#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fss s LYS 2 N 0.00 4.31 -0.12 0.00 2.20 -1.26 -0.05 119.74 124.82 2fss s LYS 2 Ca 0.00 0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.96 2fss s LYS 2 Cb 0.00 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 2fss s LYS 2 CO 0.00 0.17 -0.16 0.42 -0.36 0.00 0.00 175.35 175.42 2fss s ILE 3 N 0.62 1.59 -0.35 5.43 1.09 0.61 -1.93 121.20 128.26 2fss s ILE 3 Ca 0.23 -0.69 -0.11 0.00 -1.10 0.00 0.00 60.65 58.98 2fss s ILE 3 Cb -0.14 -1.44 0.01 0.00 -1.06 0.00 0.00 42.46 39.82 2fss s ILE 3 CO 0.08 0.46 0.19 -0.69 -0.10 0.00 0.00 174.94 174.88 2fss s VAL 4 N 0.98 4.65 -0.28 2.92 1.01 -0.12 -0.05 120.40 129.50 2fss s VAL 4 Ca -0.06 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 2fss s VAL 4 Cb -0.15 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 2fss s VAL 4 CO -0.02 -0.10 0.10 -0.22 0.00 0.00 0.00 175.10 174.85 2fss s LEU 5 N 1.59 3.76 -0.30 3.92 2.96 0.15 -0.20 118.68 130.57 2fss s LEU 5 Ca 0.03 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.42 2fss s LEU 5 Cb -0.18 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.58 2fss s LEU 5 CO 0.07 -0.13 0.09 -0.69 -1.32 0.00 0.00 176.35 174.36 2fss s VAL 6 N 1.58 4.00 0.19 1.68 1.01 -0.30 -0.94 120.40 127.62 2fss s VAL 6 Ca 0.05 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.35 2fss s VAL 6 Cb -0.16 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2fss s VAL 6 CO 0.04 0.06 0.10 0.18 0.00 0.00 0.00 175.10 175.48 2fss n LEU 7 N 4.87 0.00 -4.93 3.92 4.77 -0.61 -3.88 117.00 121.15 2fss n LEU 7 Ca -0.14 -1.58 -0.25 0.00 -0.03 0.00 0.00 56.01 54.00 2fss n LEU 7 Cb 0.48 0.64 -0.01 0.00 -2.33 0.00 0.00 43.42 42.20 2fss n LEU 7 CO 0.32 -0.25 0.26 -0.72 -1.33 0.00 0.00 177.39 175.66 2fss s TYR 8 N -2.46 3.52 -0.36 -1.77 1.13 -1.26 -3.97 117.35 112.19 2fss s TYR 8 Ca 0.14 0.49 -0.23 0.00 -1.41 0.00 0.00 57.07 56.06 2fss s TYR 8 Cb 0.01 -2.02 0.01 0.00 -1.10 0.00 0.00 41.96 38.85 2fss s TYR 8 CO 0.10 -0.00 0.77 -0.51 -2.51 0.00 0.00 175.55 173.40 2fss s ASP 9 N -4.05 6.55 0.33 -0.18 1.01 -1.26 -0.42 116.67 118.64 2fss s ASP 9 Ca 0.42 0.37 0.22 0.00 0.71 0.00 0.00 52.55 54.27 2fss s ASP 9 Cb -0.10 -2.39 0.18 0.00 1.01 0.00 0.00 42.92 41.62 2fss s ASP 9 CO 0.39 -0.71 1.36 0.00 0.21 0.00 0.00 175.17 176.42 2fss h ALA 10 N 8.45 0.78 -1.00 5.23 0.00 -1.96 -3.49 119.26 127.28 2fss h ALA 10 Ca -0.25 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2fss h ALA 10 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fss h ALA 10 CO 0.90 0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.63 2fss n GLY 11 N 1.15 3.36 0.32 0.00 0.00 -1.26 -2.27 105.19 106.48 2fss n GLY 11 Ca 0.02 -0.21 0.16 0.00 0.00 0.00 0.00 46.02 45.99 2fss n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fss h LYS 12 N 0.00 0.00 0.00 1.61 6.56 -2.01 -0.48 116.57 122.26 2fss h LYS 12 Ca 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.55 2fss h LYS 12 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 2fss h LYS 12 CO 0.00 0.00 -0.20 0.45 -2.06 0.00 0.00 179.45 177.64 2fss h HIS 13 N 0.00 0.00 0.00 -1.35 3.86 -1.87 -1.17 115.15 114.62 2fss h HIS 13 Ca 0.05 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.12 2fss h HIS 13 Cb 0.30 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 2fss h HIS 13 CO 0.00 0.20 -0.67 0.00 0.86 0.00 0.00 177.93 178.33 2fss h ALA 14 N 1.80 0.65 -0.21 2.45 0.00 -1.21 -3.17 119.26 119.57 2fss h ALA 14 Ca -0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 54.91 54.22 2fss h ALA 14 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2fss h ALA 14 CO 0.03 0.83 -0.23 0.00 0.00 0.00 0.00 179.25 179.88 2fss h ALA 15 N 1.33 1.23 -0.07 0.00 0.00 -1.22 -3.13 119.26 117.41 2fss h ALA 15 Ca -0.01 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 2fss h ALA 15 Cb 1.40 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2fss h ALA 15 CO 0.09 0.50 -0.58 -0.44 0.00 0.00 0.00 179.25 178.82 2fss h ASP 16 N 0.34 0.26 -2.72 0.00 3.32 -1.45 -3.46 116.42 112.71 2fss h ASP 16 Ca 0.06 -0.14 -0.27 0.00 0.02 0.00 0.00 57.03 56.69 2fss h ASP 16 Cb 0.59 -0.07 -0.34 0.00 0.22 0.00 0.00 39.33 39.72 2fss h ASP 16 CO 0.04 0.78 -0.59 -0.70 -1.72 0.00 0.00 179.24 177.06 2fss s GLU 17 N -3.80 0.15 0.16 3.56 2.56 -1.18 -5.04 118.70 115.10 2fss s GLU 17 Ca -0.04 0.48 -0.09 0.00 0.00 0.00 0.00 54.97 55.33 2fss s GLU 17 Cb 0.12 -0.58 0.00 0.00 2.00 0.00 0.00 34.13 35.68 2fss s GLU 17 CO 0.79 -0.46 1.48 1.05 -0.56 0.00 0.00 175.26 177.57 2fss h GLU 18 N 8.31 0.84 0.00 4.30 4.11 -1.89 -3.00 114.58 127.25 2fss h GLU 18 Ca -0.15 -0.46 0.00 0.00 0.07 0.00 0.00 59.36 58.81 2fss h GLU 18 Cb 1.13 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2fss h GLU 18 CO 0.20 1.10 0.00 1.63 0.07 0.00 0.00 179.01 182.01 2fss n LYS 19 N -4.04 0.43 -1.93 1.06 5.02 -1.26 -4.27 118.16 113.17 2fss n LYS 19 Ca -0.03 0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2fss n LYS 19 Cb 0.56 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 2fss n LYS 19 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2fss n LEU 20 N -1.03 6.59 0.19 -0.35 7.94 -1.13 -4.64 117.00 124.56 2fss n LEU 20 Ca 0.10 -4.19 0.05 0.00 -1.11 0.00 0.00 56.01 50.87 2fss n LEU 20 Cb 0.05 -1.65 0.34 0.00 0.53 0.00 0.00 43.42 42.70 2fss n LEU 20 CO 0.08 1.03 0.68 1.88 -1.11 0.00 0.00 177.39 179.95 2fss h TYR 21 N 6.17 0.00 -0.11 1.96 0.05 -1.87 -3.34 116.97 119.82 2fss h TYR 21 Ca 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.30 2fss h TYR 21 Cb 0.67 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.40 2fss h TYR 21 CO 1.42 0.38 0.02 0.41 -1.05 0.00 0.00 178.16 179.34 2fss n GLY 22 N 0.14 1.85 3.53 3.88 0.00 -1.26 -0.38 105.19 112.94 2fss n GLY 22 Ca -0.00 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 2fss n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fss h THR 24 N 2.11 0.68 -0.22 0.00 1.35 -1.03 -0.03 112.91 115.77 2fss h THR 24 Ca -0.41 0.00 -0.16 0.00 -0.55 0.00 0.00 66.41 65.29 2fss h THR 24 Cb 1.25 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 2fss h THR 24 CO 0.64 0.00 -0.49 -0.33 -0.25 0.00 0.00 175.52 175.09 2fss h GLU 25 N 0.00 0.71 0.00 4.72 3.07 -1.93 -3.29 114.58 117.86 2fss h GLU 25 Ca 0.23 -0.48 0.00 0.00 -0.50 0.00 0.00 59.36 58.61 2fss h GLU 25 Cb 0.95 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 2fss h GLU 25 CO -0.00 1.10 -1.00 0.09 -1.40 0.00 0.00 179.01 177.80 2fss n ASN 26 N -4.14 0.74 -4.01 1.42 3.02 -0.87 -4.99 115.26 106.42 2fss n ASN 26 Ca -0.06 -0.61 -0.30 0.00 -0.03 0.00 0.00 54.58 53.57 2fss n ASN 26 Cb 0.59 0.91 -0.00 0.00 -0.61 0.00 0.00 39.78 40.66 2fss n ASN 26 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2fss n LYS 27 N -1.66 -4.14 -1.36 3.52 5.02 -0.08 -0.59 118.16 118.86 2fss n LYS 27 Ca 0.03 0.48 -0.13 0.00 -2.02 0.00 0.00 58.31 56.67 2fss n LYS 27 Cb 0.37 -5.11 -0.05 0.00 -0.02 0.00 0.00 35.03 30.22 2fss n LYS 27 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2fss n LEU 28 N -4.48 -0.53 -0.24 -0.35 4.77 0.48 -2.10 117.00 114.56 2fss n LEU 28 Ca -0.06 0.31 -0.03 0.00 -0.03 0.00 0.00 56.01 56.20 2fss n LEU 28 Cb 0.56 -2.71 -0.01 0.00 -2.33 0.00 0.00 43.42 38.93 2fss n LEU 28 CO 0.79 -1.05 -0.03 0.61 -1.33 0.00 0.00 177.39 176.37 2fss n GLY 29 N 0.16 0.44 0.28 -0.72 0.00 0.24 -4.73 105.19 100.87 2fss n GLY 29 Ca -0.13 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 45.88 2fss n GLY 29 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2fss n ILE 30 N -2.37 0.00 -0.23 -0.61 -5.35 -0.89 -4.69 119.36 105.23 2fss n ILE 30 Ca -0.03 -0.36 0.02 0.00 -0.27 0.00 0.00 62.75 62.11 2fss n ILE 30 Cb 0.37 1.15 0.14 0.00 -1.74 0.00 0.00 39.64 39.56 2fss n ILE 30 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2fss h ALA 31 N 2.21 0.90 -0.29 -1.28 0.00 -1.86 -0.35 119.26 118.59 2fss h ALA 31 Ca 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2fss h ALA 31 Cb 0.43 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2fss h ALA 31 CO 0.00 -0.19 -0.13 -0.91 0.00 0.00 0.00 179.25 178.01 2fss h ASN 32 N 0.43 0.62 -0.64 0.00 2.35 -1.95 -2.02 115.58 114.36 2fss h ASN 32 Ca 0.35 -0.40 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 2fss h ASN 32 Cb 0.48 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 2fss h ASN 32 CO -0.35 0.88 0.36 -0.25 -1.65 0.00 0.00 177.43 176.42 2fss h TRP 33 N 0.35 0.89 0.39 1.19 7.01 -1.73 -0.49 115.95 123.57 2fss h TRP 33 Ca 0.07 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 2fss h TRP 33 Cb 0.65 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 27.42 2fss h TRP 33 CO 0.06 0.63 -0.19 -0.07 -2.79 0.00 0.00 178.44 176.08 2fss h LEU 34 N 0.92 -0.45 -1.01 0.65 3.38 -1.02 -2.91 115.31 114.87 2fss h LEU 34 Ca 0.23 -0.02 0.26 0.00 0.09 0.00 0.00 57.88 58.44 2fss h LEU 34 Cb 0.03 0.12 -0.13 0.00 0.09 0.00 0.00 40.66 40.77 2fss h LEU 34 CO -0.04 -0.00 0.59 0.50 0.09 0.00 0.00 178.44 179.58 2fss h LYS 35 N -1.12 0.51 0.00 1.13 3.64 -1.30 0.20 116.57 119.62 2fss h LYS 35 Ca -0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2fss h LYS 35 Cb 0.44 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2fss h LYS 35 CO 0.09 0.34 0.00 -0.25 -2.27 0.00 0.00 179.45 177.35 2fss n ASP 36 N -4.92 0.11 -0.55 4.20 8.00 -0.20 -2.30 116.55 120.89 2fss n ASP 36 Ca 0.28 0.52 0.10 0.00 0.71 0.00 0.00 54.79 56.40 2fss n ASP 36 Cb 0.80 -0.54 0.01 0.00 -0.02 0.00 0.00 41.12 41.37 2fss n ASP 36 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fss n GLN 37 N -1.61 1.49 0.00 -1.24 6.02 0.64 -4.97 117.38 117.71 2fss n GLN 37 Ca 0.05 -1.13 0.00 0.00 -0.01 0.00 0.00 57.00 55.92 2fss n GLN 37 Cb 0.27 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.11 2fss n GLN 37 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fss n GLY 38 N 1.33 0.57 3.82 1.08 0.00 -0.88 -4.97 105.19 106.13 2fss n GLY 38 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2fss n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2fss s HIS 39 N -2.00 3.18 -0.52 1.61 3.76 -0.91 -4.54 115.29 115.87 2fss s HIS 39 Ca 0.00 1.53 -0.14 0.00 -0.15 0.00 0.00 55.06 56.29 2fss s HIS 39 Cb 0.00 -2.93 0.13 0.00 1.11 0.00 0.00 32.58 30.89 2fss s HIS 39 CO 0.00 -0.66 0.46 -2.00 -0.85 0.00 0.00 174.74 171.69 2fss s GLU 40 N -3.73 2.88 -0.24 1.40 2.12 0.92 -4.00 118.70 118.04 2fss s GLU 40 Ca 0.63 -1.71 -0.21 0.00 0.36 0.00 0.00 54.97 54.03 2fss s GLU 40 Cb -0.13 -4.22 -0.02 0.00 0.26 0.00 0.00 34.13 30.03 2fss s GLU 40 CO 0.27 -1.29 0.66 -1.17 -0.54 0.00 0.00 175.26 173.19 2fss s LEU 41 N 1.55 4.08 -0.22 2.70 2.96 -1.26 -0.28 118.68 128.20 2fss s LEU 41 Ca 0.04 0.79 -0.07 0.00 -0.22 0.00 0.00 54.13 54.67 2fss s LEU 41 Cb -0.29 -2.92 -0.03 0.00 0.50 0.00 0.00 46.19 43.46 2fss s LEU 41 CO 0.02 -0.37 0.05 -0.63 -1.32 0.00 0.00 176.35 174.10 2fss s ILE 42 N 2.42 4.25 -0.14 6.68 1.09 0.92 -4.97 121.20 131.45 2fss s ILE 42 Ca 0.28 -0.20 0.01 0.00 -1.10 0.00 0.00 60.65 59.64 2fss s ILE 42 Cb -0.16 -2.96 -0.00 0.00 -1.06 0.00 0.00 42.46 38.29 2fss s ILE 42 CO 0.09 0.39 -0.17 -0.89 -0.10 0.00 0.00 174.94 174.25 2fss s THR 43 N 1.24 2.57 0.07 2.92 2.01 -1.26 0.32 115.64 123.50 2fss s THR 43 Ca 0.04 -0.81 -0.11 0.00 0.31 0.00 0.00 61.69 61.12 2fss s THR 43 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 72.50 70.31 2fss s THR 43 CO 0.03 0.53 0.24 0.28 -0.69 0.00 0.00 174.62 175.00 2fss s THR 44 N 0.69 0.11 -1.00 -0.82 -1.32 -0.11 -4.98 115.64 108.20 2fss s THR 44 Ca -0.08 -0.91 0.11 0.00 -1.21 0.00 0.00 61.69 59.61 2fss s THR 44 Cb -0.16 -1.09 -0.01 0.00 -1.51 0.00 0.00 72.50 69.73 2fss s THR 44 CO 0.02 -0.50 0.67 -1.54 -2.21 0.00 0.00 174.62 171.05 2fss n SER 45 N 0.32 1.24 -4.55 8.08 3.41 -1.25 -1.57 113.62 119.29 2fss n SER 45 Ca -0.17 -1.12 -0.43 0.00 -0.26 0.00 0.00 58.87 56.89 2fss n SER 45 Cb 0.61 0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 65.04 2fss n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2fss s ASP 46 N -1.54 6.40 0.00 4.04 3.68 -1.26 -4.83 116.67 123.16 2fss s ASP 46 Ca 0.09 -0.13 0.00 0.00 2.13 0.00 0.00 52.55 54.64 2fss s ASP 46 Cb 0.09 -2.49 0.00 0.00 -1.45 0.00 0.00 42.92 39.08 2fss s ASP 46 CO 0.30 -1.32 0.15 -1.84 0.13 0.00 0.00 175.17 172.60 2fss n GLU 47 N 7.85 0.59 -3.59 4.34 0.28 -1.26 -2.76 120.64 126.09 2fss n