#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 4.14 -0.12 0.00 2.20 -1.26 -1.15 119.74 123.55 2fss s LYS 2 Ca 0.00 -0.24 0.03 0.00 -0.36 0.00 0.00 55.97 55.40 2fss s LYS 2 Cb 0.00 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2fss s LYS 2 CO 0.00 0.21 -0.22 0.42 -0.36 0.00 0.00 175.35 175.40 2fss s ILE 3 N 0.62 2.14 -0.29 5.43 1.01 0.32 -0.42 121.20 130.02 2fss s ILE 3 Ca 0.08 -0.97 -0.10 0.00 0.00 0.00 0.00 60.65 59.65 2fss s ILE 3 Cb -0.12 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 2fss s ILE 3 CO 0.00 0.55 0.17 -0.69 0.00 0.00 0.00 174.94 174.97 2fss s VAL 4 N 0.57 5.00 -0.27 2.92 1.01 -0.33 -0.42 120.40 128.89 2fss s VAL 4 Ca -0.13 -0.03 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 2fss s VAL 4 Cb -0.17 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 2fss s VAL 4 CO 0.04 0.21 0.06 -0.22 0.00 0.00 0.00 175.10 175.18 2fss s LEU 5 N 1.71 3.62 -0.30 3.92 2.96 0.14 -0.25 118.68 130.47 2fss s LEU 5 Ca 0.06 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.34 2fss s LEU 5 Cb -0.16 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.67 2fss s LEU 5 CO 0.09 -0.13 0.09 -0.69 -1.32 0.00 0.00 176.35 174.39 2fss s VAL 6 N 1.52 4.09 0.22 1.68 1.01 -0.36 -0.52 120.40 128.04 2fss s VAL 6 Ca 0.04 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.38 2fss s VAL 6 Cb -0.16 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 2fss s VAL 6 CO 0.02 0.08 0.17 -0.76 0.00 0.00 0.00 175.10 174.61 2fss s LEU 7 N 1.52 1.22 0.46 3.92 1.43 -0.31 -3.89 118.68 123.03 2fss s LEU 7 Ca 0.03 -1.43 -0.15 0.00 -1.03 0.00 0.00 54.13 51.55 2fss s LEU 7 Cb -0.17 0.46 -0.08 0.00 0.03 0.00 0.00 46.19 46.43 2fss s LEU 7 CO 0.03 -0.89 0.89 -0.72 0.23 0.00 0.00 176.35 175.90 2fss s TYR 8 N -4.03 3.44 -0.09 0.29 -0.85 -1.26 -3.62 117.35 111.23 2fss s TYR 8 Ca 0.39 1.32 -0.30 0.00 -0.52 0.00 0.00 57.07 57.96 2fss s TYR 8 Cb 0.06 -2.66 -0.02 0.00 0.38 0.00 0.00 41.96 39.72 2fss s TYR 8 CO 0.14 -0.23 1.02 -0.51 -1.52 0.00 0.00 175.55 174.45 2fss s ASP 9 N -2.99 7.25 0.00 -0.18 1.01 -1.26 -0.46 116.67 120.03 2fss s ASP 9 Ca 0.56 1.56 0.24 0.00 0.71 0.00 0.00 52.55 55.62 2fss s ASP 9 Cb -0.10 -2.56 0.26 0.00 1.01 0.00 0.00 42.92 41.53 2fss s ASP 9 CO 0.29 -0.44 1.24 0.00 0.21 0.00 0.00 175.17 176.48 2fss n ALA 10 N 4.89 3.88 -0.44 5.23 0.00 -1.26 -4.95 120.51 127.86 2fss n ALA 10 Ca 0.09 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2fss n ALA 10 Cb 0.49 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.96 2fss n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fss n GLY 11 N 1.47 3.03 0.42 0.00 0.00 -1.26 -1.34 105.19 107.51 2fss n GLY 11 Ca 0.06 -0.01 0.23 0.00 0.00 0.00 0.00 46.02 46.30 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 0.12 0.00 1.61 6.56 -2.02 -2.21 116.57 120.62 2fss h LYS 12 Ca 0.00 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.56 2fss h LYS 12 Cb 0.00 -0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 31.63 2fss h LYS 12 CO 0.00 0.08 -0.13 0.45 -2.06 0.00 0.00 179.45 177.79 2fss h HIS 13 N 0.12 0.00 0.00 -1.35 3.86 -1.64 -2.92 115.15 113.22 2fss h HIS 13 Ca 0.37 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.44 2fss h HIS 13 Cb 1.29 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.74 2fss h HIS 13 CO -0.00 0.13 -0.68 0.00 0.86 0.00 0.00 177.93 178.24 2fss h ALA 14 N 1.87 0.60 -0.27 2.45 0.00 -1.48 -3.11 119.26 119.32 2fss h ALA 14 Ca -0.00 -0.62 -0.19 0.00 0.00 0.00 0.00 54.91 54.10 2fss h ALA 14 Cb 0.69 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2fss h ALA 14 CO 0.02 0.85 -0.56 0.00 0.00 0.00 0.00 179.25 179.55 2fss h ALA 15 N 1.32 0.48 -0.74 0.00 0.00 -1.64 -3.24 119.26 115.43 2fss h ALA 15 Ca -0.01 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.43 2fss h ALA 15 Cb 1.46 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 2fss h ALA 15 CO 0.09 0.68 0.49 -0.44 0.00 0.00 0.00 179.25 180.07 2fss h ASP 16 N 0.64 0.75 -2.99 0.00 3.32 -1.50 -3.42 116.42 113.23 2fss h ASP 16 Ca 0.01 -0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.58 2fss h ASP 16 Cb 1.17 -0.17 -0.41 0.00 0.22 0.00 0.00 39.33 40.14 2fss h ASP 16 CO 0.12 0.51 -0.76 -0.70 -1.72 0.00 0.00 179.24 176.69 2fss s GLU 17 N -5.75 0.09 0.49 3.56 2.56 -1.18 -5.00 118.70 113.47 2fss s GLU 17 Ca -0.10 -0.19 0.14 0.00 0.00 0.00 0.00 54.97 54.82 2fss s GLU 17 Cb 0.19 -1.67 1.18 0.00 2.00 0.00 0.00 34.13 35.82 2fss s GLU 17 CO 0.78 -0.75 2.12 1.49 -0.56 0.00 0.00 175.26 178.33 2fss h GLU 18 N 8.42 0.09 0.00 4.30 4.81 -1.82 -2.29 114.58 128.08 2fss h GLU 18 Ca -0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2fss h GLU 18 Cb 1.12 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.48 2fss h GLU 18 CO 0.33 0.08 0.00 1.17 -0.73 0.00 0.00 179.01 179.85 2fss n LYS 19 N -4.51 0.64 -1.83 1.92 4.81 -1.26 -4.36 118.16 113.58 2fss n LYS 19 Ca -0.02 0.02 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 2fss n LYS 19 Cb 0.10 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.64 2fss n LYS 19 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2fss n LEU 20 N -1.14 6.34 0.06 3.14 7.94 -0.87 -4.71 117.00 127.76 2fss n LEU 20 Ca 0.17 -4.01 -0.02 0.00 -1.11 0.00 0.00 56.01 51.04 2fss n LEU 20 Cb 0.15 -1.64 0.24 0.00 0.53 0.00 0.00 43.42 42.71 2fss n LEU 20 CO 0.18 0.83 0.73 1.88 -1.11 0.00 0.00 177.39 179.90 2fss h TYR 21 N 6.42 0.40 0.00 1.96 0.05 -1.87 -3.34 116.97 120.58 2fss h TYR 21 Ca 0.54 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 59.23 2fss h TYR 21 Cb 0.68 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2fss h TYR 21 CO 1.44 0.61 0.00 0.41 -1.05 0.00 0.00 178.16 179.57 2fss n GLY 22 N -0.40 2.27 3.34 3.88 0.00 -1.26 -0.55 105.19 112.47 2fss n GLY 22 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 2.44 0.59 -0.27 0.00 1.35 -1.03 0.65 112.91 116.65 2fss h THR 24 Ca -0.39 -0.61 -0.19 0.00 -0.55 0.00 0.00 66.41 64.67 2fss h THR 24 Cb 1.22 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 2fss h THR 24 CO 0.65 0.14 -0.59 -0.33 -0.25 0.00 0.00 175.52 175.14 2fss h GLU 25 N 0.00 0.87 0.00 4.72 3.07 -1.93 -3.34 114.58 117.96 2fss h GLU 25 Ca -0.00 -0.58 0.00 0.00 -0.50 0.00 0.00 59.36 58.28 2fss h GLU 25 Cb 0.38 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 2fss h GLU 25 CO 0.02 1.21 -1.79 0.09 -1.40 0.00 0.00 179.01 177.13 2fss n ASN 26 N -4.00 0.20 -3.67 1.42 3.02 -0.96 -5.01 115.26 106.26 2fss n ASN 26 Ca -0.05 -0.15 -0.26 0.00 -0.03 0.00 0.00 54.58 54.10 2fss n ASN 26 Cb 0.65 1.77 0.07 0.00 -0.61 0.00 0.00 39.78 41.65 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 -2.15 -7.30 -1.21 3.52 5.02 0.18 -1.33 118.16 114.89 2fss n LYS 27 Ca -0.03 0.77 -0.07 0.00 -2.02 0.00 0.00 58.31 56.96 2fss n LYS 27 Cb 0.53 -5.79 -0.03 0.00 -0.02 0.00 0.00 35.03 29.72 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 -4.91 0.08 -0.09 -0.35 4.77 0.29 -1.84 117.00 114.95 2fss n LEU 28 Ca 0.02 0.18 -0.01 0.00 -0.03 0.00 0.00 56.01 56.17 2fss n LEU 28 Cb 0.55 -2.55 -0.00 0.00 -2.33 0.00 0.00 43.42 39.08 2fss n LEU 28 CO 0.67 -1.00 -0.01 0.61 -1.33 0.00 0.00 177.39 176.34 2fss n GLY 29 N 0.36 0.35 0.49 -0.72 0.00 -0.44 -4.76 105.19 100.48 2fss n GLY 29 Ca -0.07 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.52 0.00 0.06 -0.61 -5.35 -0.77 -4.72 119.36 105.46 2fss n ILE 30 Ca -0.01 -0.48 -0.12 0.00 -0.27 0.00 0.00 62.75 61.86 2fss n ILE 30 Cb 0.26 1.26 -0.07 0.00 -1.74 0.00 0.00 39.64 39.35 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 2.53 -0.06 -0.67 -1.28 0.00 -1.87 0.32 119.26 118.22 2fss h ALA 31 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2fss h ALA 31 Cb 0.53 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2fss h ALA 31 CO 0.00 -0.53 0.18 -0.91 0.00 0.00 0.00 179.25 177.99 2fss h ASN 32 N -0.08 1.01 -0.33 0.00 2.35 -1.95 -1.15 115.58 115.44 2fss h ASN 32 Ca -0.01 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.55 2fss h ASN 32 Cb 0.06 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.13 2fss h ASN 32 CO 0.01 0.98 0.11 -0.25 -1.65 0.00 0.00 177.43 176.63 2fss h TRP 33 N 1.00 0.20 -0.26 1.19 7.01 -1.78 0.94 115.95 124.26 2fss h TRP 33 Ca 0.21 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.22 2fss h TRP 33 Cb 0.35 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.36 2fss h TRP 33 CO 0.03 0.09 0.12 -0.07 -2.79 0.00 0.00 178.44 175.81 2fss h LEU 34 N 0.26 0.34 -0.10 0.65 3.38 -0.80 -2.72 115.31 116.32 2fss h LEU 34 Ca 0.15 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.02 2fss h LEU 34 Cb 0.12 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2fss h LEU 34 CO -0.15 0.38 -0.15 0.50 0.09 0.00 0.00 178.44 179.11 2fss h LYS 35 N 0.28 -0.20 -0.26 1.13 3.64 -0.85 -1.52 116.57 118.79 2fss h LYS 35 Ca 0.09 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 2fss h LYS 35 Cb 0.14 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 2fss h LYS 35 CO -0.01 -0.13 0.25 -0.44 -2.27 0.00 0.00 179.45 176.84 2fss h ASP 36 N -0.21 0.00 0.17 4.20 3.32 -0.70 0.24 116.42 123.45 2fss h ASP 36 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2fss h ASP 36 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2fss h ASP 36 CO -0.22 0.00 -0.14 0.00 -1.72 0.00 0.00 179.24 177.16 2fss n GLN 37 N -3.96 1.08 -0.68 3.56 6.02 -0.63 -4.94 117.38 117.84 2fss n GLN 37 Ca 0.03 -0.59 0.00 0.00 -0.01 0.00 0.00 57.00 56.44 2fss n GLN 37 Cb 0.39 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.16 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 1.27 0.66 3.89 1.08 0.00 0.85 -4.98 105.19 107.96 2fss n GLY 38 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 3.53 -0.25 1.61 3.76 -0.86 -4.52 115.29 116.55 2fss s HIS 39 Ca 0.00 0.93 -0.08 0.00 -0.15 0.00 0.00 55.06 55.76 2fss s HIS 39 Cb 0.00 -2.37 -0.03 0.00 1.11 0.00 0.00 32.58 31.28 2fss s HIS 39 CO 0.00 -0.21 0.09 -2.00 -0.85 0.00 0.00 174.74 171.77 2fss s GLU 40 N -4.35 3.71 -0.23 1.40 2.12 -0.30 -4.29 118.70 116.76 2fss s GLU 40 Ca 0.49 -0.45 -0.05 0.00 0.36 0.00 0.00 54.97 55.32 2fss s GLU 40 Cb -0.10 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.88 2fss s GLU 40 CO 0.39 -0.19 -0.00 -1.17 -0.54 0.00 0.00 175.26 173.75 2fss s LEU 41 N 1.64 3.10 -0.26 2.70 2.96 -1.26 -0.52 118.68 127.04 2fss s LEU 41 Ca 0.06 -0.31 -0.09 0.00 -0.22 0.00 0.00 54.13 53.57 2fss s LEU 41 Cb -0.15 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2fss s LEU 41 CO 0.05 -0.01 0.12 -0.63 -1.32 0.00 0.00 176.35 174.55 2fss s ILE 42 N 1.46 4.75 -0.12 6.68 -1.09 0.44 -4.99 121.20 128.34 2fss s ILE 42 Ca 0.05 -0.02 -0.00 0.00 -2.23 0.00 0.00 60.65 58.45 2fss s ILE 42 Cb -0.15 -3.24 -0.02 0.00 -1.58 0.00 0.00 42.46 37.48 2fss s ILE 42 CO -0.00 0.31 -0.11 -0.89 -1.23 0.00 0.00 174.94 173.02 2fss s THR 43 N 1.57 3.30 -0.00 2.92 2.01 -1.26 0.23 115.64 124.42 2fss s THR 43 Ca 0.06 -0.59 -0.15 0.00 0.31 0.00 0.00 61.69 61.33 2fss s THR 43 Cb -0.15 -2.38 0.02 0.00 0.01 0.00 0.00 72.50 70.00 2fss s THR 43 CO 0.06 0.53 0.31 0.28 -0.69 0.00 0.00 174.62 175.12 2fss s THR 44 N 0.09 0.06 -1.02 -0.82 -1.32 0.33 -4.96 115.64 108.00 2fss s THR 44 Ca -0.04 -0.52 0.16 0.00 -1.21 0.00 0.00 61.69 60.07 2fss s THR 44 Cb -0.14 -0.69 -0.10 0.00 -1.51 0.00 0.00 72.50 70.05 2fss s THR 44 CO 0.04 -0.29 0.73 -1.54 -2.21 0.00 0.00 174.62 171.36 2fss n SER 45 N 1.11 1.08 -4.46 8.08 3.41 -1.24 -1.16 113.62 120.45 2fss n SER 45 Ca -0.21 -1.04 -0.43 0.00 -0.26 0.00 0.00 58.87 56.93 2fss n SER 45 Cb 0.57 0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 65.27 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 -2.22 6.22 0.00 4.04 2.15 -1.26 -4.81 116.67 120.79 2fss s ASP 46 Ca 0.09 -1.09 0.02 0.00 0.43 0.00 0.00 52.55 52.00 2fss s ASP 46 Cb 0.12 -2.42 -0.01 0.00 -0.30 0.00 0.00 42.92 40.30 2fss s ASP 46 CO 0.54 -1.42 0.17 -1.84 -0.17 0.00 0.00 175.17 172.45 2fss n GLU 47 N 7.67 5.03 -4.87 4.34 0.28 -1.26 -2.27 120.64 129.57 2fss n GLU 47 Ca -0.00 -0.12 -0.25 0.00 -0.16 0.00 0.00 57.16 56.63 