.26 1nud s GLN 350 N 1.79 1.71 -0.14 4.98 -1.52 0.16 -1.78 119.66 124.86 1nud s GLN 350 Ca 0.73 -1.19 -0.16 0.00 -1.95 0.00 0.00 55.36 52.78 1nud s GLN 350 Cb -0.43 -2.04 -0.04 0.00 -0.22 0.00 0.00 33.01 30.27 1nud s GLN 350 CO 0.32 0.48 0.38 0.08 -0.25 0.00 0.00 175.29 176.31 1nud s VAL 351 N -1.04 5.25 -0.09 1.09 1.01 0.17 -0.13 120.40 126.66 1nud s VAL 351 Ca 0.15 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.88 1nud s VAL 351 Cb -0.10 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1nud s VAL 351 CO 0.07 0.35 -0.07 -0.76 0.00 0.00 0.00 175.10 174.69 1nud s LEU 352 N 0.61 1.24 -0.20 3.92 1.43 -0.07 -2.64 118.68 122.96 1nud s LEU 352 Ca 0.21 -0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1nud s LEU 352 Cb -0.14 -0.74 0.05 0.00 0.03 0.00 0.00 46.19 45.39 1nud s LEU 352 CO 0.07 -0.08 -0.04 -0.62 0.23 0.00 0.00 176.35 175.90 1nud s ASP 353 N 1.39 3.25 0.00 2.29 -1.08 -0.99 0.15 116.67 121.67 1nud s ASP 353 Ca -0.02 -0.89 0.26 0.00 -0.52 0.00 0.00 52.55 51.38 1nud s ASP 353 Cb -0.14 -0.99 0.66 0.00 -1.46 0.00 0.00 42.92 41.00 1nud s ASP 353 CO -0.04 -0.22 1.51 0.00 0.52 0.00 0.00 175.17 176.94 1nud n ALA 354 N 4.81 3.25 -1.99 3.66 0.00 -1.26 -3.90 120.51 125.08 1nud n ALA 354 Ca -0.12 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 1nud n ALA 354 Cb 0.46 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 1nud n ALA 354 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1nud s THR 355 N -2.67 3.21 -1.17 0.00 2.01 -1.26 -4.45 115.64 111.32 1nud s THR 355 Ca 0.20 0.62 -0.22 0.00 0.31 0.00 0.00 61.69 62.60 1nud s THR 355 Cb 0.19 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 1nud s THR 355 CO 0.58 -0.01 1.84 -2.16 -0.69 0.00 0.00 174.62 174.19 1nud s PRO 356 N 2.70 3.00 -0.14 4.92 0.04 -1.26 -4.56 135.00 139.70 1nud s PRO 356 Ca 0.72 -1.28 -0.13 0.00 0.04 0.00 0.00 61.00 60.35 1nud s PRO 356 Cb -0.38 -5.31 -0.06 0.00 0.04 0.00 0.00 34.50 28.79 1nud s PRO 356 CO 0.31 -3.29 -0.27 1.04 0.04 0.00 0.00 177.00 174.83 1nud n GLN 357 N 8.44 0.41 -5.04 4.56 6.02 -1.26 -5.03 117.38 125.47 1nud n GLN 357 Ca 0.44 0.17 -0.28 0.00 -0.01 0.00 0.00 57.00 57.33 1nud n GLN 357 Cb 0.47 -1.22 -0.16 0.00 1.02 0.00 0.00 30.24 30.35 1nud n GLN 357 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1nud s GLU 358 N -2.59 1.73 0.35 -1.09 2.56 -1.26 -5.12 118.70 113.27 1nud s GLU 358 Ca -0.24 -0.77 -0.21 0.00 0.00 0.00 0.00 54.97 53.74 1nud s GLU 358 Cb 0.06 -1.68 -0.10 0.00 2.00 0.00 0.00 34.13 34.41 1nud s GLU 358 CO 0.34 0.46 0.87 1.03 -0.56 0.00 0.00 175.26 177.40 1nud s ARG 359 N -0.52 4.30 -0.13 4.30 0.52 -1.26 -4.25 118.95 121.90 1nud s ARG 359 Ca 0.08 1.06 -0.02 0.00 -0.52 0.00 0.00 55.73 56.34 1nud s ARG 359 Cb -0.08 -2.52 0.04 0.00 0.52 0.00 0.00 34.95 32.91 1nud s ARG 359 CO -0.01 0.16 0.00 0.45 0.02 0.00 0.00 175.30 175.93 1nud s SER 360 N -1.94 2.27 -1.13 0.23 0.15 0.11 -4.69 113.70 108.68 1nud s SER 360 Ca 0.54 -0.44 -0.02 0.00 0.70 0.00 0.00 55.95 56.73 1nud s SER 360 Cb -0.13 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.59 1nud s SER 360 CO 0.18 -0.23 0.30 0.00 1.20 0.00 0.00 173.24 174.69 1nud n GLN 361 N 5.06 -2.74 0.00 5.44 6.02 -1.26 -2.79 117.38 127.10 1nud n GLN 361 Ca -0.09 0.66 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 1nud n GLN 361 Cb 0.49 -4.95 0.00 0.00 1.02 0.00 0.00 30.24 26.80 1nud n GLN 361 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nud n GLY 362 N -1.21 2.21 3.93 1.08 0.00 -1.26 -5.01 105.19 104.93 1nud n GLY 362 Ca -0.11 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 1nud n GLY 362 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nud s VAL 363 N -0.75 5.02 -1.10 1.61 -7.23 -1.12 -4.89 120.40 111.95 1nud s VAL 363 Ca 0.00 -1.09 -0.22 0.00 -1.81 0.00 0.00 61.98 58.86 1nud s VAL 363 Cb 0.00 -3.72 0.05 0.00 0.56 0.00 0.00 36.38 33.27 1nud s VAL 363 CO 0.00 -0.32 1.55 -0.36 -0.31 0.00 0.00 175.10 175.66 1nud s PHE 364 N -2.01 2.57 0.21 2.82 0.40 -1.26 0.06 117.98 120.77 1nud s PHE 364 Ca 0.34 -1.00 0.02 0.00 -0.60 0.00 0.00 56.93 55.69 1nud s PHE 364 Cb -0.09 -4.69 -0.05 0.00 0.51 0.00 0.00 43.02 38.70 1nud s PHE 364 CO 0.28 -1.89 0.01 1.14 0.70 0.00 0.00 175.22 175.46 1nud s GLN 365 N 4.84 1.23 -0.30 0.44 -2.07 -1.26 -4.21 119.66 118.34 1nud s GLN 365 Ca 0.49 -1.62 -0.14 0.00 -1.82 0.00 0.00 55.36 52.27 1nud s GLN 365 Cb 0.01 -0.40 0.15 0.00 -1.09 0.00 0.00 33.01 31.68 1nud s GLN 365 CO -0.05 -0.14 0.90 0.00 -1.32 0.00 0.00 175.29 174.69 1nud n GLY 367 N 4.86 1.87 3.76 0.00 0.00 -1.26 -2.35 105.19 112.07 1nud n GLY 367 Ca -0.12 -1.97 -0.40 0.00 0.00 0.00 0.00 46.02 43.53 1nud n GLY 367 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nud s PRO 368 N -2.42 4.64 -0.22 1.61 0.04 -1.26 -4.47 135.00 132.91 1nud s PRO 368 Ca 0.00 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.30 1nud s PRO 368 Cb 0.00 -3.29 0.06 0.00 0.04 0.00 0.00 34.50 31.30 1nud s PRO 368 CO 0.00 0.49 -0.06 0.00 0.04 0.00 0.00 177.00 177.47 1nud s ALA 369 N -0.90 1.93 0.11 8.56 0.00 -1.08 0.45 121.76 130.82 1nud s ALA 369 Ca 0.38 -1.29 -0.36 0.00 0.00 0.00 0.00 51.96 50.70 1nud s ALA 369 Cb -0.23 -1.38 -0.15 0.00 0.00 0.00 0.00 23.12 21.35 1nud s ALA 369 CO 0.27 -1.09 1.46 0.45 0.00 0.00 0.00 175.76 176.85 1nud n SER 370 N 4.69 2.30 0.10 0.00 2.88 -1.26 -0.66 113.62 121.67 1nud n SER 370 Ca -0.13 1.10 -0.01 0.00 -1.33 0.00 0.00 58.87 58.51 1nud n SER 370 Cb 0.45 -1.29 0.28 0.00 -0.75 0.00 0.00 64.21 62.89 1nud n SER 370 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1nud h VAL 371 N 3.52 1.26 -0.55 2.46 2.07 -1.68 -1.54 116.25 121.79 1nud h VAL 371 Ca -0.46 -1.26 -0.11 0.00 0.82 0.00 0.00 66.70 65.69 1nud h VAL 371 Cb 1.30 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 1nud h VAL 371 CO 0.83 0.38 -0.07 0.40 0.02 0.00 0.00 177.57 179.13 1nud h ILE 372 N 0.22 1.27 0.00 4.57 2.04 -1.83 -1.99 117.51 121.78 1nud h ILE 372 Ca 0.03 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 1nud h ILE 372 Cb 0.66 0.93 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1nud h ILE 372 CO 0.05 0.43 -0.06 1.23 0.00 0.00 0.00 178.15 179.81 1nud h GLY 373 N 0.90 0.00 0.75 5.37 0.00 -1.65 -3.01 103.07 105.43 1nud h GLY 373 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.27 1nud h GLY 373 CO 0.04 0.00 -0.90 -2.08 0.00 0.00 0.00 176.54 173.60 1nud h VAL 374 N 0.00 1.48 -0.22 4.60 2.07 -0.57 -2.31 116.25 121.30 1nud h VAL 374 Ca -0.00 -2.56 -0.01 0.00 0.82 0.00 0.00 66.70 64.95 1nud h VAL 374 Cb 0.22 3.18 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1nud h VAL 374 CO 0.01 0.73 0.07 -0.09 0.02 0.00 0.00 177.57 178.31 1nud h ARG 375 N -0.31 0.30 -0.01 1.57 2.43 -1.34 -2.10 114.38 114.91 1nud h ARG 375 Ca -0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1nud h ARG 375 Cb 1.71 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.20 1nud h ARG 375 CO 0.16 0.26 -0.10 0.39 -1.51 0.00 0.00 179.97 179.18 1nud n GLU 376 N -4.43 1.31 -2.95 0.20 -0.58 -1.20 -4.55 120.64 108.43 1nud n GLU 376 Ca 0.00 -0.74 -0.11 0.00 -0.42 0.00 0.00 57.16 55.89 1nud n GLU 376 Cb 0.13 -1.48 0.04 0.00 -0.57 0.00 0.00 31.44 29.56 1nud n GLU 376 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nud n GLY 377 N 1.24 0.11 2.70 0.62 0.00 -0.79 -4.91 105.19 104.16 1nud n GLY 377 Ca 0.16 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1nud n GLY 377 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nud n ASP 378 N -1.38 7.10 -0.02 1.61 8.00 -0.87 -4.17 116.55 126.81 1nud n ASP 378 Ca -0.06 -3.65 0.00 0.00 0.71 0.00 0.00 54.79 51.79 1nud n ASP 378 Cb 0.55 -1.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 1nud n ASP 378 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1nud n VAL 379 N 0.11 0.00 1.20 2.53 0.24 -1.26 -2.69 118.33 118.47 1nud n VAL 379 Ca 0.43 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.86 1nud n VAL 379 Cb 0.28 -0.21 0.31 0.00 -1.47 0.00 0.00 33.84 32.75 1nud n VAL 379 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nud n GLN 380 N -0.47 0.87 -3.06 7.34 -0.00 -1.26 -4.15 117.38 116.65 1nud n GLN 380 Ca 0.00 -0.56 -0.26 0.00 -0.00 0.00 0.00 57.00 56.19 1nud n GLN 380 Cb 0.01 -1.49 -0.01 0.00 -0.00 0.00 0.00 30.24 28.75 1nud n GLN 380 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1nud s LEU 381 N -2.51 3.85 0.25 2.61 1.43 -1.09 -5.09 118.68 118.13 1nud s LEU 381 Ca 0.23 0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 53.86 1nud s LEU 381 Cb 0.19 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.76 1nud s LEU 381 CO 0.53 -0.41 0.64 0.20 0.23 0.00 0.00 176.35 177.55 1nud s ASN 382 N -4.01 6.76 0.23 2.29 0.01 -1.26 -4.18 114.94 114.78 1nud s ASN 382 Ca 0.43 1.14 0.11 0.00 -0.71 0.00 0.00 52.86 53.83 1nud s ASN 382 Cb -0.10 -2.31 -0.05 0.00 0.41 0.00 0.00 41.25 39.20 1nud s ASN 382 CO 0.39 -0.09 -0.20 -0.36 -1.51 0.00 0.00 177.10 175.34 1nud s PHE 383 N -1.80 2.12 -1.73 2.20 0.40 0.17 -4.53 117.98 114.83 1nud s PHE 383 Ca 0.48 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 56.24 1nud s PHE 383 Cb -0.12 -0.98 0.16 0.00 0.51 0.00 0.00 43.02 42.59 1nud s PHE 383 CO 0.19 0.55 0.63 -0.25 0.70 0.00 0.00 175.22 177.04 1nud n ASP 384 N -0.22 -2.25 -0.04 1.36 8.00 -1.26 -4.20 116.55 117.94 1nud n ASP 384 Ca -0.09 -1.11 -0.16 0.00 0.71 0.00 0.00 54.79 54.15 1nud n ASP 384 Cb 0.59 -2.32 -0.07 0.00 -0.02 0.00 0.00 41.12 39.29 1nud n ASP 384 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 1nud h MET 385 N -1.35 0.66 -0.64 -1.24 2.86 -1.83 -2.32 114.93 111.08 1nud h MET 385 Ca -0.60 -0.49 0.11 0.00 -2.06 0.00 0.00 59.70 56.66 1nud h MET 385 Cb 1.39 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 33.05 1nud h MET 385 CO 0.80 1.11 0.23 -1.35 1.06 0.00 0.00 176.91 178.76 1nud h PRO 386 N 0.35 0.39 -0.24 -0.22 0.11 -1.89 0.17 132.00 130.66 1nud h PRO 386 Ca -0.02 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1nud h PRO 386 Cb 1.16 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1nud h PRO 386 CO 0.11 0.26 0.14 0.35 -0.21 0.00 0.00 178.00 178.65 1nud h PHE 387 N 0.40 0.33 -0.55 0.65 3.57 -1.92 -2.27 116.94 117.16 1nud h PHE 387 Ca 0.33 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 1nud h PHE 387 Cb 0.44 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1nud h PHE 387 CO -0.18 0.27 0.07 0.82 -2.23 0.00 0.00 178.31 177.06 1nud h ILE 388 N 0.29 1.26 -0.78 1.41 2.04 -0.81 -2.39 117.51 118.53 1nud h ILE 388 Ca 0.09 -1.00 0.04 0.00 1.00 0.00 0.00 64.86 64.99 1nud h ILE 388 Cb 0.04 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 36.91 1nud h ILE 388 CO -0.01 0.36 0.51 0.15 0.00 0.00 0.00 178.15 179.16 1nud h PHE 389 N 0.81 0.91 -0.00 1.37 3.57 -0.59 -1.24 116.94 121.76 1nud h PHE 389 Ca 0.16 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 1nud h PHE 389 Cb 0.44 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1nud h PHE 389 CO 0.03 0.51 -0.34 0.00 -2.23 0.00 0.00 178.31 176.28 1nud h ALA 390 N 1.55 1.43 -0.16 2.41 0.00 -0.92 0.19 119.26 123.76 1nud h ALA 390 Ca 0.32 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1nud h ALA 390 Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1nud h ALA 390 CO -0.10 0.43 -0.49 0.93 0.00 0.00 0.00 179.25 180.02 1nud h GLU 391 N 0.01 0.43 