GLU 47 Ca 0.05 -0.15 -0.08 0.00 -0.16 0.00 0.00 57.16 56.82 2fss n GLU 47 Cb 0.48 -0.57 -0.09 0.00 1.43 0.00 0.00 31.44 32.69 2fss n GLU 47 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2fss s GLU 48 N -0.13 0.35 -0.28 3.44 2.56 -1.26 -4.85 118.70 118.52 2fss s GLU 48 Ca 0.00 0.98 -0.25 0.00 0.00 0.00 0.00 54.97 55.70 2fss s GLU 48 Cb 0.00 0.24 0.13 0.00 2.00 0.00 0.00 34.13 36.51 2fss s GLU 48 CO 0.00 -0.32 1.10 0.20 -0.56 0.00 0.00 175.26 175.68 2fss s GLY 49 N 2.63 -0.07 0.00 -1.50 0.00 -1.26 -4.94 107.32 102.18 2fss s GLY 49 Ca 0.01 2.82 0.00 0.00 0.00 0.00 0.00 44.72 47.55 2fss s GLY 49 CO -0.14 1.86 0.00 0.61 0.00 0.00 0.00 173.10 175.43 2fss n GLY 50 N 2.12 -1.72 0.82 0.20 0.00 -1.26 -4.62 105.19 100.74 2fss n GLY 50 Ca -0.12 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2fss n GLY 50 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2fss n ASN 51 N -0.21 -0.42 -4.71 1.61 2.85 -1.26 -5.09 115.26 108.03 2fss n ASN 51 Ca 0.00 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.15 2fss n ASN 51 Cb 0.00 -0.07 0.13 0.00 1.24 0.00 0.00 39.78 41.08 2fss n ASN 51 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2fss s SER 52 N -2.56 3.57 0.43 1.20 1.04 -1.26 -4.81 113.70 111.31 2fss s SER 52 Ca 0.00 2.16 0.10 0.00 0.48 0.00 0.00 55.95 58.68 2fss s SER 52 Cb 0.00 -2.56 0.93 0.00 0.10 0.00 0.00 66.02 64.49 2fss s SER 52 CO 0.00 -2.67 2.04 0.58 0.98 0.00 0.00 173.24 174.17 2fss h VAL 53 N -1.31 1.10 0.42 5.02 2.07 -1.97 -1.76 116.25 119.82 2fss h VAL 53 Ca -0.44 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 2fss h VAL 53 Cb 1.27 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2fss h VAL 53 CO 0.46 0.11 -0.35 0.25 0.02 0.00 0.00 177.57 178.06 2fss h LEU 54 N 0.35 -0.91 -1.78 2.57 6.46 -1.87 -2.93 115.31 117.20 2fss h LEU 54 Ca 0.09 0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.90 2fss h LEU 54 Cb 0.06 0.30 -0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2fss h LEU 54 CO -0.01 -0.51 -0.08 0.44 -0.62 0.00 0.00 178.44 177.67 2fss h ASP 55 N -0.77 0.04 0.71 1.25 3.32 -1.72 0.22 116.42 119.47 2fss h ASP 55 Ca -0.04 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 2fss h ASP 55 Cb 0.67 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 2fss h ASP 55 CO -0.02 0.12 -0.22 1.56 -1.72 0.00 0.00 179.24 178.96 2fss h GLN 56 N 0.04 0.00 0.00 3.56 4.20 -1.19 -3.22 115.11 118.50 2fss h GLN 56 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2fss h GLN 56 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2fss h GLN 56 CO 0.01 0.22 -0.89 0.72 -0.67 0.00 0.00 178.83 178.22 2fss n HIS 57 N -3.51 0.00 -0.10 2.96 8.25 -0.73 -4.62 115.22 117.47 2fss n HIS 57 Ca -0.01 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.40 2fss n HIS 57 Cb 0.38 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2fss n HIS 57 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2fss h ILE 58 N 0.00 0.51 -0.66 1.59 2.04 -0.99 -0.70 117.51 119.29 2fss h ILE 58 Ca 0.00 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.05 2fss h ILE 58 Cb 0.30 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2fss h ILE 58 CO 0.00 0.00 0.64 -0.65 0.00 0.00 0.00 178.15 178.14 2fss h PRO 59 N -0.09 0.00 0.00 2.37 0.11 -1.74 -1.47 132.00 131.17 2fss h PRO 59 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2fss h PRO 59 Cb 0.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.47 2fss h PRO 59 CO -0.41 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.13 2fss n ASP 60 N -3.76 0.80 -4.73 -2.05 9.92 -1.02 -3.51 116.55 112.20 2fss n ASP 60 Ca 0.13 -0.91 -0.41 0.00 -0.53 0.00 0.00 54.79 53.07 2fss n ASP 60 Cb 0.88 0.17 -0.03 0.00 -0.64 0.00 0.00 41.12 41.50 2fss n ASP 60 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fss s ALA 61 N -0.17 3.41 -0.07 2.24 0.00 -0.30 -4.80 121.76 122.07 2fss s ALA 61 Ca 0.00 0.90 -0.02 0.00 0.00 0.00 0.00 51.96 52.84 2fss s ALA 61 Cb 0.00 -3.41 -0.26 0.00 0.00 0.00 0.00 23.12 19.45 2fss s ALA 61 CO 0.00 -0.34 0.56 -0.44 0.00 0.00 0.00 175.76 175.54 2fss h ASP 62 N 5.51 0.33 -3.59 0.00 3.32 -1.60 -2.29 116.42 118.10 2fss h ASP 62 Ca -0.44 -0.64 -0.36 0.00 0.02 0.00 0.00 57.03 55.61 2fss h ASP 62 Cb 1.21 -0.11 -0.32 0.00 0.22 0.00 0.00 39.33 40.33 2fss h ASP 62 CO 0.75 1.56 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.45 2fss s ILE 63 N -2.58 0.36 -0.16 0.35 1.01 -1.07 -0.51 121.20 118.60 2fss s ILE 63 Ca -0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2fss s ILE 63 Cb 0.07 -0.39 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 2fss s ILE 63 CO 0.81 0.17 -0.11 -0.63 0.00 0.00 0.00 174.94 175.17 2fss s ILE 64 N 0.68 3.04 -0.19 2.92 1.01 -0.53 -0.95 121.20 127.19 2fss s ILE 64 Ca -0.08 -0.64 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 2fss s ILE 64 Cb -0.11 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 2fss s ILE 64 CO -0.01 0.49 0.02 -0.63 0.00 0.00 0.00 174.94 174.82 2fss s ILE 65 N 0.82 4.31 0.28 2.92 1.01 0.72 -0.38 121.20 130.89 2fss s ILE 65 Ca -0.04 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.48 2fss s ILE 65 Cb -0.15 -2.94 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 2fss s ILE 65 CO 0.01 0.45 -0.06 0.42 0.00 0.00 0.00 174.94 175.75 2fss s THR 66 N 0.65 1.70 -0.03 2.92 -4.23 0.86 -1.14 115.64 116.36 2fss s THR 66 Ca 0.01 -2.14 0.03 0.00 -1.18 0.00 0.00 61.69 58.41 2fss s THR 66 Cb -0.14 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2fss s THR 66 CO 0.02 -0.30 -0.11 0.28 -0.54 0.00 0.00 174.62 173.97 2fss s THR 67 N -2.98 0.92 -0.73 3.99 -1.32 -1.25 0.05 115.64 114.31 2fss s THR 67 Ca 0.30 -0.44 0.21 0.00 -1.21 0.00 0.00 61.69 60.54 2fss s THR 67 Cb 0.03 -0.80 0.20 0.00 -1.51 0.00 0.00 72.50 70.43 2fss s THR 67 CO 0.12 0.28 1.64 -0.81 -2.21 0.00 0.00 174.62 173.64 2fss n PRO 68 N 3.20 0.11 0.19 7.08 -0.04 -1.26 -2.34 135.00 141.94 2fss n PRO 68 Ca -0.18 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 63.72 2fss n PRO 68 Cb 0.54 -1.70 0.29 0.00 -0.04 0.00 0.00 33.50 32.59 2fss n PRO 68 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2fss h PHE 69 N 0.00 0.00 -1.31 0.54 -1.00 -1.95 -3.37 116.94 109.85 2fss h PHE 69 Ca 0.00 0.00 -0.44 0.00 2.81 0.00 0.00 57.97 60.34 2fss h PHE 69 Cb 0.37 0.00 -0.30 0.00 3.61 0.00 0.00 35.95 39.63 2fss h PHE 69 CO 0.00 0.00 -0.89 1.58 -1.61 0.00 0.00 178.31 177.39 2fss n HIS 70 N -2.85 -1.46 -3.41 -0.55 -0.00 -0.99 -5.02 115.22 100.95 2fss n HIS 70 Ca 0.04 -2.90 -0.32 0.00 0.46 0.00 0.00 57.72 55.00 2fss n HIS 70 Cb 0.47 0.35 -0.05 0.00 -0.12 0.00 0.00 29.99 30.64 2fss n HIS 70 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 2fss s PRO 71 N -0.48 3.81 0.00 1.57 0.04 -1.10 -4.48 135.00 134.36 2fss s PRO 71 Ca 0.34 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2fss s PRO 71 Cb 0.19 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 32.08 2fss s PRO 71 CO -0.16 0.31 0.00 0.00 0.04 0.00 0.00 177.00 177.19 2fss n ALA 72 N -0.14 0.00 -2.37 8.56 0.00 -1.26 -5.11 120.51 120.19 2fss n ALA 72 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 2fss n ALA 72 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.95 2fss n ALA 72 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2fss s TYR 73 N -1.49 2.44 -1.24 0.00 2.02 -1.26 -4.81 117.35 113.02 2fss s TYR 73 Ca 0.00 0.69 -0.14 0.00 -0.37 0.00 0.00 57.07 57.24 2fss s TYR 73 Cb 0.00 -4.30 0.15 0.00 -0.40 0.00 0.00 41.96 37.41 2fss s TYR 73 CO 0.00 -1.92 1.54 -0.89 -1.57 0.00 0.00 175.55 172.71 2fss n ILE 74 N 7.01 4.19 -2.08 2.71 2.08 0.26 -4.94 119.36 128.58 2fss n ILE 74 Ca 0.16 -4.56 -0.27 0.00 0.56 0.00 0.00 62.75 58.63 2fss n ILE 74 Cb 0.48 -2.44 0.07 0.00 -0.75 0.00 0.00 39.64 37.00 2fss n ILE 74 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 2fss s THR 75 N 2.03 2.32 0.20 1.39 -4.23 -1.26 -1.81 115.64 114.28 2fss s THR 75 Ca 0.45 -0.11 -0.15 0.00 -1.18 0.00 0.00 61.69 60.70 2fss s THR 75 Cb -0.00 -3.05 0.19 0.00 1.34 0.00 0.00 72.50 70.97 2fss s THR 75 CO 0.02 -0.06 1.64 0.50 -0.54 0.00 0.00 174.62 176.17 2fss h LYS 76 N -0.75 -0.00 -0.50 3.99 3.64 -1.94 0.38 116.57 121.40 2fss h LYS 76 Ca -0.45 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.00 2fss h LYS 76 Cb 1.31 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.07 2fss h LYS 76 CO 0.63 -0.00 0.16 0.93 -2.27 0.00 0.00 179.45 178.89 2fss h GLU 77 N -0.00 0.31 -0.35 1.90 3.07 -1.99 -1.86 114.58 115.67 2fss h GLU 77 Ca 0.27 -0.02 -0.15 0.00 -0.50 0.00 0.00 59.36 58.96 2fss h GLU 77 Cb 0.41 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2fss h GLU 77 CO -0.58 0.21 -0.37 0.00 -1.40 0.00 0.00 179.01 176.87 2fss h ARG 78 N 0.32 0.87 -0.72 2.33 3.08 -1.79 -2.99 114.38 115.49 2fss h ARG 78 Ca 0.24 -0.46 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 2fss h ARG 78 Cb 0.28 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 2fss h ARG 78 CO -0.26 1.11 0.30 0.82 -1.07 0.00 0.00 179.97 180.86 2fss h ILE 79 N 0.67 1.25 -0.49 2.04 2.04 -0.66 -1.79 117.51 120.56 2fss h ILE 79 Ca 0.05 -0.77 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2fss h ILE 79 Cb 0.96 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2fss h ILE 79 CO 0.09 0.31 0.33 0.44 0.00 0.00 0.00 178.15 179.32 2fss h ASP 80 N 1.03 0.45 0.08 1.72 3.32 -1.36 -2.12 116.42 119.54 2fss h ASP 80 Ca 0.24 -0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.09 2fss h ASP 80 Cb 0.20 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2fss h ASP 80 CO -0.02 0.31 -0.74 0.11 -1.72 0.00 0.00 179.24 177.17 2fss h LYS 81 N 0.52 0.58 -4.76 3.56 1.79 -1.29 -3.41 116.57 113.56 2fss h LYS 81 Ca 0.20 -0.47 -0.61 0.00 -2.18 0.00 0.00 60.65 57.60 2fss h LYS 81 Cb 0.15 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2fss h LYS 81 CO -0.05 1.09 2.25 0.00 -1.08 0.00 0.00 179.45 181.66 2fss n ALA 82 N -2.55 3.61 0.44 3.86 0.00 -0.72 -4.27 120.51 120.89 2fss n ALA 82 Ca -0.06 -3.48 0.11 0.00 0.00 0.00 0.00 53.44 50.01 2fss n ALA 82 Cb 0.72 -3.58 0.44 0.00 0.00 0.00 0.00 19.45 17.03 2fss n ALA 82 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2fss n LYS 83 N 7.24 0.14 0.00 0.00 5.02 -1.23 -1.74 118.16 127.59 2fss n LYS 83 Ca 0.49 0.36 0.07 0.00 -2.02 0.00 0.00 58.31 57.21 2fss n LYS 83 Cb 0.42 -1.76 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 2fss n LYS 83 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fss n LYS 84 N -2.01 1.94 -1.65 1.97 4.01 -1.26 -5.02 118.16 116.15 2fss n LYS 84 Ca 0.03 -0.49 -0.48 0.00 -0.51 0.00 0.00 58.31 56.86 2fss n LYS 84 Cb 0.22 -1.22 -0.05 0.00 -0.51 0.00 0.00 35.03 33.48 2fss n LYS 84 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 2fss n LEU 85 N -0.59 3.34 -0.02 -0.35 7.94 -0.71 -4.44 117.00 122.18 2fss n LEU 85 Ca 0.05 0.83 -0.01 0.00 -1.11 0.00 0.00 56.01 55.77 2fss n LEU 85 Cb 0.28 -1.39 -0.04 0.00 0.53 0.00 0.00 43.42 42.80 2fss n LEU 85 CO 0.23 -0.17 -0.63 0.29 -1.11 0.00 0.00 177.39 175.99 2fss n LYS 86 N 7.12 2.10 -3.77 1.96 5.02 0.33 -4.71 118.16 126.22 2fss n LYS 86 Ca 0.25 -0.02 -0.14 0.00 -2.02 0.00 0.00 58.31 56.38 2fss n LYS 86 Cb 0.31 -1.13 -0.15 0.00 -0.02 0.00 0.00 35.03 34.04 2fss n LYS 86 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2fss s LEU 87 N -4.04 1.01 -0.15 -0.35 2.96 -1.07 -0.57 118.68 116.47 2fss s LEU 87 Ca -0.02 0.16 -0.00 0.00 -0.22 0.00 0.00 54.13 54.05 2fss s LEU 87 Cb 0.02 0.15 -0.01 0.00 0.50 0.00 0.00 46.19 46.86 2fss s LEU 87 CO 0.22 -0.12 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.30 2fss s VAL 88 N 0.98 2.82 -0.11 1.68 1.01 0.40 -1.46 120.40 125.71 2fss s VAL 88 Ca -0.08 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 2fss s VAL 88 Cb -0.11 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 2fss s VAL 88 CO -0.04 0.51 -0.09 -0.69 0.00 0.00 0.00 175.10 174.79 2fss s VAL 89 N 0.74 3.43 -0.34 2.92 1.01 0.49 -0.74 120.40 127.90 2fss s VAL 89 Ca -0.06 -0.54 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 2fss s VAL 89 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2fss s VAL 89 CO 0.01 0.54 0.24 -0.69 0.00 0.00 0.00 175.10 175.21 2fss s VAL 90 N -0.04 5.27 -1.30 2.92 1.01 0.12 -0.10 120.40 128.28 2fss s VAL 90 Ca -0.01 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.54 2fss s VAL 90 Cb -0.14 -3.72 0.06 0.00 