2fss n GLU 47 Cb 0.46 -0.67 -0.15 0.00 1.43 0.00 0.00 31.44 32.50 2fss n GLU 47 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 2fss s GLU 48 N -0.98 1.47 -0.34 3.44 -1.05 -1.26 -4.81 118.70 115.16 2fss s GLU 48 Ca 0.01 -0.65 0.06 0.00 -0.15 0.00 0.00 54.97 54.23 2fss s GLU 48 Cb 0.01 -1.42 0.18 0.00 -0.44 0.00 0.00 34.13 32.46 2fss s GLU 48 CO 0.07 0.39 0.54 0.20 0.95 0.00 0.00 175.26 177.41 2fss s GLY 49 N -0.44 -0.98 0.00 -3.83 0.00 -1.26 -4.49 107.32 96.31 2fss s GLY 49 Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.16 2fss s GLY 49 CO -0.01 3.44 0.00 0.61 0.00 0.00 0.00 173.10 177.15 2fss n GLY 50 N 4.93 2.37 0.02 0.20 0.00 -1.26 -4.74 105.19 106.71 2fss n GLY 50 Ca 0.07 -0.80 0.16 0.00 0.00 0.00 0.00 46.02 45.44 2fss n GLY 50 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2fss n ASN 51 N 0.01 0.07 -4.59 1.61 6.94 -1.26 -4.73 115.26 113.32 2fss n ASN 51 Ca 0.00 -0.76 -0.35 0.00 -0.02 0.00 0.00 54.58 53.45 2fss n ASN 51 Cb 0.00 -0.08 0.10 0.00 -2.36 0.00 0.00 39.78 37.43 2fss n ASN 51 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2fss n SER 52 N -1.04 0.06 -0.30 0.53 3.41 -1.26 -4.74 113.62 110.28 2fss n SER 52 Ca 0.21 0.60 0.06 0.00 -0.26 0.00 0.00 58.87 59.48 2fss n SER 52 Cb 0.16 -1.38 0.27 0.00 -0.26 0.00 0.00 64.21 63.01 2fss n SER 52 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2fss h VAL 53 N -0.55 0.99 -0.02 -3.33 2.07 -1.92 -1.23 116.25 112.27 2fss h VAL 53 Ca -0.46 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 66.76 2fss h VAL 53 Cb 1.32 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 2fss h VAL 53 CO 0.45 0.17 -0.17 0.25 0.02 0.00 0.00 177.57 178.29 2fss h LEU 54 N 0.94 -0.49 -1.73 2.57 5.85 -1.80 -2.32 115.31 118.34 2fss h LEU 54 Ca 0.42 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.18 2fss h LEU 54 Cb 0.36 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 2fss h LEU 54 CO -0.18 -0.23 -0.13 0.44 -0.34 0.00 0.00 178.44 178.01 2fss h ASP 55 N -0.27 0.00 0.15 1.25 3.32 -1.71 -1.64 116.42 117.52 2fss h ASP 55 Ca 0.06 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 2fss h ASP 55 Cb 0.34 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2fss h ASP 55 CO -0.17 0.13 -0.31 1.56 -1.72 0.00 0.00 179.24 178.73 2fss h GLN 56 N 0.00 0.25 0.00 3.56 4.20 -0.68 -3.28 115.11 119.17 2fss h GLN 56 Ca -0.00 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2fss h GLN 56 Cb 0.44 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2fss h GLN 56 CO 0.02 0.54 -0.88 0.72 -0.67 0.00 0.00 178.83 178.56 2fss n HIS 57 N -4.11 0.00 -0.16 2.96 8.25 -0.89 -4.55 115.22 116.73 2fss n HIS 57 Ca -0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.43 2fss n HIS 57 Cb 0.41 -0.06 0.07 0.00 1.12 0.00 0.00 29.99 31.53 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 0.71 -0.65 1.59 2.04 -1.37 -2.07 117.51 117.75 2fss h ILE 58 Ca 0.00 -0.08 0.19 0.00 1.00 0.00 0.00 64.86 65.97 2fss h ILE 58 Cb 0.42 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2fss h ILE 58 CO 0.00 0.04 0.50 -0.65 0.00 0.00 0.00 178.15 178.04 2fss h PRO 59 N 0.23 0.00 0.00 2.37 0.11 -1.78 -2.96 132.00 129.97 2fss h PRO 59 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 2fss h PRO 59 Cb 0.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 2fss h PRO 59 CO -0.34 0.00 -0.01 -0.40 -0.21 0.00 0.00 178.00 177.05 2fss n ASP 60 N -4.20 1.72 -4.71 -2.05 5.75 -1.03 -3.33 116.55 108.70 2fss n ASP 60 Ca 0.13 -1.93 -0.42 0.00 -0.01 0.00 0.00 54.79 52.56 2fss n ASP 60 Cb 0.75 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.79 2fss n ASP 60 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2fss s ALA 61 N -0.97 3.70 0.06 2.12 0.00 -0.81 -4.66 121.76 121.20 2fss s ALA 61 Ca 0.02 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.26 2fss s ALA 61 Cb 0.02 -3.59 -0.24 0.00 0.00 0.00 0.00 23.12 19.30 2fss s ALA 61 CO 0.00 -0.74 1.06 -0.44 0.00 0.00 0.00 175.76 175.64 2fss h ASP 62 N 6.93 0.17 -3.76 0.00 3.32 -0.93 -2.80 116.42 119.35 2fss h ASP 62 Ca -0.42 -0.21 -0.34 0.00 0.02 0.00 0.00 57.03 56.08 2fss h ASP 62 Cb 1.21 -0.06 -0.30 0.00 0.22 0.00 0.00 39.33 40.40 2fss h ASP 62 CO 0.90 1.17 -0.75 -0.63 -1.72 0.00 0.00 179.24 178.20 2fss s ILE 63 N -2.66 0.38 -0.09 0.35 1.01 -0.91 -1.34 121.20 117.94 2fss s ILE 63 Ca -0.03 -0.15 0.04 0.00 0.00 0.00 0.00 60.65 60.51 2fss s ILE 63 Cb 0.08 -0.36 -0.00 0.00 0.01 0.00 0.00 42.46 42.19 2fss s ILE 63 CO 0.84 0.14 -0.23 -0.63 0.00 0.00 0.00 174.94 175.06 2fss s ILE 64 N 0.24 1.95 -0.15 2.92 1.01 -0.67 -1.18 121.20 125.32 2fss s ILE 64 Ca -0.02 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.64 2fss s ILE 64 Cb -0.06 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 2fss s ILE 64 CO -0.00 0.54 -0.08 -0.63 0.00 0.00 0.00 174.94 174.76 2fss s ILE 65 N 0.28 3.43 0.33 2.92 1.01 0.65 -0.98 121.20 128.84 2fss s ILE 65 Ca -0.16 -0.52 0.06 0.00 0.00 0.00 0.00 60.65 60.04 2fss s ILE 65 Cb -0.17 -2.48 -0.07 0.00 0.01 0.00 0.00 42.46 39.75 2fss s ILE 65 CO 0.07 0.50 -0.01 0.42 0.00 0.00 0.00 174.94 175.92 2fss s THR 66 N 0.47 1.66 -0.01 2.92 -4.23 0.14 -1.22 115.64 115.37 2fss s THR 66 Ca -0.06 -2.07 0.03 0.00 -1.18 0.00 0.00 61.69 58.40 2fss s THR 66 Cb -0.15 -2.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 2fss s THR 66 CO 0.04 -0.14 -0.08 0.28 -0.54 0.00 0.00 174.62 174.17 2fss s THR 67 N -2.98 0.67 0.52 3.99 -1.32 -1.25 -0.22 115.64 115.05 2fss s THR 67 Ca 0.33 -0.36 0.33 0.00 -1.21 0.00 0.00 61.69 60.79 2fss s THR 67 Cb 0.06 -0.57 0.36 0.00 -1.51 0.00 0.00 72.50 70.85 2fss s THR 67 CO 0.15 0.19 2.21 -0.65 -2.21 0.00 0.00 174.62 174.31 2fss h PRO 68 N 5.99 0.00 -0.14 7.08 0.11 -1.85 -2.41 132.00 140.78 2fss h PRO 68 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2fss h PRO 68 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2fss h PRO 68 CO 0.50 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 179.51 2fss n PHE 69 N -3.52 0.18 -2.67 0.65 3.72 -1.26 -4.09 117.46 110.48 2fss n PHE 69 Ca -0.02 -0.09 -0.04 0.00 -0.05 0.00 0.00 57.45 57.25 2fss n PHE 69 Cb 0.14 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.78 2fss n PHE 69 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2fss n HIS 70 N -0.04 -0.53 -2.22 1.38 -0.00 -1.13 -4.85 115.22 107.83 2fss n HIS 70 Ca 0.12 -0.76 -0.42 0.00 0.46 0.00 0.00 57.72 57.12 2fss n HIS 70 Cb 0.20 1.16 -0.03 0.00 -0.12 0.00 0.00 29.99 31.20 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 0.07 4.31 -0.20 1.57 0.04 -0.92 -4.55 135.00 135.32 2fss s PRO 71 Ca 0.23 1.99 -0.28 0.00 0.04 0.00 0.00 61.00 62.98 2fss s PRO 71 Cb 0.26 -3.43 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2fss s PRO 71 CO -0.16 -0.49 0.97 0.00 0.04 0.00 0.00 177.00 177.36 2fss s ALA 72 N 1.77 3.61 -0.50 8.56 0.00 -1.26 -5.00 121.76 128.95 2fss s ALA 72 Ca 0.64 0.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.44 2fss s ALA 72 Cb -0.33 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.37 2fss s ALA 72 CO 0.28 -0.90 1.29 0.71 0.00 0.00 0.00 175.76 177.14 2fss s TYR 73 N 2.80 2.53 -1.10 0.00 2.02 -1.26 -4.75 117.35 117.58 2fss s TYR 73 Ca 0.42 0.59 -0.14 0.00 -0.37 0.00 0.00 57.07 57.58 2fss s TYR 73 Cb -0.16 -4.41 0.19 0.00 -0.40 0.00 0.00 41.96 37.18 2fss s TYR 73 CO 0.09 -1.70 1.26 0.42 -1.57 0.00 0.00 175.55 174.05 2fss s ILE 74 N 5.21 5.19 0.64 2.71 1.09 0.07 -4.94 121.20 131.18 2fss s ILE 74 Ca 0.52 -2.55 -0.07 0.00 -1.10 0.00 0.00 60.65 57.45 2fss s ILE 74 Cb -0.10 -4.79 0.02 0.00 -1.06 0.00 0.00 42.46 36.53 2fss s ILE 74 CO 0.30 -1.47 0.97 0.42 -0.10 0.00 0.00 174.94 175.05 2fss s THR 75 N 1.18 3.30 0.21 2.92 -4.23 -1.26 -1.40 115.64 116.36 2fss s THR 75 Ca 0.36 0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.80 2fss s THR 75 Cb -0.05 -3.35 0.20 0.00 1.34 0.00 0.00 72.50 70.63 2fss s THR 75 CO -0.04 -0.39 1.66 0.50 -0.54 0.00 0.00 174.62 175.81 2fss h LYS 76 N -0.37 0.11 -0.48 3.99 3.64 -1.94 0.21 116.57 121.73 2fss h LYS 76 Ca -0.45 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 2fss h LYS 76 Cb 1.27 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 2fss h LYS 76 CO 0.61 0.07 0.08 1.05 -2.27 0.00 0.00 179.45 178.99 2fss h GLU 77 N 0.11 0.74 -0.20 1.90 9.09 -1.99 0.18 114.58 124.42 2fss h GLU 77 Ca 0.32 -0.16 -0.17 0.00 0.05 0.00 0.00 59.36 59.40 2fss h GLU 77 Cb 0.51 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 2fss h GLU 77 CO -0.53 0.70 -0.53 0.00 0.05 0.00 0.00 179.01 178.70 2fss h ARG 78 N 0.71 0.72 -0.45 1.06 3.08 -1.79 -2.94 114.38 114.77 2fss h ARG 78 Ca 0.15 -0.50 0.06 0.00 0.07 0.00 0.00 59.98 59.76 2fss h ARG 78 Cb 0.32 0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 2fss h ARG 78 CO 0.00 1.12 0.14 0.82 -1.07 0.00 0.00 179.97 180.99 2fss h ILE 79 N 0.43 0.83 -0.74 2.04 2.04 -0.20 -1.74 117.51 120.17 2fss h ILE 79 Ca -0.01 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.77 2fss h ILE 79 Cb 1.15 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 2fss h ILE 79 CO 0.11 0.06 0.49 0.44 0.00 0.00 0.00 178.15 179.25 2fss h ASP 80 N 0.30 0.81 1.30 1.72 3.32 -0.99 -2.41 116.42 120.48 2fss h ASP 80 Ca 0.21 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 2fss h ASP 80 Cb 0.23 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2fss h ASP 80 CO -0.23 0.57 -0.25 0.11 -1.72 0.00 0.00 179.24 177.72 2fss h LYS 81 N 0.95 0.00 -4.70 3.56 1.79 -1.24 -3.39 116.57 113.53 2fss h LYS 81 Ca 0.29 0.00 -0.71 0.00 -2.18 0.00 0.00 60.65 58.05 2fss h LYS 81 Cb -0.01 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.54 2fss h LYS 81 CO -0.08 0.25 2.32 0.00 -1.08 0.00 0.00 179.45 180.86 2fss n ALA 82 N -2.19 4.53 0.32 3.86 0.00 -0.70 -4.07 120.51 122.25 2fss n ALA 82 Ca 0.01 -4.01 0.21 0.00 0.00 0.00 0.00 53.44 49.66 2fss n ALA 82 Cb 0.53 -3.39 1.05 0.00 0.00 0.00 0.00 19.45 17.64 2fss n ALA 82 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2fss h LYS 83 N 6.70 0.00 -0.01 0.00 1.79 -1.76 -2.32 116.57 120.98 2fss h LYS 83 Ca 0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.92 2fss h LYS 83 Cb 0.76 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 2fss h LYS 83 CO 1.58 0.00 -0.16 1.63 -1.08 0.00 0.00 179.45 181.42 2fss n LYS 84 N -3.07 1.51 -1.92 3.15 5.02 -1.25 -5.03 118.16 116.57 2fss n LYS 84 Ca -0.02 -0.90 -0.42 0.00 -2.02 0.00 0.00 58.31 54.95 2fss n LYS 84 Cb 0.14 -1.19 -0.03 0.00 -0.02 0.00 0.00 35.03 33.94 2fss n LYS 84 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2fss s LEU 85 N -1.51 4.37 0.00 -0.35 2.96 -0.88 -4.31 118.68 118.96 2fss s LEU 85 Ca 0.12 2.52 0.00 0.00 -0.22 0.00 0.00 54.13 56.55 2fss s LEU 85 Cb 0.10 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.22 2fss s LEU 85 CO 0.25 -0.87 0.00 0.29 -1.32 0.00 0.00 176.35 174.70 2fss n LYS 86 N 5.20 1.93 -3.72 1.98 5.02 -0.45 -4.73 118.16 123.39 2fss n LYS 86 Ca 0.15 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.33 2fss n LYS 86 Cb 0.40 -0.95 -0.12 0.00 -0.02 0.00 0.00 35.03 34.34 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 -3.16 0.24 -0.13 -0.35 2.96 -1.11 -1.17 118.68 115.96 2fss s LEU 87 Ca 0.00 0.69 0.00 0.00 -0.22 0.00 0.00 54.13 54.60 2fss s LEU 87 Cb 0.00 1.02 -0.01 0.00 0.50 0.00 0.00 46.19 47.70 2fss s LEU 87 CO 0.00 -0.17 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.03 2fss s VAL 88 N 1.20 2.96 -0.07 1.68 1.01 -0.09 -1.67 120.40 125.42 2fss s VAL 88 Ca -0.08 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.24 2fss s VAL 88 Cb -0.09 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 2fss s VAL 88 CO -0.09 0.52 -0.18 -0.69 0.00 0.00 0.00 175.10 174.65 2fss s VAL 89 N 0.44 2.65 -0.37 2.92 1.01 -0.15 -1.47 120.40 125.44 2fss s VAL 89 Ca -0.10 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 2fss s VAL 89 Cb -0.16 -2.03 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 2fss s VAL 89 CO 0.05 0.57 0.30 -0.69 0.00 0.00 0.00 175.10 175.33 2fss s VAL 90 N -0.26 5.23 -1.39 2.92 1.01 0.18 0.24 120.40 128.32 2fss s VAL 90 Ca 0.01 -0.29 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 2fss s VAL 90 Cb -0.13 -3.83 0.04 0.00 0.00 0.00 0.00 36.38 32.46 2fss s VAL 90 CO 0.03 -0.15 2.07 0.00 0.00 0.00 0.00 175.10 177.05 2fss n ALA 91 N 5.23 4.87 0.00 5.51 0.00 0.70 -3.24 120.51 133.57 2fss n ALA 91 Ca -0.11 -3.85 0.00 0.00 0.00 0.00 0.00 53.44 49.48 2fss n ALA 91 Cb 0.49 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.37 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 4.51 0.48 2.96 0.00 0.00 -1.26 -4.65 105.19 107.23 2fss n GLY 92 Ca 0.51 -1.48 -0.18 0.00 0.00 0.00 0.00 46.02 44.87 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 -3.69 0.54 0.00 1.61 1.01 -1.26 -0.75 120.40 117.85 2fss s VAL 93 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2fss s VAL 93 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 36.38 35.89 2fss s VAL 93 CO 0.00 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2fss n GLY 94 N 3.26 3.44 0.21 4.51 0.00 -1.26 -4.81 105.19 110.54 2fss n GLY 94 Ca -0.17 -0.78 0.05 0.00 0.00 0.00 0.00 46.02 45.12 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 1.38 0.29 1.61 3.41 -1.26 -4.75 113.62 114.30 2fss n SER 95 Ca 0.00 -2.53 0.18 0.00 -0.26 0.00 0.00 58.87 56.26 2fss n SER 95 Cb 0.00 -0.30 0.78 0.00 -0.26 0.00 0.00 64.21 64.44 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 0.34 4.04 3.45 -2.02 -1.60 116.42 120.64 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 1.