0.00 0.00 5.08 -0.80 -2.78 114.58 116.52 1nud h GLU 391 Ca -0.00 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1nud h GLU 391 Cb 0.60 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1nud h GLU 391 CO 0.04 0.83 -1.69 1.33 -1.00 0.00 0.00 179.01 178.52 1nud n VAL 392 N -3.97 0.31 -2.15 3.13 0.24 -1.03 -2.61 118.33 112.24 1nud n VAL 392 Ca -0.02 -0.54 -0.01 0.00 -2.04 0.00 0.00 64.34 61.73 1nud n VAL 392 Cb 0.56 -0.16 -0.01 0.00 -1.47 0.00 0.00 33.84 32.76 1nud n VAL 392 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1nud n ASN 393 N -2.44 0.05 -4.80 -1.34 5.15 0.62 -3.54 115.26 108.97 1nud n ASN 393 Ca -0.04 -1.80 -0.31 0.00 -0.60 0.00 0.00 54.58 51.82 1nud n ASN 393 Cb 0.60 -0.07 0.05 0.00 -0.53 0.00 0.00 39.78 39.84 1nud n ASN 393 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nud s ALA 394 N 0.00 2.58 0.03 5.20 0.00 -1.05 -4.93 121.76 123.59 1nud s ALA 394 Ca 0.10 0.19 -0.18 0.00 0.00 0.00 0.00 51.96 52.07 1nud s ALA 394 Cb 0.12 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.97 1nud s ALA 394 CO -0.05 -1.30 0.52 -0.51 0.00 0.00 0.00 175.76 174.42 1nud s ASP 395 N -3.51 6.96 -0.41 0.00 1.01 0.01 -4.63 116.67 116.10 1nud s ASP 395 Ca 0.60 1.14 -0.17 0.00 0.71 0.00 0.00 52.55 54.83 1nud s ASP 395 Cb -0.15 -2.33 0.02 0.00 1.01 0.00 0.00 42.92 41.47 1nud s ASP 395 CO 0.52 0.25 0.40 -0.60 0.21 0.00 0.00 175.17 175.95 1nud s ARG 396 N -0.85 3.15 -0.14 8.23 3.52 -0.18 -0.35 118.95 132.34 1nud s ARG 396 Ca 0.28 -0.75 -0.11 0.00 -0.13 0.00 0.00 55.73 55.02 1nud s ARG 396 Cb -0.18 -3.94 -0.05 0.00 -1.56 0.00 0.00 34.95 29.22 1nud s ARG 396 CO 0.17 -0.78 0.21 0.42 -0.81 0.00 0.00 175.30 174.51 1nud s ILE 397 N 2.04 5.37 -0.25 4.11 1.01 -0.34 -0.29 121.20 132.85 1nud s ILE 397 Ca 0.11 0.38 -0.06 0.00 0.00 0.00 0.00 60.65 61.08 1nud s ILE 397 Cb -0.17 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1nud s ILE 397 CO 0.13 0.50 0.03 -0.89 0.00 0.00 0.00 174.94 174.71 1nud s THR 398 N -0.24 3.84 0.06 2.92 2.01 -0.73 -2.06 115.64 121.44 1nud s THR 398 Ca 0.15 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.72 1nud s THR 398 Cb -0.13 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 1nud s THR 398 CO 0.03 0.30 0.14 0.26 -0.69 0.00 0.00 174.62 174.66 1nud s TRP 399 N 1.53 3.34 -0.11 4.92 0.52 0.40 0.29 118.94 129.83 1nud s TRP 399 Ca 0.05 0.16 -0.02 0.00 0.02 0.00 0.00 56.10 56.32 1nud s TRP 399 Cb -0.15 -1.69 -0.03 0.00 -1.15 0.00 0.00 33.47 30.45 1nud s TRP 399 CO 0.01 0.56 -0.04 -0.51 0.02 0.00 0.00 176.95 176.98 1nud s LEU 400 N -2.39 3.27 -0.18 2.99 2.01 -0.42 -1.84 118.68 122.13 1nud s LEU 400 Ca 0.31 -0.04 -0.04 0.00 0.01 0.00 0.00 54.13 54.37 1nud s LEU 400 Cb -0.13 -1.75 0.09 0.00 0.01 0.00 0.00 46.19 44.42 1nud s LEU 400 CO 0.24 0.28 0.30 -0.47 1.01 0.00 0.00 176.35 177.72 1nud s TYR 401 N -0.33 -0.54 -0.38 0.29 6.14 -0.23 -0.37 117.35 121.93 1nud s TYR 401 Ca 0.05 0.86 -0.13 0.00 0.64 0.00 0.00 57.07 58.50 1nud s TYR 401 Cb -0.12 -0.04 0.02 0.00 0.42 0.00 0.00 41.96 42.23 1nud s TYR 401 CO 0.02 -0.51 0.25 0.34 0.64 0.00 0.00 175.55 176.29 1nud s ASP 402 N 2.46 5.93 0.45 4.32 2.15 -1.07 -4.26 116.67 126.65 1nud s ASP 402 Ca 0.05 -0.87 0.14 0.00 0.43 0.00 0.00 52.55 52.29 1nud s ASP 402 Cb -0.14 -2.10 1.01 0.00 -0.30 0.00 0.00 42.92 41.40 1nud s ASP 402 CO -0.12 -0.39 2.00 -1.13 -0.17 0.00 0.00 175.17 175.36 1nud h ASN 403 N 8.53 0.02 0.00 -0.34 -1.24 -1.95 -1.04 115.58 119.56 1nud h ASN 403 Ca -0.27 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.74 1nud h ASN 403 Cb 1.12 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.16 1nud h ASN 403 CO 0.69 0.18 0.01 0.71 -1.29 0.00 0.00 177.43 177.73 1nud h THR 404 N 0.02 0.00 0.00 -3.57 1.35 -1.96 -2.72 112.91 106.03 1nud h THR 404 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1nud h THR 404 Cb 0.29 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1nud h THR 404 CO 0.02 0.00 -0.03 0.35 -0.25 0.00 0.00 175.52 175.61 1nud n THR 405 N -2.93 0.00 -0.83 6.82 -2.24 -0.84 -4.99 114.28 109.27 1nud n THR 405 Ca -0.03 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1nud n THR 405 Cb 0.07 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 1nud n THR 405 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nud n GLY 406 N 0.90 0.69 3.82 3.38 0.00 -0.45 -4.98 105.19 108.55 1nud n GLY 406 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1nud n GLY 406 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nud s LYS 407 N -0.32 3.73 -0.12 1.61 2.20 -1.21 -4.96 119.74 120.67 1nud s LYS 407 Ca 0.00 1.15 -0.08 0.00 -0.36 0.00 0.00 55.97 56.68 1nud s LYS 407 Cb 0.00 -2.10 0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1nud s LYS 407 CO 0.00 -0.47 0.30 -1.14 -0.36 0.00 0.00 175.35 173.69 1nud s GLN 408 N -3.80 0.30 -0.06 4.03 0.74 -1.26 -2.61 119.66 117.00 1nud s GLN 408 Ca 0.63 0.55 -0.02 0.00 0.05 0.00 0.00 55.36 56.57 1nud s GLN 408 Cb -0.13 -0.00 0.04 0.00 1.10 0.00 0.00 33.01 34.01 1nud s GLN 408 CO 0.29 -0.12 0.12 1.67 -0.55 0.00 0.00 175.29 176.70 1nud s TRP 409 N 0.92 -0.12 0.38 1.67 -2.14 0.51 -4.97 118.94 115.19 1nud s TRP 409 Ca -0.06 0.41 -0.25 0.00 2.66 0.00 0.00 56.10 58.86 1nud s TRP 409 Cb -0.07 -0.12 -0.12 0.00 -3.10 0.00 0.00 33.47 30.05 1nud s TRP 409 CO -0.07 -0.15 0.85 1.17 -2.66 0.00 0.00 176.95 176.09 1nud n LYS 410 N 4.24 1.06 -0.04 3.25 4.81 -1.26 -1.30 118.16 128.92 1nud n LYS 410 Ca -0.26 0.38 -0.05 0.00 -0.87 0.00 0.00 58.31 57.50 1nud n LYS 410 Cb 0.51 -1.79 -0.04 0.00 0.02 0.00 0.00 35.03 33.74 1nud n LYS 410 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1nud n ASN 411 N 0.97 3.38 -3.52 3.14 5.15 0.14 -4.78 115.26 119.75 1nud n ASN 411 Ca 0.10 -0.04 -0.02 0.00 -0.60 0.00 0.00 54.58 54.03 1nud n ASN 411 Cb 0.37 -0.12 0.01 0.00 -0.53 0.00 0.00 39.78 39.51 1nud n ASN 411 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1nud s SER 412 N -4.76 -0.02 -0.09 1.20 1.04 -1.16 -4.99 113.70 104.93 1nud s SER 412 Ca -0.11 -0.51 -0.03 0.00 0.48 0.00 0.00 55.95 55.78 1nud s SER 412 Cb 0.03 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.59 1nud s SER 412 CO 0.18 -0.78 0.17 -0.69 0.98 0.00 0.00 173.24 173.10 1nud s VAL 413 N -2.28 -0.24 -0.21 5.02 1.01 -1.26 -1.78 120.40 120.65 1nud s VAL 413 Ca 0.22 0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 1nud s VAL 413 Cb -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 36.38 36.05 1nud s VAL 413 CO 0.03 0.13 -0.06 0.21 0.00 0.00 0.00 175.10 175.41 1nud s ASN 414 N 2.12 4.20 -0.27 3.32 3.84 0.60 -4.97 114.94 123.79 1nud s ASN 414 Ca 0.01 -0.40 0.11 0.00 0.21 0.00 0.00 52.86 52.79 1nud s ASN 414 Cb -0.12 -1.71 0.57 0.00 -0.55 0.00 0.00 41.25 39.44 1nud s ASN 414 CO -0.06 -0.00 1.54 -1.20 -2.79 0.00 0.00 177.10 174.59 1nud n SER 415 N 4.67 3.44 0.00 -4.21 7.64 -1.26 -1.01 113.62 122.89 1nud n SER 415 Ca -0.18 -3.41 0.00 0.00 1.01 0.00 0.00 58.87 56.28 1nud n SER 415 Cb 0.51 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 1nud n SER 415 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1nud n HIS 416 N -0.77 0.00 0.05 1.43 8.25 -1.26 -4.84 115.22 118.08 1nud n HIS 416 Ca 0.33 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.74 1nud n HIS 416 Cb 1.10 0.00 0.16 0.00 1.12 0.00 0.00 29.99 32.36 1nud n HIS 416 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nud h THR 417 N 0.00 1.32 -3.63 1.59 1.03 -1.93 -3.45 112.91 107.84 1nud h THR 417 Ca 0.00 -1.62 -0.51 0.00 -0.01 0.00 0.00 66.41 64.28 1nud h THR 417 Cb 0.00 1.68 -0.02 0.00 -1.07 0.00 0.00 68.15 68.74 1nud h THR 417 CO 0.00 0.49 0.29 -0.63 -0.01 0.00 0.00 175.52 175.66 1nud s ILE 418 N -4.12 4.27 -0.14 0.00 1.01 -1.26 -4.49 121.20 116.46 1nud s ILE 418 Ca -0.06 1.94 -0.01 0.00 0.00 0.00 0.00 60.65 62.52 1nud s ILE 418 Cb 0.13 -4.26 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1nud s ILE 418 CO 0.80 0.47 0.15 0.61 0.00 0.00 0.00 174.94 176.96 1nud n GLY 419 N 1.70 -0.58 3.34 6.18 0.00 -0.86 -4.54 105.19 110.44 1nud n GLY 419 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 1nud n GLY 419 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nud s ARG 420 N -2.61 1.30 -1.65 1.61 0.52 -0.80 -4.83 118.95 112.50 1nud s ARG 420 Ca 0.01 -1.59 -0.21 0.00 -0.52 0.00 0.00 55.73 53.42 1nud s ARG 420 Cb -0.00 -1.00 0.21 0.00 0.52 0.00 0.00 34.95 34.68 1nud s ARG 420 CO 0.16 0.13 0.52 0.66 0.02 0.00 0.00 175.30 176.80 1nud n TYR 421 N -0.37 -1.25 -1.53 -0.53 0.53 -1.26 -2.22 117.16 110.53 1nud n TYR 421 Ca -0.08 0.60 -0.46 0.00 -1.02 0.00 0.00 57.90 56.94 1nud n TYR 421 Cb 0.61 -1.74 -0.05 0.00 -1.03 0.00 0.00 39.34 37.13 1nud n TYR 421 CO 0.00 0.00 0.00 -0.89 -1.02 0.00 0.00 176.86 174.95 1nud n ILE 422 N -3.84 0.25 -4.34 -0.72 5.41 -1.26 -4.60 119.36 110.26 1nud n ILE 422 Ca 0.10 -0.39 -0.23 0.00 1.00 0.00 0.00 62.75 63.23 1nud n ILE 422 Cb 0.45 -2.16 -0.08 0.00 -0.71 0.00 0.00 39.64 37.15 1nud n ILE 422 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1nud s SER 423 N 8.12 4.32 0.02 4.38 0.01 0.14 -0.17 113.70 130.52 1nud s SER 423 Ca 1.05 -0.74 -0.19 0.00 1.31 0.00 0.00 55.95 57.38 1nud s SER 423 Cb -0.56 -0.71 0.04 0.00 0.21 0.00 0.00 66.02 64.99 1nud s SER 423 CO 0.41 0.01 0.42 0.28 0.41 0.00 0.00 173.24 174.76 1nud s THR 424 N -2.37 0.05 0.13 1.44 -1.32 -0.31 -0.20 115.64 113.07 1nud s THR 424 Ca 0.31 -0.41 -0.31 0.00 -1.21 0.00 0.00 61.69 60.07 1nud s THR 424 Cb -0.06 -0.88 -0.09 0.00 -1.51 0.00 0.00 72.50 69.97 1nud s THR 424 CO 0.19 -0.23 1.45 -0.75 -2.21 0.00 0.00 174.62 173.07 1nud s LYS 425 N -2.05 4.29 0.87 7.08 2.20 -1.26 -1.02 119.74 129.84 1nud s LYS 425 Ca -0.08 2.17 -0.12 0.00 -0.36 0.00 0.00 55.97 57.58 1nud s LYS 425 Cb -0.02 -3.21 0.11 0.00 -1.51 0.00 0.00 37.83 33.19 1nud s LYS 425 CO 0.01 -0.49 1.08 0.00 -0.36 0.00 0.00 175.35 175.59 1nud n ALA 426 N 3.92 -0.69 -2.54 3.13 0.00 -0.08 -4.81 120.51 119.44 1nud n ALA 426 Ca 0.12 -0.46 -0.43 0.00 0.00 0.00 0.00 53.44 52.67 1nud n ALA 426 Cb 0.41 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 1nud n ALA 426 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nud s VAL 427 N -2.39 4.31 0.00 0.00 1.01 -1.26 -3.65 120.40 118.42 1nud s VAL 427 Ca 0.69 1.47 0.00 0.00 0.00 0.00 0.00 61.98 64.13 1nud s VAL 427 Cb -0.26 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.78 1nud s VAL 427 CO 0.56 -0.57 0.00 0.61 0.00 0.00 0.00 175.10 175.70 1nud n GLY 428 N 4.22 0.45 3.80 4.51 0.00 -1.26 -5.00 105.19 111.90 1nud n GLY 428 Ca 0.13 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.55 1nud n GLY 428 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nud s SER 429 N -2.50 -0.16 0.00 1.61 1.04 -1.24 -5.04 113.70 107.41 1nud s SER 429 Ca 0.00 -0.55 0.21 0.00 0.48 0.00 0.00 55.95 56.08 1nud s SER 429 Cb 0.00 0.58 0.72 0.00 0.10 0.00 0.00 66.02 67.42 1nud s SER 429 CO 0.00 -1.10 1.53 0.59 0.98 0.00 0.00 173.24 175.24 1nud n ASN 430 N -0.63 1.76 -4.74 7.02 3.02 -1.26 -3.94 115.26 116.49 1nud n ASN 430 Ca -0.05 -1.73 -0.38 0.00 -0.03 0.00 0.00 54.58 52.39 1nud n ASN 430 Cb 0.60 -0.12 0.06 0.00 -0.61 0.00 0.00 39.78 39.71 1nud n ASN 430 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nud n ALA 431 N 0.39 1.42 -2.62 5.41 0.00 -1.26 -4.75 120.51 119.11 1nud n ALA 431 Ca 0.16 0.07 -0.42 0.00 0.00 0.00 0.00 53.44 53.25 1nud n ALA 431 Cb 0.34 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.40 1nud n ALA 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1nud s ARG 432 N -3.13 3.97 -0.23 0.00 3.52 -1.26 -0.91 118.95 120.92 1nud s ARG 432 Ca 0.77 0.64 -0.13 0.00 -0.13 0.00 0.00 55.73 56.88 1nud s ARG 432 Cb -0.40 -3.73 -0.05 0.00 -1.56 0.00 0.00 34.95 29.22 1nud s ARG 432 CO 0.45 -0.70 0.26 1.41 -0.81 0.00 0.00 175.30 175.91 1nud s MET 433 N 3.02 4.09 -0.28 5.12 -2.45 -0.19 -4.89 119.30 123.72 1nud s MET 433 Ca 0.34 -0.10 -0.18 0.00 -1.25 0.00 0.00 55.69 54.50 1nud s MET 433 Cb -0.14 -3.56 -0.02 0.00 1.25 0.00 0.00 34.83 32.36 1nud s MET 433 CO 0.13 -0.02 0.51 0.34 1.05 0.00 0.00 175.02 177.02 1nud s ASP 434 N 1.16 6.40 -0.20 1.11 -1.08 -1.26 -1.16 116.67 121.63 1nud s ASP 434 Ca 0.12 0.39 0.15 0.00 -0.52 0.00 0.00 52.55 52.69 1nud s ASP 434 Cb -0.14 -2.27 0.51 0.00 -1.46 0.00 0.00 42.92 39.56 1nud s ASP 434 CO 0.07 -0.32 1.42 1.33 0.52 0.00 0.00 175.17 178.18 1nud n VAL 435 N 5.22 2.32 -0.33 1.11 0.24 0.77 -4.69 118.33 122.97 1nud n VAL 435 Ca -0.04 -2.06 0.00 0.00 -2.04 0.00 0.00 64.34 60.20 1nud n VAL 435 Cb 0.50 -0.27 0.14 0.00 -1.47 0.00 0.00 33.84 32.73 1nud n VAL 435 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1nud h THR 436 N 1.54 1.10 0.00 3.34 2.02 -1.92 0.70 112.91 119.68 1nud h THR 436 Ca 0.05 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1nud h THR 436 Cb 1.48 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1nud h THR 436 CO 0.25 0.20 0.00 -0.90 0.37 0.00 0.00 175.52 175.44 1nud n ASP 437 N -4.56 0.00 -0.05 4.18 5.75 -1.26 -1.28 116.55 119.34 1nud n ASP 437 Ca 0.13 0.18 -0.09 0.00 -0.01 0.00 0.00 54.79 55.00 1nud n ASP 437 Cb 0.14 -0.26 -0.15 0.00 -1.03 0.00 0.00 41.12 39.82 1nud n ASP 437 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1nud n LYS 438 N -1.26 0.65 0.06 0.11 4.76 0.23 -4.26 118.16 118.46 1nud n LYS 438 Ca 0.03 0.20 0.12 0.00 -2.87 0.00 0.00 58.31 55.78 1nud n LYS 438 Cb 0.04 -1.70 0.13 0.00 -1.84 0.00 0.00 35.03 31.65 1nud n LYS 438 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1nud h TYR 439 N 0.00 0.00 -2.31 2.13 -1.99 -1.16 -3.41 116.97 110.23 1nud h TYR 439 Ca -0.37 0.00 0.13 0.00 2.00 0.00 0.00 58.73 60.49 1nud h TYR 439 Cb 2.09 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 40.69 1nud h TYR 439 CO 0.00 0.00 0.49 -1.59 -0.00 0.00 0.00 178.16 177.06 1nud s LYS 440 N -3.20 0.95 0.77 4.88 -2.85 -0.99 -3.33 119.74 115.97 1nud s LYS 440 Ca 0.05 -0.43 -0.11 0.00 -1.00 0.00 0.00 55.97 54.48 1nud s LYS 440 Cb 0.13 0.39 0.05 0.00 -2.06 0.00 0.00 37.83 36.34 1nud s LYS 440 CO 0.74 -0.43 1.09 0.71 0.10 0.00 0.00 175.35 177.57 1nud s TYR 441 N -3.18 2.95 0.08 1.78 1.51 -1.26 -4.40 117.35 114.82 1nud s TYR 441 Ca 0.07 1.17 -0.33 0.00 -1.01 0.00 0.00 57.07 56.97 1nud s TYR 441 Cb -0.01 -3.08 -0.13 0.00 -0.11 0.00 0.00 41.96 38.63 1nud s TYR 441 CO -0.05 -1.61 1.72 -2.30 -1.11 0.00 0.00 175.55 172.20 1nud n PRO 442 N -3.33 2.29 -1.75 -1.71 -0.02 -1.26 -4.71 135.00 124.51 1nud n PRO 442 Ca 0.07 0.83 -0.42 0.00 -2.02 0.00 0.00 63.50 61.97 1nud n PRO 442 Cb 0.56 -2.65 -0.01 0.00 -0.02 0.00 0.00 33.50 31.38 1nud n PRO 442 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1nud n GLU 443 N 4.84 2.72 -0.30 -0.52 -0.58 -1.26 -1.29 120.64 124.25 1nud n GLU 443 Ca 0.19 0.97 0.00 0.00 -0.42 0.00 0.00 57.16 57.90 1nud n GLU 443 Cb 0.31 -2.75 0.00 0.00 -0.57 0.00 0.00 31.44 28.43 1nud n GLU 443 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nud n GLY 444 N 1.94 0.85 3.36 0.62 0.00 -1.26 -5.07 105.19 105.63 1nud n GLY 444 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1nud n GLY 444 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nud s SER 445 N -2.02 3.22 0.43 1.61 1.04 -0.41 -5.03 113.70 112.54 1nud s SER 445 Ca 0.00 -0.66 0.15 0.00 0.48 0.00 0.00 55.95 55.92 1nud s SER 445 Cb 0.00 -0.26 1.04 0.00 0.10 0.00 0.00 66.02 66.91 1nud s SER 445 CO 0.00 0.22 1.93 0.44 0.98 0.00 0.00 173.24 176.81 1nud h ASP 446 N 4.40 0.39 -0.51 7.02 5.19 -1.98 -1.96 116.42 128.97 1nud h ASP 446 Ca -0.48 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 55.92 1nud h ASP 446 Cb 1.15 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 1nud h ASP 446 CO 0.42 0.21 0.23 1.56 -3.12 0.00 0.00 179.24 178.53 1nud h GLN 447 N 0.42 0.75 -0.92 3.56 7.50 -1.96 0.57 115.11 125.04 1nud h GLN 447 Ca 0.35 -0.12 0.00 0.00 0.50 0.00 0.00 58.65 59.38 1nud h GLN 447 Cb 0.79 -0.13 -0.04 0.00 0.05 0.00 0.00 27.48 28.15 1nud h GLN 447 CO -0.11 0.65 0.58 1.05 -1.50 0.00 0.00 178.83 179.50 1nud h GLU 448 N 0.69 1.23 -0.20 1.46 -0.00 -1.58 0.52 114.58 116.70 1nud h GLU 448 Ca 0.17 -0.09 -0.17 0.00 -0.00 0.00 0.00 59.36 59.27 1nud h GLU 448 Cb 0.16 -0.27 -0.00 0.00 -0.00 0.00 0.00 28.75 28.64 1nud h GLU 448 CO -0.02 0.84 -0.56 -0.09 -0.00 0.00 0.00 179.01 179.18 1nud h ARG 449 N 1.26 0.62 -0.44 1.06 9.65 -1.21 -2.41 114.38 122.91 1nud h ARG 449 Ca 0.33 -0.40 -0.09 0.00 -1.10 0.00 0.00 59.98 58.72 1nud h ARG 449 Cb -0.10 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.51 1nud h ARG 449 CO -0.07 1.01 -0.10 1.96 2.80 0.00 0.00 179.97 185.57 1nud h GLN 450 N 0.47 0.79 0.00 0.20 4.20 0.95 -2.90 115.11 118.82 1nud h GLN 450 Ca 0.01 -0.26 -0.23 0.00 0.06 0.00 0.00 58.65 58.22 1nud h GLN 450 Cb 1.12 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.84 1nud h GLN 450 CO 0.11 0.86 -0.97 0.28 -0.67 0.00 0.00 178.83 178.44 1nud h VAL 451 N 0.72 1.38 0.05 -0.54 2.07 -0.90 -2.55 116.25 116.48 1nud h VAL 451 Ca 0.12 -2.42 0.02 0.00 0.82 0.00 0.00 66.70 65.24 1nud h VAL 451 Cb 0.58 2.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.74 1nud h VAL 451 CO 0.04 0.73 -0.23 0.15 0.02 0.00 0.00 177.57 178.27 1nud h PHE 452 N 0.26 -0.62 -0.38 1.57 3.57 -1.34 0.86 116.94 120.86 1nud h PHE 452 Ca -0.09 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.39 1nud h PHE 452 Cb 1.61 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 40.60 1nud h PHE 452 CO 0.07 -0.32 0.08 0.37 -2.23 0.00 0.00 178.31 176.28 1nud h GLN 453 N -0.39 0.57 -0.24 1.11 4.15 -1.59 0.19 115.11 118.90 1nud h GLN 453 Ca 0.05 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1nud h GLN 453 Cb 0.45 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 1nud h GLN 453 CO -0.17 0.53 0.15 -0.22 -1.93 0.00 0.00 178.83 177.19 1nud h LYS 454 N 0.55 0.33 -0.31 1.69 3.64 -0.85 0.65 116.57 122.27 1nud h LYS 454 Ca 0.13 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1nud h LYS 454 Cb 0.23 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1nud h LYS 454 CO -0.00 0.24 -0.05 0.00 -2.27 0.00 0.00 179.45 177.37 1nud h ALA 455 N 1.06 0.42 -0.89 5.00 0.00 -0.13 -2.62 119.26 122.11 1nud h ALA 455 Ca 0.09 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1nud h ALA 455 Cb -0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 1nud h ALA 455 CO -0.02 0.22 0.55 1.25 0.00 0.00 0.00 179.25 181.25 1nud h LEU 456 N 0.36 0.84 -0.99 0.00 5.85 -0.51 -1.38 115.31 119.48 1nud h LEU 456 Ca 0.08 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.92 1nud h LEU 456 Cb 0.52 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.33 1nud h LEU 456 CO 0.03 0.52 0.63 1.23 -0.34 0.00 0.00 178.44 180.51 1nud h GLY 457 N 0.97 1.57 2.00 3.75 0.00 -0.51 -0.62 103.07 110.23 1nud h GLY 457 Ca 0.40 -0.45 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 1nud h GLY 457 CO -0.20 0.25 -0.27 0.50 0.00 0.00 0.00 176.54 176.82 1nud h LYS 458 N 1.08 0.00 -0.07 4.80 1.57 -0.94 -2.49 116.57 120.53 1nud h LYS 458 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1nud h LYS 458 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1nud h LYS 458 CO -0.22 0.27 0.00 1.28 -0.57 0.00 0.00 179.45 180.21 1nud n LEU 459 N -3.63 1.87 0.00 2.94 4.77 -0.32 -5.04 117.00 117.59 1nud n LEU 459 Ca -0.01 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 1nud n LEU 459 Cb 0.40 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1nud n LEU 459 CO 0.34 0.33 0.00 0.29 -1.33 0.00 0.00 177.39 177.03 1nud n LYS 460 N 0.46 0.00 0.00 3.23 4.01 -0.69 -5.01 118.16 120.15 1nud n LYS 460 Ca 0.18 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.98 1nud n LYS 460 Cb 0.40 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.92 1nud n LYS 460 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1nud n PRO 480 N 0.00 0.00 -0.04 1.97 -0.04 -1.26 -5.02 135.00 130.61 1nud n PRO 480 Ca 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 1nud n PRO 480 Cb 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.37 1nud n PRO 480 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1nud h SER 481 N 0.00 0.24 -3.09 3.54 0.02 -1.95 -3.46 113.55 108.85 1nud h SER 481 Ca 0.00 -0.55 -0.60 0.00 -0.84 0.00 0.00 61.79 59.81 1nud h SER 481 Cb 0.00 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.43 1nud h SER 481 CO 0.00 0.74 -0.26 -0.63 -1.14 0.00 0.00 176.83 175.54 1nud s ILE 482 N -4.03 5.11 0.04 3.27 1.09 -1.26 -1.58 121.20 123.85 1nud s ILE 482 Ca -0.15 0.44 0.08 0.00 -1.10 0.00 0.00 60.65 59.92 1nud s ILE 482 Cb 0.03 -3.64 -0.03 0.00 -1.06 0.00 0.00 42.46 37.76 1nud s ILE 482 CO 0.73 0.31 -0.23 0.27 -0.10 0.00 0.00 174.94 175.91 1nud s ILE 483 N -1.38 1.88 0.03 2.92 -4.36 -0.39 -4.95 121.20 114.95 1nud s ILE 483 Ca 0.32 -1.28 -0.09 0.00 -0.26 0.00 0.00 60.65 59.34 1nud s ILE 483 Cb -0.14 -1.62 0.00 0.00 1.25 0.00 0.00 42.46 41.95 1nud s ILE 483 CO 0.18 0.28 0.18 -0.83 0.24 0.00 0.00 174.94 174.98 1nud s GLY 484 N -1.20 0.04 -0.10 6.27 0.00 -1.25 -1.42 107.32 109.65 1nud s GLY 484 Ca 0.09 -0.23 -0.09 0.00 0.00 0.00 0.00 44.72 44.49 1nud s GLY 484 CO 0.02 -0.39 0.27 1.25 0.00 0.00 0.00 173.10 174.24 1nud s LYS 485 N -2.16 0.31 -0.17 2.90 2.20 -0.42 -4.87 119.74 117.52 1nud s LYS 485 Ca -0.08 0.39 -0.15 0.00 -0.36 0.00 0.00 55.97 55.77 1nud s LYS 485 Cb -0.03 0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.37 1nud s LYS 485 CO -0.02 -0.05 0.34 -0.51 -0.36 0.00 0.00 175.35 174.75 1nud s LEU 486 N 0.26 4.22 -0.13 5.43 1.43 -1.26 -0.12 118.68 128.51 1nud s LEU 486 Ca -0.01 0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 1nud s LEU 486 Cb -0.03 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.73 1nud s LEU 486 CO -0.01 0.04 -0.14 -0.75 0.23 0.00 0.00 176.35 175.72 1nud s LYS 487 N 0.72 3.36 0.21 1.70 2.20 0.24 -4.90 119.74 123.27 1nud s LYS 487 Ca 0.18 -0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 54.79 1nud s LYS 487 Cb -0.14 -2.60 -0.08 0.00 -1.51 0.00 0.00 37.83 33.50 1nud s LYS 487 CO 0.06 0.21 1.04 0.08 -0.36 0.00 0.00 175.35 176.38 1nud s VAL 488 N 0.34 3.91 -0.17 4.02 1.01 -1.26 0.19 120.40 128.44 1nud s VAL 488 Ca -0.12 1.78 0.01 0.00 0.00 0.00 0.00 61.98 63.65 1nud s VAL 488 Cb -0.16 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1nud s VAL 488 CO 0.06 0.37 -0.20 0.00 0.00 0.00 0.00 175.10 175.33 1nud s ALA 489 N -0.72 2.27 0.18 5.51 0.00 0.58 -4.92 121.76 124.66 1nud s ALA 489 Ca 0.45 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1nud s ALA 489 Cb -0.28 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.71 1nud s ALA 489 CO 0.35 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.24 1nud n GLY 490 N 4.51 -2.15 3.76 0.00 0.00 -1.26 -4.28 105.19 105.77 1nud n GLY 490 Ca -0.21 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.12 1nud n GLY 490 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nud s MET 491 N -2.39 2.79 -0.22 1.61 -1.94 -1.26 -4.93 119.30 112.95 1nud s MET 491 Ca 0.00 1.53 -0.01 0.00 -1.71 0.00 0.00 55.69 55.50 1nud s MET 491 Cb 0.00 -1.94 0.02 0.00 2.01 0.00 0.00 34.83 34.92 1nud s MET 491 CO 0.00 -1.29 -0.09 -0.51 -0.01 0.00 0.00 175.02 173.12 1nud s LEU 492 N -4.67 2.85 -0.15 -0.03 1.43 -1.26 -4.87 118.68 111.98 1nud s LEU 492 Ca 0.70 -0.70 -0.13 0.00 -1.03 0.00 0.00 54.13 52.97 1nud s LEU 492 Cb -0.23 -1.63 0.04 0.00 0.03 0.00 0.00 46.19 44.39 1nud s LEU 492 CO 0.39 -0.07 0.40 0.00 0.23 0.00 0.00 176.35 177.30 1nud s ALA 493 N 1.35 -0.98 -0.22 4.21 0.00 -1.26 -0.62 121.76 124.23 1nud s ALA 493 Ca 0.03 1.17 -0.33 0.00 0.00 0.00 0.00 51.96 52.82 1nud s ALA 493 Cb -0.15 -0.68 -0.10 0.00 0.00 0.00 0.00 23.12 22.19 1nud s ALA 493 CO -0.06 -0.20 2.10 0.28 0.00 0.00 0.00 175.76 177.88 1nud n VAL 494 N 3.04 0.37 0.00 0.00 0.31 0.11 -1.02 118.33 121.14 1nud n VAL 494 Ca -0.14 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 1nud n VAL 494 Cb 0.57 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 1nud n VAL 494 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nud n GLY 495 N 5.61 0.93 3.99 2.92 0.00 -1.26 -4.64 105.19 112.75 1nud n GLY 495 Ca 0.32 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.14 1nud n GLY 495 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nud s LYS 496 N 0.00 2.61 0.30 1.61 1.02 -0.19 -4.81 119.74 120.28 1nud s LYS 496 Ca 0.00 -1.04 -0.11 0.00 0.02 0.00 0.00 55.97 54.83 1nud s LYS 496 Cb 0.00 -2.61 -0.08 0.00 -0.52 0.00 0.00 37.83 34.63 1nud s LYS 496 CO 0.00 -0.56 0.65 -1.83 -0.92 0.00 0.00 175.35 172.69 1nud s GLU 497 N -4.60 3.86 -0.15 1.68 -1.05 -1.26 -4.23 118.70 112.94 1nud s GLU 497 Ca 0.57 0.43 -0.14 0.00 -0.15 0.00 0.00 54.97 55.67 1nud s GLU 497 Cb -0.10 -2.53 -0.05 0.00 -0.44 0.00 0.00 34.13 31.02 1nud s GLU 497 CO 0.36 0.20 0.32 0.08 0.95 0.00 0.00 175.26 177.17 1nud s VAL 498 N -1.99 5.29 -0.14 1.83 1.01 0.66 -4.87 120.40 122.19 1nud s VAL 498 Ca 0.50 0.61 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1nud s VAL 498 Cb -0.11 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.64 1nud s VAL 498 CO 0.22 0.38 -0.13 0.20 0.00 0.00 0.00 175.10 175.76 1nud s ASN 499 N 0.50 2.60 0.35 3.32 0.01 -1.26 -1.22 114.94 119.25 1nud s ASN 499 Ca 0.18 -0.46 0.04 0.00 -0.71 0.00 0.00 52.86 51.91 1nud s ASN 499 Cb -0.13 -1.13 -0.06 0.00 0.41 0.00 0.00 41.25 40.33 1nud s ASN 499 CO 0.05 -0.06 0.05 -0.76 -1.51 0.00 0.00 177.10 174.87 1nud s LEU 500 N 1.48 2.30 -0.19 0.60 1.43 -0.04 -0.31 118.68 123.95 1nud s LEU 500 Ca 0.04 -1.41 -0.04 0.00 -1.03 0.00 0.00 54.13 51.69 1nud s LEU 500 Cb -0.13 -0.47 0.09 0.00 0.03 0.00 0.00 46.19 45.71 1nud s LEU 500 CO -0.10 -0.61 0.22 -0.69 0.23 0.00 0.00 176.35 175.41 1nud s VAL 501 N -3.16 -0.33 -0.15 -1.59 1.01 0.13 -1.23 120.40 115.08 1nud s VAL 501 Ca 0.34 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.99 1nud s VAL 501 Cb 0.08 -0.63 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 1nud s VAL 501 CO 0.15 -0.15 1.21 -0.22 0.00 0.00 0.00 175.10 176.10 1nud s LEU 502 N 2.34 4.19 -0.23 3.92 2.96 -0.37 -0.59 118.68 130.90 1nud s LEU 502 Ca 0.06 1.67 -0.06 0.00 -0.22 0.00 0.00 54.13 55.58 1nud s LEU 502 Cb -0.15 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.97 1nud s LEU 502 CO -0.11 -0.70 0.03 -0.76 -1.32 0.00 0.00 176.35 173.48 1nud s LEU 503 N 3.13 3.28 0.18 -0.68 1.43 0.83 -1.09 118.68 125.75 1nud s LEU 503 Ca 0.53 -0.24 0.10 0.00 -1.03 0.00 0.00 54.13 53.50 1nud s LEU 503 Cb -0.21 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1nud s LEU 503 CO 0.15 0.00 -0.22 -0.76 0.23 0.00 0.00 176.35 175.75 1nud s LEU 504 N 1.39 2.42 -0.15 1.79 1.43 0.53 -1.31 118.68 124.78 1nud s LEU 504 Ca 0.05 -0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 52.16 1nud s LEU 504 Cb -0.15 -1.04 0.04 0.00 0.03 0.00 0.00 46.19 45.07 1nud s LEU 504 CO 0.02 0.07 0.41 -0.75 0.23 0.00 0.00 176.35 176.32 1nud s LYS 505 N -2.64 0.47 -0.47 1.70 2.20 -0.51 -0.74 119.74 119.74 1nud s LYS 505 Ca 0.18 0.58 -0.17 0.00 -0.36 0.00 0.00 55.97 56.20 1nud s LYS 505 Cb -0.07 0.21 0.05 0.00 -1.51 0.00 0.00 37.83 36.51 1nud s LYS 505 CO 0.08 -0.06 0.48 1.21 -0.36 0.00 0.00 175.35 176.70 1nud s ASN 506 N 0.30 6.18 0.00 1.43 3.04 -0.76 -1.27 114.94 123.87 1nud s ASN 506 Ca -0.01 -1.03 0.16 0.00 0.04 0.00 0.00 52.86 52.02 1nud s ASN 506 Cb -0.03 -2.23 0.51 0.00 -1.54 0.00 0.00 41.25 37.96 1nud s ASN 506 CO -0.00 -0.71 1.39 0.18 -3.04 0.00 0.00 177.10 174.92 1nud n LEU 507 N 5.62 1.93 -4.94 3.21 4.32 -0.61 0.18 117.00 126.71 1nud n LEU 507 Ca -0.09 -0.90 -0.26 0.00 -0.02 0.00 0.00 56.01 54.74 1nud n LEU 507 Cb 0.45 -0.19 -0.03 0.00 -1.62 0.00 0.00 43.42 42.03 1nud n LEU 507 CO 0.49 0.45 -0.06 -0.94 -1.22 0.00 0.00 177.39 176.11 1nud s SER 508 N -1.24 6.35 0.00 -1.43 1.04 -1.26 -4.84 113.70 112.31 1nud s SER 508 Ca 0.29 0.21 0.19 0.00 0.48 0.00 0.00 55.95 57.12 1nud s SER 508 Cb 0.15 -1.93 1.14 0.00 0.10 0.00 0.00 66.02 65.48 1nud s SER 508 CO 0.21 0.01 1.54 -2.11 0.98 0.00 0.00 173.24 173.88 1nud n ARG 509 N -0.69 0.65 -4.20 4.02 1.85 -1.26 -3.93 116.66 113.09 1nud n ARG 509 Ca -0.07 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.50 1nud n ARG 509 Cb 0.54 -1.46 -0.08 0.00 -1.05 0.00 0.00 32.46 30.41 1nud n ARG 509 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1nud s ASP 510 N -1.95 4.68 -0.15 2.89 -0.00 -1.26 -4.76 116.67 116.12 1nud s ASP 510 Ca 0.29 -0.37 -0.23 0.00 -0.00 0.00 0.00 52.55 52.24 1nud s ASP 510 Cb 0.13 -0.98 -0.03 0.00 -0.00 0.00 0.00 42.92 42.04 1nud s ASP 510 CO 0.22 0.13 0.70 -0.89 -0.00 0.00 0.00 175.17 175.33 1nud s THR 511 N -1.51 4.99 0.31 -1.27 2.01 -1.26 -3.65 115.64 115.25 1nud s THR 511 Ca 0.25 1.38 0.10 0.00 0.31 0.00 0.00 61.69 63.73 1nud s THR 511 Cb -0.10 -4.02 -0.06 0.00 0.01 0.00 0.00 72.50 68.33 1nud s THR 511 CO 0.17 0.13 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.56 1nud s LYS 512 N 1.66 1.72 -0.23 4.92 -0.14 -0.48 -4.98 119.74 122.22 1nud s LYS 512 Ca 0.34 -1.85 -0.02 0.00 -1.36 0.00 0.00 55.97 53.07 1nud s LYS 512 Cb -0.16 -1.65 0.01 0.00 -1.68 0.00 0.00 37.83 34.35 1nud s LYS 512 CO 0.13 0.20 -0.07 0.99 -0.76 0.00 0.00 175.35 175.84 1nud s THR 513 N -2.63 2.98 -0.06 2.17 2.01 -1.26 -1.15 115.64 117.70 1nud s THR 513 Ca 0.31 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.54 1nud s THR 513 Cb -0.00 -2.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 1nud s THR 513 CO 0.15 0.32 -0.20 0.54 -0.69 0.00 0.00 174.62 174.73 1nud s VAL 514 N 1.38 2.50 -0.19 3.82 0.11 0.94 -3.86 120.40 125.09 1nud s VAL 514 Ca 0.03 -0.91 -0.07 0.00 -2.93 0.00 0.00 61.98 58.09 1nud s VAL 514 Cb -0.15 -1.95 -0.04 0.00 -1.53 0.00 0.00 36.38 32.71 1nud s VAL 514 CO -0.05 0.57 0.06 -0.89 -3.33 0.00 0.00 175.10 171.46 1nud s THR 515 N -0.31 4.69 -0.23 5.04 2.01 -0.30 -0.93 115.64 125.62 1nud s THR 515 Ca 0.01 -0.07 0.02 0.00 0.31 0.00 0.00 61.69 61.97 1nud s THR 515 Cb -0.13 -3.12 0.04 0.00 0.01 0.00 0.00 72.50 69.30 1nud s THR 515 CO 0.02 0.44 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.56 1nud s VAL 516 N 0.59 2.16 -0.25 3.82 1.01 0.13 -0.97 120.40 126.89 1nud s VAL 516 Ca 0.03 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.56 1nud s VAL 516 Cb -0.13 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1nud s VAL 516 CO 0.01 0.19 0.13 0.20 0.00 0.00 0.00 175.10 175.63 1nud s ASN 517 N 1.18 5.70 0.09 3.32 0.02 -0.77 -1.69 114.94 122.79 1nud s ASN 517 Ca -0.03 -0.03 0.08 0.00 -1.02 0.00 0.00 52.86 51.85 1nud s ASN 517 Cb -0.17 -2.03 -0.03 0.00 0.02 0.00 0.00 41.25 39.03 1nud s ASN 517 CO -0.08 0.01 -0.22 -0.04 0.02 0.00 0.00 177.10 176.79 1nud s MET 518 N 1.37 1.23 0.09 -0.60 -1.94 -0.73 -0.39 119.30 118.32 1nud s MET 518 Ca 0.06 -1.13 -0.09 0.00 -1.71 0.00 0.00 55.69 52.82 1nud s MET 518 Cb -0.15 -1.49 -0.00 0.00 2.01 0.00 0.00 34.83 35.20 1nud s MET 518 CO 0.06 0.36 0.19 0.95 -0.01 0.00 0.00 175.02 176.56 1nud s THR 519 N -1.06 0.14 -0.07 2.05 -4.23 -0.31 -2.36 115.64 109.81 1nud s THR 519 Ca 0.08 -1.18 -0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1nud s THR 519 Cb -0.10 -1.33 0.03 0.00 1.34 0.00 0.00 72.50 72.44 1nud s THR 519 CO 0.04 -0.65 0.04 0.00 -0.54 0.00 0.00 174.62 173.50 1nud s ALA 520 N -3.84 0.47 -0.04 3.99 0.00 -0.44 -1.42 121.76 120.48 1nud s ALA 520 Ca 0.05 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.05 1nud s ALA 520 Cb 0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1nud s ALA 520 CO -0.11 -0.55 -0.22 -1.58 0.00 0.00 0.00 175.76 173.30 1nud s TRP 521 N 2.07 2.11 0.35 0.00 0.52 -0.90 -0.20 118.94 122.89 1nud s TRP 521 Ca 0.05 -0.56 -0.26 0.00 0.02 0.00 0.00 56.10 55.35 1nud s TRP 521 Cb -0.13 -1.38 -0.10 0.00 -1.15 0.00 0.00 33.47 30.72 1nud s TRP 521 CO -0.05 -0.15 1.00 0.95 0.02 0.00 0.00 176.95 178.72 1nud s THR 522 N -0.21 3.95 0.19 2.01 -4.23 -0.20 0.79 115.64 117.95 1nud s THR 522 Ca -0.00 1.60 0.00 0.00 -1.18 0.00 0.00 61.69 62.11 1nud s THR 522 Cb -0.12 -3.88 -0.04 0.00 1.34 0.00 0.00 72.50 69.80 1nud s THR 522 CO 0.02 0.11 0.08 0.27 -0.54 0.00 0.00 174.62 174.55 1nud s ILE 523 N -1.59 0.32 0.02 2.99 -4.36 -0.89 -0.48 121.20 117.21 1nud s ILE 523 Ca 0.53 -1.98 -0.04 0.00 -0.26 0.00 0.00 60.65 58.90 1nud s ILE 523 Cb -0.21 -2.35 -0.04 0.00 1.25 0.00 0.00 42.46 41.10 1nud s ILE 523 CO 0.27 -0.21 0.23 -0.63 0.24 0.00 0.00 174.94 174.84 1nud s ILE 524 N -3.92 5.36 0.57 8.37 -1.09 -0.70 -4.44 121.20 125.35 1nud s ILE 524 Ca 0.32 -0.06 0.32 0.00 -2.23 0.00 0.00 60.65 59.00 1nud s ILE 524 Cb 0.07 -3.57 0.46 0.00 -1.58 0.00 0.00 42.46 37.84 1nud s ILE 524 CO 0.08 0.29 1.77 0.10 -1.23 0.00 0.00 174.94 175.96 1nud h TYR 525 N 3.70 0.00 0.00 3.97 -0.00 -1.93 0.17 116.97 122.88 1nud h TYR 525 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.24 1nud h TYR 525 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.92 1nud h TYR 525 CO 0.66 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 179.09 1nud n ASN 526 N -3.85 0.00 0.00 0.10 6.94 -1.26 -1.00 115.26 116.19 1nud n ASN 526 Ca 0.18 0.19 0.00 0.00 -0.02 0.00 0.00 54.58 54.93 1nud n ASN 526 Cb 1.04 -0.37 0.00 0.00 -2.36 0.00 0.00 39.78 38.09 1nud n ASN 526 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nud n GLY 527 N 0.53 2.69 3.57 4.83 0.00 0.61 -4.06 105.19 113.36 1nud n GLY 527 Ca 0.08 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.55 1nud n GLY 527 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1nud n THR 528 N -1.08 0.25 -2.49 2.61 -1.04 -1.24 -4.73 114.28 106.56 1nud n THR 528 Ca 0.00 -0.13 -0.41 0.00 -2.04 0.00 0.00 64.05 61.47 1nud n THR 528 Cb 0.00 -1.35 -0.04 0.00 -1.82 0.00 0.00 70.33 67.12 1nud n THR 528 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1nud s LEU 529 N 5.20 4.48 -0.10 -4.42 1.43 -1.26 -1.73 118.68 122.27 1nud s LEU 529 Ca 1.04 2.11 -0.12 0.00 -1.03 0.00 0.00 54.13 56.13 1nud s LEU 529 Cb -1.01 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.56 1nud s LEU 529 CO 0.59 -0.25 -0.23 0.52 0.23 0.00 0.00 176.35 177.20 