0.00 0.00 0.00 36.38 32.58 2fss s VAL 90 CO 0.03 -0.03 1.78 0.00 0.00 0.00 0.00 175.10 176.88 2fss n ALA 91 N 5.11 3.53 0.00 5.51 0.00 0.11 -3.07 120.51 131.69 2fss n ALA 91 Ca -0.13 -3.80 0.00 0.00 0.00 0.00 0.00 53.44 49.52 2fss n ALA 91 Cb 0.50 -3.60 0.00 0.00 0.00 0.00 0.00 19.45 16.35 2fss n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fss n GLY 92 N 5.36 0.54 2.90 0.00 0.00 -1.26 -4.50 105.19 108.24 2fss n GLY 92 Ca 0.49 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.62 2fss n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fss s VAL 93 N -2.55 0.20 0.00 1.61 1.01 -1.26 -0.56 120.40 118.84 2fss s VAL 93 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2fss s VAL 93 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 36.38 36.20 2fss s VAL 93 CO 0.00 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2fss n GLY 94 N 3.12 3.46 0.09 4.51 0.00 -1.26 -4.78 105.19 110.32 2fss n GLY 94 Ca -0.14 -0.91 0.02 0.00 0.00 0.00 0.00 46.02 44.99 2fss n GLY 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fss n SER 95 N 0.00 1.29 0.31 1.61 3.41 -1.26 -4.73 113.62 114.26 2fss n SER 95 Ca 0.00 -1.99 0.20 0.00 -0.26 0.00 0.00 58.87 56.82 2fss n SER 95 Cb 0.00 -0.12 0.98 0.00 -0.26 0.00 0.00 64.21 64.81 2fss n SER 95 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2fss h ASP 96 N 0.00 0.00 -0.08 4.04 3.45 -2.02 -1.68 116.42 120.14 2fss h ASP 96 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2fss h ASP 96 Cb 0.86 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.63 2fss h ASP 96 CO 0.00 0.01 0.00 0.00 -1.57 0.00 0.00 179.24 177.68 2fss n HIS 97 N -3.17 0.10 -4.85 4.55 1.44 -1.26 -4.75 115.22 107.27 2fss n HIS 97 Ca -0.02 -0.05 -0.30 0.00 -2.01 0.00 0.00 57.72 55.35 2fss n HIS 97 Cb 0.17 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.11 2fss n HIS 97 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2fss s ILE 98 N -1.90 1.75 -1.25 0.61 1.01 -0.63 -0.57 121.20 120.21 2fss s ILE 98 Ca 0.27 -0.82 -0.18 0.00 0.00 0.00 0.00 60.65 59.91 2fss s ILE 98 Cb 0.13 -1.55 0.00 0.00 0.01 0.00 0.00 42.46 41.06 2fss s ILE 98 CO 0.21 0.49 1.96 -0.67 0.00 0.00 0.00 174.94 176.93 2fss n ASP 99 N 3.80 3.93 -0.30 3.58 -0.08 -0.75 -4.70 116.55 122.03 2fss n ASP 99 Ca -0.20 -2.82 -0.01 0.00 -1.51 0.00 0.00 54.79 50.25 2fss n ASP 99 Cb 0.52 -1.62 0.17 0.00 2.34 0.00 0.00 41.12 42.54 2fss n ASP 99 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2fss h LEU 100 N 12.71 1.01 -0.70 -2.67 3.38 -1.89 -2.46 115.31 124.69 2fss h LEU 100 Ca 0.45 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.41 2fss h LEU 100 Cb 0.77 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 2fss h LEU 100 CO 1.64 0.74 0.45 0.44 0.09 0.00 0.00 178.44 181.80 2fss h ASP 101 N 1.19 0.75 -0.29 -0.43 3.45 -1.99 0.44 116.42 119.54 2fss h ASP 101 Ca 0.32 -0.01 -0.15 0.00 0.43 0.00 0.00 57.03 57.62 2fss h ASP 101 Cb -0.12 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 38.47 2fss h ASP 101 CO -0.07 0.53 -0.42 0.22 -1.57 0.00 0.00 179.24 177.93 2fss h TYR 102 N 0.89 0.99 -0.33 4.55 3.20 -1.88 0.17 116.97 124.56 2fss h TYR 102 Ca 0.27 -0.33 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 2fss h TYR 102 Cb -0.03 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 2fss h TYR 102 CO -0.04 1.12 0.15 0.82 -1.64 0.00 0.00 178.16 178.58 2fss h ILE 103 N 0.57 1.16 -0.23 1.81 2.04 -1.10 -2.05 117.51 119.71 2fss h ILE 103 Ca 0.03 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 2fss h ILE 103 Cb 1.01 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 2fss h ILE 103 CO 0.10 0.17 -0.03 -1.13 0.00 0.00 0.00 178.15 177.26 2fss h ASN 104 N 0.39 0.42 -0.15 1.72 -1.24 -0.74 -1.43 115.58 114.56 2fss h ASN 104 Ca 0.11 -0.34 -0.12 0.00 0.71 0.00 0.00 56.30 56.66 2fss h ASN 104 Cb 0.13 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 2fss h ASN 104 CO -0.01 0.66 -0.31 1.56 -1.29 0.00 0.00 177.43 178.04 2fss h GLN 105 N 0.17 0.64 -0.15 6.67 4.20 -0.67 -2.93 115.11 123.04 2fss h GLN 105 Ca 0.06 -0.29 -0.18 0.00 0.06 0.00 0.00 58.65 58.31 2fss h GLN 105 Cb 0.46 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2fss h GLN 105 CO 0.02 0.87 -0.64 1.79 -0.67 0.00 0.00 178.83 180.20 2fss h THR 106 N 0.55 1.33 0.00 -0.54 1.35 -1.41 -3.48 112.91 110.70 2fss h THR 106 Ca 0.06 -1.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.00 2fss h THR 106 Cb 0.80 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2fss h THR 106 CO 0.07 0.59 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 2fss n GLY 107 N 0.41 0.70 3.68 5.82 0.00 -0.56 -5.05 105.19 110.19 2fss n GLY 107 Ca -0.04 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2fss n GLY 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fss n LYS 108 N -2.54 1.92 -1.66 1.61 5.02 -1.10 -4.81 118.16 116.60 2fss n LYS 108 Ca 0.00 0.68 -0.40 0.00 -2.02 0.00 0.00 58.31 56.57 2fss n LYS 108 Cb 0.00 -2.27 -0.02 0.00 -0.02 0.00 0.00 35.03 32.72 2fss n LYS 108 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fss n LYS 109 N 0.39 3.95 -4.67 1.97 5.02 -1.26 -2.91 118.16 120.65 2fss n LYS 109 Ca 0.06 -2.78 -0.33 0.00 -2.02 0.00 0.00 58.31 53.24 2fss n LYS 109 Cb 0.37 -2.79 -0.14 0.00 -0.02 0.00 0.00 35.03 32.45 2fss n LYS 109 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2fss s ILE 110 N 0.93 3.07 0.12 -0.18 1.01 -1.26 -4.73 121.20 120.15 2fss s ILE 110 Ca 0.60 -0.65 -0.18 0.00 0.00 0.00 0.00 60.65 60.43 2fss s ILE 110 Cb 0.17 -2.30 -0.07 0.00 0.01 0.00 0.00 42.46 40.27 2fss s ILE 110 CO -0.07 0.51 0.58 -0.44 0.00 0.00 0.00 174.94 175.53 2fss s SER 111 N 0.48 6.98 -0.17 3.58 0.01 0.26 -0.57 113.70 124.28 2fss s SER 111 Ca -0.09 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.40 2fss s SER 111 Cb -0.16 -2.34 0.04 0.00 0.21 0.00 0.00 66.02 63.77 2fss s SER 111 CO 0.04 0.18 -0.10 -0.69 0.41 0.00 0.00 173.24 173.09 2fss s VAL 112 N -1.29 1.43 0.05 3.43 1.01 0.92 -0.46 120.40 125.49 2fss s VAL 112 Ca 0.34 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.66 2fss s VAL 112 Cb -0.18 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 2fss s VAL 112 CO 0.19 0.25 -0.25 -0.76 0.00 0.00 0.00 175.10 174.53 2fss s LEU 113 N 1.51 2.18 0.22 3.92 1.02 0.08 -0.60 118.68 127.01 2fss s LEU 113 Ca 0.01 -0.58 0.03 0.00 0.02 0.00 0.00 54.13 53.61 2fss s LEU 113 Cb -0.15 -1.20 -0.05 0.00 0.02 0.00 0.00 46.19 44.81 2fss s LEU 113 CO -0.09 0.23 -0.00 -1.83 0.02 0.00 0.00 176.35 174.68 2fss s GLU 114 N -1.27 1.30 -1.11 1.70 -1.05 -0.56 0.15 118.70 117.86 2fss s GLU 114 Ca 0.11 -1.65 -0.12 0.00 -0.15 0.00 0.00 54.97 53.15 2fss s GLU 114 Cb -0.10 -0.55 0.22 0.00 -0.44 0.00 0.00 34.13 33.26 2fss s GLU 114 CO 0.02 -0.11 1.20 0.08 0.95 0.00 0.00 175.26 177.41 2fss s VAL 115 N -3.47 5.49 0.40 1.83 1.01 0.27 -4.44 120.40 121.49 2fss s VAL 115 Ca 0.28 -2.87 -0.26 0.00 0.00 0.00 0.00 61.98 59.12 2fss s VAL 115 Cb 0.06 -4.73 -0.09 0.00 0.00 0.00 0.00 36.38 31.62 2fss s VAL 115 CO 0.08 -1.37 1.27 -0.89 0.00 0.00 0.00 175.10 174.20 2fss s THR 116 N 0.31 2.74 0.00 3.92 2.01 -1.26 -2.68 115.64 120.67 2fss s THR 116 Ca 0.34 0.66 0.00 0.00 0.31 0.00 0.00 61.69 63.00 2fss s THR 116 Cb -0.07 -3.39 0.00 0.00 0.01 0.00 0.00 72.50 69.05 2fss s THR 116 CO -0.05 0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 2fss n GLY 117 N 0.68 2.48 0.14 4.40 0.00 -1.26 -4.91 105.19 106.71 2fss n GLY 117 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2fss n GLY 117 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2fss h SER 118 N 0.00 0.00 0.00 1.61 4.64 -1.89 -3.23 113.55 114.68 2fss h SER 118 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fss h SER 118 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2fss h SER 118 CO 0.00 0.00 -1.32 -0.46 -0.87 0.00 0.00 176.83 174.18 2fss n ASN 119 N -2.42 1.07 -0.07 4.97 6.94 -1.26 -4.71 115.26 119.78 2fss n ASN 119 Ca 0.04 -0.36 -0.15 0.00 -0.02 0.00 0.00 54.58 54.09 2fss n ASN 119 Cb 0.39 1.43 -0.05 0.00 -2.36 0.00 0.00 39.78 39.19 2fss n ASN 119 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 2fss h VAL 120 N 0.00 1.29 -0.61 3.53 -1.51 -1.96 -1.83 116.25 115.16 2fss h VAL 120 Ca 0.00 -1.70 -0.07 0.00 -1.23 0.00 0.00 66.70 63.70 2fss h VAL 120 Cb 0.58 1.71 -0.02 0.00 -2.13 0.00 0.00 31.29 31.43 2fss h VAL 120 CO 0.00 0.55 0.12 0.58 -1.23 0.00 0.00 177.57 177.59 2fss h VAL 121 N 0.56 1.26 -0.41 7.19 2.07 -1.86 -1.28 116.25 123.78 2fss h VAL 121 Ca 0.01 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.57 2fss h VAL 121 Cb 1.11 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 2fss h VAL 121 CO 0.11 0.36 0.26 0.28 0.02 0.00 0.00 177.57 178.60 2fss h SER 122 N 0.91 0.43 -0.03 0.57 0.02 -1.77 -0.09 113.55 113.59 2fss h SER 122 Ca 0.19 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2fss h SER 122 Cb 0.40 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 2fss h SER 122 CO 0.01 0.31 -0.03 0.58 -1.14 0.00 0.00 176.83 176.56 2fss h VAL 123 N 0.52 1.38 -0.92 2.27 2.07 -1.29 -2.00 116.25 118.29 2fss h VAL 123 Ca 0.16 -1.18 0.18 0.00 0.82 0.00 0.00 66.70 66.67 2fss h VAL 123 Cb -0.03 2.12 -0.10 0.00 -1.52 0.00 0.00 31.29 31.75 2fss h VAL 123 CO -0.05 0.32 0.50 0.00 0.02 0.00 0.00 177.57 178.35 2fss h ALA 124 N 0.53 1.46 -0.68 1.67 0.00 -1.06 -0.22 119.26 120.96 2fss h ALA 124 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2fss h ALA 124 Cb 0.53 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2fss h ALA 124 CO 0.01 -0.12 0.35 0.93 0.00 0.00 0.00 179.25 180.42 2fss h GLU 125 N 0.64 0.96 -0.43 0.00 5.08 -0.82 -2.40 114.58 117.61 2fss h GLU 125 Ca 0.53 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.72 2fss h GLU 125 Cb 0.82 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2fss h GLU 125 CO -0.40 0.74 0.11 1.25 -1.00 0.00 0.00 179.01 179.72 2fss h HIS 126 N 0.94 0.71 -0.06 4.33 2.76 -0.38 0.56 115.15 124.01 2fss h HIS 126 Ca 0.24 -0.08 0.04 0.00 -2.20 0.00 0.00 60.37 58.36 2fss h HIS 126 Cb 0.08 -0.20 -0.06 0.00 1.55 0.00 0.00 27.41 28.78 2fss h HIS 126 CO -0.00 0.66 -0.33 0.28 -1.30 0.00 0.00 177.93 177.24 2fss h VAL 127 N 0.56 0.28 -0.54 5.26 2.07 -1.00 0.14 116.25 123.02 2fss h VAL 127 Ca 0.14 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.60 2fss h VAL 127 Cb 0.30 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2fss h VAL 127 CO -0.00 0.00 0.10 0.58 0.02 0.00 0.00 177.57 178.27 2fss h VAL 128 N -0.45 1.23 -0.29 2.57 2.07 -1.11 0.61 116.25 120.89 2fss h VAL 128 Ca 0.07 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 2fss h VAL 128 Cb 0.56 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2fss h VAL 128 CO -0.31 0.32 0.15 -0.03 0.02 0.00 0.00 177.57 177.73 2fss h MET 129 N 0.82 0.40 -0.55 1.57 -1.53 -0.81 -1.33 114.93 113.49 2fss h MET 129 Ca 0.17 -0.05 -0.04 0.00 -3.44 0.00 0.00 59.70 56.34 2fss h MET 129 Cb 0.34 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.29 2fss h MET 129 CO 0.00 0.36 0.19 1.15 0.14 0.00 0.00 176.91 178.75 2fss h THR 130 N 0.34 1.23 -0.35 -0.77 2.02 -0.14 -0.78 112.91 114.46 2fss h THR 130 Ca 0.10 -0.77 0.06 0.00 0.77 0.00 0.00 66.41 66.57 2fss h THR 130 Cb 0.08 0.