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.88 2fss h ASP 96 CO 0.00 0.02 0.00 0.00 -1.57 0.00 0.00 179.24 177.69 2fss n HIS 97 N -3.13 0.00 -4.76 4.55 1.44 -1.26 -4.79 115.22 107.28 2fss n HIS 97 Ca -0.00 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.38 2fss n HIS 97 Cb 0.26 -0.21 -0.14 0.00 0.12 0.00 0.00 29.99 30.03 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 -2.42 3.16 -1.40 0.61 1.01 -0.60 -0.75 121.20 120.81 2fss s ILE 98 Ca 0.28 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 60.14 2fss s ILE 98 Cb 0.17 -2.32 0.05 0.00 0.01 0.00 0.00 42.46 40.38 2fss s ILE 98 CO 0.36 0.54 2.04 -0.67 0.00 0.00 0.00 174.94 177.21 2fss n ASP 99 N 3.27 4.28 -0.31 3.58 -0.08 -0.49 -4.70 116.55 122.10 2fss n ASP 99 Ca -0.18 -2.87 0.01 0.00 -1.51 0.00 0.00 54.79 50.24 2fss n ASP 99 Cb 0.53 -1.69 0.14 0.00 2.34 0.00 0.00 41.12 42.44 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 10.97 0.81 -0.21 -2.67 3.38 -1.89 -2.69 115.31 123.00 2fss h LEU 100 Ca 0.52 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.57 2fss h LEU 100 Cb 0.73 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 2fss h LEU 100 CO 1.73 0.51 -0.19 -0.78 0.09 0.00 0.00 178.44 179.79 2fss h ASP 101 N 0.94 -0.61 -0.66 -0.43 1.82 -1.99 0.52 116.42 116.00 2fss h ASP 101 Ca 0.38 0.12 -0.01 0.00 -0.39 0.00 0.00 57.03 57.13 2fss h ASP 101 Cb 0.20 0.30 -0.03 0.00 0.68 0.00 0.00 39.33 40.48 2fss h ASP 101 CO -0.18 -0.23 0.38 0.22 -1.61 0.00 0.00 179.24 177.82 2fss h TYR 102 N -0.20 0.88 -0.23 0.28 3.20 -1.88 0.23 116.97 119.25 2fss h TYR 102 Ca 0.13 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 2fss h TYR 102 Cb 0.39 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 2fss h TYR 102 CO -0.34 0.61 0.08 0.82 -1.64 0.00 0.00 178.16 177.69 2fss h ILE 103 N 0.90 1.19 -0.40 1.81 2.04 -1.21 -0.20 117.51 121.63 2fss h ILE 103 Ca 0.23 -0.59 -0.11 0.00 1.00 0.00 0.00 64.86 65.40 2fss h ILE 103 Cb -0.00 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2fss h ILE 103 CO -0.04 0.19 -0.18 -1.13 0.00 0.00 0.00 178.15 176.98 2fss h ASN 104 N 0.21 0.86 0.37 1.72 -1.24 -0.61 -0.40 115.58 116.49 2fss h ASN 104 Ca 0.07 -0.40 -0.14 0.00 0.71 0.00 0.00 56.30 56.55 2fss h ASN 104 Cb 0.22 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 2fss h ASN 104 CO -0.00 1.07 -0.57 1.56 -1.29 0.00 0.00 177.43 178.20 2fss h GLN 105 N 0.65 0.20 0.07 6.67 4.20 -0.41 -3.05 115.11 123.45 2fss h GLN 105 Ca 0.09 -0.13 -0.26 0.00 0.06 0.00 0.00 58.65 58.41 2fss h GLN 105 Cb 0.74 0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.54 2fss h GLN 105 CO 0.06 0.72 -1.11 1.79 -0.67 0.00 0.00 178.83 179.61 2fss h THR 106 N 0.16 1.41 0.00 -0.54 1.35 -0.97 -3.48 112.91 110.84 2fss h THR 106 Ca -0.00 -2.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.18 2fss h THR 106 Cb 1.05 2.67 0.00 0.00 -1.73 0.00 0.00 68.15 70.13 2fss h THR 106 CO 0.09 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 2fss n GLY 107 N 1.24 0.66 3.76 5.82 0.00 -0.18 -5.04 105.19 111.45 2fss n GLY 107 Ca -0.09 -0.51 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.57 2.22 -2.12 1.61 5.02 -1.10 -4.84 118.16 116.39 2fss n LYS 108 Ca 0.00 0.79 -0.42 0.00 -2.02 0.00 0.00 58.31 56.66 2fss n LYS 108 Cb 0.00 -2.64 0.00 0.00 -0.02 0.00 0.00 35.03 32.37 2fss n LYS 108 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2fss n LYS 109 N -0.27 3.31 -4.34 1.97 4.81 -1.26 -3.15 118.16 119.22 2fss n LYS 109 Ca 0.06 -3.17 -0.26 0.00 -0.87 0.00 0.00 58.31 54.06 2fss n LYS 109 Cb 0.42 -3.08 -0.17 0.00 0.02 0.00 0.00 35.03 32.22 2fss n LYS 109 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2fss s ILE 110 N 1.58 1.22 0.21 3.15 1.01 -1.26 -4.63 121.20 122.47 2fss s ILE 110 Ca 0.43 -0.47 -0.14 0.00 0.00 0.00 0.00 60.65 60.47 2fss s ILE 110 Cb 0.11 -1.14 -0.08 0.00 0.01 0.00 0.00 42.46 41.36 2fss s ILE 110 CO -0.03 0.38 0.60 -0.44 0.00 0.00 0.00 174.94 175.46 2fss s SER 111 N 1.06 6.78 -0.10 3.58 0.01 -0.32 -0.58 113.70 124.13 2fss s SER 111 Ca -0.06 1.10 -0.01 0.00 1.31 0.00 0.00 55.95 58.29 2fss s SER 111 Cb -0.15 -2.30 0.03 0.00 0.21 0.00 0.00 66.02 63.82 2fss s SER 111 CO -0.01 -0.01 -0.03 -0.69 0.41 0.00 0.00 173.24 172.90 2fss s VAL 112 N -1.67 0.68 0.08 3.43 1.01 0.58 -0.91 120.40 123.59 2fss s VAL 112 Ca 0.44 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 62.37 2fss s VAL 112 Cb -0.13 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 2fss s VAL 112 CO 0.20 0.25 -0.24 -0.76 0.00 0.00 0.00 175.10 174.55 2fss s LEU 113 N 1.84 2.23 0.27 3.92 2.01 -0.54 -0.79 118.68 127.62 2fss s LEU 113 Ca 0.04 -0.63 0.02 0.00 0.01 0.00 0.00 54.13 53.57 2fss s LEU 113 Cb -0.13 -1.10 -0.05 0.00 0.01 0.00 0.00 46.19 44.92 2fss s LEU 113 CO -0.07 0.17 0.11 -1.83 1.01 0.00 0.00 176.35 175.74 2fss s GLU 114 N -1.56 1.46 -1.13 1.70 -1.05 0.17 -0.65 118.70 117.64 2fss s GLU 114 Ca 0.10 -1.80 -0.07 0.00 -0.15 0.00 0.00 54.97 53.05 2fss s GLU 114 Cb -0.10 -0.26 0.27 0.00 -0.44 0.00 0.00 34.13 33.60 2fss s GLU 114 CO 0.03 -0.32 1.43 0.28 0.95 0.00 0.00 175.26 177.63 2fss n VAL 115 N -0.50 4.88 -1.71 1.83 0.31 0.07 -4.52 118.33 118.69 2fss n VAL 115 Ca -0.00 -5.45 -0.42 0.00 -0.01 0.00 0.00 64.34 58.46 2fss n VAL 115 Cb 0.66 -2.30 -0.01 0.00 -0.91 0.00 0.00 33.84 31.28 2fss n VAL 115 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2fss n THR 116 N 2.30 1.87 0.00 2.52 -1.04 -1.26 -2.25 114.28 116.43 2fss n THR 116 Ca 0.28 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2fss n THR 116 Cb 0.36 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.25 2fss n THR 116 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fss n GLY 117 N 0.90 2.77 0.21 3.41 0.00 -1.26 -4.89 105.19 106.33 2fss n GLY 117 Ca 0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.84 -3.25 113.55 114.72 2fss h SER 118 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 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 -1.85 -0.46 -0.87 0.00 0.00 176.83 173.65 2fss n ASN 119 N -2.77 0.79 -0.14 4.97 6.94 -1.26 -4.73 115.26 119.05 2fss n ASN 119 Ca 0.02 0.00 -0.11 0.00 -0.02 0.00 0.00 54.58 54.47 2fss n ASN 119 Cb 0.33 1.83 -0.01 0.00 -2.36 0.00 0.00 39.78 39.56 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 1.28 -0.44 3.53 -1.51 -1.96 -2.08 116.25 115.06 2fss h VAL 120 Ca -0.01 -1.28 -0.10 0.00 -1.23 0.00 0.00 66.70 64.08 2fss h VAL 120 Cb 0.86 1.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.21 2fss h VAL 120 CO 0.00 0.43 -0.10 0.58 -1.23 0.00 0.00 177.57 177.25 2fss h VAL 121 N 0.68 1.27 -0.08 7.19 2.07 -1.86 -0.66 116.25 124.88 2fss h VAL 121 Ca 0.10 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.45 2fss h VAL 121 Cb 0.70 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 2fss h VAL 121 CO 0.05 0.41 -0.15 0.28 0.02 0.00 0.00 177.57 178.19 2fss h SER 122 N 0.68 -0.45 -0.40 0.57 0.02 -1.80 0.06 113.55 112.24 2fss h SER 122 Ca 0.11 0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 2fss h SER 122 Cb 0.64 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 2fss h SER 122 CO 0.04 -0.20 0.07 0.58 -1.14 0.00 0.00 176.83 176.18 2fss h VAL 123 N -0.21 1.24 -0.96 2.27 2.07 -1.28 -2.04 116.25 117.34 2fss h VAL 123 Ca 0.08 -0.85 0.04 0.00 0.82 0.00 0.00 66.70 66.78 2fss h VAL 123 Cb 0.31 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 2fss h VAL 123 CO -0.20 0.29 0.63 0.00 0.02 0.00 0.00 177.57 178.31 2fss h ALA 124 N 0.93 1.39 -0.63 1.67 0.00 -0.79 -0.59 119.26 121.24 2fss h ALA 124 Ca 0.12 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2fss h ALA 124 Cb 0.36 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2fss h ALA 124 CO 0.01 0.51 0.14 0.93 0.00 0.00 0.00 179.25 180.84 2fss h GLU 125 N 1.19 1.01 -0.75 0.00 5.08 -0.83 -2.15 114.58 118.14 2fss h GLU 125 Ca 0.38 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 2fss h GLU 125 Cb 0.03 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2fss h GLU 125 CO -0.12 0.92 0.28 1.25 -1.00 0.00 0.00 179.01 180.35 2fss h HIS 126 N 0.93 1.15 0.24 4.33 2.76 -0.51 0.33 115.15 124.38 2fss h HIS 126 Ca 0.20 -0.09 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 2fss h HIS 126 Cb 0.37 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 28.99 2fss h HIS 126 CO 0.03 0.89 -0.11 0.28 -1.30 0.00 0.00 177.93 177.71 2fss h VAL 127 N 1.08 0.77 -0.66 5.26 2.07 -0.97 0.32 116.25 124.12 2fss h VAL 127 Ca 0.25 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.76 2fss h VAL 127 Cb 0.24 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2fss h VAL 127 CO -0.02 0.00 0.41 0.58 0.02 0.00 0.00 177.57 178.56 2fss h VAL 128 N -0.32 1.19 -0.55 2.57 2.07 -1.07 0.13 116.25 120.27 2fss h VAL 128 Ca -0.03 -0.40 0.08 0.00 0.82 0.00 0.00 66.70 67.17 2fss h VAL 128 Cb 0.25 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 30.21 2fss h VAL 128 CO 0.05 0.19 0.18 -0.03 0.02 0.00 0.00 177.57 177.98 2fss h MET 129 N 0.90 0.34 -0.35 1.57 -1.53 -0.89 0.19 114.93 115.16 2fss h MET 129 Ca 0.24 -0.02 -0.14 0.00 -3.44 0.00 0.00 59.70 56.34 2fss h MET 129 Cb -0.04 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 30.92 2fss h MET 129 CO -0.05 0.22 -0.34 1.15 0.14 0.00 0.00 176.91 178.03 2fss h THR 130 N 0.35 1.28 -0.15 -0.77 2.02 -0.25 -0.38 112.91 115.01 2fss h THR 130 Ca 0.27 -1.51 0.03 0.00 0.77 0.00 0.00 66.41 65.97 2fss h THR 130 Cb 0.33 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2fss h THR 130 CO -0.29 0.50 -0.01 0.24 0.37 0.00 0.00 175.52 176.33 2fss h MET 131 N 0.66 0.04 -0.31 6.66 2.86 -0.24 -1.40 114.93 123.21 2fss h MET 131 Ca 0.07 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2fss h MET 131 Cb 0.89 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 2fss h MET 131 CO 0.08 0.03 0.15 -0.07 1.06 0.00 0.00 176.91 178.16 2fss h LEU 132 N 0.04 0.40 -0.32 1.22 3.38 -0.53 -1.21 115.31 118.29 2fss h LEU 132 Ca 0.07 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.96 2fss h LEU 132 Cb 0.09 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2fss h LEU 132 CO -0.13 0.41 0.08 0.58 0.09 0.00 0.00 178.44 179.47 2fss h VAL 133 N 0.36 0.87 0.57 1.22 2.07 -0.92 -0.54 116.25 119.89 2fss h VAL 133 Ca 0.11 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 2fss h VAL 133 Cb 0.11 0.65 0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2fss h VAL 133 CO -0.01 0.04 -0.27 -0.07 0.02 0.00 0.00 177.57 177.27 2fss h LEU 134 N 0.20 -0.65 -0.79 2.57 3.38 -1.15 -1.51 115.31 117.36 2fss h LEU 134 Ca 0.15 