1nud n VAL 530 N 2.45 1.18 -3.55 -1.59 0.31 0.36 -4.96 118.33 112.53 1nud n VAL 530 Ca 0.03 0.23 -0.15 0.00 -0.01 0.00 0.00 64.34 64.45 1nud n VAL 530 Cb 0.46 -2.06 -0.06 0.00 -0.91 0.00 0.00 33.84 31.27 1nud n VAL 530 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1nud s HIS 531 N -2.42 -0.55 0.03 3.52 2.46 -1.22 -4.96 115.29 112.16 1nud s HIS 531 Ca -0.19 0.98 -0.30 0.00 0.47 0.00 0.00 55.06 56.02 1nud s HIS 531 Cb 0.03 0.42 -0.04 0.00 -0.13 0.00 0.00 32.58 32.85 1nud s HIS 531 CO 0.29 -0.48 1.08 -2.00 -2.47 0.00 0.00 174.74 171.16 1nud s GLU 532 N -1.03 4.50 0.00 2.88 2.12 -1.26 -1.03 118.70 124.88 1nud s GLU 532 Ca -0.06 1.59 0.01 0.00 0.36 0.00 0.00 54.97 56.87 1nud s GLU 532 Cb -0.01 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.98 1nud s GLU 532 CO 0.06 -0.14 0.37 1.33 -0.54 0.00 0.00 175.26 176.34 1nud n VAL 533 N 3.87 0.00 -3.58 3.70 0.24 0.72 -4.97 118.33 118.32 1nud n VAL 533 Ca 0.07 -0.49 -0.09 0.00 -2.04 0.00 0.00 64.34 61.79 1nud n VAL 533 Cb 0.49 1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 33.83 1nud n VAL 533 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1nud s TRP 534 N -0.44 -0.33 -0.10 6.34 -0.00 -1.20 -4.63 118.94 118.57 1nud s TRP 534 Ca 0.01 0.54 -0.31 0.00 -0.00 0.00 0.00 56.10 56.34 1nud s TRP 534 Cb 0.01 0.46 0.10 0.00 -0.00 0.00 0.00 33.47 34.04 1nud s TRP 534 CO 0.03 -0.33 0.83 -1.59 -0.00 0.00 0.00 176.95 175.89 1nud s LYS 535 N -1.30 0.84 0.09 5.86 -2.85 -1.26 -1.33 119.74 119.79 1nud s LYS 535 Ca -0.00 0.20 -0.26 0.00 -1.00 0.00 0.00 55.97 54.91 1nud s LYS 535 Cb -0.01 0.40 0.08 0.00 -2.06 0.00 0.00 37.83 36.24 1nud s LYS 535 CO -0.00 -0.26 0.80 0.34 0.10 0.00 0.00 175.35 176.32 1nud s ASP 536 N -1.16 -0.39 0.26 0.03 2.15 -0.99 -5.01 116.67 111.55 1nud s ASP 536 Ca -0.07 -0.11 0.04 0.00 0.43 0.00 0.00 52.55 52.85 1nud s ASP 536 Cb -0.00 0.49 -0.05 0.00 -0.30 0.00 0.00 42.92 43.06 1nud s ASP 536 CO 0.06 -0.83 -0.00 -0.44 -0.17 0.00 0.00 175.17 173.78 1nud s SER 537 N -2.67 2.09 -0.30 -0.34 0.01 -1.26 -1.77 113.70 109.46 1nud s SER 537 Ca 0.05 -1.24 -0.16 0.00 1.31 0.00 0.00 55.95 55.91 1nud s SER 537 Cb -0.01 -0.04 0.17 0.00 0.21 0.00 0.00 66.02 66.35 1nud s SER 537 CO -0.07 -0.50 1.06 0.00 0.41 0.00 0.00 173.24 174.14 1nud s ALA 538 N -3.32 -2.85 -0.10 1.44 0.00 -0.68 -4.98 121.76 111.27 1nud s ALA 538 Ca 0.30 1.99 -0.02 0.00 0.00 0.00 0.00 51.96 54.22 1nud s ALA 538 Cb 0.06 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 1nud s ALA 538 CO 0.10 -0.96 -0.00 0.99 0.00 0.00 0.00 175.76 175.89 1nud s THR 539 N 2.35 4.26 0.15 0.00 2.01 -1.26 0.19 115.64 123.34 1nud s THR 539 Ca -0.02 -0.26 -0.21 0.00 0.31 0.00 0.00 61.69 61.51 1nud s THR 539 Cb -0.05 -2.80 0.06 0.00 0.01 0.00 0.00 72.50 69.72 1nud s THR 539 CO -0.17 0.58 0.55 0.00 -0.69 0.00 0.00 174.62 174.89 1nud s MET 540 N -0.64 1.23 -0.20 4.92 0.23 -0.11 -5.00 119.30 119.74 1nud s MET 540 Ca 0.10 -0.54 -0.04 0.00 -1.03 0.00 0.00 55.69 54.18 1nud s MET 540 Cb -0.12 0.56 -0.02 0.00 -1.53 0.00 0.00 34.83 33.72 1nud s MET 540 CO 0.02 -0.53 -0.02 0.45 -2.03 0.00 0.00 175.02 172.91 1nud s SER 541 N -2.77 4.64 -0.06 -1.18 0.15 -1.26 -0.04 113.70 113.18 1nud s SER 541 Ca 0.02 -0.25 0.04 0.00 0.70 0.00 0.00 55.95 56.46 1nud s SER 541 Cb -0.00 -1.78 -0.02 0.00 -1.71 0.00 0.00 66.02 62.50 1nud s SER 541 CO -0.12 0.06 -0.17 -0.76 1.20 0.00 0.00 173.24 173.44 1nud s LEU 542 N 1.00 2.52 0.63 3.45 1.43 -0.30 -4.99 118.68 122.43 1nud s LEU 542 Ca 0.01 -0.31 -0.07 0.00 -1.03 0.00 0.00 54.13 52.73 1nud s LEU 542 Cb -0.14 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.59 1nud s LEU 542 CO 0.01 0.29 0.95 -1.81 0.23 0.00 0.00 176.35 176.02 1nud s ASP 543 N -0.41 5.37 -0.19 2.29 1.01 -1.26 -1.38 116.67 122.10 1nud s ASP 543 Ca 0.04 0.69 -0.33 0.00 0.71 0.00 0.00 52.55 53.67 1nud s ASP 543 Cb -0.12 -1.57 -0.10 0.00 1.01 0.00 0.00 42.92 42.14 1nud s ASP 543 CO 0.02 -1.24 2.06 -2.65 0.21 0.00 0.00 175.17 173.57 1nud n PRO 544 N -2.72 1.87 -0.55 8.23 -0.02 -1.24 -0.29 135.00 140.28 1nud n PRO 544 Ca 0.06 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1nud n PRO 544 Cb 0.58 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1nud n PRO 544 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1nud n GLU 545 N 7.68 0.00 -2.30 -0.52 4.07 0.48 -5.00 120.64 125.05 1nud n GLU 545 Ca 0.29 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.98 1nud n GLU 545 Cb 0.33 -1.74 -0.03 0.00 -0.06 0.00 0.00 31.44 29.94 1nud n GLU 545 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1nud s GLU 546 N -0.21 4.45 -0.03 5.31 2.12 0.60 -4.70 118.70 126.25 1nud s GLU 546 Ca 0.00 1.96 -0.01 0.00 0.36 0.00 0.00 54.97 57.29 1nud s GLU 546 Cb 0.00 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 1nud s GLU 546 CO 0.00 -0.14 0.04 -1.21 -0.54 0.00 0.00 175.26 173.42 1nud s GLU 547 N -0.40 2.98 -0.08 4.30 2.02 -1.26 -1.83 118.70 124.42 1nud s GLU 547 Ca 0.53 -0.49 -0.10 0.00 0.02 0.00 0.00 54.97 54.94 1nud s GLU 547 Cb -0.35 -2.80 0.02 0.00 0.10 0.00 0.00 34.13 31.11 1nud s GLU 547 CO 0.39 0.66 0.26 0.00 0.02 0.00 0.00 175.26 176.59 1nud s ALA 548 N -1.08 -0.65 -0.05 5.21 0.00 0.08 -5.00 121.76 120.27 1nud s ALA 548 Ca 0.19 0.62 0.05 0.00 0.00 0.00 0.00 51.96 52.82 1nud s ALA 548 Cb -0.12 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.68 1nud s ALA 548 CO 0.09 -0.15 -0.19 -1.83 0.00 0.00 0.00 175.76 173.69 1nud s GLU 549 N -0.20 1.92 -0.18 0.00 -1.05 -1.26 -0.35 118.70 117.57 1nud s GLU 549 Ca -0.03 -0.66 -0.03 0.00 -0.15 0.00 0.00 54.97 54.09 1nud s GLU 549 Cb -0.03 -1.66 -0.02 0.00 -0.44 0.00 0.00 34.13 31.99 1nud s GLU 549 CO 0.01 0.27 -0.05 -1.58 0.95 0.00 0.00 175.26 174.86 1nud s HIS 550 N -0.00 2.96 -0.03 4.83 5.65 -0.25 -4.96 115.29 123.49 1nud s HIS 550 Ca -0.04 -0.62 -0.28 0.00 0.25 0.00 0.00 55.06 54.38 1nud s HIS 550 Cb -0.12 -2.01 -0.03 0.00 -1.18 0.00 0.00 32.58 29.24 1nud s HIS 550 CO 0.02 -0.29 0.90 -1.25 -0.65 0.00 0.00 174.74 173.48 1nud s PRO 551 N 0.86 4.52 -0.18 2.88 0.04 -1.26 -1.24 135.00 140.62 1nud s PRO 551 Ca -0.01 1.26 -0.04 0.00 0.04 0.00 0.00 61.00 62.25 1nud s PRO 551 Cb -0.15 -3.46 -0.03 0.00 0.04 0.00 0.00 34.50 30.91 1nud s PRO 551 CO 0.01 -0.03 -0.02 0.42 0.04 0.00 0.00 177.00 177.42 1nud s ILE 552 N 1.01 3.94 -0.06 0.56 1.01 -0.36 -4.98 121.20 122.31 1nud s ILE 552 Ca 0.48 -0.33 -0.00 0.00 0.00 0.00 0.00 60.65 60.79 1nud s ILE 552 Cb -0.20 -2.75 0.03 0.00 0.01 0.00 0.00 42.46 39.55 1nud s ILE 552 CO 0.25 0.46 -0.02 -0.75 0.00 0.00 0.00 174.94 174.88 1nud s LYS 553 N 0.66 0.74 -0.15 2.79 2.20 -1.26 -0.86 119.74 123.85 1nud s LYS 553 Ca -0.01 0.00 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 1nud s LYS 553 Cb -0.14 -0.95 0.03 0.00 -1.51 0.00 0.00 37.83 35.26 1nud s LYS 553 CO 0.02 -0.21 -0.11 0.42 -0.36 0.00 0.00 175.35 175.11 1nud s ILE 554 N 1.54 1.41 0.79 5.43 1.01 -0.35 -5.01 121.20 126.02 1nud s ILE 554 Ca -0.01 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 59.88 1nud s ILE 554 Cb -0.13 -1.41 0.07 0.00 0.01 0.00 0.00 42.46 41.00 1nud s ILE 554 CO -0.03 0.34 1.10 -0.94 0.00 0.00 0.00 174.94 175.41 1nud s SER 555 N 1.53 4.55 0.07 3.58 1.04 -1.26 -0.24 113.70 122.97 1nud s SER 555 Ca 0.03 1.22 -0.27 0.00 0.48 0.00 0.00 55.95 57.42 1nud s SER 555 Cb -0.14 -1.94 -0.17 0.00 0.10 0.00 0.00 66.02 63.87 1nud s SER 555 CO -0.09 -1.92 1.62 0.22 0.98 0.00 0.00 173.24 174.04 1nud h TYR 556 N -1.06 -0.32 -0.98 5.02 3.20 -1.88 -2.87 116.97 118.08 1nud h TYR 556 Ca -0.47 -0.01 0.33 0.00 3.14 0.00 0.00 58.73 61.73 1nud h TYR 556 Cb 1.27 0.11 -0.17 0.00 1.54 0.00 0.00 36.73 39.49 1nud h TYR 556 CO 0.45 -0.15 0.39 0.00 -1.64 0.00 0.00 178.16 177.21 1nud h ALA 557 N 0.31 1.76 0.35 1.82 0.00 -1.94 0.51 119.26 122.07 1nud h ALA 557 Ca -0.04 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1nud h ALA 557 Cb 0.32 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1nud h ALA 557 CO 0.06 -0.70 -0.17 1.96 0.00 0.00 0.00 179.25 180.40 1nud h GLN 558 N 0.12 -0.45 0.00 0.00 4.20 -1.86 -3.36 115.11 113.76 1nud h GLN 558 Ca 0.72 0.03 -0.17 0.00 0.06 0.00 0.00 58.65 59.29 1nud h GLN 558 Cb 1.71 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 29.56 1nud h GLN 558 CO -0.74 -0.15 -0.82 0.10 -0.67 0.00 0.00 178.83 176.55 1nud h TYR 559 N -0.99 0.00 -0.47 2.96 -0.00 -1.21 -3.30 116.97 113.97 1nud h TYR 559 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 58.73 58.75 1nud h TYR 559 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.21 1nud h TYR 559 CO 0.03 0.82 0.31 1.05 -0.00 0.00 0.00 178.16 180.38 1nud h GLU 560 N 0.00 0.35 -0.49 0.10 -0.00 -0.17 0.78 114.58 115.15 1nud h GLU 560 Ca -0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 59.36 59.35 1nud h GLU 560 Cb 1.58 -0.08 -0.03 0.00 -0.00 0.00 0.00 28.75 30.23 1nud h GLU 560 CO 0.11 0.23 0.32 -0.09 -0.00 0.00 0.00 179.01 179.58 1nud h ARG 561 N 0.36 0.57 0.00 1.06 9.65 -1.71 -3.19 114.38 121.12 1nud h ARG 561 Ca 0.21 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1nud h ARG 561 Cb 0.35 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 1nud h ARG 561 CO -0.05 0.38 -0.01 0.66 2.80 0.00 0.00 179.97 183.74 1nud n TYR 562 N -4.47 0.00 -2.63 2.20 4.02 -0.48 -5.03 117.16 110.77 1nud n TYR 562 Ca 0.05 -0.52 -0.42 0.00 -0.01 0.00 0.00 57.90 57.00 1nud n TYR 562 Cb 0.11 -0.06 -0.03 0.00 -0.02 0.00 0.00 39.34 39.34 1nud n TYR 562 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1nud s LEU 563 N -1.20 4.39 0.41 7.72 2.96 0.15 -4.77 118.68 128.34 1nud s LEU 563 Ca 0.05 1.79 0.08 0.00 -0.22 0.00 0.00 54.13 55.83 1nud s LEU 563 Cb 0.05 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.17 1nud s LEU 563 CO 0.01 -0.29 0.56 -0.54 -1.32 0.00 0.00 176.35 174.76 1nud s LYS 564 N 0.85 2.84 0.00 1.98 -0.14 -1.26 -4.93 119.74 119.07 1nud s LYS 564 Ca 0.53 -1.24 0.00 0.00 -1.36 0.00 0.00 55.97 53.90 1nud s LYS 564 Cb -0.24 -2.75 0.00 0.00 -1.68 0.00 0.00 37.83 33.16 1nud s LYS 564 CO 0.29 -0.25 0.44 -1.13 -0.76 0.00 0.00 175.35 173.94 1nud n SER 565 N -1.83 0.00 0.18 2.83 3.41 -1.26 0.82 113.62 117.78 1nud n SER 565 Ca 0.07 0.08 0.12 0.00 -0.26 0.00 0.00 58.87 58.88 1nud n SER 565 Cb 0.59 -0.08 0.14 0.00 -0.26 0.00 0.00 64.21 64.60 1nud n SER 565 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1nud h ASP 566 N 0.00 0.00 -6.59 4.04 3.32 -1.92 -3.48 116.42 111.80 1nud h ASP 566 Ca 0.00 -0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 1nud h ASP 566 Cb 0.08 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.49 1nud h ASP 566 CO 0.00 0.00 -0.81 0.59 -1.72 0.00 0.00 179.24 177.30 1nud n ASN 567 N -2.94 -3.54 -4.28 6.45 3.02 0.24 -4.78 115.26 109.43 1nud n ASN 567 Ca 0.03 -0.94 -0.28 0.00 -0.03 0.00 0.00 54.58 53.36 1nud n ASN 567 Cb 0.53 -3.14 -0.15 0.00 -0.61 0.00 0.00 39.78 36.41 1nud n ASN 567 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1nud s MET 568 N -6.80 1.74 -0.02 3.52 -1.94 -1.26 -0.19 119.30 114.35 1nud s MET 568 Ca 0.66 -0.94 0.02 0.00 -1.71 0.00 0.00 55.69 53.73 1nud s MET 568 Cb -0.35 -1.79 -0.00 0.00 2.01 0.00 0.00 34.83 34.70 1nud s MET 568 CO 0.89 0.47 -0.09 0.42 -0.01 0.00 0.00 175.02 176.71 1nud s ILE 569 N -0.68 0.71 -0.48 2.53 1.01 -0.92 -2.08 121.20 121.28 1nud s ILE 569 Ca 0.09 -0.35 -0.18 0.00 0.00 0.00 0.00 60.65 60.22 1nud s ILE 569 Cb -0.09 -0.62 0.05 0.00 0.01 0.00 0.00 42.46 41.81 1nud s ILE 569 CO 0.01 0.21 0.52 -0.60 0.00 0.00 0.00 174.94 175.08 1nud s ARG 570 N 0.01 3.08 -0.06 2.79 6.06 0.24 -0.78 118.95 130.29 1nud s ARG 570 Ca 0.00 -0.99 -0.17 0.00 -2.50 0.00 0.00 55.73 52.07 1nud s ARG 570 Cb -0.06 -4.08 -0.05 0.00 0.06 0.00 0.00 34.95 30.82 1nud s ARG 570 CO -0.00 -1.08 0.46 0.42 -2.50 0.00 0.00 175.30 172.60 1nud s ILE 571 N 2.24 5.09 -0.02 4.11 -1.09 0.21 -2.11 121.20 129.63 1nud s ILE 571 Ca 0.11 0.93 0.00 0.00 -2.23 0.00 0.00 60.65 59.46 1nud s ILE 571 Cb -0.20 -3.78 0.02 0.00 -1.58 0.00 0.00 42.46 36.92 1nud s ILE 571 CO 0.11 0.44 0.00 -0.89 -1.23 0.00 0.00 174.94 173.37 1nud s THR 572 N -0.17 0.10 -0.09 2.92 2.01 -0.51 -1.60 115.64 118.30 1nud s THR 572 Ca 0.25 0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.34 1nud s THR 572 Cb -0.16 -0.18 0.02 0.00 0.01 0.00 0.00 72.50 72.19 1nud s THR 572 CO 0.12 0.10 -0.10 0.00 -0.69 0.00 0.00 174.62 174.05 1nud s ALA 573 N 0.72 1.26 -0.31 7.40 0.00 0.51 -1.17 121.76 130.18 1nud s ALA 573 Ca -0.07 -0.45 -0.00 0.00 0.00 0.00 0.00 51.96 51.44 1nud s ALA 573 Cb -0.10 -0.71 0.06 0.00 0.00 0.00 0.00 23.12 22.37 1nud s ALA 573 CO -0.02 -0.13 -0.00 0.08 0.00 0.00 0.00 175.76 175.69 1nud s VAL 574 N 1.14 2.77 -0.25 0.00 1.01 0.47 0.13 120.40 125.68 1nud s VAL 574 Ca -0.06 -1.59 -0.10 0.00 0.00 0.00 0.00 61.98 60.23 1nud s VAL 574 Cb -0.14 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.52 1nud s VAL 574 CO -0.02 -0.19 0.14 0.00 0.00 0.00 0.00 175.10 175.04 1nud s LYS 576 N 1.31 2.93 0.01 0.00 2.47 -0.14 -0.35 119.74 125.98 1nud s LYS 576 Ca 0.07 -0.87 0.03 0.00 -1.56 0.00 0.00 55.97 53.64 1nud s LYS 576 Cb -0.14 -2.25 -0.03 0.00 -1.46 0.00 0.00 37.83 33.94 1nud s LYS 576 CO 0.06 0.20 -0.06 0.08 0.16 0.00 0.00 175.35 175.79 1nud s VAL 577 N 0.28 3.71 -0.06 4.02 1.01 -1.26 -1.14 120.40 126.96 1nud s VAL 577 Ca -0.17 -0.79 -0.38 0.00 0.00 0.00 0.00 61.98 60.64 1nud s VAL 577 Cb -0.17 -2.63 -0.16 0.00 0.00 0.00 0.00 36.38 33.41 1nud s VAL 577 CO 0.08 0.36 1.55 -2.65 0.00 0.00 0.00 175.10 174.45 1nud n PRO 578 N 1.44 1.29 0.00 2.72 -0.02 -1.25 -1.80 135.00 137.38 1nud n PRO 578 Ca -0.15 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1nud n PRO 578 Cb 0.52 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1nud n PRO 578 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1nud n ASP 579 N 3.99 0.00 -4.90 2.55 8.00 -1.26 -4.96 116.55 119.96 1nud n ASP 579 Ca 0.22 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.44 1nud n ASP 579 Cb 0.18 -0.40 -0.01 0.00 -0.02 0.00 0.00 41.12 40.87 1nud n ASP 579 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1nud s GLU 580 N 0.00 3.59 0.81 -1.24 2.02 -0.74 -5.06 118.70 118.07 1nud s GLU 580 Ca 0.00 0.17 -0.10 0.00 0.02 0.00 0.00 54.97 55.05 1nud s GLU 580 Cb 0.00 -2.44 0.08 0.00 0.10 0.00 0.00 34.13 31.87 1nud s GLU 580 CO 0.00 -0.09 1.10 0.45 0.02 0.00 0.00 175.26 176.74 1nud s SER 581 N -3.83 4.15 0.87 -0.19 0.15 -1.26 -4.48 113.70 109.10 1nud s SER 581 Ca 0.47 1.87 -0.12 0.00 0.70 0.00 0.00 55.95 58.88 1nud s SER 581 Cb -0.10 -2.51 0.11 0.00 -1.71 0.00 0.00 66.02 61.80 1nud s SER 581 CO 0.40 -2.27 1.10 -1.61 1.20 0.00 0.00 173.24 172.06 1nud s GLU 582 N -4.86 1.51 -0.14 5.44 8.01 -1.26 -4.52 118.70 122.88 1nud s GLU 582 Ca 0.62 0.70 -0.01 0.00 0.01 0.00 0.00 54.97 56.29 1nud s GLU 582 Cb -0.18 -1.85 0.04 0.00 -4.31 0.00 0.00 34.13 27.83 1nud s GLU 582 CO 0.56 -2.03 -0.03 0.08 0.01 0.00 0.00 175.26 173.85 1nud s VAL 583 N -3.04 0.86 -0.33 2.63 1.01 0.52 -4.98 120.40 117.06 1nud s VAL 583 Ca 0.63 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 62.04 1nud s VAL 583 Cb -0.16 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 1nud s VAL 583 CO 0.56 0.13 0.36 -0.69 0.00 0.00 0.00 175.10 175.46 1nud s VAL 584 N 1.75 5.17 -0.26 2.92 1.01 -1.26 -0.45 120.40 129.29 1nud s VAL 584 Ca 0.02 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1nud s VAL 584 Cb -0.15 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 1nud s VAL 584 CO -0.07 -0.06 0.08 -0.69 0.00 0.00 0.00 175.10 174.36 1nud s VAL 585 N 2.01 4.39 0.11 2.92 1.01 0.12 -4.99 120.40 125.97 1nud s VAL 585 Ca 0.12 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 61.99 1nud s VAL 585 Cb -0.16 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1nud s VAL 585 CO 0.11 0.31 -0.16 -1.83 0.00 0.00 0.00 175.10 173.54 1nud s GLU 586 N 1.62 1.02 -0.30 2.72 -1.05 -1.26 -0.36 118.70 121.08 1nud s GLU 586 Ca 0.06 -1.17 -0.14 0.00 -0.15 0.00 0.00 54.97 53.57 1nud s GLU 586 Cb -0.15 -1.02 0.16 0.00 -0.44 0.00 0.00 34.13 32.68 1nud s GLU 586 CO 0.04 0.21 0.95 0.50 0.95 0.00 0.00 175.26 177.92 1nud s ARG 587 N -2.30 0.33 -0.03 -4.83 6.06 -0.63 -4.81 118.95 112.74 1nud s ARG 587 Ca 0.06 0.81 -0.15 0.00 -2.50 0.00 0.00 55.73 53.95 1nud s ARG 587 Cb -0.07 0.47 -0.05 0.00 0.06 0.00 0.00 34.95 35.35 1nud s ARG 587 CO 0.03 -0.11 0.42 -0.51 -2.50 0.00 0.00 175.30 172.63 1nud s ASP 588 N 2.44 6.76 0.12 -2.12 1.01 -1.26 -0.61 116.67 123.01 1nud s ASP 588 Ca -0.03 0.91 0.09 0.00 0.71 0.00 0.00 52.55 54.23 1nud s ASP 588 Cb -0.07 -2.26 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 1nud s ASP 588 CO -0.18 0.24 -0.18 0.27 0.21 0.00 0.00 175.17 175.54 1nud s ILE 589 N -0.63 2.86 -0.16 0.77 -4.36 0.04 -4.96 121.20 114.75 1nud s ILE 589 Ca 0.24 -1.51 -0.01 0.00 -0.26 0.00 0.00 60.65 59.11 1nud s ILE 589 Cb -0.16 -2.32 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1nud s ILE 589 CO 0.12 0.09 -0.13 -0.63 0.24 0.00 0.00 174.94 174.64 1nud s ILE 590 N -1.17 2.89 -0.23 8.37 1.01 -1.26 -2.18 121.20 128.63 1nud s ILE 590 Ca 0.18 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 60.04 1nud s ILE 590 Cb -0.10 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1nud s ILE 590 CO 0.10 0.50 0.14 -0.76 0.00 0.00 0.00 174.94 174.92 1nud s LEU 591 N 0.85 4.02 0.75 2.97 1.02 0.74 -4.75 118.68 124.28 1nud s LEU 591 Ca -0.04 0.08 -0.12 0.00 0.02 0.00 0.00 54.13 54.07 1nud s LEU 591 Cb -0.15 -2.07 0.04 0.00 0.02 0.00 0.00 46.19 44.03 1nud s LEU 591 CO -0.00 0.07 1.10 -1.81 0.02 0.00 0.00 176.35 175.73 1nud s ASP 592 N 1.04 4.58 0.17 2.29 1.01 0.21 -4.49 116.67 121.48 1nud s ASP 592 Ca 0.07 1.91 -0.07 0.00 0.71 0.00 0.00 52.55 55.17 1nud s ASP 592 Cb -0.14 -2.53 -0.06 0.00 1.01 0.00 0.00 42.92 41.20 1nud s ASP 592 CO 0.04 -1.98 0.44 0.20 0.21 0.00 0.00 175.17 174.07 1nud s ASN 593 N -3.07 6.54 0.19 0.27 0.01 -1.26 0.08 114.94 117.70 1nud s ASN 593 Ca 0.64 0.71 -0.32 0.00 -0.71 0.00 0.00 52.86 53.18 1nud s ASN 593 Cb -0.19 -2.14 -0.11 0.00 0.41 0.00 0.00 41.25 39.22 1nud s ASN 593 CO 0.52 0.01 1.69 -2.16 -1.51 0.00 0.00 177.10 175.64 1nud s PRO 594 N -2.69 4.15 0.43 -0.60 0.04 -1.26 -4.83 135.00 130.24 1nud s PRO 594 Ca 0.43 2.54 -0.22 0.00 0.04 0.00 0.00 61.00 63.79 1nud s PRO 594 Cb -0.12 -3.11 -0.12 0.00 0.04 0.00 0.00 34.50 31.19 1nud s PRO 594 CO 0.23 -0.72 0.56 2.41 0.04 0.00 0.00 177.00 179.52 1nud n THR 595 N 4.01 1.81 -3.98 1.26 -1.04 -1.26 -4.96 114.28 110.12 1nud n THR 595 Ca 0.15 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 61.38 1nud n THR 595 Cb 0.36 -0.57 -0.17 0.00 -1.82 0.00 0.00 70.33 68.13 1nud n THR 595 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1nud s LEU 596 N 1.62 1.42 0.10 -4.42 2.96 -1.26 -4.43 118.68 114.66 1nud s LEU 596 Ca 0.64 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 54.22 1nud s LEU 596 Cb -0.59 -0.99 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 1nud s LEU 596 CO 0.58 -0.09 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.61 1nud s THR 597 N 1.57 3.87 0.01 3.68 2.01 -0.50 -4.59 115.64 121.69 1nud s THR 597 Ca 0.04 -1.08 0.08 0.00 0.31 0.00 0.00 61.69 61.04 1nud s THR 597 Cb -0.13 -2.85 -0.02 0.00 0.01 0.00 0.00 72.50 69.51 1nud s THR 597 CO -0.09 0.10 -0.25 -0.76 -0.69 0.00 0.00 174.62 172.93 1nud s LEU 598 N -2.35 2.11 -0.08 4.42 1.43 -1.26 -1.56 118.68 121.38 1nud s LEU 598 Ca 0.25 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.69 1nud s LEU 598 Cb -0.11 -1.26 0.03 0.00 0.03 0.00 0.00 46.19 44.88 1nud s LEU 598 CO 0.18 0.27 0.36 -1.61 0.23 0.00 0.00 176.35 175.78 1nud s GLU 599 N -0.91 0.57 -0.08 1.70 2.02 -1.15 -4.94 118.70 115.90 1nud s GLU 599 Ca 0.10 0.20 -0.05 0.00 0.02 0.00 0.00 54.97 55.24 1nud s GLU 599 Cb -0.10 0.26 -0.04 0.00 0.10 0.00 0.00 34.13 34.36 1nud s GLU 599 CO 0.01 -0.12 0.14 0.14 0.02 0.00 0.00 175.26 175.45 1nud s VAL 600 N -0.52 5.41 -0.86 2.63 -7.23 -1.26 -2.50 120.40 116.06 1nud s VAL 600 Ca -0.06 0.06 0.17 0.00 -1.81 0.00 0.00 61.98 60.34 1nud s VAL 600 Cb -0.04 -3.40 0.73 0.00 0.56 0.00 0.00 36.38 34.23 1nud s VAL 600 CO 0.03 0.53 1.65 0.18 -0.31 0.00 0.00 175.10 177.17 1nud n LEU 601 N 1.67 4.94 -3.65 1.32 4.32 0.73 -4.98 117.00 121.35 1nud n LEU 601 Ca -0.17 -2.59 0.02 0.00 -0.02 0.00 0.00 56.01 53.25 1nud n LEU 601 Cb 0.54 -0.60 -0.00 0.00 -1.62 0.00 0.00 43.42 41.74 1nud n LEU 601 CO 0.35 0.76 1.06 0.54 -1.22 0.00 0.00 177.39 178.88 1nud s ASN 602 N -0.94 -0.05 0.14 -1.43 2.20 -1.26 -4.88 114.94 108.71 1nud s ASN 602 Ca 0.51 -0.15 -0.30 0.00 -0.94 0.00 0.00 52.86 51.98 1nud s ASN 602 Cb 0.35 0.16 -0.07 0.00 -2.00 0.00 0.00 41.25 39.69 1nud s ASN 602 CO 0.22 -0.30 1.20 -0.70 -2.94 0.00 0.00 177.10 174.57 1nud s GLU 603 N -2.39 4.47 -0.06 3.55 2.12 -1.26 -4.90 118.70 120.24 1nud s GLU 603 Ca 0.15 1.84 -0.18 0.00 0.36 0.00 0.00 54.97 57.14 1nud s GLU 603 Cb 0.04 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 31.11 1nud s GLU 603 CO -0.04 -0.15 0.50 0.00 -0.54 0.00 0.00 175.26 175.03 1nud s ALA 604 N 0.36 3.52 0.03 6.30 0.00 -1.26 -4.96 121.76 125.75 1nud s ALA 604 Ca 0.55 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.39 1nud s ALA 604 Cb -0.32 -2.62 -0.02 0.00 0.00 0.00 0.00 23.12 20.16 1nud s ALA 604 CO 0.34 0.15 -0.05 1.03 0.00 0.00 0.00 175.76 177.22 1nud s ARG 605 N 0.04 0.39 0.34 0.00 0.52 -1.26 -2.01 118.95 116.97 1nud s ARG 605 Ca 0.27 -0.61 -0.29 0.00 -0.52 0.00 0.00 55.73 54.59 1nud s ARG 605 Cb -0.16 -0.11 -0.12 0.00 0.52 0.00 0.00 34.95 35.08 1nud s ARG 605 CO 0.13 0.01 1.46 1.55 0.02 0.00 0.00 175.30 178.47 1nud n VAL 606 N 1.73 1.73 -1.18 3.52 3.14 -0.80 -2.14 118.33 124.33 1nud n VAL 606 Ca -0.22 -0.43 -0.06 0.00 -2.96 0.00 0.00 64.34 60.66 1nud n VAL 606 Cb 0.55 -1.85 -0.03 0.00 -1.06 0.00 0.00 33.84 31.45 1nud n VAL 606 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1nud n ARG 607 N 0.92 -1.60 -4.99 1.45 1.74 0.39 -4.97 116.66 109.60 1nud n ARG 607 Ca 0.04 0.68 -0.29 0.00 -0.77 0.00 0.00 57.85 57.52 1nud n ARG 607 Cb 0.37 -4.99 -0.16 0.00 -1.02 0.00 0.00 32.46 26.66 1nud n ARG 607 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1nud s LYS 608 N -2.38 2.24 0.48 5.56 3.01 -0.91 -4.98 119.74 122.76 1nud s LYS 608 Ca 0.00 -0.72 -0.22 0.00 -1.01 0.00 0.00 55.97 54.02 1nud s LYS 608 Cb 0.00 -1.85 -0.09 0.00 -1.01 0.00 0.00 37.83 34.88 1nud s LYS 608 CO 0.00 0.23 0.94 -2.30 0.51 0.00 0.00 175.35 174.74 1nud n PRO 609 N 3.27 1.14 -3.74 -1.68 -0.02 -1.26 -4.17 135.00 128.54 1nud n PRO 609 Ca -0.19 0.42 -0.24 0.00 -2.02 0.00 0.00 63.50 61.47 1nud n PRO 609 Cb 0.53 -2.03 -0.17 0.00 -0.02 0.00 