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.12 2fss h THR 130 CO -0.02 0.29 -0.00 0.24 0.37 0.00 0.00 175.52 176.40 2fss h MET 131 N 0.77 0.09 -0.68 6.66 2.86 -0.71 -0.72 114.93 123.19 2fss h MET 131 Ca 0.18 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 2fss h MET 131 Cb 0.26 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 2fss h MET 131 CO -0.01 0.06 0.34 -0.07 1.06 0.00 0.00 176.91 178.29 2fss h LEU 132 N 0.10 0.88 -0.44 1.22 3.38 -0.79 0.02 115.31 119.67 2fss h LEU 132 Ca 0.17 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2fss h LEU 132 Cb 0.23 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2fss h LEU 132 CO -0.28 0.76 0.17 0.58 0.09 0.00 0.00 178.44 179.76 2fss h VAL 133 N 0.95 1.20 0.12 1.22 2.07 -0.94 -0.17 116.25 120.69 2fss h VAL 133 Ca 0.24 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2fss h VAL 133 Cb 0.10 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2fss h VAL 133 CO -0.03 0.23 -0.06 -0.07 0.02 0.00 0.00 177.57 177.67 2fss h LEU 134 N 0.57 -0.13 -0.69 2.57 3.38 -0.90 -1.32 115.31 118.79 2fss h LEU 134 Ca 0.15 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2fss h LEU 134 Cb 0.20 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2fss h LEU 134 CO -0.01 0.39 0.44 0.58 0.09 0.00 0.00 178.44 179.93 2fss h VAL 135 N -0.71 1.12 -0.01 1.22 2.07 -0.91 -2.19 116.25 116.84 2fss h VAL 135 Ca -0.02 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2fss h VAL 135 Cb 0.53 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2fss h VAL 135 CO 0.03 0.16 -0.01 0.54 0.02 0.00 0.00 177.57 178.31 2fss n ARG 136 N -4.65 1.28 -3.35 1.57 1.74 -0.09 -0.87 116.66 112.29 2fss n ARG 136 Ca 0.07 -0.45 -0.19 0.00 -0.77 0.00 0.00 57.85 56.52 2fss n ARG 136 Cb 0.06 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.08 2fss n ARG 136 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2fss n ASN 137 N -0.47 -5.14 -0.01 0.55 5.15 -0.83 -4.67 115.26 109.85 2fss n ASN 137 Ca 0.21 -0.44 -0.05 0.00 -0.60 0.00 0.00 54.58 53.71 2fss n ASN 137 Cb 0.23 -4.13 0.16 0.00 -0.53 0.00 0.00 39.78 35.51 2fss n ASN 137 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2fss h PHE 138 N -2.10 0.64 0.31 1.20 3.57 -1.52 -3.22 116.94 115.81 2fss h PHE 138 Ca -0.46 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 60.89 2fss h PHE 138 Cb 1.29 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.88 2fss h PHE 138 CO 0.39 0.77 -0.15 0.28 -2.23 0.00 0.00 178.31 177.38 2fss h VAL 139 N 0.50 0.72 0.00 1.41 2.07 -1.92 -0.03 116.25 119.00 2fss h VAL 139 Ca 0.07 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2fss h VAL 139 Cb 0.71 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2fss h VAL 139 CO 0.05 0.06 -0.02 1.55 0.02 0.00 0.00 177.57 179.23 2fss h PRO 140 N -0.56 0.00 -0.07 1.57 0.13 -1.94 -1.08 132.00 130.06 2fss h PRO 140 Ca -0.04 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 2fss h PRO 140 Cb 0.41 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.54 2fss h PRO 140 CO 0.07 0.02 -0.07 0.00 -0.23 0.00 0.00 178.00 177.80 2fss h ALA 141 N 1.98 0.10 -0.82 -0.56 0.00 -1.37 -1.95 119.26 116.63 2fss h ALA 141 Ca -0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 2fss h ALA 141 Cb 0.38 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2fss h ALA 141 CO 0.00 -0.09 0.36 1.25 0.00 0.00 0.00 179.25 180.77 2fss h HIS 142 N -0.27 1.22 -0.90 0.00 -0.00 -0.80 -2.69 115.15 111.70 2fss h HIS 142 Ca 0.01 -0.08 0.11 0.00 -0.00 0.00 0.00 60.37 60.42 2fss h HIS 142 Cb 0.58 -0.37 -0.08 0.00 -0.00 0.00 0.00 27.41 27.54 2fss h HIS 142 CO 0.09 0.90 0.53 1.49 -0.00 0.00 0.00 177.93 180.95 2fss h GLU 143 N 1.18 0.83 -0.64 5.26 4.57 -1.14 -1.67 114.58 122.97 2fss h GLU 143 Ca 0.28 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 2fss h GLU 143 Cb 0.17 -0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.53 2fss h GLU 143 CO -0.03 0.55 0.37 1.96 -1.18 0.00 0.00 179.01 180.68 2fss h GLN 144 N 0.85 0.68 0.05 1.92 4.20 -1.01 -1.02 115.11 120.78 2fss h GLN 144 Ca 0.45 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 59.12 2fss h GLN 144 Cb 0.46 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2fss h GLN 144 CO -0.27 0.45 -0.02 0.82 -0.67 0.00 0.00 178.83 179.14 2fss h ILE 145 N 0.70 1.11 0.00 2.54 1.08 -1.22 0.31 117.51 122.03 2fss h ILE 145 Ca 0.27 -0.50 -0.04 0.00 -0.39 0.00 0.00 64.86 64.20 2fss h ILE 145 Cb 0.11 1.44 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 2fss h ILE 145 CO -0.14 0.13 -0.18 0.16 -0.69 0.00 0.00 178.15 177.42 2fss h ILE 146 N -0.28 0.46 -0.22 -0.67 3.07 -1.33 -2.04 117.51 116.50 2fss h ILE 146 Ca -0.01 -1.00 0.00 0.00 1.55 0.00 0.00 64.86 65.40 2fss h ILE 146 Cb 0.26 1.71 0.00 0.00 -0.27 0.00 0.00 36.82 38.52 2fss h ILE 146 CO 0.01 0.18 0.00 -3.20 -1.05 0.00 0.00 178.15 174.09 2fss n ASN 147 N -3.35 1.50 -1.65 2.16 4.05 -0.39 -4.94 115.26 112.65 2fss n ASN 147 Ca 0.00 -1.82 -0.15 0.00 0.45 0.00 0.00 54.58 53.07 2fss n ASN 147 Cb 0.40 -0.14 -0.01 0.00 1.23 0.00 0.00 39.78 41.26 2fss n ASN 147 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2fss n HIS 148 N 0.26 -0.67 -3.45 1.20 8.25 -0.77 -5.01 115.22 115.03 2fss n HIS 148 Ca 0.13 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.38 2fss n HIS 148 Cb 0.27 -3.07 -0.01 0.00 1.12 0.00 0.00 29.99 28.31 2fss n HIS 148 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2fss s ASP 149 N -2.36 5.09 -0.29 0.41 1.01 0.10 -5.03 116.67 115.60 2fss s ASP 149 Ca 0.00 -0.79 0.03 0.00 0.71 0.00 0.00 52.55 52.50 2fss s ASP 149 Cb 0.00 -0.31 0.20 0.00 1.01 0.00 0.00 42.92 43.81 2fss s ASP 149 CO 0.00 -0.83 0.63 0.86 0.21 0.00 0.00 175.17 176.03 2fss s TRP 150 N -2.53 -1.69 -0.32 4.23 -0.11 -1.26 -4.30 118.94 112.96 2fss s TRP 150 Ca 0.49 1.21 0.00 0.00 1.22 0.00 0.00 56.10 59.01 2fss s TRP 150 Cb -0.04 0.37 0.14 0.00 -1.50 0.00 0.00 33.47 32.43 2fss s TRP 150 CO 0.29 -0.97 0.29 -2.00 -4.62 0.00 0.00 176.95 169.94 2fss s GLU 151 N 2.85 0.41 0.22 5.86 2.12 -1.26 -5.04 118.70 123.86 2fss s GLU 151 Ca 0.14 -0.48 -0.07 0.00 0.36 0.00 0.00 54.97 54.91 2fss s GLU 151 Cb -0.11 -0.79 0.19 0.00 0.26 0.00 0.00 34.13 33.67 2fss s GLU 151 CO -0.24 -1.09 1.80 0.28 -0.54 0.00 0.00 175.26 175.47 2fss h VAL 152 N 5.86 1.26 -0.44 3.70 2.07 -2.01 -2.63 116.25 124.06 2fss h VAL 152 Ca -0.08 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2fss h VAL 152 Cb 1.05 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2fss h VAL 152 CO 0.31 0.33 0.29 0.00 0.02 0.00 0.00 177.57 178.52 2fss h ALA 153 N 1.21 1.68 0.00 1.67 0.00 -1.98 0.81 119.26 122.66 2fss h ALA 153 Ca 0.28 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2fss h ALA 153 Cb 0.17 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2fss h ALA 153 CO -0.03 0.30 -0.15 0.00 0.00 0.00 0.00 179.25 179.37 2fss h ALA 154 N 1.72 1.11 0.03 0.00 0.00 -1.91 -1.75 119.26 118.46 2fss h ALA 154 Ca 0.16 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 2fss h ALA 154 Cb -0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2fss h ALA 154 CO -0.04 0.19 -1.73 -0.89 0.00 0.00 0.00 179.25 176.78 2fss n ILE 155 N -3.42 1.59 0.11 0.00 2.08 -0.49 -4.46 119.36 114.76 2fss n ILE 155 Ca -0.01 -0.26 0.12 0.00 0.56 0.00 0.00 62.75 63.16 2fss n ILE 155 Cb 0.33 -1.91 0.62 0.00 -0.75 0.00 0.00 39.64 37.93 2fss n ILE 155 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2fss h ALA 156 N -0.43 2.14 0.00 -1.39 0.00 -0.79 -2.71 119.26 116.07 2fss h ALA 156 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2fss h ALA 156 Cb 1.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2fss h ALA 156 CO -0.18 -0.20 0.00 1.57 0.00 0.00 0.00 179.25 180.44 2fss h LYS 157 N 0.10 0.00 0.00 0.00 2.10 -1.54 -2.42 116.57 114.81 2fss h LYS 157 Ca 0.13 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.67 2fss h LYS 157 Cb 0.39 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 31.48 2fss h LYS 157 CO -0.01 0.00 -0.81 -3.47 -2.00 0.00 0.00 179.45 173.16 2fss n ASP 158 N -2.58 1.05 -4.57 7.07 2.03 -1.04 -5.06 116.55 113.46 2fss n ASP 158 Ca -0.01 -2.42 -0.34 0.00 0.52 0.00 0.00 54.79 52.54 2fss n ASP 158 Cb 0.12 -0.34 -0.11 0.00 -0.72 0.00 0.00 41.12 40.08 2fss n ASP 158 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fss s ALA 159 N -0.76 3.22 0.23 -1.67 0.00 -0.91 -4.47 121.76 117.39 2fss s ALA 159 Ca 0.30 -0.79 0.07 0.00 0.00 0.00 0.00 51.96 51.53 2fss s ALA 159 Cb 0.32 -1.77 -0.05 0.00 0.00 0.00 0.00 23.12 21.62 2fss s ALA 159 CO -0.12 0.16 -0.09 0.71 0.00 0.00 0.00 175.76 176.43 2fss s TYR 160 N 0.42 1.75 0.25 0.00 2.02 -0.05 -4.97 117.35 116.77 2fss s TYR 160 Ca 0.00 -0.68 -0.14 0.00 -0.37 0.00 0.00 57.07 55.88 2fss s TYR 160 Cb -0.13 -0.92 -0.08 0.00 -0.40 0.00 0.00 41.96 40.43 2fss s TYR 160 CO 0.01 0.26 0.66 -0.51 -1.57 0.00 0.00 175.55 174.40 2fss s ASP 161 N -3.35 6.80 0.40 2.29 1.01 -1.26 -3.68 116.67 118.87 2fss s ASP 161 Ca 0.26 1.19 0.21 0.00 0.71 0.00 0.00 52.55 54.92 2fss s ASP 161 Cb 0.02 -2.33 0.62 0.00 1.01 0.00 0.00 42.92 42.24 2fss s ASP 161 CO 0.09 -0.08 1.70 -0.29 0.21 0.00 0.00 175.17 176.79 2fss h ILE 162 N 2.24 0.57 -2.47 0.77 2.10 -1.92 -3.44 117.51 115.36 2fss h ILE 162 Ca -0.48 -1.41 -0.61 0.00 1.08 0.00 0.00 64.86 63.44 2fss h ILE 162 Cb 1.18 1.98 0.10 0.00 -1.09 0.00 0.00 36.82 38.98 2fss h ILE 162 CO 0.66 0.27 0.30 1.21 -1.08 0.00 0.00 178.15 179.51 2fss n GLU 163 N -3.30 1.52 -0.91 2.19 2.13 -1.25 -2.14 120.64 118.87 2fss n GLU 163 Ca 0.01 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.37 2fss n GLU 163 Cb 0.53 -2.02 0.00 0.00 0.27 0.00 0.00 31.44 30.22 2fss n GLU 163 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fss n GLY 164 N 1.56 0.82 3.84 8.31 0.00 -0.29 -4.87 105.19 114.54 2fss n GLY 164 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2fss n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fss s LYS 165 N -0.18 4.10 -0.16 1.61 -0.14 -0.91 -3.99 119.74 120.06 2fss s LYS 165 Ca 0.00 0.76 -0.21 0.00 -1.36 0.00 0.00 55.97 55.16 2fss s LYS 165 Cb 0.00 -2.56 -0.03 0.00 -1.68 0.00 0.00 37.83 33.56 2fss s LYS 165 CO 0.00 0.22 0.65 0.99 -0.76 0.00 0.00 175.35 176.45 2fss s THR 166 N -1.85 5.03 -0.10 2.17 2.01 -1.26 -0.29 115.64 121.35 2fss s THR 166 Ca 0.51 1.25 0.04 0.00 0.31 0.00 0.00 61.69 63.80 2fss s THR 166 Cb -0.12 -3.97 -0.00 0.00 0.01 0.00 0.00 72.50 68.42 2fss s THR 166 CO 0.18 0.15 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.40 2fss s ILE 167 N 1.62 2.17 -0.05 1.82 1.01 -0.64 -0.42 121.20 126.71 2fss s ILE 167 Ca 0.31 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 60.02 2fss s ILE 167 Cb -0.16 -1.83 -0.01 0.00 0.01 0.00 0.00 42.46 40.47 2fss s ILE 167 CO 0.12 0.56 -0.19 0.00 0.00 0.00 0.00 174.94 175.42 2fss s ALA 168 N 0.29 1.70 -0.12 9.38 0.00 0.27 -0.62 121.76 132.65 2fss s ALA 168 Ca -0.16 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 2fss s ALA 168 Cb -0.17 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 2fss s ALA 168 CO 0.08 0.31 -0.02 -0.08 0.00 0.00 0.00 175.76 176.05 2fss s THR 169 N -0.02 4.05 -0.49 0.00 -1.32 -0.41 -0.70 115.64 116.75 2fss s THR 169 Ca -0.04 -0.32 -0.20 0.00 -1.21 0.00 0.00 61.69 59.92 2fss s THR 169 Cb -0.12 -2.73 0.05 0.00 -1.51 0.00 0.00 72.50 68.18 2fss s THR 169 CO 0.03 0.54 0.64 -0.63 -2.21 0.00 0.00 174.62 172.99 2fss s ILE 170 N -0.23 4.85 0.00 5.08 1.01 -0.12 -1.45 121.20 130.34 2fss s ILE 170 Ca 0.05 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.37 2fss s ILE 170 Cb -0.13 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 38.06 2fss s ILE 170 CO 0.02 -0.76 0.00 0.61 0.00 0.00 0.00 174.94 174.81 2fss n GLY 171 N 5.14 0.51 2.36 6.18 0.00 0.01 0.01 105.19 119.40 2fss n GLY 171 Ca -0.05 -1.22 -0.15 0.00 0.00 0.00 0.00 46.02 44.60 2fss n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fss n ALA 172 N 2.32 4.08 -1.00 4.61 0.00 -1.26 -4.38 120.51 124.88 2fss n ALA 172 Ca 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 53.44 50.02 2fss n ALA 172 Cb 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 18.90 2fss n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fss n GLY 173 N -0.64 -1.99 0.28 0.00 0.00 -1.26 -4.14 105.19 97.43 2fss n GLY 173 Ca 0.29 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2fss n GLY 173 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fss h ARG 174 N 0.00 0.70 0.09 1.61 3.08 -1.96 0.14 114.38 118.04 2fss h ARG 174 Ca 0.00 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.86 2fss h ARG 174 Cb 0.00 -0.16 0.02 0.00 0.08 0.00 0.00 29.97 29.91 2fss h ARG 174 CO 0.00 0.46 -0.65 0.82 -1.07 0.00 0.00 179.97 179.53 2fss h ILE 175 N 0.72 1.52 -0.76 2.04 2.04 -1.91 -2.93 117.51 118.23 2fss h ILE 175 Ca 0.34 -2.37 0.02 0.00 1.00 0.00 0.00 64.86 63.85 2fss h ILE 175 Cb 0.27 3.05 -0.04 0.00 -0.74 0.00 0.00 36.82 39.36 2fss h ILE 175 CO -0.22 0.67 0.49 1.23 0.00 0.00 0.00 178.15 180.33 2fss h GLY 176 N -0.38 1.09 1.17 5.37 0.00 -1.71 -0.50 103.07 108.11 2fss h GLY 176 Ca -0.11 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 2fss h GLY 176 CO 0.12 0.35 -0.06 -1.82 0.00 0.00 0.00 176.54 175.13 2fss h TYR 177 N 0.99 1.08 0.00 5.60 3.20 -1.08 -1.83 116.97 124.93 2fss h TYR 177 Ca 0.29 -0.20 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 2fss h TYR 177 Cb -0.05 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.93 2fss h TYR 177 CO -0.03 0.99 -0.37 0.00 -1.64 0.00 0.00 178.16 177.11 2fss h ARG 178 N 0.89 0.00 -0.06 1.82 3.08 -1.14 -0.94 114.38 118.04 2fss h ARG 178 Ca 0.15 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 2fss h ARG 178 Cb 0.60 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 2fss h ARG 178 CO 0.04 0.37 -0.01 0.28 -1.07 0.00 0.00 179.97 179.58 2fss h VAL 179 N 0.00 1.29 -0.58 2.04 2.07 -0.83 -2.32 116.25 117.92 2fss h VAL 179 Ca -0.00 -0.91 0.08 0.00 0.82 0.00 0.00 66.70 66.69 2fss h VAL 179 Cb 0.79 1.79 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 2fss h VAL 179 CO 0.05 0.25 0.22 -0.07 0.02 0.00 0.00 177.57 178.04 2fss h LEU 180 N -0.24 0.24 -0.73 2.57 3.38 -0.84 -1.81 115.31 117.88 2fss h LEU 180 Ca 0.01 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.12 2fss h LEU 180 Cb 0.40 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 2fss h LEU 180 CO 0.01 0.15 0.42 -0.33 0.09 0.00 0.00 178.44 178.77 2fss h GLU 181 N 0.41 0.73 0.00 1.13 5.08 -1.16 -1.31 114.58 119.47 2fss h GLU 181 Ca 0.29 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 2fss h GLU 181 Cb 0.33 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2fss h GLU 181 CO -0.28 0.48 -0.27 0.00 -1.00 0.00 0.00 179.01 177.94 2fss h ARG 182 N 0.75 0.00 0.00 2.33 3.08 -0.83 -3.01 114.38 116.70 2fss h ARG 182 Ca 0.33 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.33 2fss h ARG 182 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2fss h ARG 182 CO -0.20 0.27 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.37 2fss h LEU 183 N 0.00 0.00 -0.53 3.04 3.38 -0.43 -3.39 115.31 117.38 2fss h LEU 183 Ca -0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 2fss h LEU 183 Cb 0.58 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.22 2fss h LEU 183 CO 0.03 0.21 -0.27 0.58 0.09 0.00 0.00 178.44 179.09 2fss h VAL 184 N 0.00 0.26 0.00 1.22 2.07 -1.29 -0.66 116.25 117.85 2fss h VAL 184 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2fss h VAL 184 Cb 1.18 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2fss h VAL 184 CO 0.02 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.80 2fss n PRO 185 N -5.43 0.85 0.00 1.57 -0.04 -1.26 -2.30 135.00 128.40 2fss n PRO 185 Ca 0.04 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.65 2fss n PRO 185 Cb 0.34 -1.34 0.70 0.00 -0.04 0.00 0.00 33.50 33.16 2fss n PRO 185 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2fss n PHE 186 N -0.84 0.00 -3.42 0.54 3.72 -0.26 -4.96 117.46 112.25 2fss n PHE 186 Ca 0.14 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.36 2fss n PHE 186 Cb 0.06 -0.04 0.07 0.00 -0.94 0.00 0.00 39.48 38.64 2fss n PHE 186 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2fss n ASN 187 N -0.50 -3.61 -4.74 4.37 5.15 -0.97 -3.77 115.26 111.20 2fss n ASN 187 Ca 0.20 -0.69 -0.33 0.00 -0.60 0.00 0.00 54.58 53.16 2fss n ASN 187 Cb 0.25 -4.94 0.09 0.00 -0.53 0.00 0.00 39.78 34.65 2fss n ASN 187 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2fss s PRO 188 N -5.15 2.17 0.10 1.20 0.04 -1.26 -1.14 135.00 130.96 2fss s PRO 188 Ca 0.17 1.47 -0.22 0.00 0.04 0.00 0.00 61.00 62.47 2fss s PRO 188 Cb -0.03 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.53 2fss s PRO 188 CO 0.75 -1.75 1.74 -0.22 0.04 0.00 0.00 177.00 177.56 2fss h LYS 189 N -0.67 0.10 -3.08 4.56 3.64 -0.78 -3.42 116.57 116.92 2fss h LYS 189 Ca -0.46 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 58.81 2fss h LYS 189 Cb 1.26 -0.02 -0.19 0.00 -0.41 0.00 0.00 32.23 32.87 2fss h LYS 189 CO 0.50 0.09 -0.24 -2.00 -2.27 0.00 0.00 179.45 175.52 2fss s GLU 190 N -6.11 0.74 -0.19 1.90 2.12 -1.22 -4.97 118.70 110.96 2fss s GLU 190 Ca -0.13 -0.28 -0.05 0.00 0.36 0.00 0.00 54.97 54.87 2fss s GLU 190 Cb 0.07 0.32 -0.03 0.00 0.26 0.00 0.00 34.13 34.76 2fss s GLU 190 CO 0.67 -0.22 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.66 2fss s LEU 191 N -1.58 3.27 0.20 2.70 1.43 -1.26 -1.63 118.68 121.82 2fss s LEU 191 Ca -0.11 -0.18 0.11 0.00 -1.03 0.00 0.00 54.13 52.93 2fss s LEU 191 Cb -0.03 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2fss s LEU 191 CO 0.02 0.09 -0.23 -0.76 0.23 0.00 0.00 176.35 175.69 2fss s LEU 192 N 0.84 2.45 0.00 1.79 1.43 0.21 -1.26 118.68 124.15 2fss s LEU 192 Ca 0.00 -0.88 -0.06 0.00 -1.03 0.00 0.00 54.13 52.16 2fss s LEU 192 Cb -0.14 -1.15 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 2fss s LEU 192 CO 0.02 0.11 0.11 -0.72 0.23 0.00 0.00 176.35 176.10 2fss s TYR 193 N -1.77 0.07 -0.09 0.29 -0.85 -0.59 -1.29 117.35 113.13 2fss s TYR 193 Ca 0.22 -0.18 0.02 0.00 -0.52 0.00 0.00 57.07 56.60 2fss s TYR 193 Cb -0.08 -0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.18 2fss s TYR 193 CO 0.10 -0.27 -0.13 -0.47 -1.52 0.00 0.00 175.55 173.26 2fss s TYR 194 N -1.36 2.77 0.30 -3.49 5.04 -0.53 -0.41 117.35 119.67 2fss s TYR 194 Ca -0.15 -0.37 -0.15 0.00 -2.44 0.00 0.00 57.07 53.96 2fss s TYR 194 Cb -0.08 -1.74 0.02 0.00 0.35 0.00 0.00 41.96 40.52 2fss s TYR 194 CO 0.01 0.01 0.64 0.34 -1.34 0.00 0.00 175.55 175.21 2fss s ASP 195 N -0.22 -0.00 0.37 4.32 -1.08 -1.26 -0.81 116.67 117.98 2fss s ASP 195 Ca 0.01 -0.94 0.26 0.00 -0.52 0.00 0.00 52.55 51.35 2fss s ASP 195 Cb -0.13 0.71 0.69 0.00 -1.46 0.00 0.00 42.92 42.73 2fss s ASP 195 CO 0.03 -1.37 1.72 1.88 0.52 0.00 0.00 175.17 177.95 2fss h TYR 196 N 2.09 0.00 -3.72 -5.34 0.05 -1.99 -3.44 116.97 104.62 2fss h TYR 196 Ca -0.25 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.28 2fss h TYR 196 Cb 1.25 0.00 -0.15 0.00 1.01 0.00 0.00 36.73 38.84 2fss h TYR 196 CO 0.79 0.00 -0.70 1.14 -1.05 0.00 0.00 178.16 178.33 2fss s GLN 197 N -3.25 0.88 0.57 4.88 -2.07 -1.26 -5.15 119.66 114.26 2fss s GLN 197 Ca 0.07 -1.36 -0.18 0.00 -1.82 0.00 0.00 55.36 52.07 2fss s GLN 197 Cb 0.08 -0.30 -0.05 0.00 -1.09 0.00 0.00 33.01 31.65 2fss s GLN 197 CO 0.60 0.00 1.10 0.00 -1.32 0.00 0.00 175.29 175.68 2fss s ALA 198 N -3.54 2.68 0.43 2.60 0.00 -1.26 -5.00 121.76 117.67 2fss s ALA 198 Ca 0.13 0.67 -0.23 0.00 0.00 0.00 0.00 51.96 52.53 2fss s ALA 198 Cb 0.05 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.77 2fss s ALA 198 CO -0.04 -0.82 1.12 -0.51 0.00 0.00 0.00 175.76 175.52 2fss s LEU 199 N -4.08 4.07 0.57 0.00 1.43 -1.26 -5.01 118.68 114.40 2fss s LEU 199 Ca 0.69 2.21 -0.20 0.00 -1.03 0.00 0.00 54.13 55.80 2fss s LEU 199 Cb -0.21 -4.20 -0.05 0.00 0.03 0.00 0.00 46.19 41.76 2fss s LEU 199 CO 0.30 -0.74 1.22 -2.65 0.23 0.00 0.00 176.35 174.71 2fss n PRO 200 N -0.29 1.35 -0.26 1.29 -0.02 -1.26 -4.70 135.00 131.12 2fss n PRO 200 Ca 0.06 0.51 0.05 0.00 -2.02 0.00 0.00 63.50 62.10 2fss n PRO 200 Cb 0.48 -2.42 0.19 0.00 -0.02 0.00 0.00 33.50 31.74 2fss n PRO 200 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2fss h LYS 201 N 1.03 0.46 -0.64 -0.52 3.64 -1.99 -0.37 116.57 118.18 2fss h LYS 201 Ca -0.50 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.86 2fss h LYS 201 Cb 1.33 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 2fss h LYS 201 CO 0.55 0.30 0.43 -0.44 -2.27 0.00 0.00 179.45 178.02 2fss h ASP 202 N 0.47 0.74 -0.34 4.20 3.45 -1.99 0.59 116.42 123.54 2fss h ASP 202 Ca 0.42 -0.02 -0.09 0.00 0.43 0.00 0.00 57.03 57.77 2fss h ASP 202 Cb 0.62 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 2fss h ASP 202 CO -0.39 0.53 -0.13 0.00 -1.57 0.00 0.00 179.24 177.68 2fss h ALA 203 N 1.23 0.48 0.18 3.45 0.00 -1.66 -2.12 119.26 120.82 2fss h ALA 203 Ca 0.23 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2fss h ALA 203 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2fss h ALA 203 CO -0.05 0.37 -0.45 0.93 0.00 0.00 0.00 179.25 180.05 2fss h GLU 204 N 0.48 -0.70 -0.38 0.00 5.08 -0.94 -2.91 114.58 115.21 2fss h GLU 204 Ca 0.08 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.55 2fss h GLU 204 Cb 0.66 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 2fss h GLU 204 CO 0.04 -0.47 0.26 0.93 -1.00 0.00 0.00 179.01 178.78 2fss h GLU 205 N -0.73 0.23 -0.40 2.33 5.08 -0.90 -0.42 114.58 119.78 2fss h GLU 205 Ca 0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2fss h GLU 205 Cb 0.72 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2fss h GLU 205 CO -0.22 0.15 0.16 -0.22 -1.00 0.00 0.00 179.01 177.88 2fss h LYS 206 N 0.23 0.56 -0.15 2.33 3.64 -1.17 -2.44 116.57 119.58 2fss h LYS 206 Ca 0.17 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2fss h LYS 206 Cb 0.38 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2fss h LYS 206 CO -0.03 0.46 0.00 1.33 -2.27 0.00 0.00 179.45 178.94 2fss n VAL 207 N -4.38 0.36 -2.59 2.00 0.24 -1.02 -5.00 118.33 107.94 2fss n VAL 207 Ca 0.03 -0.68 -0.19 0.00 -2.04 0.00 0.00 64.34 61.45 2fss n VAL 207 Cb 0.14 0.98 0.01 0.00 -1.47 0.00 0.00 33.84 33.50 2fss n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fss n GLY 208 N 0.66 -0.39 3.81 7.63 0.00 -0.28 -4.82 105.19 111.80 2fss n GLY 208 Ca 0.09 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2fss n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fss s ALA 209 N -3.00 3.24 -0.10 4.61 0.00 -0.53 -4.40 121.76 121.57 2fss s ALA 209 Ca 0.11 0.31 0.03 0.00 0.00 0.00 0.00 51.96 52.41 2fss s ALA 209 Cb -0.05 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.06 2fss s ALA 209 CO 0.14 0.23 -0.21 0.50 0.00 0.00 0.00 175.76 176.42 2fss s ARG 210 N -2.49 3.06 0.08 0.00 3.52 -0.39 -4.73 118.95 118.00 2fss s ARG 210 Ca 0.52 -0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 54.99 2fss s ARG 210 Cb -0.14 -2.37 -0.05 0.00 -1.56 0.00 0.00 34.95 30.83 2fss s ARG 210 CO 0.19 0.22 1.02 0.50 -0.81 0.00 0.00 175.30 176.43 2fss s ARG 211 N 0.25 4.60 -0.07 5.12 3.52 -1.26 -1.54 118.95 129.57 2fss s ARG 211 Ca -0.14 1.53 0.01 0.00 -0.13 0.00 0.00 55.73 56.99 2fss s ARG 211 Cb -0.17 -3.38 -0.03 0.00 -1.56 0.00 0.00 34.95 29.81 2fss s ARG 211 CO 0.07 0.05 -0.08 0.08 -0.81 0.00 0.00 175.30 174.61 2fss s VAL 212 N 0.42 3.63 -0.02 7.11 1.01 0.45 -4.91 120.40 128.09 2fss s VAL 212 Ca 0.50 -0.50 0.11 0.00 0.00 0.00 0.00 61.98 62.10 2fss s VAL 212 Cb -0.24 -2.49 -0.09 0.00 0.00 0.00 0.00 36.38 33.56 2fss s VAL 212 CO 0.30 0.59 1.29 1.05 0.00 0.00 0.00 175.10 178.33 2fss h GLU 213 N 5.38 0.00 -4.56 2.72 -0.00 -1.97 -3.40 114.58 112.75 2fss h GLU 213 Ca -0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 59.36 58.68 2fss h GLU 213 Cb 1.17 0.00 -0.16 0.00 -0.00 0.00 0.00 28.75 29.76 2fss h GLU 213 CO 0.53 0.72 -0.70 0.54 -0.00 0.00 0.00 179.01 180.10 2fss s ASN 214 N -6.52 0.97 0.29 3.06 2.20 -1.26 -4.99 114.94 108.70 2fss s ASN 214 Ca 0.02 -0.93 -0.00 0.00 -0.94 0.00 0.00 52.86 51.00 2fss s ASN 214 Cb 0.09 0.10 0.44 0.00 -2.00 0.00 0.00 41.25 39.88 2fss s ASN 214 CO 0.79 -0.45 1.85 0.40 -2.94 0.00 0.00 177.10 176.75 2fss h ILE 215 N 3.25 1.22 -0.74 0.54 2.04 -1.99 -2.04 117.51 119.79 2fss h ILE 215 Ca -0.35 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 2fss h ILE 215 Cb 1.17 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.85 2fss h ILE 215 CO 0.61 0.28 0.44 -0.33 0.00 0.00 0.00 178.15 179.15 2fss h GLU 216 N 0.79 1.02 -0.14 2.37 3.07 -1.97 -1.00 114.58 118.71 2fss h GLU 216 Ca 0.18 -0.10 -0.17 0.00 -0.50 0.00 0.00 59.36 58.77 2fss h GLU 216 Cb 0.25 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2fss h GLU 216 CO -0.01 0.73 -0.62 0.93 -1.40 0.00 0.00 179.01 178.65 2fss h GLU 217 N 1.02 0.50 0.24 2.33 5.08 -1.87 -2.31 114.58 119.57 2fss h GLU 217 Ca 0.26 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2fss h GLU 217 Cb -0.01 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2fss h GLU 217 CO -0.05 0.96 -0.18 1.25 -1.00 0.00 0.00 179.01 180.00 2fss h LEU 218 N 0.37 -0.45 -0.82 1.33 5.85 -0.89 -3.04 115.31 117.65 2fss h LEU 218 Ca -0.01 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 2fss h LEU 218 Cb 1.17 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 2fss h LEU 218 CO 0.11 -0.28 -0.49 -0.37 -0.34 0.00 0.00 178.44 177.08 2fss h VAL 219 N -0.42 1.13 -0.15 1.05 -1.51 -1.22 -2.74 116.25 112.39 2fss h VAL 219 Ca -0.02 -1.82 0.04 0.00 -1.23 0.00 0.00 66.70 63.68 2fss h VAL 219 Cb 0.37 2.05 -0.01 0.00 -2.13 0.00 0.00 31.29 31.57 2fss h VAL 219 CO 0.00 0.48 0.12 0.00 -1.23 0.00 0.00 177.57 176.94 2fss h ALA 220 N 1.51 1.94 -0.01 5.19 0.00 -1.30 -3.13 119.26 123.46 2fss h ALA 220 