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2fss h LEU 134 Cb 0.15 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 2fss h LEU 134 CO -0.18 -0.39 0.52 0.58 0.09 0.00 0.00 178.44 179.06 2fss h VAL 135 N -0.88 1.19 -0.01 1.22 2.07 -1.14 -2.53 116.25 116.17 2fss h VAL 135 Ca -0.08 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2fss h VAL 135 Cb 0.63 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2fss h VAL 135 CO 0.13 0.19 -0.03 0.54 0.02 0.00 0.00 177.57 178.43 2fss n ARG 136 N -4.55 1.36 -3.19 1.57 1.74 -0.22 -1.09 116.66 112.29 2fss n ARG 136 Ca 0.08 -0.63 -0.21 0.00 -0.77 0.00 0.00 57.85 56.33 2fss n ARG 136 Cb 0.03 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.03 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 -0.27 -5.79 -0.21 0.55 4.05 -0.81 -4.69 115.26 108.09 2fss n ASN 137 Ca 0.19 -0.36 -0.08 0.00 0.45 0.00 0.00 54.58 54.79 2fss n ASN 137 Cb 0.29 -4.52 0.03 0.00 1.23 0.00 0.00 39.78 36.81 2fss n ASN 137 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 2fss h PHE 138 N -1.79 0.89 0.24 1.20 3.57 -1.58 -3.20 116.94 116.26 2fss h PHE 138 Ca -0.49 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 60.95 2fss h PHE 138 Cb 1.33 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 2fss h PHE 138 CO 0.46 0.71 -0.24 0.28 -2.23 0.00 0.00 178.31 177.29 2fss h VAL 139 N 0.80 0.49 0.00 1.41 2.07 -1.92 0.76 116.25 119.86 2fss h VAL 139 Ca 0.19 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.68 2fss h VAL 139 Cb 0.20 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2fss h VAL 139 CO -0.02 0.00 -0.18 1.55 0.02 0.00 0.00 177.57 178.94 2fss h PRO 140 N -0.50 0.00 0.10 1.57 0.13 -1.93 -1.11 132.00 130.26 2fss h PRO 140 Ca -0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2fss h PRO 140 Cb 0.47 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.60 2fss h PRO 140 CO -0.05 0.18 -0.05 0.00 -0.23 0.00 0.00 178.00 177.85 2fss h ALA 141 N 1.82 -0.14 -0.88 -0.56 0.00 -1.35 -1.63 119.26 116.52 2fss h ALA 141 Ca -0.00 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2fss h ALA 141 Cb 0.48 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2fss h ALA 141 CO 0.02 -0.39 0.58 1.25 0.00 0.00 0.00 179.25 180.71 2fss h HIS 142 N -0.51 1.09 -0.89 0.00 -0.00 -0.66 -2.57 115.15 111.60 2fss h HIS 142 Ca -0.01 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.42 2fss h HIS 142 Cb 0.42 -0.37 -0.06 0.00 -0.00 0.00 0.00 27.41 27.40 2fss h HIS 142 CO 0.04 0.67 0.57 1.49 -0.00 0.00 0.00 177.93 180.70 2fss h GLU 143 N 1.16 1.06 -0.79 5.26 4.57 -1.08 -2.10 114.58 122.66 2fss h GLU 143 Ca 0.33 -0.06 0.10 0.00 -1.18 0.00 0.00 59.36 58.55 2fss h GLU 143 Cb -0.08 -0.24 -0.07 0.00 -0.16 0.00 0.00 28.75 28.19 2fss h GLU 143 CO -0.08 0.70 0.44 1.96 -1.18 0.00 0.00 179.01 180.85 2fss h GLN 144 N 1.10 0.70 0.08 1.92 4.20 -0.88 -1.78 115.11 120.45 2fss h GLN 144 Ca 0.36 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 59.03 2fss h GLN 144 Cb 0.04 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.67 2fss h GLN 144 CO -0.13 0.46 -0.04 0.82 -0.67 0.00 0.00 178.83 179.27 2fss h ILE 145 N 0.72 1.07 0.00 2.54 1.08 -1.31 0.22 117.51 121.84 2fss h ILE 145 Ca 0.39 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 2fss h ILE 145 Cb 0.39 1.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.58 2fss h ILE 145 CO -0.26 0.14 0.00 0.16 -0.69 0.00 0.00 178.15 177.50 2fss h ILE 146 N -0.37 0.00 -0.01 -0.67 3.07 -1.41 -2.29 117.51 115.84 2fss h ILE 146 Ca -0.01 -0.64 0.00 0.00 1.55 0.00 0.00 64.86 65.76 2fss h ILE 146 Cb 0.32 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.49 2fss h ILE 146 CO 0.02 0.00 -0.11 0.59 -1.05 0.00 0.00 178.15 177.60 2fss n ASN 147 N -3.03 0.66 -0.48 2.16 4.13 -0.68 -4.94 115.26 113.08 2fss n ASN 147 Ca 0.02 -0.80 -0.04 0.00 1.68 0.00 0.00 54.58 55.44 2fss n ASN 147 Cb 0.37 -0.02 -0.00 0.00 -1.54 0.00 0.00 39.78 38.58 2fss n ASN 147 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2fss n HIS 148 N -0.75 -0.19 -3.68 3.10 8.25 -0.86 -5.05 115.22 116.05 2fss n HIS 148 Ca 0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.40 2fss n HIS 148 Cb 0.28 -1.57 -0.03 0.00 1.12 0.00 0.00 29.99 29.79 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 -2.82 4.89 -0.29 0.41 1.01 0.73 -5.03 116.67 115.57 2fss s ASP 149 Ca 0.00 -0.87 0.03 0.00 0.71 0.00 0.00 52.55 52.42 2fss s ASP 149 Cb 0.00 -0.41 0.20 0.00 1.01 0.00 0.00 42.92 43.72 2fss s ASP 149 CO 0.00 -0.71 0.62 0.86 0.21 0.00 0.00 175.17 176.15 2fss s TRP 150 N -2.54 -1.72 -0.42 4.23 -0.11 -1.26 -4.27 118.94 112.85 2fss s TRP 150 Ca 0.46 1.24 0.05 0.00 1.22 0.00 0.00 56.10 59.06 2fss s TRP 150 Cb -0.02 0.38 0.17 0.00 -1.50 0.00 0.00 33.47 32.50 2fss s TRP 150 CO 0.26 -0.98 0.47 -2.00 -4.62 0.00 0.00 176.95 170.08 2fss s GLU 151 N 2.85 0.82 0.18 5.86 -6.30 -1.26 -5.03 118.70 115.81 2fss s GLU 151 Ca 0.14 -1.15 -0.13 0.00 -2.50 0.00 0.00 54.97 51.33 2fss s GLU 151 Cb -0.11 -0.66 0.09 0.00 0.00 0.00 0.00 34.13 33.45 2fss s GLU 151 CO -0.24 -1.27 1.83 0.28 0.02 0.00 0.00 175.26 175.88 2fss h VAL 152 N 4.92 1.17 -0.50 3.70 2.07 -2.01 -2.56 116.25 123.05 2fss h VAL 152 Ca 0.10 -0.36 0.09 0.00 0.82 0.00 0.00 66.70 67.35 2fss h VAL 152 Cb 1.05 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 2fss h VAL 152 CO 0.18 0.17 0.34 0.00 0.02 0.00 0.00 177.57 178.29 2fss h ALA 153 N 1.20 2.09 0.00 1.67 0.00 -1.98 0.91 119.26 123.15 2fss h ALA 153 Ca 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2fss h ALA 153 Cb -0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2fss h ALA 153 CO -0.04 -0.20 -0.16 0.00 0.00 0.00 0.00 179.25 178.84 2fss h ALA 154 N 1.75 1.13 0.00 0.00 0.00 -1.90 -2.55 119.26 117.68 2fss h ALA 154 Ca 0.23 -0.15 -0.27 0.00 0.00 0.00 0.00 54.91 54.72 2fss h ALA 154 Cb 0.53 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2fss h ALA 154 CO -0.05 0.20 -1.63 -0.89 0.00 0.00 0.00 179.25 176.88 2fss n ILE 155 N -3.47 1.52 0.05 0.00 2.08 -0.20 -4.47 119.36 114.87 2fss n ILE 155 Ca -0.01 -0.12 0.18 0.00 0.56 0.00 0.00 62.75 63.37 2fss n ILE 155 Cb 0.33 -2.05 0.69 0.00 -0.75 0.00 0.00 39.64 37.86 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 -0.78 2.38 0.00 -1.39 0.00 -0.91 -1.67 119.26 116.89 2fss h ALA 156 Ca -0.41 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2fss h ALA 156 Cb 1.30 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2fss h ALA 156 CO -0.25 -0.54 0.00 1.57 0.00 0.00 0.00 179.25 180.03 2fss h LYS 157 N 0.00 0.00 0.00 0.00 2.10 -1.68 -2.54 116.57 114.45 2fss h LYS 157 Ca 0.21 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.81 2fss h LYS 157 Cb 0.85 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 32.07 2fss h LYS 157 CO -0.00 0.00 -0.56 -3.47 -2.00 0.00 0.00 179.45 173.42 2fss n ASP 158 N -2.67 1.46 -4.40 7.07 2.03 -0.64 -5.05 116.55 114.34 2fss n ASP 158 Ca 0.00 -3.06 -0.33 0.00 0.52 0.00 0.00 54.79 51.92 2fss n ASP 158 Cb 0.19 -0.42 -0.14 0.00 -0.72 0.00 0.00 41.12 40.04 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 -1.98 2.75 0.32 -1.67 0.00 -0.96 -4.45 121.76 115.77 2fss s ALA 159 Ca 0.32 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.44 2fss s ALA 159 Cb 0.32 -1.35 -0.06 0.00 0.00 0.00 0.00 23.12 22.02 2fss s ALA 159 CO -0.07 0.18 0.00 0.71 0.00 0.00 0.00 175.76 176.58 2fss s TYR 160 N 0.44 2.05 0.44 0.00 2.02 -0.25 -4.97 117.35 117.08 2fss s TYR 160 Ca -0.08 -0.80 -0.04 0.00 -0.37 0.00 0.00 57.07 55.79 2fss s TYR 160 Cb -0.15 -1.29 -0.04 0.00 -0.40 0.00 0.00 41.96 40.08 2fss s TYR 160 CO 0.04 0.20 0.71 -0.51 -1.57 0.00 0.00 175.55 174.42 2fss s ASP 161 N -3.51 6.28 0.11 2.29 1.01 -1.26 -3.88 116.67 117.72 2fss s ASP 161 Ca 0.33 0.80 0.09 0.00 0.71 0.00 0.00 52.55 54.48 2fss s ASP 161 Cb 0.07 -2.19 -0.18 0.00 1.01 0.00 0.00 42.92 41.63 2fss s ASP 161 CO 0.14 -0.49 1.21 -0.29 0.21 0.00 0.00 175.17 175.96 2fss h ILE 162 N 0.42 1.50 -2.84 0.77 2.10 -1.93 -3.45 117.51 114.07 2fss h ILE 162 Ca -0.48 -3.19 -0.59 0.00 1.08 0.00 0.00 64.86 61.69 2fss h ILE 162 Cb 1.21 2.74 0.11 0.00 -1.09 0.00 0.00 36.82 39.78 2fss h ILE 162 CO 0.62 0.85 0.36 1.21 -1.08 0.00 0.00 178.15 180.11 2fss n GLU 163 N -3.29 1.77 -0.98 2.19 2.13 -1.23 -2.31 120.64 118.92 2fss n GLU 163 Ca -0.02 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.42 2fss n GLU 163 Cb 0.93 -2.13 0.00 0.00 0.27 0.00 0.00 31.44 30.52 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 1.17 0.48 3.88 8.31 0.00 0.06 -4.87 105.19 114.23 2fss n GLY 164 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.32 3.76 -0.19 1.61 -0.14 -0.98 -4.14 119.74 119.34 2fss s LYS 165 Ca 0.00 0.18 -0.19 0.00 -1.36 0.00 0.00 55.97 54.60 2fss s LYS 165 Cb 0.00 -2.70 -0.03 0.00 -1.68 0.00 0.00 37.83 33.42 2fss s LYS 165 CO 0.00 0.35 0.56 0.99 -0.76 0.00 0.00 175.35 176.50 2fss s THR 166 N -1.78 5.08 -0.12 2.17 2.01 -1.26 -0.12 115.64 121.62 2fss s THR 166 Ca 0.46 1.06 0.02 0.00 0.31 0.00 0.00 61.69 63.53 2fss s THR 166 Cb -0.11 -3.88 0.02 0.00 0.01 0.00 0.00 72.50 68.53 2fss s THR 166 CO 0.22 0.17 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.53 2fss s ILE 167 N 1.61 1.57 -0.03 1.82 1.01 -0.74 -0.28 121.20 126.16 2fss s ILE 167 Ca 0.26 -0.68 0.07 0.00 0.00 0.00 0.00 60.65 60.31 2fss s ILE 167 Cb -0.16 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 2fss s ILE 167 CO 0.10 0.46 -0.25 0.00 0.00 0.00 0.00 174.94 175.25 2fss s ALA 168 N 1.04 2.21 -0.09 9.38 0.00 -0.33 -1.32 121.76 132.66 2fss s ALA 168 Ca -0.05 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2fss s ALA 168 Cb -0.15 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2fss s ALA 168 CO -0.03 0.52 -0.07 -0.08 0.00 0.00 0.00 175.76 176.10 2fss s THR 169 N -0.57 3.67 -0.56 0.00 -1.32 -0.67 -1.16 115.64 115.04 2fss s THR 169 Ca 0.08 -0.48 -0.18 0.00 -1.21 0.00 0.00 61.69 59.90 2fss s THR 169 Cb -0.11 -2.52 0.10 0.00 -1.51 0.00 0.00 72.50 68.47 2fss s THR 169 CO -0.00 0.58 0.63 -0.63 -2.21 0.00 0.00 174.62 172.98 2fss s ILE 170 N -0.54 4.94 0.00 5.08 1.01 -0.08 -1.35 121.20 130.26 2fss s ILE 170 Ca 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.73 2fss s ILE 170 Cb -0.12 -4.40 0.00 0.00 0.01 0.00 0.00 42.46 37.95 2fss s ILE 170 CO 0.02 -0.98 0.00 0.61 0.00 0.00 0.00 174.94 174.59 2fss n GLY 171 N 5.25 1.60 1.99 6.18 0.00 0.26 0.52 105.19 121.00 2fss n GLY 171 Ca -0.10 -1.27 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 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 2.85 4.45 -1.00 4.61 0.00 -1.26 -4.44 120.51 125.72 2fss n ALA 172 Ca 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 53.44 49.89 2fss n ALA 172 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.03 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 -0.71 -0.25 0.29 0.00 0.00 -1.26 -4.17 105.19 99.09 2fss n GLY 173 Ca 0.35 -1.43 -0.01 0.00 0.00 0.00 0.00 46.02 44.94 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 0.81 0.04 1.61 3.08 -1.96 -1.18 114.38 116.77 2fss h ARG 174 Ca 0.00 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 2fss h ARG 174 Cb 0.00 -0.18 0.01 0.00 0.08 0.00 0.00 29.97 29.87 2fss h ARG 174 CO 0.00 0.53 -0.22 0.82 -1.07 0.00 0.00 179.97 180.03 2fss h ILE 175 N 0.83 1.71 -0.95 2.04 2.04 -1.91 -3.08 117.51 118.19 2fss h ILE 175 Ca 0.33 -2.36 0.08 0.00 1.00 0.00 0.00 64.86 63.91 2fss h ILE 175 Cb 0.16 3.30 -0.07 0.00 -0.74 0.00 0.00 36.82 39.47 2fss h ILE 175 CO -0.17 0.63 0.60 1.23 0.00 0.00 0.00 178.15 180.44 2fss h GLY 176 N -0.80 1.47 0.95 5.37 0.00 -1.75 -0.60 103.07 107.70 2fss h GLY 176 Ca -0.04 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 46.80 2fss h GLY 176 CO 0.04 0.25 -0.05 -1.82 0.00 0.00 0.00 176.54 174.97 2fss h TYR 177 N 1.04 0.79 0.00 5.60 3.20 -1.35 -1.76 116.97 124.49 2fss h TYR 177 Ca 0.43 -0.15 -0.05 0.00 3.14 0.00 0.00 58.73 62.09 2fss h TYR 177 Cb 0.26 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2fss h TYR 177 CO -0.02 0.83 -0.26 0.00 -1.64 0.00 0.00 178.16 177.07 2fss h ARG 178 N 0.53 