0.00 33.50 31.80 1nud n PRO 609 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nud s VAL 610 N -1.38 0.33 0.26 -1.45 1.01 -0.50 -4.85 120.40 113.81 1nud s VAL 610 Ca 0.67 -0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.31 1nud s VAL 610 Cb -0.51 -0.63 -0.09 0.00 0.00 0.00 0.00 36.38 35.15 1nud s VAL 610 CO 0.54 0.09 1.01 0.20 0.00 0.00 0.00 175.10 176.94 1nud s ASN 611 N 1.98 7.48 0.19 3.32 -0.87 -1.26 -2.08 114.94 123.70 1nud s ASN 611 Ca 0.03 2.09 -0.02 0.00 -1.57 0.00 0.00 52.86 53.39 1nud s ASN 611 Cb -0.14 -2.62 -0.04 0.00 -0.02 0.00 0.00 41.25 38.44 1nud s ASN 611 CO -0.06 0.03 0.13 -0.69 -2.57 0.00 0.00 177.10 173.94 1nud s VAL 612 N -1.18 0.02 -0.12 1.60 1.01 0.28 -0.19 120.40 121.82 1nud s VAL 612 Ca 0.43 -1.95 -0.19 0.00 0.00 0.00 0.00 61.98 60.26 1nud s VAL 612 Cb -0.29 -2.40 0.05 0.00 0.00 0.00 0.00 36.38 33.74 1nud s VAL 612 CO 0.36 -0.08 0.48 0.00 0.00 0.00 0.00 175.10 175.85 1nud s GLN 613 N -4.13 0.69 -0.06 2.72 -2.07 -1.04 -1.60 119.66 114.16 1nud s GLN 613 Ca 0.35 0.38 -0.04 0.00 -1.82 0.00 0.00 55.36 54.23 1nud s GLN 613 Cb 0.07 0.33 -0.04 0.00 -1.09 0.00 0.00 33.01 32.27 1nud s GLN 613 CO 0.10 -0.15 0.11 1.41 -1.32 0.00 0.00 175.29 175.45 1nud s MET 614 N -0.42 3.28 -0.05 9.60 -2.45 0.69 -2.95 119.30 127.00 1nud s MET 614 Ca -0.06 -0.30 0.03 0.00 -1.25 0.00 0.00 55.69 54.12 1nud s MET 614 Cb -0.03 -3.03 0.01 0.00 1.25 0.00 0.00 34.83 33.02 1nud s MET 614 CO 0.03 0.71 -0.13 -0.51 1.05 0.00 0.00 175.02 176.18 1nud s LEU 615 N -1.36 1.76 -0.15 4.11 1.43 -0.60 -1.61 118.68 122.26 1nud s LEU 615 Ca 0.19 -0.28 -0.09 0.00 -1.03 0.00 0.00 54.13 52.92 1nud s LEU 615 Cb -0.12 -0.78 0.05 0.00 0.03 0.00 0.00 46.19 45.37 1nud s LEU 615 CO 0.09 0.08 0.36 0.12 0.23 0.00 0.00 176.35 177.23 1nud s PHE 616 N 0.33 -0.48 -0.14 0.29 5.36 -0.77 -1.42 117.98 121.16 1nud s PHE 616 Ca -0.08 1.09 -0.01 0.00 -0.96 0.00 0.00 56.93 56.97 1nud s PHE 616 Cb -0.12 0.18 -0.01 0.00 -0.34 0.00 0.00 43.02 42.73 1nud s PHE 616 CO 0.02 -0.27 -0.12 -1.12 -1.46 0.00 0.00 175.22 172.26 1nud s SER 617 N 1.00 4.01 -0.48 6.13 0.01 -1.26 0.46 113.70 123.58 1nud s SER 617 Ca -0.07 -0.35 -0.20 0.00 1.31 0.00 0.00 55.95 56.65 1nud s SER 617 Cb -0.07 -1.62 0.04 0.00 0.21 0.00 0.00 66.02 64.58 1nud s SER 617 CO -0.08 0.14 0.63 0.21 0.41 0.00 0.00 173.24 174.55 1nud s ASN 618 N 0.51 6.26 0.14 2.44 2.47 -0.57 -4.89 114.94 121.29 1nud s ASN 618 Ca -0.08 -0.66 0.23 0.00 0.42 0.00 0.00 52.86 52.77 1nud s ASN 618 Cb -0.16 -2.30 0.90 0.00 -1.45 0.00 0.00 41.25 38.25 1nud s ASN 618 CO 0.04 -0.84 1.71 -0.81 -3.72 0.00 0.00 177.10 173.48 1nud n PRO 619 N 6.22 0.13 -1.58 0.43 -0.04 -1.26 -0.28 135.00 138.62 1nud n PRO 619 Ca -0.04 0.25 -0.31 0.00 -0.04 0.00 0.00 63.50 63.36 1nud n PRO 619 Cb 0.47 -1.70 0.05 0.00 -0.04 0.00 0.00 33.50 32.28 1nud n PRO 619 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nud s LEU 620 N -3.88 3.08 0.00 1.53 1.43 -1.26 -4.75 118.68 114.83 1nud s LEU 620 Ca 0.08 1.58 0.27 0.00 -1.03 0.00 0.00 54.13 55.03 1nud s LEU 620 Cb 0.12 -4.43 1.30 0.00 0.03 0.00 0.00 46.19 43.21 1nud s LEU 620 CO 0.44 -1.48 1.87 0.47 0.23 0.00 0.00 176.35 177.88 1nud n ASP 621 N -3.15 0.82 -4.45 2.29 8.00 -1.26 -3.37 116.55 115.43 1nud n ASP 621 Ca 0.07 -1.35 -0.27 0.00 0.71 0.00 0.00 54.79 53.95 1nud n ASP 621 Cb 0.54 -0.02 -0.12 0.00 -0.02 0.00 0.00 41.12 41.51 1nud n ASP 621 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1nud s GLU 622 N -1.97 1.60 0.90 -1.24 -1.05 -1.26 -4.76 118.70 110.93 1nud s GLU 622 Ca 0.39 -1.43 -0.12 0.00 -0.15 0.00 0.00 54.97 53.65 1nud s GLU 622 Cb 0.20 -1.92 0.13 0.00 -0.44 0.00 0.00 34.13 32.10 1nud s GLU 622 CO 0.32 0.42 1.14 -1.25 0.95 0.00 0.00 175.26 176.83 1nud s PRO 623 N -2.56 1.20 -0.18 -4.83 0.04 -1.26 -4.15 135.00 123.25 1nud s PRO 623 Ca 0.20 0.30 -0.00 0.00 0.04 0.00 0.00 61.00 61.54 1nud s PRO 623 Cb -0.09 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.62 1nud s PRO 623 CO 0.10 -2.16 -0.16 0.14 0.04 0.00 0.00 177.00 174.96 1nud s VAL 624 N -3.28 2.44 0.54 -0.36 -7.23 0.20 -4.91 120.40 107.79 1nud s VAL 624 Ca 0.64 -0.82 0.06 0.00 -1.81 0.00 0.00 61.98 60.04 1nud s VAL 624 Cb -0.15 -2.04 0.04 0.00 0.56 0.00 0.00 36.38 34.79 1nud s VAL 624 CO 0.53 0.51 0.42 0.00 -0.31 0.00 0.00 175.10 176.25 1nud s ARG 625 N 1.24 2.26 -1.34 4.82 1.70 -1.26 -1.41 118.95 124.96 1nud s ARG 625 Ca 0.03 -1.99 -0.00 0.00 -0.47 0.00 0.00 55.73 53.30 1nud s ARG 625 Cb -0.14 -2.13 0.00 0.00 -0.57 0.00 0.00 34.95 32.11 1nud s ARG 625 CO -0.08 -0.61 0.64 -0.25 -1.08 0.00 0.00 175.30 173.91 1nud n ASP 626 N -1.78 -1.03 -4.72 -2.89 8.00 -1.26 -1.27 116.55 111.61 1nud n ASP 626 Ca -0.01 -0.86 -0.40 0.00 0.71 0.00 0.00 54.79 54.23 1nud n ASP 626 Cb 0.64 -3.81 -0.04 0.00 -0.02 0.00 0.00 41.12 37.88 1nud n ASP 626 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nud s VAL 628 N 0.76 0.23 -0.09 0.00 1.01 -0.50 0.96 120.40 122.77 1nud s VAL 628 Ca 0.39 -0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 1nud s VAL 628 Cb -0.18 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 1nud s VAL 628 CO 0.20 0.11 -0.07 -0.22 0.00 0.00 0.00 175.10 175.12 1nud s LEU 629 N 0.48 3.16 -0.12 3.92 0.20 0.41 -2.25 118.68 124.49 1nud s LEU 629 Ca -0.05 -0.06 0.01 0.00 0.69 0.00 0.00 54.13 54.72 1nud s LEU 629 Cb -0.08 -1.70 0.02 0.00 -0.43 0.00 0.00 46.19 44.00 1nud s LEU 629 CO -0.01 0.31 -0.14 -0.04 -0.29 0.00 0.00 176.35 176.18 1nud s MET 630 N -0.51 2.14 0.04 1.98 -1.94 -0.12 -0.89 119.30 120.01 1nud s MET 630 Ca 0.08 -0.52 0.06 0.00 -1.71 0.00 0.00 55.69 53.59 1nud s MET 630 Cb -0.12 -1.89 -0.02 0.00 2.01 0.00 0.00 34.83 34.81 1nud s MET 630 CO 0.02 -0.12 -0.16 0.08 -0.01 0.00 0.00 175.02 174.83 1nud s VAL 631 N 1.17 1.27 0.13 -6.03 1.01 -0.26 0.24 120.40 117.92 1nud s VAL 631 Ca -0.03 -1.08 -0.25 0.00 0.00 0.00 0.00 61.98 60.62 1nud s VAL 631 Cb -0.14 -1.14 0.07 0.00 0.00 0.00 0.00 36.38 35.17 1nud s VAL 631 CO -0.04 0.04 0.86 -1.83 0.00 0.00 0.00 175.10 174.12 1nud s GLU 632 N -1.20 1.19 0.00 2.72 -1.05 -0.67 0.88 118.70 120.57 1nud s GLU 632 Ca 0.03 -0.58 0.00 0.00 -0.15 0.00 0.00 54.97 54.27 1nud s GLU 632 Cb -0.08 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 34.06 1nud s GLU 632 CO 0.02 -0.53 0.00 0.41 0.95 0.00 0.00 175.26 176.10 1nud n GLY 633 N -0.39 1.38 3.68 -3.83 0.00 -1.26 -1.47 105.19 103.31 1nud n GLY 633 Ca -0.08 0.49 -0.45 0.00 0.00 0.00 0.00 46.02 45.99 1nud n GLY 633 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nud n SER 634 N 0.00 3.67 0.00 1.61 7.64 -1.26 -0.91 113.62 124.36 1nud n SER 634 Ca 0.00 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.89 1nud n SER 634 Cb 0.00 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.73 1nud n SER 634 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nud n GLY 635 N 4.07 1.36 0.38 0.23 0.00 -1.26 -4.67 105.19 105.30 1nud n GLY 635 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 1nud n GLY 635 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nud n LEU 636 N 0.00 1.81 -4.27 0.99 4.77 -0.09 -0.92 117.00 119.29 1nud n LEU 636 Ca 0.00 0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.87 1nud n LEU 636 Cb 0.00 -0.33 -0.10 0.00 -2.33 0.00 0.00 43.42 40.66 1nud n LEU 636 CO 0.00 0.43 -0.37 -0.76 -1.33 0.00 0.00 177.39 175.36 1nud s LEU 637 N -6.11 2.35 -0.46 2.23 1.43 -0.69 -2.20 118.68 115.23 1nud s LEU 637 Ca -0.14 -1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 51.72 1nud s LEU 637 Cb 0.05 -0.27 0.08 0.00 0.03 0.00 0.00 46.19 46.08 1nud s LEU 637 CO 0.21 -0.43 0.36 -0.76 0.23 0.00 0.00 176.35 175.96 1nud s LEU 638 N -3.21 5.53 0.00 1.79 1.43 -1.26 -4.61 118.68 118.35 1nud s LEU 638 Ca 0.22 -1.45 0.00 0.00 -1.03 0.00 0.00 54.13 51.86 1nud s LEU 638 Cb 0.04 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 44.15 1nud s LEU 638 CO 0.04 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 176.59 1nud n GLY 639 N 5.10 -1.62 3.41 -3.19 0.00 -1.26 -4.85 105.19 102.79 1nud n GLY 639 Ca -0.12 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 1nud n GLY 639 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1nud s ASN 640 N -4.00 4.82 -0.18 1.61 3.84 -1.26 -4.39 114.94 115.38 1nud s ASN 640 Ca 0.00 -0.26 -0.28 0.00 0.21 0.00 0.00 52.86 52.53 1nud s ASN 640 Cb 0.00 -1.85 -0.00 0.00 -0.55 0.00 0.00 41.25 38.85 1nud s ASN 640 CO 0.00 -0.00 0.97 -0.22 -2.79 0.00 0.00 177.10 175.06 1nud s LEU 641 N 1.42 4.16 -0.12 3.21 2.96 0.25 -4.86 118.68 125.69 1nud s LEU 641 Ca 0.05 1.36 -0.03 0.00 -0.22 0.00 0.00 54.13 55.28 1nud s LEU 641 Cb -0.15 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.05 1nud s LEU 641 CO 0.01 -0.54 -0.00 -0.75 -1.32 0.00 0.00 176.35 173.75 1nud s LYS 642 N 2.61 3.33 -0.10 1.98 2.20 -1.26 -1.10 119.74 127.40 1nud s LYS 642 Ca 0.43 -0.43 -0.03 0.00 -0.36 0.00 0.00 55.97 55.58 1nud s LYS 642 Cb -0.16 -2.89 0.04 0.00 -1.51 0.00 0.00 37.83 33.31 1nud s LYS 642 CO 0.11 0.51 0.06 0.42 -0.36 0.00 0.00 175.35 176.08 1nud s ILE 643 N -0.34 0.06 0.00 5.43 1.01 -0.06 -4.96 121.20 122.33 1nud s ILE 643 Ca 0.07 0.08 -0.30 0.00 0.00 0.00 0.00 60.65 60.50 1nud s ILE 643 Cb -0.12 -0.45 -0.06 0.00 0.01 0.00 0.00 42.46 41.84 1nud s ILE 643 CO 0.02 0.01 1.45 -1.81 0.00 0.00 0.00 174.94 174.61 1nud s ASP 644 N 2.09 6.80 -0.16 3.58 -0.00 -1.26 -0.44 116.67 127.28 1nud s ASP 644 Ca 0.03 2.16 -0.07 0.00 -0.00 0.00 0.00 52.55 54.68 1nud s ASP 644 Cb -0.14 -2.56 -0.04 0.00 -0.00 0.00 0.00 42.92 40.18 1nud s ASP 644 CO -0.06 -0.76 0.07 -0.69 -0.00 0.00 0.00 175.17 173.73 1nud s VAL 645 N 2.60 4.84 0.25 -1.27 1.01 0.27 -4.94 120.40 123.16 1nud s VAL 645 Ca 0.66 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.31 1nud s VAL 645 Cb -0.32 -3.15 -0.10 0.00 0.00 0.00 0.00 36.38 32.81 1nud s VAL 645 CO 0.27 0.51 1.43 -2.16 0.00 0.00 0.00 175.10 175.15 1nud s PRO 646 N -0.04 4.27 0.14 2.72 0.04 -1.26 -3.71 135.00 137.16 1nud s PRO 646 Ca 0.07 2.29 -0.29 0.00 0.04 0.00 0.00 61.00 63.11 1nud s PRO 646 Cb -0.12 -3.11 -0.17 0.00 0.04 0.00 0.00 34.50 31.14 1nud s PRO 646 CO 0.01 -0.41 0.62 2.41 0.04 0.00 0.00 177.00 179.66 1nud n THR 647 N 2.30 1.41 -4.16 1.26 -1.04 -1.26 -4.92 114.28 107.87 1nud n THR 647 Ca 0.07 -0.35 -0.34 0.00 -2.04 0.00 0.00 64.05 61.38 1nud n THR 647 Cb 0.40 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.78 1nud n THR 647 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1nud s LEU 648 N 2.11 2.94 1.02 -4.42 2.96 -0.50 -4.97 118.68 117.83 1nud s LEU 648 Ca 0.66 -0.32 -0.12 0.00 -0.22 0.00 0.00 54.13 54.13 1nud s LEU 648 Cb -0.95 -1.73 0.20 0.00 0.50 0.00 0.00 46.19 44.21 1nud s LEU 648 CO 0.53 0.05 1.08 -0.83 -1.32 0.00 0.00 176.35 175.85 1nud s GLY 649 N 1.05 1.59 0.24 7.98 0.00 -1.26 -0.63 107.32 116.29 1nud s GLY 649 Ca 0.01 -0.10 -0.31 0.00 0.00 0.00 0.00 44.72 44.32 1nud s GLY 649 CO -0.00 0.50 1.58 2.56 0.00 0.00 0.00 173.10 177.74 1nud s PRO 650 N -4.75 4.17 0.00 2.90 0.04 -1.26 -1.70 135.00 134.40 1nud s PRO 650 Ca 0.66 2.48 0.00 0.00 0.04 0.00 0.00 61.00 64.18 1nud s PRO 650 Cb -0.21 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.25 1nud s PRO 650 CO 0.60 -0.60 0.00 1.63 0.04 0.00 0.00 177.00 178.67 1nud n LYS 651 N 2.94 -0.83 -2.29 4.56 4.76 0.61 -4.99 118.16 122.92 