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fss h ALA 220 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2fss h ALA 220 CO 0.06 -0.20 -0.16 0.00 0.00 0.00 0.00 179.25 178.95 2fss n GLN 221 N -4.17 1.61 -3.40 0.00 10.64 -1.05 -4.42 117.38 116.60 2fss n GLN 221 Ca 0.01 -0.80 -0.38 0.00 -1.83 0.00 0.00 57.00 53.99 2fss n GLN 221 Cb 0.25 -1.15 -0.06 0.00 -0.86 0.00 0.00 30.24 28.42 2fss n GLN 221 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2fss s ALA 222 N -1.32 3.59 0.09 2.61 0.00 -1.15 -4.79 121.76 120.79 2fss s ALA 222 Ca 0.10 -0.18 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 2fss s ALA 222 Cb 0.09 -2.52 -0.20 0.00 0.00 0.00 0.00 23.12 20.49 2fss s ALA 222 CO 0.24 0.27 1.22 -0.44 0.00 0.00 0.00 175.76 177.05 2fss h ASP 223 N 5.51 0.85 -3.82 0.00 3.32 -1.07 -3.38 116.42 117.82 2fss h ASP 223 Ca -0.47 -0.67 -0.59 0.00 0.02 0.00 0.00 57.03 55.32 2fss h ASP 223 Cb 1.20 -0.26 -0.32 0.00 0.22 0.00 0.00 39.33 40.18 2fss h ASP 223 CO 0.68 1.47 -0.85 -0.63 -1.72 0.00 0.00 179.24 178.19 2fss s ILE 224 N -3.33 1.57 -0.05 0.35 1.01 -0.46 -1.25 121.20 119.03 2fss s ILE 224 Ca -0.09 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 59.83 2fss s ILE 224 Cb 0.07 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 2fss s ILE 224 CO 0.91 0.45 -0.21 -0.69 0.00 0.00 0.00 174.94 175.40 2fss s VAL 225 N 0.10 1.73 -0.07 2.92 1.01 0.16 -0.57 120.40 125.67 2fss s VAL 225 Ca -0.06 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.07 2fss s VAL 225 Cb -0.13 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 34.79 2fss s VAL 225 CO 0.03 0.49 -0.15 0.28 0.00 0.00 0.00 175.10 175.75 2fss s THR 226 N 0.01 1.35 -0.27 3.92 -1.32 0.12 -0.62 115.64 118.83 2fss s THR 226 Ca -0.06 -0.60 -0.20 0.00 -1.21 0.00 0.00 61.69 59.63 2fss s THR 226 Cb -0.13 -1.21 -0.02 0.00 -1.51 0.00 0.00 72.50 69.63 2fss s THR 226 CO 0.03 0.40 0.62 -0.69 -2.21 0.00 0.00 174.62 172.78 2fss s VAL 227 N 0.62 4.98 -0.40 5.08 1.01 -0.25 -0.95 120.40 130.49 2fss s VAL 227 Ca -0.15 1.04 0.11 0.00 0.00 0.00 0.00 61.98 62.98 2fss s VAL 227 Cb -0.16 -3.94 0.34 0.00 0.00 0.00 0.00 36.38 32.61 2fss s VAL 227 CO 0.05 -0.01 0.73 0.59 0.00 0.00 0.00 175.10 176.46 2fss n ASN 228 N 5.74 1.19 -4.01 3.32 3.02 0.10 -3.86 115.26 120.76 2fss n ASN 228 Ca -0.01 -3.05 -0.08 0.00 -0.03 0.00 0.00 54.58 51.40 2fss n ASN 228 Cb 0.49 -0.62 -0.11 0.00 -0.61 0.00 0.00 39.78 38.94 2fss n ASN 228 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fss s ALA 229 N -2.41 0.25 0.82 5.41 0.00 -1.21 -4.29 121.76 120.32 2fss s ALA 229 Ca 0.40 -0.78 -0.10 0.00 0.00 0.00 0.00 51.96 51.48 2fss s ALA 229 Cb 0.32 0.18 0.08 0.00 0.00 0.00 0.00 23.12 23.71 2fss s ALA 229 CO -0.09 -0.22 1.10 -1.25 0.00 0.00 0.00 175.76 175.30 2fss s PRO 230 N -2.20 1.88 -0.28 0.00 0.04 -1.26 -4.55 135.00 128.63 2fss s PRO 230 Ca -0.09 1.23 -0.25 0.00 0.04 0.00 0.00 61.00 61.93 2fss s PRO 230 Cb -0.05 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2fss s PRO 230 CO -0.04 -1.93 0.88 -1.17 0.04 0.00 0.00 177.00 174.79 2fss s LEU 231 N -6.11 4.06 0.00 -3.56 2.96 -1.26 -4.74 118.68 110.03 2fss s LEU 231 Ca 0.63 0.92 -0.05 0.00 -0.22 0.00 0.00 54.13 55.41 2fss s LEU 231 Cb -0.19 -3.24 0.02 0.00 0.50 0.00 0.00 46.19 43.28 2fss s LEU 231 CO 0.57 -0.64 0.44 0.00 -1.32 0.00 0.00 176.35 175.40 2fss n HIS 232 N 6.28 -1.49 0.30 5.38 1.44 -1.26 -4.97 115.22 120.90 2fss n HIS 232 Ca 0.07 -1.59 0.19 0.00 -2.01 0.00 0.00 57.72 54.37 2fss n HIS 232 Cb 0.47 0.51 1.03 0.00 0.12 0.00 0.00 29.99 32.12 2fss n HIS 232 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2fss h ALA 233 N 1.92 1.34 0.00 1.59 0.00 -1.95 0.26 119.26 122.42 2fss h ALA 233 Ca -0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2fss h ALA 233 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2fss h ALA 233 CO 0.29 -0.07 -0.25 0.78 0.00 0.00 0.00 179.25 180.00 2fss h GLY 234 N 0.00 0.00 0.00 0.00 0.00 -1.95 -3.38 103.07 97.74 2fss h GLY 234 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2fss h GLY 234 CO -0.00 0.00 -0.94 -1.30 0.00 0.00 0.00 176.54 174.30 2fss n THR 235 N -2.64 0.00 -1.77 4.70 -2.24 -0.12 -4.82 114.28 107.39 2fss n THR 235 Ca 0.04 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.23 2fss n THR 235 Cb 0.49 0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 2fss n THR 235 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2fss s LYS 236 N -2.05 4.04 -1.12 -0.78 2.20 0.73 -1.93 119.74 120.84 2fss s LYS 236 Ca -0.01 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.01 2fss s LYS 236 Cb 0.02 -4.13 0.00 0.00 -1.51 0.00 0.00 37.83 32.21 2fss s LYS 236 CO 0.15 -1.05 0.00 0.41 -0.36 0.00 0.00 175.35 174.50 2fss n GLY 237 N 4.56 1.18 0.18 5.54 0.00 -0.07 -4.92 105.19 111.66 2fss n GLY 237 Ca 0.20 -0.44 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 2fss n GLY 237 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2fss h LEU 238 N 0.00 0.50 -7.92 0.99 5.85 -0.38 -3.31 115.31 111.04 2fss h LEU 238 Ca -0.22 -0.06 -0.68 0.00 0.84 0.00 0.00 57.88 57.77 2fss h LEU 238 Cb 0.74 -0.13 -0.14 0.00 0.37 0.00 0.00 40.66 41.51 2fss h LEU 238 CO 0.32 0.41 1.44 -0.63 -0.34 0.00 0.00 178.44 179.64 2fss s ILE 239 N -5.98 4.46 0.52 4.05 -1.09 -0.43 -4.71 121.20 118.03 2fss s ILE 239 Ca -0.13 -1.71 0.01 0.00 -2.23 0.00 0.00 60.65 56.59 2fss s ILE 239 Cb 0.11 -4.98 -0.00 0.00 -1.58 0.00 0.00 42.46 36.01 2fss s ILE 239 CO 0.73 -1.76 0.03 0.54 -1.23 0.00 0.00 174.94 173.25 2fss s ASN 240 N 3.91 4.19 0.37 3.58 2.20 -1.25 -1.25 114.94 126.69 2fss s ASN 240 Ca 0.43 -1.65 0.05 0.00 -0.94 0.00 0.00 52.86 50.75 2fss s ASN 240 Cb -0.01 0.61 0.72 0.00 -2.00 0.00 0.00 41.25 40.57 2fss s ASN 240 CO -0.03 -0.91 1.98 0.07 -2.94 0.00 0.00 177.10 175.26 2fss h LYS 241 N 1.26 0.58 0.66 3.55 2.10 -1.92 0.16 116.57 122.96 2fss h LYS 241 Ca -0.43 -0.07 -0.03 0.00 -2.00 0.00 0.00 60.65 58.12 2fss h LYS 241 Cb 1.32 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2fss h LYS 241 CO 0.72 0.47 -0.34 1.49 -2.00 0.00 0.00 179.45 179.79 2fss h GLU 242 N 0.58 -0.89 -0.48 0.07 4.22 -1.96 -1.49 114.58 114.64 2fss h GLU 242 Ca 0.15 0.06 -0.06 0.00 0.08 0.00 0.00 59.36 59.58 2fss h GLU 242 Cb 0.09 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2fss h GLU 242 CO -0.02 -0.59 0.04 1.25 -2.18 0.00 0.00 179.01 177.51 2fss h LEU 243 N -0.92 0.79 -1.63 1.64 5.85 -1.74 -2.50 115.31 116.79 2fss h LEU 243 Ca -0.09 -0.28 0.14 0.00 0.84 0.00 0.00 57.88 58.49 2fss h LEU 243 Cb 0.72 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 2fss h LEU 243 CO 0.13 0.87 0.48 -0.07 -0.34 0.00 0.00 178.44 179.51 2fss h LEU 244 N 0.67 0.35 -1.43 2.25 3.38 -0.70 0.11 115.31 119.95 2fss h LEU 244 Ca 0.14 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2fss h LEU 244 Cb 0.44 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2fss h LEU 244 CO 0.02 0.18 0.00 0.77 0.09 0.00 0.00 178.44 179.50 2fss h SER 245 N 0.37 0.00 0.01 -0.43 4.64 -0.79 -2.53 113.55 114.82 2fss h SER 245 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2fss h SER 245 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2fss h SER 245 CO -0.10 0.00 -1.18 0.29 -0.87 0.00 0.00 176.83 174.97 2fss n LYS 246 N -2.39 0.12 -1.13 4.77 4.76 0.01 -4.93 118.16 119.37 2fss n LYS 246 Ca -0.01 -0.04 -0.33 0.00 -2.87 0.00 0.00 58.31 55.07 2fss n LYS 246 Cb 0.10 -1.50 0.12 0.00 -1.84 0.00 0.00 35.03 31.91 2fss n LYS 246 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2fss s PHE 247 N -3.10 1.87 0.45 2.13 0.40 -0.95 -3.34 117.98 115.43 2fss s PHE 247 Ca 0.05 1.67 -0.24 0.00 -0.60 0.00 0.00 56.93 57.81 2fss s PHE 247 Cb 0.16 -3.44 -0.09 0.00 0.51 0.00 0.00 43.02 40.16 2fss s PHE 247 CO 0.88 -2.74 1.22 1.63 0.70 0.00 0.00 175.22 176.91 2fss n LYS 248 N -3.33 1.75 -1.70 0.44 5.02 -1.19 -4.88 118.16 114.26 2fss n LYS 248 Ca 0.13 0.63 -0.42 0.00 -2.02 0.00 0.00 58.31 56.63 2fss n LYS 248 Cb 0.51 -2.34 -0.03 0.00 -0.02 0.00 0.00 35.03 33.15 2fss n LYS 248 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2fss s LYS 249 N -2.28 4.13 0.00 1.97 2.47 -1.26 -2.69 119.74 122.07 2fss s LYS 249 Ca 0.63 2.61 0.00 0.00 -1.56 0.00 0.00 55.97 57.66 2fss s LYS 249 Cb -0.50 -3.53 0.00 0.00 -1.46 0.00 0.00 37.83 32.34 2fss s LYS 249 CO 0.56 -0.84 0.00 0.41 0.16 0.00 0.00 175.35 175.64 2fss n GLY 250 N 4.22 0.60 3.77 5.54 0.00 -0.72 -5.00 105.19 113.59 2fss n GLY 250 Ca 0.18 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2fss n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fss s ALA 251 N -2.00 2.30 -0.10 4.61 0.00 -1.10 -3.73 121.76 121.75 2fss s ALA 251 Ca 0.00 0.34 -0.01 0.00 0.00 0.00 0.00 51.96 52.29 2fss s ALA 251 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 2fss s ALA 251 CO 0.00 -1.66 -0.06 -1.58 0.00 0.00 0.00 175.76 172.46 2fss s TRP 252 N -2.77 2.97 -0.07 0.00 0.51 -0.38 0.61 118.94 119.80 2fss s TRP 252 Ca 0.63 -0.09 0.03 0.00 -2.12 0.00 0.00 56.10 54.54 2fss s TRP 252 Cb -0.18 -1.79 0.01 0.00 -0.81 0.00 0.00 33.47 30.70 2fss s TRP 252 CO 0.53 0.21 -0.17 -1.17 -0.51 0.00 0.00 176.95 175.84 2fss s LEU 253 N -0.44 1.82 -0.04 2.99 2.96 -0.47 -0.66 118.68 124.85 2fss s LEU 253 Ca 0.07 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 53.65 2fss s LEU 253 Cb -0.12 -1.04 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 2fss s LEU 253 CO 0.02 0.09 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.22 2fss s VAL 254 N 0.48 1.88 -0.22 1.68 1.01 0.21 -1.41 120.40 124.03 2fss s VAL 254 Ca -0.15 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.82 2fss s VAL 254 Cb -0.16 -1.58 0.07 0.00 0.00 0.00 0.00 36.38 34.71 2fss s VAL 254 CO 0.05 0.53 0.07 0.21 0.00 0.00 0.00 175.10 175.96 2fss s ASN 255 N -0.27 3.02 -0.18 3.32 2.47 -0.31 -1.09 114.94 121.90 2fss s ASN 255 Ca 0.01 -0.95 0.17 0.00 0.42 0.00 0.00 52.86 52.51 2fss s ASN 255 Cb -0.12 -0.51 0.51 0.00 -1.45 0.00 0.00 41.25 39.68 2fss s ASN 255 CO 0.02 -0.35 1.40 0.35 -3.72 0.00 0.00 177.10 174.79 2fss n THR 256 N 5.11 2.26 0.00 -5.21 -2.24 -1.26 -3.04 114.28 109.89 2fss n THR 256 Ca -0.07 -1.93 0.00 0.00 -2.27 0.00 0.00 64.05 59.78 2fss n THR 256 Cb 0.46 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2fss n THR 256 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fss n ALA 257 N -0.61 0.00 -3.04 6.98 0.00 -1.25 -4.86 120.51 117.72 2fss n ALA 257 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.53 2fss n ALA 257 Cb 0.87 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 20.18 2fss n ALA 257 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2fss s ARG 258 N 0.00 0.04 0.28 0.00 1.81 -1.26 -4.95 118.95 114.86 2fss s ARG 258 Ca 0.00 0.09 -0.02 0.00 -1.72 0.00 0.00 55.73 54.08 2fss s ARG 258 Cb 0.00 -0.02 0.44 0.00 -0.45 0.00 0.00 34.95 34.92 2fss s ARG 258 CO 0.00 -0.03 1.90 0.78 -0.68 0.00 0.00 175.30 177.27 2fss h GLY 259 N 6.27 1.42 1.90 -3.53 0.00 -1.79 -2.35 103.07 104.98 2fss h GLY 259 Ca -0.27 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.60 2fss h GLY 259 CO 0.48 0.35 0.00 0.00 0.00 0.00 0.00 176.54 177.37 2fss n ALA 260 N -2.38 1.88 0.21 3.60 0.00 -1.26 -1.79 120.51 120.77 2fss n ALA 260 Ca 0.14 -0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.59 2fss n ALA 260 Cb 0.16 -1.30 0.61 0.00 0.00 0.00 0.00 19.45 18.93 2fss n ALA 260 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2fss h ILE 261 N 0.00 1.00 -2.93 0.00 2.04 -1.60 -0.15 117.51 115.87 2fss h ILE 261 Ca 0.00 -0.03 -0.56 0.00 1.00 0.00 0.00 64.86 65.27 2fss h ILE 261 Cb 0.28 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2fss h ILE 261 CO 0.00 0.01 -0.36 0.00 0.00 0.00 0.00 178.15 177.81 2fss s VAL 263 N -1.75 5.03 0.14 0.00 1.01 -0.38 -4.63 120.40 119.82 2fss s VAL 263 Ca 0.39 -0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.91 2fss s VAL 263 Cb -0.12 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2fss s VAL 263 CO 0.28 -0.43 1.58 0.00 0.00 0.00 0.00 175.10 176.52 2fss h ALA 264 N 8.73 -0.50 0.00 5.51 0.00 -1.89 -1.73 119.26 129.37 2fss h ALA 264 Ca -0.26 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2fss h ALA 264 Cb 1.11 0.84 -0.00 0.00 0.00 0.00 0.00 17.79 19.74 2fss h ALA 264 CO 0.81 -0.89 -0.11 1.05 0.00 0.00 0.00 179.25 180.11 2fss h GLU 265 N -0.40 0.00 -0.28 0.00 4.11 -1.98 -1.83 114.58 114.20 2fss h GLU 265 Ca 0.11 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.43 2fss h GLU 265 Cb 0.60 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2fss h GLU 265 CO -0.49 0.11 -0.24 -0.44 0.07 0.00 0.00 179.01 178.02 2fss h ASP 266 N 0.00 0.69 -0.06 3.06 5.19 -1.72 -1.05 116.42 122.54 2fss h ASP 266 Ca -0.00 -0.46 -0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2fss h ASP 266 Cb 0.25 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.57 2fss h ASP 266 CO 0.01 1.01 0.02 0.58 -3.12 0.00 0.00 179.24 177.74 2fss h VAL 267 N 0.39 1.16 -0.48 -1.35 2.07 -0.81 -1.09 116.25 116.14 2fss h VAL 267 Ca 0.05 -0.49 0.10 0.00 0.82 0.00 0.00 66.70 67.18 2fss h VAL 267 Cb 0.80 1.39 -0.10 0.00 -1.52 0.00 0.00 31.29 31.86 2fss h VAL 267 CO 0.06 0.14 -0.20 0.00 0.02 0.00 0.00 177.57 177.58 2fss h ALA 268 N 0.83 0.16 -0.30 1.67 0.00 -1.39 -0.28 119.26 119.94 2fss h ALA 268 Ca 0.02 0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2fss h ALA 268 Cb 0.20 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2fss h ALA 268 CO -0.00 -0.54 -0.07 0.00 0.00 0.00 0.00 179.25 178.64 2fss h ALA 269 N 1.26 1.32 -0.36 0.00 0.00 -1.07 -1.94 119.26 118.46 2fss h ALA 269 Ca 0.23 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2fss h ALA 269 Cb 0.