0.00 0.27 1.82 3.08 -1.28 -0.56 114.38 118.23 2fss h ARG 178 Ca 0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 2fss h ARG 178 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2fss h ARG 178 CO 0.03 0.26 -0.13 0.28 -1.07 0.00 0.00 179.97 179.34 2fss h VAL 179 N 0.00 0.78 -0.65 2.04 2.07 -0.93 -2.58 116.25 116.98 2fss h VAL 179 Ca -0.00 -0.43 0.13 0.00 0.82 0.00 0.00 66.70 67.22 2fss h VAL 179 Cb 0.58 1.02 -0.10 0.00 -1.52 0.00 0.00 31.29 31.27 2fss h VAL 179 CO 0.03 0.09 0.13 -0.07 0.02 0.00 0.00 177.57 177.77 2fss h LEU 180 N -0.58 -0.03 -0.97 2.57 3.38 -0.87 -1.07 115.31 117.73 2fss h LEU 180 Ca -0.04 0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2fss h LEU 180 Cb 0.42 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 2fss h LEU 180 CO 0.06 -0.02 0.64 -0.33 0.09 0.00 0.00 178.44 178.88 2fss h GLU 181 N 0.25 1.22 0.00 1.13 5.08 -1.08 -1.55 114.58 119.63 2fss h GLU 181 Ca 0.35 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.60 2fss h GLU 181 Cb 0.56 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2fss h GLU 181 CO -0.46 0.81 -0.18 0.00 -1.00 0.00 0.00 179.01 178.18 2fss h ARG 182 N 1.26 0.00 0.00 2.33 3.08 -0.90 -3.12 114.38 117.03 2fss h ARG 182 Ca 0.38 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.32 2fss h ARG 182 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2fss h ARG 182 CO -0.11 0.18 -0.51 -0.07 -1.07 0.00 0.00 179.97 178.39 2fss h LEU 183 N 0.00 0.00 -0.46 3.04 3.38 -0.22 -3.40 115.31 117.66 2fss h LEU 183 Ca -0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2fss h LEU 183 Cb 0.87 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.53 2fss h LEU 183 CO 0.02 0.49 -0.46 0.58 0.09 0.00 0.00 178.44 179.15 2fss h VAL 184 N 0.00 0.08 0.00 1.22 2.07 -1.40 -1.20 116.25 117.02 2fss h VAL 184 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2fss h VAL 184 Cb 1.38 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2fss h VAL 184 CO 0.06 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.84 2fss n PRO 185 N -5.40 0.27 0.00 1.57 -0.04 -1.26 -1.99 135.00 128.14 2fss n PRO 185 Ca -0.01 0.11 0.15 0.00 -0.04 0.00 0.00 63.50 63.71 2fss n PRO 185 Cb 0.35 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.05 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 -1.19 0.00 -3.52 0.54 3.72 -0.45 -4.96 117.46 111.60 2fss n PHE 186 Ca 0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.26 2fss n PHE 186 Cb 0.09 -0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.68 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 -0.43 -4.07 -4.72 4.37 5.15 -0.84 -3.55 115.26 111.16 2fss n ASN 187 Ca 0.21 -0.81 -0.30 0.00 -0.60 0.00 0.00 54.58 53.08 2fss n ASN 187 Cb 0.23 -4.39 0.13 0.00 -0.53 0.00 0.00 39.78 35.22 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 -5.39 1.52 0.18 1.20 0.04 -1.26 -0.76 135.00 130.52 2fss s PRO 188 Ca 0.27 1.01 -0.14 0.00 0.04 0.00 0.00 61.00 62.18 2fss s PRO 188 Cb -0.06 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.73 2fss s PRO 188 CO 0.79 -2.11 1.83 -0.22 0.04 0.00 0.00 177.00 177.33 2fss h LYS 189 N -1.46 0.74 -1.83 4.56 3.64 -0.68 -3.41 116.57 118.12 2fss h LYS 189 Ca -0.47 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 2fss h LYS 189 Cb 1.27 -0.16 -0.21 0.00 -0.41 0.00 0.00 32.23 32.72 2fss h LYS 189 CO 0.52 0.51 0.32 -2.00 -2.27 0.00 0.00 179.45 176.53 2fss s GLU 190 N -6.08 0.87 -0.12 1.90 2.12 -1.23 -5.00 118.70 111.16 2fss s GLU 190 Ca -0.13 0.25 -0.02 0.00 0.36 0.00 0.00 54.97 55.43 2fss s GLU 190 Cb 0.12 0.41 -0.03 0.00 0.26 0.00 0.00 34.13 34.90 2fss s GLU 190 CO 0.75 -0.26 -0.05 -0.51 -0.54 0.00 0.00 175.26 174.65 2fss s LEU 191 N -1.08 3.22 0.11 2.70 1.43 -1.26 -1.79 118.68 122.01 2fss s LEU 191 Ca -0.07 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 2fss s LEU 191 Cb -0.00 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 2fss s LEU 191 CO 0.06 0.24 -0.11 -0.76 0.23 0.00 0.00 176.35 176.02 2fss s LEU 192 N -0.10 2.44 0.02 1.79 1.43 -0.43 -1.58 118.68 122.25 2fss s LEU 192 Ca 0.02 -0.87 -0.07 0.00 -1.03 0.00 0.00 54.13 52.18 2fss s LEU 192 Cb -0.13 -0.36 -0.00 0.00 0.03 0.00 0.00 46.19 45.73 2fss s LEU 192 CO 0.03 -0.26 0.13 -0.72 0.23 0.00 0.00 176.35 175.75 2fss s TYR 193 N -2.63 0.10 -0.13 0.29 -0.85 -0.76 -1.66 117.35 111.70 2fss s TYR 193 Ca 0.09 -0.27 -0.02 0.00 -0.52 0.00 0.00 57.07 56.35 2fss s TYR 193 Cb -0.02 -0.08 -0.03 0.00 0.38 0.00 0.00 41.96 42.22 2fss s TYR 193 CO 0.01 -0.32 -0.05 -0.47 -1.52 0.00 0.00 175.55 173.19 2fss s TYR 194 N -1.87 2.99 0.18 -3.49 5.04 -0.46 -0.94 117.35 118.80 2fss s TYR 194 Ca -0.11 -0.25 -0.19 0.00 -2.44 0.00 0.00 57.07 54.08 2fss s TYR 194 Cb -0.05 -1.89 0.04 0.00 0.35 0.00 0.00 41.96 40.41 2fss s TYR 194 CO -0.01 0.04 0.55 0.34 -1.34 0.00 0.00 175.55 175.13 2fss s ASP 195 N 0.08 -0.35 0.29 4.32 -1.08 -1.26 -0.57 116.67 118.09 2fss s ASP 195 Ca -0.01 -0.32 0.26 0.00 -0.52 0.00 0.00 52.55 51.96 2fss s ASP 195 Cb -0.14 0.58 0.90 0.00 -1.46 0.00 0.00 42.92 42.81 2fss s ASP 195 CO 0.03 -1.02 1.76 1.88 0.52 0.00 0.00 175.17 178.34 2fss h TYR 196 N 2.14 0.00 -3.93 -5.34 0.05 -1.99 -3.44 116.97 104.47 2fss h TYR 196 Ca -0.30 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.24 2fss h TYR 196 Cb 1.27 0.00 -0.18 0.00 1.01 0.00 0.00 36.73 38.83 2fss h TYR 196 CO 0.32 0.00 -0.71 1.14 -1.05 0.00 0.00 178.16 177.85 2fss s GLN 197 N -3.27 0.65 0.45 4.88 -2.07 -1.26 -5.15 119.66 113.89 2fss s GLN 197 Ca 0.07 -1.02 -0.20 0.00 -1.82 0.00 0.00 55.36 52.38 2fss s GLN 197 Cb 0.10 -0.19 -0.10 0.00 -1.09 0.00 0.00 33.01 31.72 2fss s GLN 197 CO 0.51 0.00 0.97 0.00 -1.32 0.00 0.00 175.29 175.46 2fss s ALA 198 N -2.50 3.01 0.46 2.60 0.00 -1.26 -4.99 121.76 119.07 2fss s ALA 198 Ca -0.00 0.41 -0.22 0.00 0.00 0.00 0.00 51.96 52.15 2fss s ALA 198 Cb -0.02 -3.16 -0.08 0.00 0.00 0.00 0.00 23.12 19.85 2fss s ALA 198 CO -0.03 -0.01 1.09 -0.51 0.00 0.00 0.00 175.76 176.30 2fss s LEU 199 N -3.37 3.97 0.80 0.00 1.43 -1.26 -5.02 118.68 115.24 2fss s LEU 199 Ca 0.63 2.09 -0.14 0.00 -1.03 0.00 0.00 54.13 55.68 2fss s LEU 199 Cb -0.10 -4.36 0.07 0.00 0.03 0.00 0.00 46.19 41.83 2fss s LEU 199 CO 0.17 -0.78 1.14 -2.65 0.23 0.00 0.00 176.35 174.46 2fss n PRO 200 N -0.59 0.20 0.15 1.29 -0.02 -1.26 -4.69 135.00 130.08 2fss n PRO 200 Ca 0.08 0.14 0.04 0.00 -2.02 0.00 0.00 63.50 61.74 2fss n PRO 200 Cb 0.50 -2.38 0.46 0.00 -0.02 0.00 0.00 33.50 32.06 2fss n PRO 200 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2fss h LYS 201 N -0.85 0.19 -0.59 -0.52 1.79 -1.98 0.75 116.57 115.36 2fss h LYS 201 Ca -0.46 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 57.88 2fss h LYS 201 Cb 1.30 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.90 2fss h LYS 201 CO 0.45 0.26 -0.02 -0.44 -1.08 0.00 0.00 179.45 178.63 2fss h ASP 202 N 0.18 1.04 -0.28 0.86 5.19 -1.99 -0.66 116.42 120.76 2fss h ASP 202 Ca 0.04 -0.31 -0.10 0.00 -0.62 0.00 0.00 57.03 56.04 2fss h ASP 202 Cb 0.23 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 2fss h ASP 202 CO 0.01 1.10 -0.21 0.00 -3.12 0.00 0.00 179.24 177.02 2fss h ALA 203 N 0.97 0.40 -0.42 3.45 0.00 -1.72 -1.58 119.26 120.36 2fss h ALA 203 Ca 0.16 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.77 2fss h ALA 203 Cb 0.58 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 2fss h ALA 203 CO 0.03 0.35 0.12 0.93 0.00 0.00 0.00 179.25 180.68 2fss h GLU 204 N 0.37 0.26 -0.01 0.00 5.08 -0.80 -3.04 114.58 116.44 2fss h GLU 204 Ca 0.05 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.23 2fss h GLU 204 Cb 0.75 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 2fss h GLU 204 CO 0.06 0.17 -0.76 0.93 -1.00 0.00 0.00 179.01 178.41 2fss h GLU 205 N 0.27 0.06 -0.99 2.33 5.08 -1.11 0.28 114.58 120.50 2fss h GLU 205 Ca 0.20 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.64 2fss h GLU 205 Cb 0.22 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.39 2fss h GLU 205 CO -0.23 0.79 0.60 -0.22 -1.00 0.00 0.00 179.01 178.95 2fss h LYS 206 N 0.04 0.86 -0.05 2.33 3.64 -1.16 -2.48 116.57 119.75 2fss h LYS 206 Ca -0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2fss h LYS 206 Cb 1.33 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2fss h LYS 206 CO 0.10 0.57 0.00 1.33 -2.27 0.00 0.00 179.45 179.18 2fss n VAL 207 N -4.69 0.05 -2.64 2.00 0.24 -1.15 -4.99 118.33 107.15 2fss n VAL 207 Ca 0.20 -0.53 -0.18 0.00 -2.04 0.00 0.00 64.34 61.80 2fss n VAL 207 Cb 0.43 1.32 0.01 0.00 -1.47 0.00 0.00 33.84 34.14 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 1.01 -0.30 3.80 7.63 0.00 -0.15 -4.80 105.19 112.38 2fss n GLY 208 Ca 0.11 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.96 3.53 -0.12 4.61 0.00 0.80 -4.18 121.76 123.43 2fss s ALA 209 Ca 0.14 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.24 2fss s ALA 209 Cb -0.06 -2.74 -0.01 0.00 0.00 0.00 0.00 23.12 20.31 2fss s ALA 209 CO 0.17 0.37 -0.17 0.50 0.00 0.00 0.00 175.76 176.63 2fss s ARG 210 N -1.31 3.23 0.10 0.00 3.52 -0.61 -4.65 118.95 119.24 2fss s ARG 210 Ca 0.33 -0.75 -0.30 0.00 -0.13 0.00 0.00 55.73 54.88 2fss s ARG 210 Cb -0.20 -2.51 -0.06 0.00 -1.56 0.00 0.00 34.95 30.62 2fss s ARG 210 CO 0.21 0.22 1.15 0.50 -0.81 0.00 0.00 175.30 176.58 2fss s ARG 211 N 0.29 4.49 -0.18 5.12 3.52 -1.26 -1.83 118.95 129.10 2fss s ARG 211 Ca -0.12 1.73 -0.03 0.00 -0.13 0.00 0.00 55.73 57.18 2fss s ARG 211 Cb -0.16 -3.33 -0.02 0.00 -1.56 0.00 0.00 34.95 29.88 2fss s ARG 211 CO 0.06 -0.13 -0.06 0.08 -0.81 0.00 0.00 175.30 174.45 2fss s VAL 212 N 0.58 3.49 -0.20 7.11 1.01 -0.12 -4.92 120.40 127.35 2fss s VAL 212 Ca 0.55 -0.48 0.29 0.00 0.00 0.00 0.00 61.98 62.34 2fss s VAL 212 Cb -0.29 -2.55 0.33 0.00 0.00 0.00 0.00 36.38 33.87 2fss s VAL 212 CO 0.31 0.46 1.85 -0.33 0.00 0.00 0.00 175.10 177.39 2fss h GLU 213 N 7.38 0.00 -4.06 2.72 4.39 -1.96 -3.40 114.58 119.65 2fss h GLU 213 Ca -0.35 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.21 2fss h GLU 213 Cb 1.18 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.65 2fss h GLU 213 CO 0.60 0.00 -0.67 0.54 -1.16 0.00 0.00 179.01 178.32 2fss s ASN 214 N -5.11 0.34 0.35 1.42 2.20 -1.26 -4.97 114.94 107.90 2fss s ASN 214 Ca 0.03 -0.72 0.09 0.00 -0.94 0.00 0.00 52.86 51.33 2fss s ASN 214 Cb 0.09 0.16 0.66 0.00 -2.00 0.00 0.00 41.25 40.16 2fss s ASN 214 CO 0.50 -0.46 1.83 0.40 -2.94 0.00 0.00 177.10 176.43 2fss h ILE 215 N 3.87 1.24 -0.29 0.54 2.04 -2.00 -2.06 117.51 120.86 2fss h ILE 215 Ca -0.33 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 2fss h ILE 215 Cb 1.18 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 2fss h ILE 215 CO 0.53 0.34 0.15 -0.33 0.00 0.00 0.00 178.15 178.83 2fss h GLU 216 N 0.18 0.41 0.00 2.37 3.07 -1.97 -1.73 114.58 116.90 2fss h GLU 216 Ca 0.03 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2fss h GLU 216 Cb 0.57 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2fss h GLU 216 CO 0.04 0.37 0.00 0.93 -1.40 0.00 0.00 179.01 178.95 2fss h GLU 217 N 0.34 0.00 0.14 2.33 5.08 -1.91 -1.74 114.58 118.82 2fss h GLU 217 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2fss h GLU 217 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2fss h GLU 217 CO -0.01 0.00 -0.06 1.25 -1.00 0.00 0.00 179.01 179.18 2fss h LEU 218 N 0.00 -0.15 -0.52 1.33 5.85 -0.98 -3.35 115.31 117.49 2fss h LEU 218 Ca 0.00 -0.40 -0.14 0.00 0.84 0.00 0.00 57.88 58.18 2fss h LEU 218 Cb 0.70 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 2fss h LEU 218 CO 0.00 0.41 -0.67 -0.37 -0.34 0.00 0.00 178.44 177.47 2fss h VAL 219 N -0.82 1.37 -0.81 1.05 -1.51 -1.34 -3.08 116.25 111.11 2fss h VAL 219 Ca -0.02 -2.39 0.15 0.00 -1.23 0.00 0.00 66.70 63.21 2fss h VAL 219 Cb 0.54 2.33 -0.06 0.00 -2.13 0.00 0.00 31.29 31.97 2fss h VAL 219 CO 0.03 0.66 0.53 0.00 -1.23 0.00 0.00 177.57 177.56 2fss h ALA 220 N 1.33 2.00 -0.02 5.19 0.00 -1.35 -2.76 119.26 123.65 2fss h ALA 220 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fss h ALA 220 Cb 1.