1nud n LYS 651 Ca 0.11 0.21 -0.27 0.00 -2.87 0.00 0.00 58.31 55.49 1nud n LYS 651 Cb 0.38 -4.01 0.04 0.00 -1.84 0.00 0.00 35.03 29.60 1nud n LYS 651 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1nud s GLU 652 N -0.99 2.68 -0.03 1.97 0.41 -0.69 -4.79 118.70 117.26 1nud s GLU 652 Ca 0.00 -0.06 0.07 0.00 -0.41 0.00 0.00 54.97 54.58 1nud s GLU 652 Cb 0.00 -2.22 -0.02 0.00 -1.78 0.00 0.00 34.13 30.11 1nud s GLU 652 CO 0.00 -0.90 -0.24 0.50 -0.49 0.00 0.00 175.26 174.12 1nud s ARG 653 N -5.10 2.12 -0.10 1.61 3.52 -1.26 -1.52 118.95 118.22 1nud s ARG 653 Ca 0.56 -0.87 -0.01 0.00 -0.13 0.00 0.00 55.73 55.28 1nud s ARG 653 Cb -0.11 -1.97 -0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1nud s ARG 653 CO 0.45 0.48 -0.03 0.45 -0.81 0.00 0.00 175.30 175.84 1nud s SER 654 N -0.45 4.92 -0.37 -2.12 0.15 0.17 -4.96 113.70 111.05 1nud s SER 654 Ca 0.06 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1nud s SER 654 Cb -0.11 -1.44 0.13 0.00 -1.71 0.00 0.00 66.02 62.89 1nud s SER 654 CO 0.00 0.32 0.19 -0.60 1.20 0.00 0.00 173.24 174.36 1nud s ARG 655 N -0.54 0.78 -0.27 5.44 3.00 -1.26 -1.84 118.95 124.27 1nud s ARG 655 Ca 0.09 -1.43 -0.17 0.00 -1.00 0.00 0.00 55.73 53.22 1nud s ARG 655 Cb -0.12 -1.74 -0.03 0.00 0.00 0.00 0.00 34.95 33.07 1nud s ARG 655 CO 0.02 -1.14 0.45 0.08 0.00 0.00 0.00 175.30 174.71 1nud s VAL 656 N 1.02 5.11 0.15 7.11 1.01 -0.63 -4.88 120.40 129.29 1nud s VAL 656 Ca 0.16 0.70 -0.04 0.00 0.00 0.00 0.00 61.98 62.80 1nud s VAL 656 Cb -0.22 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1nud s VAL 656 CO -0.07 0.10 0.37 -0.13 0.00 0.00 0.00 175.10 175.37 1nud s ARG 657 N 2.21 3.59 0.03 2.72 0.52 -1.26 -0.22 118.95 126.53 1nud s ARG 657 Ca 0.18 -0.14 -0.28 0.00 -0.52 0.00 0.00 55.73 54.97 1nud s ARG 657 Cb -0.16 -2.85 0.09 0.00 0.52 0.00 0.00 34.95 32.55 1nud s ARG 657 CO 0.10 0.46 0.98 -0.59 0.02 0.00 0.00 175.30 176.26 1nud s PHE 658 N -1.69 -0.23 0.32 -0.53 -0.12 -0.63 -4.98 117.98 110.13 1nud s PHE 658 Ca 0.40 0.05 0.11 0.00 -0.05 0.00 0.00 56.93 57.44 1nud s PHE 658 Cb -0.12 0.57 -0.06 0.00 -0.63 0.00 0.00 43.02 42.78 1nud s PHE 658 CO 0.26 -0.58 -0.14 -0.51 -0.05 0.00 0.00 175.22 174.20 1nud s ASP 659 N -2.65 3.68 0.13 1.98 -0.00 -1.26 -0.56 116.67 118.00 1nud s ASP 659 Ca 0.09 -1.12 -0.01 0.00 -0.00 0.00 0.00 52.55 51.50 1nud s ASP 659 Cb -0.01 -0.33 -0.04 0.00 -0.00 0.00 0.00 42.92 42.54 1nud s ASP 659 CO -0.04 -0.10 0.06 0.27 -0.00 0.00 0.00 175.17 175.36 1nud s ILE 660 N -2.56 0.11 -0.38 0.77 -4.36 -0.88 -4.97 121.20 108.91 1nud s ILE 660 Ca 0.31 -1.88 0.01 0.00 -0.26 0.00 0.00 60.65 58.83 1nud s ILE 660 Cb -0.01 -2.01 0.13 0.00 1.25 0.00 0.00 42.46 41.82 1nud s ILE 660 CO 0.16 -0.48 0.21 -0.22 0.24 0.00 0.00 174.94 174.85 1nud s LEU 661 N -3.04 1.72 -0.21 0.37 2.96 -0.94 -1.41 118.68 118.14 1nud s LEU 661 Ca 0.23 -2.29 -0.41 0.00 -0.22 0.00 0.00 54.13 51.44 1nud s LEU 661 Cb 0.07 -0.68 -0.18 0.00 0.50 0.00 0.00 46.19 45.91 1nud s LEU 661 CO 0.01 -0.30 1.49 -2.65 -1.32 0.00 0.00 176.35 173.58 1nud n PRO 662 N 3.95 0.63 -0.00 0.98 -0.02 -1.24 -4.67 135.00 134.62 1nud n PRO 662 Ca 0.09 0.23 0.08 0.00 -2.02 0.00 0.00 63.50 61.88 1nud n PRO 662 Cb 0.36 -1.82 -0.11 0.00 -0.02 0.00 0.00 33.50 31.91 1nud n PRO 662 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1nud n SER 663 N 3.67 1.12 -3.87 2.55 3.41 -0.10 0.15 113.62 120.54 1nud n SER 663 Ca 0.25 -0.30 -0.12 0.00 -0.26 0.00 0.00 58.87 58.44 1nud n SER 663 Cb 0.08 1.48 -0.13 0.00 -0.26 0.00 0.00 64.21 65.39 1nud n SER 663 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1nud s ARG 664 N -2.90 0.13 0.69 4.33 3.52 -1.22 -4.82 118.95 118.68 1nud s ARG 664 Ca -0.02 -0.07 -0.11 0.00 -0.13 0.00 0.00 55.73 55.40 1nud s ARG 664 Cb 0.11 0.05 0.01 0.00 -1.56 0.00 0.00 34.95 33.56 1nud s ARG 664 CO 0.66 -0.02 1.08 -1.54 -0.81 0.00 0.00 175.30 174.67 1nud s SER 665 N -0.30 5.57 0.00 -2.12 1.04 -1.26 -4.86 113.70 111.77 1nud s SER 665 Ca -0.04 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.56 1nud s SER 665 Cb -0.02 -2.01 0.00 0.00 0.10 0.00 0.00 66.02 64.09 1nud s SER 665 CO 0.00 -1.26 0.00 0.61 0.98 0.00 0.00 173.24 173.57 1nud n GLY 666 N -2.96 -0.40 3.60 7.32 0.00 0.80 -4.92 105.19 108.63 1nud n GLY 666 Ca 0.07 -2.26 -0.43 0.00 0.00 0.00 0.00 46.02 43.40 1nud n GLY 666 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nud s THR 667 N -0.44 3.99 0.18 2.61 2.01 -1.26 -1.11 115.64 121.62 1nud s THR 667 Ca 0.00 0.99 0.08 0.00 0.31 0.00 0.00 61.69 63.07 1nud s THR 667 Cb 0.00 -4.35 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 1nud s THR 667 CO 0.00 -0.88 -0.04 -0.54 -0.69 0.00 0.00 174.62 172.48 1nud s LYS 668 N 4.84 2.27 -0.24 4.92 -0.14 0.22 -4.94 119.74 126.66 1nud s LYS 668 Ca 0.56 -1.18 -0.05 0.00 -1.36 0.00 0.00 55.97 53.94 1nud s LYS 668 Cb -0.11 -2.27 -0.01 0.00 -1.68 0.00 0.00 37.83 33.75 1nud s LYS 668 CO 0.32 0.44 0.02 -1.14 -0.76 0.00 0.00 175.35 174.23 1nud s GLN 669 N -2.93 3.42 -0.27 1.68 0.74 -1.26 0.47 119.66 121.51 1nud s GLN 669 Ca 0.27 -0.61 -0.11 0.00 0.05 0.00 0.00 55.36 54.96 1nud s GLN 669 Cb -0.09 -3.17 -0.05 0.00 1.10 0.00 0.00 33.01 30.80 1nud s GLN 669 CO 0.17 -0.23 0.17 -1.17 -0.55 0.00 0.00 175.29 173.68 1nud s LEU 670 N 1.53 3.96 0.04 3.68 2.96 0.31 -4.32 118.68 126.83 1nud s LEU 670 Ca 0.05 -0.02 0.07 0.00 -0.22 0.00 0.00 54.13 54.02 1nud s LEU 670 Cb -0.15 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 1nud s LEU 670 CO -0.00 -0.04 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.03 1nud s LEU 671 N 1.68 2.48 0.07 -0.68 1.43 -0.54 -0.93 118.68 122.19 1nud s LEU 671 Ca 0.07 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1nud s LEU 671 Cb -0.16 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 1nud s LEU 671 CO 0.10 0.26 -0.05 0.00 0.23 0.00 0.00 176.35 176.89 1nud s ALA 672 N -0.87 0.71 -0.06 4.21 0.00 -0.38 -1.67 121.76 123.70 1nud s ALA 672 Ca 0.14 -1.19 -0.00 0.00 0.00 0.00 0.00 51.96 50.90 1nud s ALA 672 Cb -0.10 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1nud s ALA 672 CO 0.04 -0.26 -0.03 0.34 0.00 0.00 0.00 175.76 175.86 1nud s ASP 673 N -2.74 1.30 -0.19 0.00 2.15 0.14 -2.55 116.67 114.77 1nud s ASP 673 Ca 0.06 -0.12 -0.02 0.00 0.43 0.00 0.00 52.55 52.90 1nud s ASP 673 Cb 0.04 -0.47 -0.00 0.00 -0.30 0.00 0.00 42.92 42.19 1nud s ASP 673 CO -0.06 -0.12 -0.11 0.12 -0.17 0.00 0.00 175.17 174.83 1nud s PHE 674 N 1.43 2.87 -0.03 -5.34 5.36 0.37 -0.94 117.98 121.69 1nud s PHE 674 Ca -0.03 -1.07 0.03 0.00 -0.96 0.00 0.00 56.93 54.90 1nud s PHE 674 Cb -0.13 -1.99 -0.00 0.00 -0.34 0.00 0.00 43.02 40.56 1nud s PHE 674 CO -0.03 -0.55 -0.12 -1.12 -1.46 0.00 0.00 175.22 171.95 1nud s SER 675 N 1.16 1.53 0.35 6.13 0.01 -0.95 -0.13 113.70 121.80 1nud s SER 675 Ca 0.01 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.06 1nud s SER 675 Cb -0.14 -0.39 -0.01 0.00 0.21 0.00 0.00 66.02 65.69 1nud s SER 675 CO -0.04 0.10 0.39 0.00 0.41 0.00 0.00 173.24 174.11 1nud h ASN 677 N 2.09 0.59 -0.02 0.00 -1.07 -1.39 -2.94 115.58 112.84 1nud h ASN 677 Ca -0.26 -0.09 0.00 0.00 0.07 0.00 0.00 56.30 56.01 1nud h ASN 677 Cb 1.23 -0.15 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 1nud h ASN 677 CO 0.37 0.60 -0.11 0.29 0.07 0.00 0.00 177.43 178.64 1nud n LYS 678 N -4.31 2.05 -3.39 4.14 4.76 -1.26 -4.77 118.16 115.38 1nud n LYS 678 Ca 0.03 -1.69 -0.21 0.00 -2.87 0.00 0.00 58.31 53.57 1nud n LYS 678 Cb 0.21 -1.47 -0.09 0.00 -1.84 0.00 0.00 35.03 31.84 1nud n LYS 678 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1nud s PHE 679 N -2.11 0.05 0.27 2.13 0.40 -1.11 -5.06 117.98 112.54 1nud s PHE 679 Ca 0.26 -1.12 -0.24 0.00 -0.60 0.00 0.00 56.93 55.23 1nud s PHE 679 Cb 0.20 -0.57 -0.09 0.00 0.51 0.00 0.00 43.02 43.06 1nud s PHE 679 CO 0.37 -0.92 0.84 -1.25 0.70 0.00 0.00 175.22 174.95 1nud s PRO 680 N 1.27 4.46 -0.89 0.24 0.04 -1.25 -1.81 135.00 137.07 1nud s PRO 680 Ca 0.18 1.14 -0.06 0.00 0.04 0.00 0.00 61.00 62.29 1nud s PRO 680 Cb -0.18 -2.89 0.00 0.00 0.04 0.00 0.00 34.50 31.48 1nud s PRO 680 CO -0.01 0.36 0.66 0.00 0.04 0.00 0.00 177.00 178.05 1nud n ALA 681 N 0.75 -2.69 -2.31 8.56 0.00 -1.24 -4.86 120.51 118.73 1nud n ALA 681 Ca -0.01 -0.24 -0.39 0.00 0.00 0.00 0.00 53.44 52.81 1nud n ALA 681 Cb 0.50 -1.56 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 1nud n ALA 681 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nud s ILE 682 N -3.11 4.77 0.30 0.00 1.01 0.81 -4.89 121.20 120.09 1nud s ILE 682 Ca 0.12 1.21 0.08 0.00 0.00 0.00 0.00 60.65 62.06 1nud s ILE 682 Cb -0.05 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1nud s ILE 682 CO 0.87 0.54 0.11 -0.54 0.00 0.00 0.00 174.94 175.92 1nud s LYS 683 N -1.00 2.46 -0.17 2.79 -0.14 -1.26 -0.48 119.74 121.94 1nud s LYS 683 Ca 0.29 -1.40 -0.20 0.00 -1.36 0.00 0.00 55.97 53.29 1nud s LYS 683 Cb -0.19 -2.26 0.05 0.00 -1.68 0.00 0.00 37.83 33.75 1nud s LYS 683 CO 0.19 0.24 0.54 0.00 -0.76 0.00 0.00 175.35 175.57 1nud s ALA 684 N -2.33 -1.36 -0.07 5.17 0.00 -1.06 -4.47 121.76 117.64 1nud s ALA 684 Ca 0.35 1.40 -0.05 0.00 0.00 0.00 0.00 51.96 53.66 1nud s ALA 684 Cb -0.05 -0.69 0.02 0.00 0.00 0.00 0.00 23.12 22.41 1nud s ALA 684 CO 0.22 -0.28 0.16 1.41 0.00 0.00 0.00 175.76 177.28 1nud s MET 685 N -0.07 0.17 -0.04 0.00 0.00 -1.26 -1.24 119.30 116.85 1nud s MET 685 Ca -0.03 0.28 -0.01 0.00 0.00 0.00 0.00 55.69 55.93 1nud s MET 685 Cb -0.03 0.01 0.03 0.00 0.00 0.00 0.00 34.83 34.84 1nud s MET 685 CO 0.02 -0.07 0.07 -1.17 0.00 0.00 0.00 175.02 173.87 1nud s LEU 686 N 0.44 0.61 -0.32 4.11 2.96 -0.11 -4.86 118.68 121.50 1nud s LEU 686 Ca -0.03 0.11 -0.22 0.00 -0.22 0.00 0.00 54.13 53.78 1nud s LEU 686 Cb -0.04 -0.01 -0.00 0.00 0.50 0.00 0.00 46.19 46.64 1nud s LEU 686 CO -0.02 -0.18 0.71 -0.55 -1.32 0.00 0.00 176.35 174.99 1nud s SER 687 N 1.57 6.56 -0.11 3.68 0.15 -1.26 -0.53 113.70 123.75 1nud s SER 687 Ca -0.03 0.46 -0.04 0.00 0.70 0.00 0.00 55.95 57.04 1nud s SER 687 Cb -0.12 -2.37 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 1nud s SER 687 CO -0.04 -0.59 0.03 -0.63 1.20 0.00 0.00 173.24 173.22 1nud s ILE 688 N 2.83 4.56 -0.43 6.45 1.01 0.18 -4.92 121.20 130.87 1nud s ILE 688 Ca 0.29 -0.14 -0.16 0.00 0.00 0.00 0.00 60.65 60.63 1nud s ILE 688 Cb -0.14 -2.96 0.03 0.00 0.01 0.00 0.00 42.46 39.40 1nud s ILE 688 CO 0.13 0.58 0.37 -1.81 0.00 0.00 0.00 174.94 174.20 1nud s ASP 689 N -0.61 6.14 -0.25 3.58 1.11 -1.26 0.70 116.67 126.08 1nud s ASP 689 Ca 0.10 -0.95 -0.11 0.00 0.18 0.00 0.00 52.55 51.78 1nud s ASP 689 Cb -0.12 -2.18 -0.05 0.00 1.07 0.00 0.00 42.92 41.64 1nud s ASP 689 CO 0.02 -0.54 0.16 -0.69 1.18 0.00 0.00 175.17 175.31 1nud s VAL 690 N 1.81 5.31 0.79 -1.27 1.01 -0.26 -4.41 120.40 123.39 1nud s VAL 690 Ca 0.07 0.17 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 1nud s VAL 690 Cb -0.20 -3.49 0.13 0.00 0.00 0.00 0.00 36.38 32.82 1nud s VAL 690 CO 0.10 0.32 1.11 0.00 0.00 0.00 0.00 175.10 176.63 1nud s ALA 691 N 1.25 3.04 0.00 5.51 0.00 -0.85 -0.14 121.76 130.56 1nud s ALA 691 Ca 0.07 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.75 1nud s ALA 691 Cb -0.14 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.52 1nud s ALA 691 CO 0.06 -1.72 0.00 0.39 0.00 0.00 0.00 175.76 174.49