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2fss h ALA 269 CO -0.55 0.46 -0.12 0.00 0.00 0.00 0.00 179.25 179.04 2fss h ALA 270 N 1.47 0.51 -0.37 0.00 0.00 -0.51 -0.91 119.26 119.44 2fss h ALA 270 Ca 0.09 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.70 2fss h ALA 270 Cb 0.41 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2fss h ALA 270 CO 0.02 0.39 0.21 1.25 0.00 0.00 0.00 179.25 181.11 2fss h LEU 271 N 0.52 0.33 -1.21 0.00 5.85 -0.88 -0.94 115.31 118.97 2fss h LEU 271 Ca 0.09 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 2fss h LEU 271 Cb 0.64 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 2fss h LEU 271 CO 0.04 0.24 -0.15 -0.33 -0.34 0.00 0.00 178.44 177.90 2fss h GLU 272 N 0.42 0.36 0.00 1.25 3.07 -1.12 -2.68 114.58 115.89 2fss h GLU 272 Ca 0.15 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 2fss h GLU 272 Cb 0.03 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2fss h GLU 272 CO -0.08 0.51 -0.12 -1.13 -1.40 0.00 0.00 179.01 176.79 2fss n SER 273 N -4.22 0.28 0.00 1.42 3.41 -0.37 -4.58 113.62 109.56 2fss n SER 273 Ca -0.00 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2fss n SER 273 Cb 0.31 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2fss n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fss n GLY 274 N 1.45 1.28 0.35 5.00 0.00 -0.95 -4.89 105.19 107.44 2fss n GLY 274 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.15 2fss n GLY 274 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2fss h GLN 275 N 3.32 0.93 -6.27 1.61 5.75 -1.58 -2.39 115.11 116.47 2fss h GLN 275 Ca 0.00 -0.06 -0.68 0.00 -0.15 0.00 0.00 58.65 57.76 2fss h GLN 275 Cb 0.00 -0.21 -0.19 0.00 1.07 0.00 0.00 27.48 28.15 2fss h GLN 275 CO 0.00 0.61 -0.72 -0.51 -2.65 0.00 0.00 178.83 175.57 2fss s LEU 276 N -10.24 3.07 0.14 -2.39 1.43 -0.45 -1.76 118.68 108.48 2fss s LEU 276 Ca -0.12 -0.13 0.20 0.00 -1.03 0.00 0.00 54.13 53.05 2fss s LEU 276 Cb 0.22 -1.72 -0.07 0.00 0.03 0.00 0.00 46.19 44.65 2fss s LEU 276 CO 0.80 0.31 0.92 -1.14 0.23 0.00 0.00 176.35 177.48 2fss n ARG 277 N 1.86 0.61 -3.57 1.70 0.63 0.20 -4.36 116.66 113.74 2fss n ARG 277 Ca -0.16 0.14 -0.14 0.00 -0.92 0.00 0.00 57.85 56.77 2fss n ARG 277 Cb 0.53 -1.80 -0.06 0.00 0.45 0.00 0.00 32.46 31.57 2fss n ARG 277 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2fss s GLY 278 N -4.54 -0.43 -0.02 5.14 0.00 -1.21 -4.29 107.32 101.97 2fss s GLY 278 Ca -0.02 1.83 0.01 0.00 0.00 0.00 0.00 44.72 46.55 2fss s GLY 278 CO 0.80 1.25 -0.04 -0.47 0.00 0.00 0.00 173.10 174.64 2fss s TYR 279 N -0.68 0.50 0.34 1.90 5.04 0.45 -1.37 117.35 123.53 2fss s TYR 279 Ca -0.04 -0.10 -0.07 0.00 -2.44 0.00 0.00 57.07 54.41 2fss s TYR 279 Cb -0.02 -0.40 0.03 0.00 0.35 0.00 0.00 41.96 41.92 2fss s TYR 279 CO 0.04 -0.07 0.58 0.41 -1.34 0.00 0.00 175.55 175.16 2fss n GLY 280 N 3.42 1.64 0.00 8.97 0.00 -0.50 -1.51 105.19 117.21 2fss n GLY 280 Ca -0.18 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.42 2fss n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fss n GLY 281 N -0.50 1.00 0.17 -0.02 0.00 -1.17 -1.16 105.19 103.50 2fss n GLY 281 Ca -0.04 -1.95 0.02 0.00 0.00 0.00 0.00 46.02 44.05 2fss n GLY 281 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2fss n ASP 282 N 2.88 0.76 -4.48 1.61 5.75 -1.17 -1.59 116.55 120.31 2fss n ASP 282 Ca 0.00 -1.84 -0.30 0.00 -0.01 0.00 0.00 54.79 52.64 2fss n ASP 282 Cb 0.00 -0.13 -0.12 0.00 -1.03 0.00 0.00 41.12 39.84 2fss n ASP 282 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2fss s VAL 283 N -0.67 2.82 0.00 2.12 -7.23 -1.25 -2.70 120.40 113.49 2fss s VAL 283 Ca 0.05 -1.38 -0.05 0.00 -1.81 0.00 0.00 61.98 58.79 2fss s VAL 283 Cb 0.05 -2.25 -0.00 0.00 0.56 0.00 0.00 36.38 34.73 2fss s VAL 283 CO 0.01 0.19 0.09 0.26 -0.31 0.00 0.00 175.10 175.33 2fss s TRP 284 N -1.06 0.09 -0.07 2.82 0.52 -1.26 -4.49 118.94 115.49 2fss s TRP 284 Ca 0.17 -0.20 -0.00 0.00 0.02 0.00 0.00 56.10 56.08 2fss s TRP 284 Cb -0.11 -0.08 0.02 0.00 -1.15 0.00 0.00 33.47 32.16 2fss s TRP 284 CO 0.08 -0.24 -0.04 0.12 0.02 0.00 0.00 176.95 176.90 2fss s PHE 285 N -1.26 0.90 1.02 -1.98 5.36 -1.26 -3.91 117.98 116.85 2fss s PHE 285 Ca -0.14 -0.32 -0.12 0.00 -0.96 0.00 0.00 56.93 55.40 2fss s PHE 285 Cb -0.08 -0.86 0.20 0.00 -0.34 0.00 0.00 43.02 41.94 2fss s PHE 285 CO 0.01 -0.32 1.08 -2.14 -1.46 0.00 0.00 175.22 172.38 2fss s PRO 286 N 1.51 0.23 -0.05 10.12 0.02 -1.26 -4.95 135.00 140.62 2fss s PRO 286 Ca -0.01 0.80 -0.02 0.00 0.02 0.00 0.00 61.00 61.79 2fss s PRO 286 Cb -0.13 -1.69 0.04 0.00 0.02 0.00 0.00 34.50 32.73 2fss s PRO 286 CO -0.04 -2.94 0.10 -1.14 -0.33 0.00 0.00 177.00 172.66 2fss s GLN 287 N -4.76 0.03 0.61 5.54 0.74 -1.25 -3.59 119.66 116.97 2fss s GLN 287 Ca 0.66 0.33 -0.18 0.00 0.05 0.00 0.00 55.36 56.23 2fss s GLN 287 Cb -0.21 -0.24 -0.06 0.00 1.10 0.00 0.00 33.01 33.60 2fss s GLN 287 CO 0.60 -0.20 0.77 -0.35 -0.55 0.00 0.00 175.29 175.56 2fss n PRO 288 N 4.43 0.67 -2.24 1.67 -0.04 -1.26 -5.10 135.00 133.14 2fss n PRO 288 Ca -0.22 0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 63.08 2fss n PRO 288 Cb 0.51 -1.97 -0.03 0.00 -0.04 0.00 0.00 33.50 31.97 2fss n PRO 288 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fss s ALA 289 N -1.64 3.54 0.90 0.55 0.00 -1.24 -5.02 121.76 118.87 2fss s ALA 289 Ca 0.73 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.57 2fss s ALA 289 Cb -0.42 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.30 2fss s ALA 289 CO 0.50 -0.66 1.11 -2.30 0.00 0.00 0.00 175.76 174.42 2fss n PRO 290 N 4.34 -0.34 0.28 0.00 -0.02 -1.26 -4.87 135.00 133.12 2fss n PRO 290 Ca 0.11 -0.03 0.14 0.00 -2.02 0.00 0.00 63.50 61.70 2fss n PRO 290 Cb 0.44 -2.36 0.81 0.00 -0.02 0.00 0.00 33.50 32.36 2fss n PRO 290 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2fss h LYS 291 N -1.71 0.00 -0.65 -0.52 1.57 -2.02 -1.66 116.57 111.57 2fss h LYS 291 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2fss h LYS 291 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2fss h LYS 291 CO 0.41 0.07 0.00 -0.40 -0.57 0.00 0.00 179.45 178.96 2fss n ASP 292 N -3.75 4.47 -4.70 0.86 5.75 -1.26 -4.96 116.55 112.95 2fss n ASP 292 Ca -0.02 -2.42 -0.43 0.00 -0.01 0.00 0.00 54.79 51.90 2fss n ASP 292 Cb 0.17 -0.56 -0.03 0.00 -1.03 0.00 0.00 41.12 39.67 2fss n ASP 292 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 2fss n HIS 293 N 1.04 2.54 0.31 2.11 -0.00 -0.63 -4.82 115.22 115.77 2fss n HIS 293 Ca 0.24 0.25 0.18 0.00 0.46 0.00 0.00 57.72 58.85 2fss n HIS 293 Cb 0.84 -2.57 1.01 0.00 -0.12 0.00 0.00 29.99 29.15 2fss n HIS 293 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2fss h PRO 294 N 5.37 0.00 0.00 1.57 0.13 -1.93 -2.38 132.00 134.76 2fss h PRO 294 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2fss h PRO 294 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2fss h PRO 294 CO 0.84 0.01 0.00 -1.49 -0.23 0.00 0.00 178.00 177.13 2fss h TRP 295 N 0.00 0.00 -0.13 1.56 6.55 -1.90 -2.59 115.95 119.44 2fss h TRP 295 Ca -0.00 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 2fss h TRP 295 Cb 0.02 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.32 2fss h TRP 295 CO 0.00 0.00 0.05 0.00 -1.05 0.00 0.00 178.44 177.44 2fss h ARG 296 N 0.00 0.19 0.00 0.49 3.08 -1.79 -3.36 114.38 112.99 2fss h ARG 296 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2fss h ARG 296 Cb 0.53 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2fss h ARG 296 CO 0.00 0.30 -1.37 -0.25 -1.07 0.00 0.00 179.97 177.58 2fss n ASP 297 N -4.89 0.77 -4.77 7.04 9.92 -1.17 -4.98 116.55 118.48 2fss n ASP 297 Ca -0.05 -0.46 -0.41 0.00 -0.53 0.00 0.00 54.79 53.34 2fss n ASP 297 Cb 0.12 1.44 -0.02 0.00 -0.64 0.00 0.00 41.12 42.02 2fss n ASP 297 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fss s MET 298 N -3.03 4.25 0.09 -1.24 0.23 -0.99 -5.03 119.30 113.59 2fss s MET 298 Ca -0.00 2.36 -0.01 0.00 -1.03 0.00 0.00 55.69 57.01 2fss s MET 298 Cb 0.13 -3.05 -0.04 0.00 -1.53 0.00 0.00 34.83 30.34 2fss s MET 298 CO 0.77 -0.37 0.01 1.03 -2.03 0.00 0.00 175.02 174.43 2fss s ARG 299 N -1.48 0.76 0.86 3.16 1.81 -1.26 -4.66 118.95 118.14 2fss s ARG 299 Ca 0.53 -1.32 -0.14 0.00 -1.72 0.00 0.00 55.73 53.08 2fss s ARG 299 Cb -0.43 0.23 0.20 0.00 -0.45 0.00 0.00 34.95 34.50 2fss s ARG 299 CO 0.53 -0.18 1.18 0.27 -0.68 0.00 0.00 175.30 176.42 2fss n ASN 300 N 0.02 0.13 0.29 0.23 0.23 0.23 -3.88 115.26 112.52 2fss n ASN 300 Ca -0.10 -1.45 0.20 0.00 -0.53 0.00 0.00 54.58 52.69 2fss n ASN 300 Cb 0.62 -0.90 1.05 0.00 -2.08 0.00 0.00 39.78 38.47 2fss n ASN 300 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 2fss h LYS 301 N 0.00 0.00 -0.03 -3.83 2.10 -1.81 0.40 116.57 113.41 2fss h LYS 301 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 2fss h LYS 301 Cb 1.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 2fss h LYS 301 CO 0.27 0.00 -0.08 0.66 -2.00 0.00 0.00 179.45 178.30 2fss n TYR 302 N -2.87 0.00 -0.67 0.07 4.01 -1.26 -4.94 117.16 111.50 2fss n TYR 302 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2fss n TYR 302 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 2fss n TYR 302 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fss n GLY 303 N 1.31 0.60 0.00 2.72 0.00 0.13 -5.04 105.19 104.91 2fss n GLY 303 Ca 0.13 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2fss n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fss n ALA 304 N 0.00 0.00 -1.02 4.61 0.00 -1.26 -4.83 120.51 118.02 2fss n ALA 304 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2fss n ALA 304 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2fss n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fss n GLY 305 N 1.78 0.48 3.06 0.00 0.00 -1.26 -0.60 105.19 108.66 2fss n GLY 305 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 2fss n GLY 305 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fss s ASN 306 N -2.28 4.03 -0.33 1.61 3.84 -1.26 -0.41 114.94 120.13 2fss s ASN 306 Ca 0.00 -1.18 0.08 0.00 0.21 0.00 0.00 52.86 51.97 2fss s ASN 306 Cb 0.00 -1.47 0.45 0.00 -0.55 0.00 0.00 41.25 39.68 2fss s ASN 306 CO 0.00 -0.15 1.16 0.00 -2.79 0.00 0.00 177.10 175.32 2fss n ALA 307 N 4.51 4.85 -1.77 1.71 0.00 -0.57 -4.95 120.51 124.29 2fss n ALA 307 Ca -0.15 -3.85 -0.38 0.00 0.00 0.00 0.00 53.44 49.05 2fss n ALA 307 Cb 0.44 -0.43 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 2fss n ALA 307 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2fss s MET 308 N -3.59 4.38 0.21 0.00 -1.94 -1.26 -3.03 119.30 114.08 2fss s MET 308 Ca 0.48 1.65 0.03 0.00 -1.71 0.00 0.00 55.69 56.15 2fss s MET 308 Cb 0.40 -2.85 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 2fss s MET 308 CO -0.02 0.02 -0.00 0.95 -0.01 0.00 0.00 175.02 175.95 2fss s THR 309 N -1.42 0.92 1.09 2.05 -4.23 -0.62 -4.93 115.64 108.51 2fss s THR 309 Ca 0.51 -2.02 -0.14 0.00 -1.18 0.00 0.00 61.69 58.87 2fss s THR 309 Cb -0.27 -2.26 0.24 0.00 1.34 0.00 0.00 