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2fss h ALA 220 CO 0.09 -0.21 -0.20 0.00 0.00 0.00 0.00 179.25 178.93 2fss n GLN 221 N -4.51 1.55 -3.40 0.00 10.64 -1.17 -3.89 117.38 116.60 2fss n GLN 221 Ca 0.15 -1.11 -0.37 0.00 -1.83 0.00 0.00 57.00 53.84 2fss n GLN 221 Cb 0.50 -1.30 -0.06 0.00 -0.86 0.00 0.00 30.24 28.52 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 -1.71 3.53 0.12 2.61 0.00 -1.07 -4.79 121.76 120.46 2fss s ALA 222 Ca 0.16 -0.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.76 2fss s ALA 222 Cb 0.14 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.61 2fss s ALA 222 CO 0.33 0.08 1.34 -0.44 0.00 0.00 0.00 175.76 177.07 2fss h ASP 223 N 6.46 0.85 -3.51 0.00 3.32 -0.98 -3.40 116.42 119.17 2fss h ASP 223 Ca -0.42 -0.55 -0.59 0.00 0.02 0.00 0.00 57.03 55.48 2fss h ASP 223 Cb 1.18 -0.25 -0.33 0.00 0.22 0.00 0.00 39.33 40.15 2fss h ASP 223 CO 0.74 1.34 -0.85 -0.63 -1.72 0.00 0.00 179.24 178.12 2fss s ILE 224 N -3.73 1.56 -0.07 0.35 1.01 -0.35 -1.50 121.20 118.47 2fss s ILE 224 Ca -0.09 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 59.87 2fss s ILE 224 Cb 0.09 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.18 2fss s ILE 224 CO 0.89 0.45 -0.23 -0.69 0.00 0.00 0.00 174.94 175.36 2fss s VAL 225 N 0.40 2.23 -0.01 2.92 1.01 -0.19 -1.19 120.40 125.57 2fss s VAL 225 Ca -0.14 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 60.91 2fss s VAL 225 Cb -0.16 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 2fss s VAL 225 CO 0.05 0.57 -0.19 0.28 0.00 0.00 0.00 175.10 175.81 2fss s THR 226 N -0.06 1.49 -0.30 3.92 -1.32 -0.31 -0.59 115.64 118.47 2fss s THR 226 Ca -0.06 -0.83 -0.09 0.00 -1.21 0.00 0.00 61.69 59.50 2fss s THR 226 Cb -0.15 -1.24 -0.01 0.00 -1.51 0.00 0.00 72.50 69.59 2fss s THR 226 CO 0.05 0.41 0.14 -0.69 -2.21 0.00 0.00 174.62 172.31 2fss s VAL 227 N -0.46 4.55 -0.45 5.08 1.01 -0.15 -0.90 120.40 129.08 2fss s VAL 227 Ca 0.07 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 61.78 2fss s VAL 227 Cb -0.07 -3.28 0.35 0.00 0.00 0.00 0.00 36.38 33.38 2fss s VAL 227 CO -0.01 0.12 0.84 0.59 0.00 0.00 0.00 175.10 176.64 2fss n ASN 228 N 4.97 2.40 -4.18 3.32 4.13 0.19 -3.89 115.26 122.19 2fss n ASN 228 Ca -0.14 -3.28 -0.17 0.00 1.68 0.00 0.00 54.58 52.66 2fss n ASN 228 Cb 0.50 -0.59 -0.11 0.00 -1.54 0.00 0.00 39.78 38.03 2fss n ASN 228 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2fss s ALA 229 N -2.90 1.21 0.57 5.41 0.00 -1.17 -4.27 121.76 120.60 2fss s ALA 229 Ca 0.43 -1.10 -0.17 0.00 0.00 0.00 0.00 51.96 51.12 2fss s ALA 229 Cb 0.33 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.34 2fss s ALA 229 CO -0.10 0.10 1.07 -1.25 0.00 0.00 0.00 175.76 175.58 2fss s PRO 230 N -2.17 3.37 -0.19 0.00 0.04 -1.26 -4.50 135.00 130.28 2fss s PRO 230 Ca 0.02 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 2fss s PRO 230 Cb -0.07 -2.03 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 2fss s PRO 230 CO 0.02 -0.79 1.12 -1.17 0.04 0.00 0.00 177.00 176.23 2fss s LEU 231 N -4.22 4.14 0.00 -3.56 2.96 -1.26 -4.77 118.68 111.98 2fss s LEU 231 Ca 0.66 1.52 -0.01 0.00 -0.22 0.00 0.00 54.13 56.07 2fss s LEU 231 Cb -0.18 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.98 2fss s LEU 231 CO 0.32 -0.69 0.13 0.00 -1.32 0.00 0.00 176.35 174.79 2fss n HIS 232 N 6.32 -0.88 0.14 5.38 1.44 -1.26 -4.99 115.22 121.37 2fss n HIS 232 Ca 0.12 -0.47 0.15 0.00 -2.01 0.00 0.00 57.72 55.52 2fss n HIS 232 Cb 0.46 0.15 0.71 0.00 0.12 0.00 0.00 29.99 31.42 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 1.71 2.17 0.00 1.59 0.00 -1.95 0.20 119.26 122.98 2fss h ALA 233 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2fss h ALA 233 Cb 0.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2fss h ALA 233 CO 0.08 -0.34 0.00 0.78 0.00 0.00 0.00 179.25 179.77 2fss h GLY 234 N 0.00 0.00 0.00 0.00 0.00 -1.96 -3.38 103.07 97.73 2fss h GLY 234 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 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 -2.91 0.00 -1.69 4.70 -2.24 -0.54 -4.79 114.28 106.81 2fss n THR 235 Ca 0.04 -0.14 -0.44 0.00 -2.27 0.00 0.00 64.05 61.25 2fss n THR 235 Cb 0.48 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 69.22 2fss n THR 235 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2fss n LYS 236 N -1.50 2.59 -1.78 -0.78 4.81 -0.05 -1.39 118.16 120.06 2fss n LYS 236 Ca -0.00 0.94 -0.14 0.00 -0.87 0.00 0.00 58.31 58.23 2fss n LYS 236 Cb 0.07 -2.80 -0.04 0.00 0.02 0.00 0.00 35.03 32.28 2fss n LYS 236 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fss n GLY 237 N 4.06 0.70 0.22 3.14 0.00 -0.13 -4.88 105.19 108.31 2fss n GLY 237 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.19 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 0.15 -7.86 0.99 5.85 0.26 -3.32 115.31 111.38 2fss h LEU 238 Ca -0.31 0.08 -0.71 0.00 0.84 0.00 0.00 57.88 57.77 2fss h LEU 238 Cb 1.05 0.07 -0.18 0.00 0.37 0.00 0.00 40.66 41.98 2fss h LEU 238 CO 0.42 0.10 1.07 -0.63 -0.34 0.00 0.00 178.44 179.07 2fss s ILE 239 N -6.11 4.86 0.49 4.05 -1.09 -0.13 -4.67 121.20 118.60 2fss s ILE 239 Ca -0.13 -2.05 0.03 0.00 -2.23 0.00 0.00 60.65 56.27 2fss s ILE 239 Cb 0.16 -4.84 -0.02 0.00 -1.58 0.00 0.00 42.46 36.18 2fss s ILE 239 CO 0.74 -1.56 0.09 0.54 -1.23 0.00 0.00 174.94 173.52 2fss s ASN 240 N 3.28 4.21 0.27 3.58 2.20 -1.25 -1.11 114.94 126.12 2fss s ASN 240 Ca 0.37 -1.49 -0.07 0.00 -0.94 0.00 0.00 52.86 50.73 2fss s ASN 240 Cb -0.04 0.29 0.48 0.00 -2.00 0.00 0.00 41.25 39.98 2fss s ASN 240 CO -0.05 -0.82 1.58 0.50 -2.94 0.00 0.00 177.10 175.37 2fss h LYS 241 N 1.31 0.01 0.51 3.55 3.64 -1.92 0.69 116.57 124.35 2fss h LYS 241 Ca -0.43 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.93 2fss h LYS 241 Cb 1.30 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2fss h LYS 241 CO 0.72 0.01 -0.24 1.49 -2.27 0.00 0.00 179.45 179.15 2fss h GLU 242 N 0.01 -0.66 -0.82 1.90 4.57 -1.96 -0.90 114.58 116.72 2fss h GLU 242 Ca 0.47 0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.67 2fss h GLU 242 Cb 0.79 0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 29.49 2fss h GLU 242 CO -0.92 -0.39 0.43 1.25 -1.18 0.00 0.00 179.01 178.20 2fss h LEU 243 N -0.79 1.05 -0.88 1.64 5.85 -1.74 -2.65 115.31 117.79 2fss h LEU 243 Ca -0.07 -0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.62 2fss h LEU 243 Cb 0.57 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.26 2fss h LEU 243 CO 0.11 0.86 0.53 -0.07 -0.34 0.00 0.00 178.44 179.54 2fss h LEU 244 N 1.15 0.80 -2.34 2.25 4.07 -0.71 0.40 115.31 120.94 2fss h LEU 244 Ca 0.29 0.03 0.02 0.00 0.08 0.00 0.00 57.88 58.31 2fss h LEU 244 Cb 0.06 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.67 2fss h LEU 244 CO -0.04 0.48 0.21 0.77 -1.08 0.00 0.00 178.44 178.77 2fss h SER 245 N 0.92 0.00 0.43 -0.43 4.64 -0.79 -1.29 113.55 117.04 2fss h SER 245 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2fss h SER 245 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2fss h SER 245 CO -0.22 0.00 -0.71 0.29 -0.87 0.00 0.00 176.83 175.32 2fss n LYS 246 N -3.29 0.09 -1.95 4.77 4.76 0.12 -4.92 118.16 117.74 2fss n LYS 246 Ca -0.01 0.01 -0.37 0.00 -2.87 0.00 0.00 58.31 55.07 2fss n LYS 246 Cb 0.29 -1.54 0.03 0.00 -1.84 0.00 0.00 35.03 31.98 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 -3.06 2.43 0.22 2.13 0.40 -0.49 -3.50 117.98 116.11 2fss s PHE 247 Ca 0.08 1.46 -0.31 0.00 -0.60 0.00 0.00 56.93 57.56 2fss s PHE 247 Cb 0.16 -3.61 -0.15 0.00 0.51 0.00 0.00 43.02 39.93 2fss s PHE 247 CO 0.75 -2.41 1.13 1.17 0.70 0.00 0.00 175.22 176.56 2fss n LYS 248 N -1.13 1.30 -2.20 0.44 4.81 -1.07 -4.88 118.16 115.44 2fss n LYS 248 Ca 0.11 0.46 -0.42 0.00 -0.87 0.00 0.00 58.31 57.59 2fss n LYS 248 Cb 0.47 -1.93 -0.03 0.00 0.02 0.00 0.00 35.03 33.57 2fss n LYS 248 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 2fss s LYS 249 N -0.77 4.35 0.00 1.64 -2.85 -1.26 -2.40 119.74 118.44 2fss s LYS 249 Ca 0.68 2.05 0.00 0.00 -1.00 0.00 0.00 55.97 57.70 2fss s LYS 249 Cb -0.78 -3.24 0.00 0.00 -2.06 0.00 0.00 37.83 31.75 2fss s LYS 249 CO 0.54 -0.37 0.00 0.41 0.10 0.00 0.00 175.35 176.03 2fss n GLY 250 N 3.15 0.44 3.78 0.59 0.00 -0.13 -4.99 105.19 108.01 2fss n GLY 250 Ca 0.10 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 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 2.38 -0.11 4.61 0.00 -1.01 -3.90 121.76 121.73 2fss s ALA 251 Ca 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 51.96 52.26 2fss s ALA 251 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2fss s ALA 251 CO 0.00 -1.55 -0.05 -1.58 0.00 0.00 0.00 175.76 172.58 2fss s TRP 252 N -2.78 2.99 -0.09 0.00 0.51 -0.56 -0.20 118.94 118.81 2fss s TRP 252 Ca 0.62 -0.11 0.03 0.00 -2.12 0.00 0.00 56.10 54.52 2fss s TRP 252 Cb -0.17 -1.82 0.01 0.00 -0.81 0.00 0.00 33.47 30.67 2fss s TRP 252 CO 0.52 0.18 -0.19 -1.17 -0.51 0.00 0.00 176.95 175.79 2fss s LEU 253 N -0.31 1.89 -0.12 2.99 2.96 -0.34 -1.02 118.68 124.73 2fss s LEU 253 Ca 0.05 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 53.53 2fss s LEU 253 Cb -0.12 -1.17 0.00 0.00 0.50 0.00 0.00 46.19 45.40 2fss s LEU 253 CO 0.02 0.09 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.23 2fss s VAL 254 N 0.56 2.13 -0.23 1.68 1.01 0.25 -1.53 120.40 124.26 2fss s VAL 254 Ca -0.15 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 2fss s VAL 254 Cb -0.17 -1.83 0.07 0.00 0.00 0.00 0.00 36.38 34.45 2fss s VAL 254 CO 0.05 0.55 0.01 0.21 0.00 0.00 0.00 175.10 175.93 2fss s ASN 255 N 0.57 3.52 -0.15 3.32 2.47 -0.45 -0.97 114.94 123.25 2fss s ASN 255 Ca -0.13 -1.14 0.17 0.00 0.42 0.00 0.00 52.86 52.19 2fss s ASN 255 Cb -0.17 -0.89 0.40 0.00 -1.45 0.00 0.00 41.25 39.14 2fss s ASN 255 CO 0.04 -0.30 1.28 0.35 -3.72 0.00 0.00 177.10 174.75 2fss n THR 256 N 4.85 2.06 0.00 -5.21 -2.24 -1.25 -3.13 114.28 109.35 2fss n THR 256 Ca -0.09 -2.03 0.00 0.00 -2.27 0.00 0.00 64.05 59.66 2fss n THR 256 Cb 0.45 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 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 -0.93 0.00 -3.33 6.98 0.00 -1.25 -4.88 120.51 117.10 2fss n ALA 257 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.49 2fss n ALA 257 Cb 0.76 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 20.06 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 0.25 0.00 1.81 -1.26 -4.95 118.95 114.84 2fss s ARG 258 Ca 0.00 0.16 -0.03 0.00 -1.72 0.00 0.00 55.73 54.14 2fss s ARG 258 Cb 0.00 -0.09 0.41 0.00 -0.45 0.00 0.00 34.95 34.82 2fss s ARG 258 CO 0.00 -0.08 1.83 0.78 -0.68 0.00 0.00 175.30 177.15 2fss h GLY 259 N 6.65 1.39 2.00 -3.53 0.00 -1.79 -2.60 103.07 105.18 2fss h GLY 259 Ca -0.34 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2fss h GLY 259 CO 0.47 0.19 0.00 0.00 0.00 0.00 0.00 176.54 177.20 2fss n ALA 260 N -2.36 1.60 0.24 3.60 0.00 -1.26 -1.64 120.51 120.69 2fss n ALA 260 Ca 0.15 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.66 2fss n ALA 260 Cb 0.26 -1.24 0.65 0.00 0.00 0.00 0.00 19.45 19.12 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 0.97 -2.87 0.00 2.04 -1.64 -0.31 117.51 115.69 2fss h ILE 261 Ca 0.00 0.00 -0.60 0.00 1.00 0.00 0.00 64.86 65.26 2fss h ILE 261 Cb 0.24 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2fss h ILE 261 CO 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 178.15 177.68 2fss s VAL 263 N -1.58 4.88 0.13 0.00 1.01 -0.27 -4.62 120.40 119.95 2fss s VAL 263 Ca 0.36 0.29 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 2fss s VAL 263 Cb -0.12 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2fss s VAL 263 CO 0.28 -0.45 1.58 0.00 0.00 0.00 0.00 175.10 176.51 2fss h ALA 264 N 8.68 -0.58 0.00 5.51 0.00 -1.88 -1.52 119.26 129.47 2fss h ALA 264 Ca -0.26 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2fss h ALA 264 Cb 1.11 0.82 -0.00 0.00 0.00 0.00 0.00 17.79 19.71 2fss h ALA 264 CO 0.85 -0.92 -0.15 1.49 0.00 0.00 0.00 179.25 180.52 2fss h GLU 265 N -0.47 0.00 -0.27 0.00 4.57 -1.98 -1.54 114.58 114.90 2fss h GLU 265 Ca 0.08 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.22 2fss h GLU 265 Cb 0.62 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 2fss h GLU 265 CO -0.43 0.15 -0.02 -0.44 -1.18 0.00 0.00 179.01 177.08 2fss h ASP 266 N 0.00 0.48 -0.24 1.04 3.32 -1.70 -0.81 116.42 118.52 2fss h ASP 266 Ca -0.00 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.72 2fss h ASP 266 Cb 0.55 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2fss h ASP 266 CO 0.02 0.70 0.14 0.58 -1.72 0.00 0.00 179.24 178.96 2fss h VAL 267 N 0.26 1.09 -0.37 -1.35 2.07 -0.86 -1.38 116.25 115.72 2fss h VAL 267 Ca 0.07 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.46 2fss h VAL 267 Cb 0.46 0.80 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 2fss h VAL 267 CO 0.02 0.08 0.01 0.00 0.02 0.00 0.00 177.57 177.71 2fss h ALA 268 N 1.05 0.34 -0.24 1.67 0.00 -1.24 -0.93 119.26 119.92 2fss h ALA 268 Ca 0.09 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.14 2fss h ALA 268 Cb 0.01 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 2fss h ALA 268 CO -0.02 -0.39 -0.08 0.00 0.00 0.00 0.00 179.25 178.77 2fss h ALA 269 N 1.31 0.13 -0.36 0.00 0.00 -0.96 -1.25 119.26 118.13 2fss h ALA 269 Ca 0.18 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 2fss h ALA 269 Cb 0.24 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2fss h ALA 269 CO -0.29 -0.49 0.08 0.00 0.00 0.00 0.00 179.25 178.56 2fss h ALA 270 N 1.20 1.48 -0.14 0.00 0.00 -0.77 -2.14 119.26 118.89 2fss h ALA 270 Ca 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2fss h ALA 270 Cb 0.21 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2fss h ALA 270 CO -0.26 0.39 -0.04 1.25 0.00 0.00 0.00 179.25 180.58 2fss h LEU 271 N 0.51 0.28 -1.58 0.00 5.85 -0.81 0.19 115.31 119.76 2fss h LEU 271 Ca 0.12 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2fss h LEU 271 Cb 0.21 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 2fss h LEU 271 CO -0.00 0.60 0.26 -0.33 -0.34 0.00 0.00 178.44 178.62 2fss h GLU 272 N -0.04 0.54 0.00 1.25 3.07 -0.98 -3.04 114.58 115.37 2fss h GLU 272 Ca 0.03 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2fss h GLU 272 Cb 0.48 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 2fss h GLU 272 CO 0.02 0.37 -0.83 -1.13 -1.40 0.00 0.00 179.01 176.03 2fss n SER 273 N -4.46 0.63 0.00 1.42 3.41 -0.83 -4.42 113.62 109.37 2fss n SER 273 Ca 0.03 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2fss n SER 273 Cb 0.07 0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 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 1.38 0.60 0.28 5.00 0.00 -0.92 -4.94 105.19 106.58 2fss n GLY 274 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 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 4.71 0.88 -6.01 1.61 5.75 -1.29 -3.11 115.11 117.65 2fss h GLN 275 Ca 0.00 -0.05 -0.68 0.00 -0.15 0.00 0.00 58.65 57.77 2fss h GLN 275 Cb 0.00 -0.20 -0.18 0.00 1.07 0.00 0.00 27.48 28.18 2fss h GLN 275 CO 0.00 0.58 -0.66 -0.51 -2.65 0.00 0.00 178.83 175.59 2fss s LEU 276 N -10.18 3.34 0.22 -2.39 1.43 -0.47 -0.96 118.68 109.67 2fss s LEU 276 Ca -0.13 0.04 0.10 0.00 -1.03 0.00 0.00 54.13 53.11 2fss s LEU 276 Cb 0.16 -1.75 0.12 0.00 0.03 0.00 0.00 46.19 44.75 2fss s LEU 276 CO 0.77 0.35 1.47 0.03 0.23 0.00 0.00 176.35 179.21 2fss h ARG 277 N 5.33 0.00 -2.03 1.70 3.08 -0.70 -3.40 114.38 118.37 2fss h ARG 277 Ca -0.48 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.58 2fss h ARG 277 Cb 1.18 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.04 2fss h ARG 277 CO 0.54 0.76 0.34 0.20 -1.07 0.00 0.00 179.97 180.74 2fss s GLY 278 N -4.56 -0.47 -0.01 0.04 0.00 -1.20 -4.30 107.32 96.82 2fss s GLY 278 Ca 0.00 1.39 0.01 0.00 0.00 0.00 0.00 44.72 46.12 2fss s GLY 278 CO 0.78 0.79 -0.03 -0.47 0.00 0.00 0.00 173.10 174.17 2fss s TYR 279 N -1.76 0.37 0.26 1.90 5.04 -0.35 -1.20 117.35 121.61 2fss s TYR 279 Ca -0.04 -0.06 -0.16 0.00 -2.44 0.00 0.00 57.07 54.36 2fss s TYR 279 Cb -0.00 -0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.02 2fss s TYR 279 CO 0.02 -0.04 0.56 0.20 -1.34 0.00 0.00 175.55 174.95 2fss s GLY 280 N 0.16 0.30 0.00 8.97 0.00 -0.58 -1.71 107.32 114.46 2fss s GLY 280 Ca -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 44.05 2fss s GLY 280 CO -0.00 -0.43 0.00 0.61 0.00 0.00 0.00 173.10 173.28 2fss n GLY 281 N -0.41 -0.64 0.02 0.20 0.00 -1.12 -1.34 105.19 101.90 2fss n GLY 281 Ca -0.03 -1.67 0.01 0.00 0.00 0.00 0.00 46.02 44.33 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 3.00 1.60 -4.51 1.61 5.75 -1.18 -1.21 116.55 121.61 2fss n ASP 282 Ca 0.00 -1.94 -0.31 0.00 -0.01 0.00 0.00 54.79 52.53 2fss n ASP 282 Cb 0.00 -0.06 -0.12 0.00 -1.03 0.00 0.00 41.12 39.92 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 -1.00 3.04 0.04 2.12 -7.23 -1.25 -2.89 120.40 113.23 2fss s VAL 283 Ca 0.04 -1.17 -0.04 0.00 -1.81 0.00 0.00 61.98 59.00 2fss s VAL 283 Cb 0.03 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.62 2fss s VAL 283 CO 0.00 0.28 0.05 0.26 -0.31 0.00 0.00 175.10 175.38 2fss s TRP 284 N -1.02 0.28 -0.18 2.82 0.52 -1.26 -4.52 118.94 115.59 2fss s TRP 284 Ca 0.17 -0.63 -0.04 0.00 0.02 0.00 0.00 56.10 55.62 2fss s TRP 284 Cb -0.11 -0.20 0.08 0.00 -1.15 0.00 0.00 33.47 32.10 2fss s TRP 284 CO 0.08 -0.34 0.23 0.12 0.02 0.00 0.00 176.95 177.05 2fss s PHE 285 N -2.73 -0.31 0.81 -1.98 5.36 -1.26 -4.03 117.98 113.84 2fss s PHE 285 Ca -0.04 0.43 -0.11 0.00 -0.96 0.00 0.00 56.93 56.25 2fss s PHE 285 Cb -0.01 -0.28 0.11 0.00 -0.34 0.00 0.00 43.02 42.51 2fss s PHE 285 CO -0.05 -0.52 1.16 -2.14 -1.46 0.00 0.00 175.22 172.20 2fss s PRO 286 N 2.35 1.70 -0.09 10.12 0.02 -1.26 -4.92 135.00 142.92 2fss s PRO 286 Ca 0.06 -0.18 -0.03 0.00 0.02 0.00 0.00 61.00 60.87 2fss s PRO 286 Cb -0.15 -2.01 0.04 0.00 0.02 0.00 0.00 34.50 32.41 2fss s PRO 286 CO -0.11 -1.68 0.09 -1.14 -0.33 0.00 0.00 177.00 173.83 2fss s GLN 287 N -5.54 -0.01 0.73 5.54 0.74 -1.26 -3.18 119.66 116.68 2fss s GLN 287 Ca 0.65 0.27 -0.11 0.00 0.05 0.00 0.00 55.36 56.21 2fss s GLN 287 Cb -0.09 -0.87 0.03 0.00 1.10 0.00 0.00 33.01 33.18 2fss s GLN 287 CO 0.48 -0.43 1.08 -2.14 -0.55 0.00 0.00 175.29 173.73 2fss s PRO 288 N 2.19 2.68 0.07 1.67 0.02 -1.26 -5.10 135.00 135.27 2fss s PRO 288 Ca 0.04 0.72 -0.31 0.00 0.02 0.00 0.00 61.00 61.48 2fss s PRO 288 Cb -0.13 -1.98 -0.06 0.00 0.02 0.00 0.00 34.50 32.35 2fss s PRO 288 CO -0.05 -1.22 1.29 0.00 -0.33 0.00 0.00 177.00 176.68 2fss s ALA 289 N -3.16 3.49 0.71 -1.55 0.00 -1.19 -4.99 121.76 115.07 2fss s ALA 289 Ca 0.59 0.94 -0.16 0.00 0.00 0.00 0.00 51.96 53.32 2fss s ALA 289 Cb -0.13 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.50 2fss s ALA 289 CO 0.54 -0.57 1.06 -2.30 0.00 0.00 0.00 175.76 174.50 2fss n PRO 290 N 4.16 0.59 0.14 0.00 -0.02 -1.26 -4.86 135.00 133.74 2fss n PRO 290 Ca 0.10 0.26 0.10 0.00 -2.02 0.00 0.00 63.50 61.94 2fss n PRO 290 Cb 0.45 -2.31 0.50 0.00 -0.02 0.00 0.00 33.50 32.12 2fss n PRO 290 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2fss n LYS 291 N -2.03 0.12 -0.02 -0.52 0.00 -1.26 -1.50 118.16 112.95 2fss n LYS 291 Ca 0.14 0.60 0.01 0.00 -0.00 0.00 0.00 58.31 59.06 2fss n LYS 291 Cb 0.49 -1.88 0.03 0.00 -0.00 0.00 0.00 35.03 33.66 2fss n LYS 291 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2fss n ASP 292 N -2.14 2.12 -4.65 -5.58 5.75 -1.26 -5.00 116.55 105.79 2fss n ASP 292 Ca -0.01 -2.12 -0.51 0.00 -0.01 0.00 0.00 54.79 52.14 2fss n ASP 292 Cb 0.05 -0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 40.02 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 -0.52 1.93 0.29 2.11 -0.00 -0.56 -4.85 115.22 113.62 2fss n HIS 293 Ca 0.03 0.43 0.18 0.00 0.46 0.00 0.00 57.72 58.82 2fss n HIS 293 Cb 0.31 -2.46 0.92 0.00 -0.12 0.00 0.00 29.99 28.64 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 6.12 0.00 0.00 1.57 0.13 -1.95 -1.53 132.00 136.35 2fss h PRO 294 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2fss h PRO 294 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2fss h PRO 294 CO 0.87 0.00 0.00 0.91 -0.23 0.00 0.00 178.00 179.55 2fss n TRP 295 N -3.21 0.79 0.05 1.56 8.01 -1.26 -2.51 117.44 120.88 2fss n TRP 295 Ca -0.01 0.26 -0.13 0.00 -1.31 0.00 0.00 57.50 56.32 2fss n TRP 295 Cb 0.30 -0.93 -0.09 0.00 -2.01 0.00 0.00 31.31 28.59 2fss n TRP 295 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2fss h ARG 296 N 0.00 -0.15 0.00 -0.99 3.08 -1.64 -3.35 114.38 111.33 2fss h ARG 296 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2fss h ARG 296 Cb 0.56 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2fss h ARG 296 CO 0.00 0.23 -0.91 -0.25 -1.07 0.00 0.00 179.97 177.96 2fss n ASP 297 N -4.98 0.63 -4.77 7.04 8.00 -1.23 -4.96 116.55 116.28 2fss n ASP 297 Ca -0.09 -0.23 -0.41 0.00 0.71 0.00 0.00 54.79 54.78 2fss n ASP 297 Cb 0.23 0.67 -0.00 0.00 -0.02 0.00 0.00 41.12 41.99 2fss n ASP 297 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 2fss n MET 298 N -1.89 2.71 -3.93 -1.24 0.00 -1.04 -5.02 117.12 106.71 2fss n MET 298 Ca 0.03 0.95 -0.09 0.00 0.00 0.00 0.00 57.70 58.59 2fss n MET 298 Cb 0.42 -2.70 -0.07 0.00 0.00 0.00 0.00 33.22 30.87 2fss n MET 298 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2fss s ARG 299 N -1.67 1.16 0.88 3.17 1.81 -1.26 -4.69 118.95 118.35 2fss s ARG 299 Ca 0.56 -1.12 -0.09 0.00 -1.72 0.00 0.00 55.73 53.35 2fss s ARG 299 Cb -0.48 0.39 0.19 0.00 -0.45 0.00 0.00 34.95 34.60 2fss s ARG 299 CO 0.60 -0.43 1.21 0.54 -0.68 0.00 0.00 175.30 176.53 2fss s ASN 300 N -2.95 3.43 0.62 0.23 2.20 0.44 -3.69 114.94 115.22 2fss s ASN 300 Ca 0.15 -0.16 0.30 0.00 -0.94 0.00 0.00 52.86 52.22 2fss s ASN 300 Cb 0.03 0.07 1.64 0.00 -2.00 0.00 0.00 41.25 40.98 2fss s ASN 300 CO -0.01 -2.50 1.99 0.07 -2.94 0.00 0.00 177.10 173.71 2fss h LYS 301 N -1.24 0.00 -0.16 3.55 2.10 -1.77 0.97 116.57 120.02 2fss h LYS 301 Ca -0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 2fss h LYS 301 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2fss h LYS 301 CO 0.34 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.45 2fss n TYR 302 N -3.43 0.19 -1.60 0.07 4.01 -1.26 -4.94 117.16 110.19 2fss n TYR 302 Ca 0.02 -0.10 -0.02 0.00 -0.16 0.00 0.00 57.90 57.65 2fss n TYR 302 Cb 0.44 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.47 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 1.34 0.39 0.00 2.72 0.00 0.34 -5.03 105.19 104.95 2fss n GLY 303 Ca 0.17 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.15 0.00 -1.18 4.61 0.00 -1.25 -4.84 120.51 117.70 2fss n ALA 304 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.36 2fss n ALA 304 Cb 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.74 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 0.67 0.86 2.95 0.00 0.00 -1.26 -0.42 105.19 107.99 2fss n GLY 305 Ca 0.00 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.92 3.79 -0.32 1.61 3.84 -1.26 -1.21 114.94 118.46 2fss s ASN 306 Ca 0.00 -1.14 0.07 0.00 0.21 0.00 0.00 52.86 52.00 2fss s ASN 306 Cb 0.00 -1.18 0.45 0.00 -0.55 0.00 0.00 41.25 39.97 2fss s ASN 306 CO 0.00 -0.22 1.17 0.00 -2.79 0.00 0.00 177.10 175.26 2fss n ALA 307 N 4.67 4.97 -1.79 1.71 0.00 -0.69 -4.95 120.51 124.43 2fss n ALA 307 Ca -0.12 -3.86 -0.35 0.00 0.00 0.00 0.00 53.44 49.11 2fss n ALA 307 Cb 0.44 -0.37 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 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 4.07 0.17 0.00 -1.94 -1.26 -2.81 119.30 113.94 2fss s MET 308 Ca 0.50 1.38 0.01 0.00 -1.71 0.00 0.00 55.69 55.86 2fss s MET 308 Cb 0.41 -2.33 -0.04 0.00 2.01 0.00 0.00 34.83 34.87 2fss s MET 308 CO -0.00 -0.20 0.03 0.95 -0.01 0.00 0.00 175.02 175.79 2fss s THR 309 N -1.86 0.49 1.04 2.05 -4.23 -0.35 -4.91 115.64 107.87 2fss s THR 309 Ca 0.61 -1.96 -0.12 0.00 -1.18 0.00 0.00 61.69 59.04 2fss s THR 309 Cb -0.17 -2.16 0.21 0.00 1.34 0.00 0.00 72.50 71.72 2fss s THR 309 CO 0.22 -0.41 1.07 -2.84 -0.54 0.00 0.00 174.62 172.12 2fss s PRO 310 N -3.97 0.06 -0.81 3.99 0.02 -1.26 -4.35 135.00 128.69 2fss s PRO 310 Ca 0.26 0.66 -0.26 0.00 0.02 0.00 0.00 61.00 61.68 2fss s PRO 310 Cb 0.07 -1.68 0.03 0.00 0.02 0.00 0.00 34.50 32.93 2fss s PRO 310 CO 0.05 -3.02 1.42 -1.58 -0.33 0.00 0.00 177.00 173.54 2fss s HIS 311 N -2.80 2.26 0.00 6.54 2.46 -1.14 -4.60 115.29 118.01 2fss s HIS 311 Ca 0.66 -0.15 0.00 0.00 0.47 0.00 0.00 55.06 56.05 2fss s HIS 311 Cb -0.21 -4.57 0.00 0.00 -0.13 0.00 0.00 32.58 27.68 2fss s HIS 311 CO 0.60 -2.05 0.00 2.48 -2.47 0.00 0.00 174.74 173.30 2fss n TYR 312 N 9.81 0.00 -0.00 3.88 0.18 -1.26 -4.92 117.16 124.84 2fss n TYR 312 Ca 0.15 0.00 0.07 0.00 1.88 0.00 0.00 57.90 60.00 2fss n TYR 312 Cb 0.50 0.00 0.47 0.00 -0.38 0.00 0.00 39.34 39.93 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 0.39 -0.49 9.48 4.64 -1.92 0.27 113.55 125.92 2fss h SER 313 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fss h SER 313 Cb 0.16 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2fss h SER 313 CO 0.00 0.26 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 2fss n GLY 314 N -1.50 1.34 1.02 -0.77 0.00 -1.26 -4.06 105.19 99.96 2fss n GLY 314 Ca 0.05 -0.53 0.03 0.00 0.00 0.00 0.00 46.02 45.56 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 0.92 1.64 -0.53 2.61 5.66 0.95 -4.69 114.28 120.84 2fss n THR 315 Ca 0.16 -2.75 -0.29 0.00 -3.05 0.00 0.00 64.05 58.12 2fss n THR 315 Cb 0.43 0.05 0.23 0.00 -1.55 0.00 0.00 70.33 69.49 2fss n THR 315 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2fss n THR 316 N -0.66 0.00 0.12 1.09 -2.24 -1.22 -4.70 114.28 106.67 2fss n THR 316 Ca 0.17 -0.38 -0.02 0.00 -2.27 0.00 0.00 64.05 61.55 2fss n THR 316 Cb 0.83 -0.92 0.13 0.00 -2.10 0.00 0.00 70.33 68.27 2fss n THR 316 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2fss h LEU 317 N -2.49 0.02 -0.45 3.22 3.38 -1.96 -0.59 115.31 116.44 2fss h LEU 317 Ca -0.58 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.32 2fss h LEU 317 Cb 1.33 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 2fss h LEU 317 CO 0.46 0.69 0.08 0.44 0.09 0.00 0.00 178.44 180.20 2fss h ASP 318 N 0.01 0.70 -0.43 -0.43 3.32 -1.93 -1.94 116.42 115.73 2fss h ASP 318 Ca -0.01 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 2fss h ASP 318 Cb 1.19 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2fss h ASP 318 CO 0.09 0.78 0.24 0.00 -1.72 0.00 0.00 179.24 178.63 2fss h ALA 319 N 0.95 0.55 -0.49 3.45 0.00 -1.75 -2.92 119.26 119.05 2fss h ALA 319 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2fss h ALA 319 Cb 0.37 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2fss h ALA 319 CO 0.01 0.08 0.32 1.96 0.00 0.00 0.00 179.25 181.61 2fss h GLN 320 N 0.57 0.65 -0.20 0.00 4.20 -0.91 0.45 115.11 119.87 2fss h GLN 320 Ca 0.15 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2fss h GLN 320 Cb 0.05 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2fss h GLN 320 CO -0.02 0.44 0.11 1.15 -0.67 0.00 0.00 178.83 179.83 2fss h THR 321 N 0.67 1.12 -0.79 -0.54 2.02 -1.19 -0.37 112.91 113.82 2fss h THR 321 Ca 0.18 -0.33 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 2fss h THR 321 Cb -0.06 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 2fss h THR 321 CO -0.04 0.11 0.33 0.03 0.37 0.00 0.00 175.52 176.33 2fss h ARG 322 N 0.22 1.17 -0.42 6.66 3.08 -1.21 -1.07 114.38 122.81 2fss h ARG 322 Ca 0.07 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2fss h ARG 322 Cb 0.09 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2fss h ARG 322 CO -0.01 0.94 0.27 1.88 -1.07 0.00 0.00 179.97 181.98 2fss h TYR 323 N 1.14 0.54 -0.22 3.04 0.05 -0.52 0.15 116.97 121.15 2fss h TYR 323 Ca 0.27 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 59.00 2fss h TYR 323 Cb 0.19 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.74 2fss h TYR 323 CO 0.02 0.36 -0.07 0.00 -1.05 0.00 0.00 178.16 177.42 2fss h ALA 324 N 1.13 0.31 -0.23 3.88 0.00 -0.85 0.52 119.26 124.02 2fss h ALA 324 Ca 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2fss h ALA 324 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2fss h ALA 324 CO -0.03 0.12 0.10 0.37 0.00 0.00 0.00 179.25 179.81 2fss h GLN 325 N 0.16 0.34 -0.86 0.00 5.75 -1.13 -1.88 115.11 117.50 2fss h GLN 325 Ca 0.05 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 2fss h GLN 325 Cb 0.55 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.99 2fss h GLN 325 CO 0.03 0.38 0.57 0.78 -2.65 0.00 0.00 178.83 177.93 2fss h GLY 326 N 0.23 1.22 1.00 2.39 0.00 -0.82 -0.56 103.07 106.53 2fss h GLY 326 Ca 0.08 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 2fss h GLY 326 CO -0.01 0.41 0.34 -0.84 0.00 0.00 0.00 176.54 176.44 2fss h THR 327 N 1.12 1.22 -0.69 4.70 2.02 -0.71 -1.85 112.91 118.72 2fss h THR 327 Ca 0.33 -0.58 -0.07 0.00 0.77 0.00 0.00 66.41 66.87 2fss h THR 327 Cb -0.06 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 2fss h THR 327 CO -0.08 0.24 0.17 0.50 0.37 0.00 0.00 175.52 176.72 2fss h LYS 328 N 0.92 1.10 -0.40 6.66 3.64 -0.70 -1.13 116.57 126.65 2fss h LYS 328 Ca 0.23 -0.27 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2fss h LYS 328 Cb 0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2fss h LYS 328 CO -0.03 0.98 0.13 -0.91 -2.27 0.00 0.00 179.45 177.34 2fss h ASN 329 N 1.03 0.58 -0.03 4.20 2.35 -0.92 0.28 115.58 123.08 2fss h ASN 329 Ca 0.22 -0.20 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2fss h ASN 329 Cb 0.37 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 2fss h ASN 329 CO 0.00 0.62 -0.09 0.40 -1.65 0.00 0.00 177.43 176.72 2fss h ILE 330 N 0.50 0.76 -0.91 2.81 2.04 -1.20 -1.14 117.51 120.38 2fss h ILE 330 Ca 0.13 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.00 2fss h ILE 330 Cb 0.25 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 2fss h ILE 330 CO -0.01 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.68 2fss h LEU 331 N -0.15 1.05 -0.44 1.44 3.38 -0.84 -1.59 115.31 118.16 2fss h LEU 331 Ca 0.04 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2fss h LEU 331 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2fss h LEU 331 CO -0.11 0.76 0.21 -0.08 0.09 0.00 0.00 178.44 179.31 2fss h GLU 332 N 1.23 0.64 -0.72 1.13 4.57 -0.70 0.32 114.58 121.04 2fss h GLU 332 Ca 0.33 -0.10 0.02 0.00 -1.18 0.00 0.00 59.36 58.44 2fss h GLU 332 Cb -0.14 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.30 2fss h GLU 332 CO -0.07 0.55 0.48 0.77 -1.18 0.00 0.00 179.01 179.56 2fss h SER 333 N 0.57 0.79 0.07 1.04 0.02 -0.61 -1.29 113.55 114.14 2fss h SER 333 Ca 0.15 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2fss h SER 333 Cb 0.12 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2fss h SER 333 CO -0.02 0.55 -0.04 0.15 -1.14 0.00 0.00 176.83 176.34 2fss h PHE 334 N 0.92 -0.09 -0.71 3.45 3.57 -0.62 0.41 116.94 123.87 2fss h PHE 334 Ca 0.28 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 2fss h PHE 334 Cb -0.01 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 2fss h PHE 334 CO -0.00 0.46 0.31 0.74 -2.23 0.00 0.00 178.31 177.60 2fss h PHE 335 N -0.76 1.02 0.00 0.41 0.04 -0.14 -0.82 116.94 116.70 2fss h PHE 335 Ca -0.01 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2fss h PHE 335 Cb 0.60 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.43 2fss h PHE 335 CO 0.12 0.76 0.00 1.79 -0.60 0.00 0.00 178.31 180.39 2fss h THR 336 N 1.01 0.00 0.00 -1.55 1.35 -1.36 -3.46 112.91 108.89 2fss h THR 336 Ca 0.24 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2fss h THR 336 Cb 0.14 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 2fss h THR 336 CO -0.03 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.85 2fss n GLY 337 N 0.00 0.44 0.24 5.82 0.00 -0.31 -4.91 105.19 106.46 2fss n GLY 337 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 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 1.02 0.82 -5.49 1.61 1.57 -1.77 -3.47 116.57 110.86 2fss h LYS 338 Ca 0.00 -0.53 -0.40 0.00 -1.87 0.00 0.00 60.65 57.85 2fss h LYS 338 Cb 0.21 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.52 2fss h LYS 338 CO 0.00 1.16 -0.61 1.19 -0.57 0.00 0.00 179.45 180.62 2fss n PHE 339 N -4.06 -1.89 -1.25 -1.35 3.72 0.12 -4.85 117.46 107.90 2fss n PHE 339 Ca -0.05 0.56 -0.24 0.00 -0.05 0.00 0.00 57.45 57.67 2fss n PHE 339 Cb 0.61 -3.34 -0.10 0.00 -0.94 0.00 0.00 39.48 35.71 2fss n PHE 339 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2fss n ASP 340 N -2.42 6.66 -4.76 4.37 5.75 -1.26 -4.97 116.55 119.91 2fss n ASP 340 Ca -0.02 -2.67 -0.35 0.00 -0.01 0.00 0.00 54.79 51.74 2fss n ASP 340 Cb 0.55 -1.42 0.03 0.00 -1.03 0.00 0.00 41.12 39.25 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 0.72 2.47 0.13 2.11 2.02 -1.26 -4.96 117.35 118.58 2fss s TYR 341 Ca 0.65 1.54 -0.31 0.00 -0.37 0.00 0.00 57.07 58.58 2fss s TYR 341 Cb 0.28 -3.38 -0.09 0.00 -0.40 0.00 0.00 41.96 38.37 2fss s TYR 341 CO -0.06 -1.99 1.55 1.03 -1.57 0.00 0.00 175.55 174.51 2fss s ARG 342 N -3.50 4.23 0.28 -0.62 0.52 -1.26 -4.89 118.95 113.71 2fss s ARG 342 Ca 0.74 2.30 0.02 0.00 -0.52 0.00 0.00 55.73 58.27 2fss s ARG 342 Cb -0.27 -3.26 0.60 0.00 0.52 0.00 0.00 34.95 32.54 2fss s ARG 342 CO 0.34 -0.61 1.78 -1.35 0.02 0.00 0.00 175.30 175.48 2fss h PRO 343 N 7.12 0.72 0.00 3.54 0.11 -1.98 0.17 132.00 141.69 2fss h PRO 343 Ca -0.42 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2fss h PRO 343 Cb 1.20 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2fss h PRO 343 CO 0.91 0.48 0.00 -0.56 -0.21 0.00 0.00 178.00 178.62 2fss h GLN 344 N 0.74 0.00 0.00 1.05 -0.00 -1.99 -2.83 115.11 112.09 2fss h GLN 344 Ca 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 59.15 2fss h GLN 344 Cb 0.70 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.18 2fss h GLN 344 CO -0.35 0.00 -0.34 -0.44 -0.00 0.00 0.00 178.83 177.70 2fss h ASP 345 N 0.00 0.00 -3.20 0.06 3.32 -0.88 -3.43 116.42 112.29 2fss h ASP 345 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2fss h ASP 345 Cb 0.20 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.67 2fss h ASP 345 CO 0.00 0.02 0.69 -0.63 -1.72 0.00 0.00 179.24 177.60 2fss s ILE 346 N -3.25 4.70 -0.11 0.35 1.01 -1.07 -0.65 121.20 122.18 2fss s ILE 346 Ca 0.04 1.79 -0.08 0.00 0.00 0.00 0.00 60.65 62.41 2fss s ILE 346 Cb 0.07 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 2fss s ILE 346 CO 0.71 -0.20 -0.15 -0.38 0.00 0.00 0.00 174.94 174.92 2fss n ILE 347 N 5.41 1.09 -4.93 2.92 5.41 0.03 -4.96 119.36 124.33 2fss n ILE 347 Ca 0.10 0.28 -0.30 0.00 1.00 0.00 0.00 62.75 63.82 2fss n ILE 347 Cb 0.47 -2.18 -0.15 0.00 -0.71 0.00 0.00 39.64 37.07 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 -7.35 2.20 -0.22 1.39 1.43 -0.86 -4.49 118.68 110.79 2fss s LEU 348 Ca -0.12 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 2fss s LEU 348 Cb 0.02 -1.32 0.04 0.00 0.03 0.00 0.00 46.19 44.96 2fss s LEU 348 CO 0.18 0.27 -0.12 -0.22 0.23 0.00 0.00 176.35 176.68 2fss s LEU 349 N -1.19 2.64 -1.54 1.79 2.96 0.30 -0.31 118.68 123.34 2fss s LEU 349 Ca 0.12 -1.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.00 2fss s LEU 349 Cb -0.10 -1.39 0.02 0.00 0.50 0.00 0.00 46.19 45.22 2fss s LEU 349 CO 0.02 -0.13 0.16 0.59 -1.32 0.00 0.00 176.35 175.67 2fss n ASN 350 N 4.59 0.38 0.00 3.68 5.03 -1.23 -1.29 115.26 126.42 2fss n ASN 350 Ca -0.16 -1.20 0.00 0.00 0.87 0.00 0.00 54.58 54.09 2fss n ASN 350 Cb 0.46 -1.98 0.00 0.00 -1.02 0.00 0.00 39.78 37.23 2fss n ASN 350 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2fss n GLY 351 N -2.32 2.32 3.87 7.41 0.00 0.25 -4.37 105.19 112.35 2fss n GLY 351 Ca -0.29 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.35 3.57 0.00 1.61 2.02 -0.41 -4.05 118.70 121.09 2fss s GLU 352 Ca 0.00 0.02 0.10 0.00 0.02 0.00 0.00 54.97 55.11 2fss s GLU 352 Cb 0.00 -3.20 0.61 0.00 0.10 0.00 0.00 34.13 31.64 2fss s GLU 352 CO 0.00 0.75 1.05 0.66 0.02 0.00 0.00 175.26 177.74