72.50 71.55 2fss s THR 309 CO 0.34 -0.38 1.07 -2.84 -0.54 0.00 0.00 174.62 172.27 2fss s PRO 310 N -3.88 -0.34 -0.92 3.99 0.02 -1.26 -4.30 135.00 128.31 2fss s PRO 310 Ca 0.27 0.49 -0.24 0.00 0.02 0.00 0.00 61.00 61.54 2fss s PRO 310 Cb 0.06 -1.65 0.00 0.00 0.02 0.00 0.00 34.50 32.93 2fss s PRO 310 CO 0.07 -3.24 1.67 -1.58 -0.33 0.00 0.00 177.00 173.59 2fss s HIS 311 N -2.81 2.15 0.00 6.54 5.65 -1.10 -4.54 115.29 121.18 2fss s HIS 311 Ca 0.67 -0.06 0.00 0.00 0.25 0.00 0.00 55.06 55.92 2fss s HIS 311 Cb -0.19 -4.38 0.00 0.00 -1.18 0.00 0.00 32.58 26.83 2fss s HIS 311 CO 0.59 -1.89 0.01 2.48 -0.65 0.00 0.00 174.74 175.27 2fss n TYR 312 N 11.30 0.00 -0.35 3.88 0.18 -1.26 -4.92 117.16 125.99 2fss n TYR 312 Ca 0.33 0.00 0.05 0.00 1.88 0.00 0.00 57.90 60.15 2fss n TYR 312 Cb 0.49 0.00 0.22 0.00 -0.38 0.00 0.00 39.34 39.67 2fss n TYR 312 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2fss h SER 313 N 0.00 0.96 -0.34 9.48 4.64 -1.91 -0.02 113.55 126.37 2fss h SER 313 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2fss h SER 313 Cb 0.40 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2fss h SER 313 CO 0.00 0.59 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 2fss n GLY 314 N -1.37 1.23 1.46 -0.77 0.00 -1.26 -4.06 105.19 100.42 2fss n GLY 314 Ca 0.16 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 45.76 2fss n GLY 314 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2fss n THR 315 N 0.48 1.44 -0.67 2.61 5.66 -0.02 -4.72 114.28 119.06 2fss n THR 315 Ca 0.13 -2.67 -0.30 0.00 -3.05 0.00 0.00 64.05 58.16 2fss n THR 315 Cb 0.45 0.22 0.20 0.00 -1.55 0.00 0.00 70.33 69.65 2fss n THR 315 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2fss s THR 316 N -2.55 2.11 0.33 1.09 -4.23 -1.24 -4.74 115.64 106.41 2fss s THR 316 Ca 0.37 0.04 0.06 0.00 -1.18 0.00 0.00 61.69 60.98 2fss s THR 316 Cb 0.38 -2.11 0.11 0.00 1.34 0.00 0.00 72.50 72.21 2fss s THR 316 CO -0.08 -0.05 1.81 -0.07 -0.54 0.00 0.00 174.62 175.69 2fss h LEU 317 N -2.18 0.35 -0.40 4.79 3.38 -1.97 -0.66 115.31 118.62 2fss h LEU 317 Ca -0.52 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.35 2fss h LEU 317 Cb 1.30 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 2fss h LEU 317 CO 0.46 0.57 0.23 0.44 0.09 0.00 0.00 178.44 180.23 2fss h ASP 318 N 0.33 0.50 -0.49 -0.43 3.32 -1.91 -2.19 116.42 115.56 2fss h ASP 318 Ca 0.06 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 2fss h ASP 318 Cb 0.54 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 2fss h ASP 318 CO 0.04 0.43 0.01 0.00 -1.72 0.00 0.00 179.24 177.99 2fss h ALA 319 N 1.09 1.00 -0.39 3.45 0.00 -1.70 -2.85 119.26 119.87 2fss h ALA 319 Ca 0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2fss h ALA 319 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2fss h ALA 319 CO -0.02 0.61 -0.00 1.96 0.00 0.00 0.00 179.25 181.80 2fss h GLN 320 N 0.84 0.62 -0.12 0.00 4.20 -1.02 -0.28 115.11 119.35 2fss h GLN 320 Ca 0.16 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2fss h GLN 320 Cb 0.49 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2fss h GLN 320 CO 0.02 0.64 0.07 1.15 -0.67 0.00 0.00 178.83 180.05 2fss h THR 321 N 0.59 1.06 -0.84 -0.54 2.02 -1.28 -0.37 112.91 113.55 2fss h THR 321 Ca 0.12 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 2fss h THR 321 Cb 0.38 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 2fss h THR 321 CO 0.01 0.06 0.48 0.03 0.37 0.00 0.00 175.52 176.48 2fss h ARG 322 N 0.13 1.15 -0.44 6.66 3.08 -1.25 -1.43 114.38 122.27 2fss h ARG 322 Ca 0.04 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2fss h ARG 322 Cb 0.03 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 2fss h ARG 322 CO -0.01 0.82 0.14 1.88 -1.07 0.00 0.00 179.97 181.74 2fss h TYR 323 N 1.15 0.71 0.56 3.04 0.05 -0.82 0.21 116.97 121.88 2fss h TYR 323 Ca 0.30 -0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.99 2fss h TYR 323 Cb -0.01 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 2fss h TYR 323 CO 0.00 0.64 -0.41 0.00 -1.05 0.00 0.00 178.16 177.35 2fss h ALA 324 N 0.99 -0.98 -0.31 3.88 0.00 -1.00 -0.03 119.26 121.81 2fss h ALA 324 Ca 0.14 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.93 2fss h ALA 324 Cb 0.26 0.53 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2fss h ALA 324 CO -0.00 -1.08 -0.01 1.96 0.00 0.00 0.00 179.25 180.11 2fss h GLN 325 N -0.94 0.07 -0.53 0.00 4.20 -1.27 -1.55 115.11 115.09 2fss h GLN 325 Ca -0.07 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.68 2fss h GLN 325 Cb 0.79 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.51 2fss h GLN 325 CO 0.03 0.05 0.29 0.78 -0.67 0.00 0.00 178.83 179.31 2fss h GLY 326 N 0.07 0.75 0.99 3.46 0.00 -0.86 -0.46 103.07 107.02 2fss h GLY 326 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2fss h GLY 326 CO -0.27 0.16 0.28 -0.84 0.00 0.00 0.00 176.54 175.87 2fss h THR 327 N 0.57 1.13 -0.55 4.70 2.02 -0.76 -1.79 112.91 118.23 2fss h THR 327 Ca 0.23 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 67.18 2fss h THR 327 Cb 0.09 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 66.96 2fss h THR 327 CO -0.13 0.13 0.29 0.50 0.37 0.00 0.00 175.52 176.67 2fss h LYS 328 N 0.59 0.53 -0.88 6.66 3.64 -0.67 -0.72 116.57 125.73 2fss h LYS 328 Ca 0.16 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 2fss h LYS 328 Cb -0.03 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 2fss h LYS 328 CO -0.03 0.35 0.46 -0.91 -2.27 0.00 0.00 179.45 177.05 2fss h ASN 329 N 0.55 1.11 0.06 4.20 2.35 -0.84 0.46 115.58 123.47 2fss h ASN 329 Ca 0.25 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2fss h ASN 329 Cb 0.15 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.24 2fss h ASN 329 CO -0.17 0.90 -0.03 0.40 -1.65 0.00 0.00 177.43 176.89 2fss h ILE 330 N 1.23 1.14 -0.80 2.81 2.04 -0.94 -1.98 117.51 121.01 2fss h ILE 330 Ca 0.31 -0.64 0.07 0.00 1.00 0.00 0.00 64.86 65.60 2fss h ILE 330 Cb 0.05 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 37.63 2fss h ILE 330 CO -0.05 0.16 0.47 -0.07 0.00 0.00 0.00 178.15 178.67 2fss h LEU 331 N -0.36 0.71 0.12 1.44 3.38 -0.90 -0.77 115.31 118.94 2fss h LEU 331 Ca -0.01 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2fss h LEU 331 Cb 0.32 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2fss h LEU 331 CO 0.01 0.44 -0.06 -0.08 0.09 0.00 0.00 178.44 178.85 2fss h GLU 332 N 0.84 -0.15 -1.01 1.13 4.57 -0.92 0.23 114.58 119.27 2fss h GLU 332 Ca 0.36 0.01 0.24 0.00 -1.18 0.00 0.00 59.36 58.79 2fss h GLU 332 Cb 0.23 0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 28.75 2fss h GLU 332 CO -0.20 -0.08 0.63 0.77 -1.18 0.00 0.00 179.01 178.95 2fss h SER 333 N -0.19 0.60 0.01 1.04 0.02 -0.66 -1.14 113.55 113.23 2fss h SER 333 Ca -0.02 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2fss h SER 333 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 2fss h SER 333 CO 0.03 0.14 -0.01 0.15 -1.14 0.00 0.00 176.83 176.00 2fss h PHE 334 N 0.54 -0.01 -0.47 3.45 3.57 -0.57 0.56 116.94 124.02 2fss h PHE 334 Ca 0.60 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 62.04 2fss h PHE 334 Cb 1.25 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.97 2fss h PHE 334 CO -0.00 0.65 0.05 0.74 -2.23 0.00 0.00 178.31 177.52 2fss h PHE 335 N -0.70 0.77 -0.01 0.41 0.05 -0.26 -2.65 116.94 114.54 2fss h PHE 335 Ca -0.00 -0.08 0.00 0.00 3.82 0.00 0.00 57.97 61.70 2fss h PHE 335 Cb 0.67 -0.22 0.00 0.00 2.00 0.00 0.00 35.95 38.41 2fss h PHE 335 CO 0.16 0.69 0.00 0.25 -0.18 0.00 0.00 178.31 179.23 2fss n THR 336 N -4.26 0.01 -0.80 -1.55 -2.24 -0.50 -4.90 114.28 100.06 2fss n THR 336 Ca 0.03 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2fss n THR 336 Cb 0.26 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 2fss n THR 336 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fss n GLY 337 N 1.01 0.38 0.23 3.38 0.00 -1.00 -4.85 105.19 104.34 2fss n GLY 337 Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 2fss n GLY 337 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fss h LYS 338 N 1.08 0.74 -6.40 1.61 1.57 -1.81 -3.47 116.57 109.89 2fss h LYS 338 Ca 0.00 -0.53 -0.50 0.00 -1.87 0.00 0.00 60.65 57.75 2fss h LYS 338 Cb 0.15 0.08 -0.12 0.00 0.08 0.00 0.00 32.23 32.43 2fss h LYS 338 CO 0.00 1.15 -0.77 1.19 -0.57 0.00 0.00 179.45 180.45 2fss n PHE 339 N -3.95 -2.01 -1.39 -1.35 3.01 0.18 -4.86 117.46 107.09 2fss n PHE 339 Ca -0.05 0.82 -0.27 0.00 1.01 0.00 0.00 57.45 58.95 2fss n PHE 339 Cb 0.67 -3.43 -0.08 0.00 -0.01 0.00 0.00 39.48 36.64 2fss n PHE 339 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2fss n ASP 340 N -2.70 6.87 -4.76 4.37 5.75 -1.26 -4.97 116.55 119.86 2fss n ASP 340 Ca 0.06 -2.82 -0.35 0.00 -0.01 0.00 0.00 54.79 51.66 2fss n ASP 340 Cb 0.51 -1.39 0.03 0.00 -1.03 0.00 0.00 41.12 39.24 2fss n ASP 340 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2fss s TYR 341 N 0.10 2.49 0.25 2.11 1.51 -1.26 -4.96 117.35 117.58 2fss s TYR 341 Ca 0.63 1.54 -0.30 0.00 -1.01 0.00 0.00 57.07 57.93 2fss s TYR 341 Cb 0.28 -3.36 -0.11 0.00 -0.11 0.00 0.00 41.96 38.67 2fss s TYR 341 CO -0.09 -1.95 1.53 1.03 -1.11 0.00 0.00 175.55 174.96 2fss s ARG 342 N -3.52 4.20 0.37 -0.62 0.52 -1.26 -4.89 118.95 113.76 2fss s ARG 342 Ca 0.74 2.42 0.04 0.00 -0.52 0.00 0.00 55.73 58.40 2fss s ARG 342 Cb -0.26 -3.09 0.72 0.00 0.52 0.00 0.00 34.95 32.84 2fss s ARG 342 CO 0.34 -0.54 2.03 -1.35 0.02 0.00 0.00 175.30 175.80 2fss h PRO 343 N 5.38 0.73 0.00 3.54 0.11 -1.98 -1.42 132.00 138.36 2fss h PRO 343 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2fss h PRO 343 Cb 1.22 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2fss h PRO 343 CO 0.82 0.48 0.00 -0.56 -0.21 0.00 0.00 178.00 178.53 2fss h GLN 344 N 0.75 0.00 0.00 1.05 -0.00 -1.98 -2.92 115.11 112.01 2fss h GLN 344 Ca 0.21 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.81 2fss h GLN 344 Cb -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.40 2fss h GLN 344 CO -0.05 0.00 -0.46 -0.44 -0.00 0.00 0.00 178.83 177.89 2fss h ASP 345 N 0.00 0.00 -2.96 0.06 3.32 -1.47 -3.42 116.42 111.96 2fss h ASP 345 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2fss h ASP 345 Cb 0.37 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 2fss h ASP 345 CO 0.00 0.19 0.88 -0.63 -1.72 0.00 0.00 179.24 177.95 2fss s ILE 346 N -3.15 4.39 -0.17 0.35 1.01 -1.10 -1.50 121.20 121.02 2fss s ILE 346 Ca 0.04 1.67 -0.14 0.00 0.00 0.00 0.00 60.65 62.23 2fss s ILE 346 Cb 0.07 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.39 2fss s ILE 346 CO 0.73 -0.15 -0.17 -0.38 0.00 0.00 0.00 174.94 174.97 2fss n ILE 347 N 5.36 1.46 -4.87 2.92 5.41 0.23 -4.94 119.36 124.93 2fss n ILE 347 Ca 0.13 0.11 -0.26 0.00 1.00 0.00 0.00 62.75 63.74 2fss n ILE 347 Cb 0.45 -2.29 -0.16 0.00 -0.71 0.00 0.00 39.64 36.93 2fss n ILE 347 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2fss s LEU 348 N -8.04 1.96 -0.27 1.39 1.43 -0.87 -4.47 118.68 109.81 2fss s LEU 348 Ca -0.22 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 52.49 2fss s LEU 348 Cb 0.04 -0.98 0.02 0.00 0.03 0.00 0.00 46.19 45.30 2fss s LEU 348 CO 0.35 0.18 -0.01 -0.22 0.23 0.00 0.00 176.35 176.87 2fss s LEU 349 N -0.10 3.46 -1.54 1.79 2.96 0.44 -0.06 118.68 125.62 2fss s LEU 349 Ca -0.01 -0.87 -0.00 0.00 -0.22 0.00 0.00 54.13 53.03 2fss s LEU 349 Cb -0.10 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.86 2fss s LEU 349 CO 0.01 -0.16 0.05 0.59 -1.32 0.00 0.00 176.35 175.52 2fss n ASN 350 N 4.72 0.80 0.00 3.68 3.02 -1.22 -1.05 115.26 125.21 2fss n ASN 350 Ca -0.16 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 2fss n ASN 350 Cb 0.47 -1.73 0.00 0.00 -0.61 0.00 0.00 39.78 37.91 2fss n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fss n GLY 351 N -2.51 1.64 3.69 7.41 0.00 0.27 -4.30 105.19 111.38 2fss n GLY 351 Ca -0.32 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 2fss n GLY 351 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fss s GLU 352 N -0.41 4.10 0.00 1.61 8.01 -0.22 -3.95 118.70 127.84 2fss s GLU 352 Ca 0.00 -0.27 0.12 0.00 0.01 0.00 0.00 54.97 54.83 2fss s GLU 352 Cb 0.00 -3.35 0.73 0.00 -4.31 0.00 0.00 34.13 27.20 2fss s GLU 352 CO 0.00 0.27 1.16 0.66 0.01 0.00 0.00 175.26 177.37