#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fax s VAL 17 N 0.00 4.63 -1.03 1.39 1.01 0.10 -3.98 120.40 122.53 1fax s VAL 17 Ca 0.00 1.64 -0.05 0.00 0.00 0.00 0.00 61.98 63.57 1fax s VAL 17 Cb 0.00 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1fax s VAL 17 CO 0.00 -0.34 0.89 0.61 0.00 0.00 0.00 175.10 176.26 1fax n GLY 18 N 3.85 -0.93 0.00 4.51 0.00 -1.26 -1.46 105.19 109.90 1fax n GLY 18 Ca 0.09 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1fax n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fax n GLY 19 N -1.22 1.72 3.37 -0.02 0.00 -1.26 -4.73 105.19 103.05 1fax n GLY 19 Ca -0.11 -2.02 -0.21 0.00 0.00 0.00 0.00 46.02 43.69 1fax n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fax s GLN 20 N 2.16 1.40 0.13 1.61 -0.21 0.17 -4.96 119.66 119.94 1fax s GLN 20 Ca 0.00 -1.58 -0.18 0.00 0.02 0.00 0.00 55.36 53.62 1fax s GLN 20 Cb 0.00 -1.33 -0.07 0.00 1.00 0.00 0.00 33.01 32.61 1fax s GLN 20 CO 0.00 0.24 0.60 -1.21 -2.12 0.00 0.00 175.29 172.80 1fax s GLU 21 N -3.38 4.16 -0.58 2.91 2.02 -1.26 -0.98 118.70 121.60 1fax s GLU 21 Ca 0.22 0.71 -0.27 0.00 0.02 0.00 0.00 54.97 55.65 1fax s GLU 21 Cb -0.03 -3.08 -0.02 0.00 0.10 0.00 0.00 34.13 31.09 1fax s GLU 21 CO 0.09 0.55 1.87 0.00 0.02 0.00 0.00 175.26 177.78 1fax n LYS 23 N 9.08 -1.31 -1.69 0.00 4.76 -1.26 -4.81 118.16 122.93 1fax n LYS 23 Ca 0.21 -0.88 -0.42 0.00 -2.87 0.00 0.00 58.31 54.35 1fax n LYS 23 Cb 0.52 -0.69 -0.03 0.00 -1.84 0.00 0.00 35.03 32.98 1fax n LYS 23 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1fax s ASP 24 N -3.05 6.28 0.00 4.39 -1.08 -1.26 -0.87 116.67 121.08 1fax s ASP 24 Ca 0.34 2.48 0.00 0.00 -0.52 0.00 0.00 52.55 54.85 1fax s ASP 24 Cb -0.02 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.91 1fax s ASP 24 CO 0.25 -1.21 0.00 0.61 0.52 0.00 0.00 175.17 175.33 1fax n GLY 25 N 4.74 0.82 0.14 2.66 0.00 -1.26 -4.90 105.19 107.38 1fax n GLY 25 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.23 1fax n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1fax h GLU 26 N 2.35 0.00 -1.98 1.61 5.08 -1.32 -3.33 114.58 117.00 1fax h GLU 26 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1fax h GLU 26 Cb 0.02 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.86 1fax h GLU 26 CO 0.00 0.62 -0.89 0.00 -1.00 0.00 0.00 179.01 177.74 1fax n PRO 28 N -0.08 0.00 0.00 0.00 -0.04 -1.25 -1.67 135.00 131.95 1fax n PRO 28 Ca 0.28 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.23 1fax n PRO 28 Cb 0.55 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.73 1fax n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1fax n TRP 29 N -1.50 0.00 -2.04 0.54 2.14 -1.15 -0.70 117.44 114.73 1fax n TRP 29 Ca 0.02 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.16 1fax n TRP 29 Cb 0.09 -0.07 -0.03 0.00 -0.81 0.00 0.00 31.31 30.49 1fax n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1fax s GLN 30 N -2.50 3.75 0.05 -2.67 2.00 -0.67 -1.67 119.66 117.95 1fax s GLN 30 Ca 0.22 1.75 0.01 0.00 -2.00 0.00 0.00 55.36 55.34 1fax s GLN 30 Cb 0.19 -4.08 -0.04 0.00 0.80 0.00 0.00 33.01 29.88 1fax s GLN 30 CO 0.55 -1.36 0.13 0.00 -0.50 0.00 0.00 175.29 174.11 1fax s ALA 31 N 5.45 3.75 -0.09 1.58 0.00 0.02 -4.45 121.76 128.04 1fax s ALA 31 Ca 0.75 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.83 1fax s ALA 31 Cb -0.27 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.21 1fax s ALA 31 CO 0.31 0.77 -0.17 -1.17 0.00 0.00 0.00 175.76 175.50 1fax s LEU 32 N -2.31 2.51 -0.36 0.00 2.96 -0.07 -1.45 118.68 119.96 1fax s LEU 32 Ca 0.30 -0.36 -0.14 0.00 -0.22 0.00 0.00 54.13 53.72 1fax s LEU 32 Cb -0.12 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.04 1fax s LEU 32 CO 0.23 0.23 0.27 -0.76 -1.32 0.00 0.00 176.35 175.00 1fax s LEU 33 N -0.04 4.65 -0.15 -0.68 1.43 0.35 -0.47 118.68 123.76 1fax s LEU 33 Ca -0.04 -0.51 -0.07 0.00 -1.03 0.00 0.00 54.13 52.47 1fax s LEU 33 Cb -0.14 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.87 1fax s LEU 33 CO 0.04 -0.30 0.10 0.27 0.23 0.00 0.00 176.35 176.69 1fax s ILE 34 N 1.75 5.12 0.96 -0.59 -4.36 0.00 -0.61 121.20 123.48 1fax s ILE 34 Ca 0.07 0.07 -0.16 0.00 -0.26 0.00 0.00 60.65 60.37 1fax s ILE 34 Cb -0.18 -3.27 0.21 0.00 1.25 0.00 0.00 42.46 40.47 1fax s ILE 34 CO 0.11 0.53 1.32 0.54 0.24 0.00 0.00 174.94 177.68 1fax s ASN 35 N -0.30 3.06 0.16 4.36 2.20 0.22 -0.71 114.94 123.92 1fax s ASN 35 Ca 0.10 0.19 -0.17 0.00 -0.94 0.00 0.00 52.86 52.04 1fax s ASN 35 Cb -0.12 -0.21 0.11 0.00 -2.00 0.00 0.00 41.25 39.03 1fax s ASN 35 CO 0.01 -2.76 1.20 -0.62 -2.94 0.00 0.00 177.10 171.99 1fax n GLU 36 N -3.76 -0.23 -0.45 3.55 4.71 -1.20 -0.27 120.64 122.99 1fax n GLU 36 Ca 0.16 1.19 -0.07 0.00 -0.01 0.00 0.00 57.16 58.43 1fax n GLU 36 Cb 0.59 -1.76 0.09 0.00 -1.01 0.00 0.00 31.44 29.35 1fax n GLU 36 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1fax n GLU 37 N -5.09 1.68 -1.23 3.49 1.02 -1.26 -4.76 120.64 114.49 1fax n GLU 37 Ca 0.06 -1.16 -0.08 0.00 -0.02 0.00 0.00 57.16 55.96 1fax n GLU 37 Cb 0.28 -1.52 -0.03 0.00 -0.02 0.00 0.00 31.44 30.14 1fax n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1fax n ASN 38 N -0.06 -4.92 -4.61 1.62 5.03 0.63 -4.96 115.26 107.99 1fax n ASN 38 Ca 0.21 0.19 -0.43 0.00 0.87 0.00 0.00 54.58 55.42 1fax n ASN 38 Cb 0.89 -3.11 -0.02 0.00 -1.02 0.00 0.00 39.78 36.52 1fax n ASN 38 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1fax s GLU 39 N -2.38 3.86 -0.34 3.52 2.02 -1.24 -4.69 118.70 119.45 1fax s GLU 39 Ca 0.00 0.75 -0.28 0.00 0.02 0.00 0.00 54.97 55.46 1fax s GLU 39 Cb 0.00 -3.84 -0.02 0.00 0.10 0.00 0.00 34.13 30.37 1fax s GLU 39 CO 0.00 -1.17 1.87 0.20 0.02 0.00 0.00 175.26 176.18 1fax s GLY 40 N 2.11 0.67 0.00 -1.39 0.00 -1.26 -0.61 107.32 106.84 1fax s GLY 40 Ca 0.46 0.24 0.22 0.00 0.00 0.00 0.00 44.72 45.64 1fax s GLY 40 CO 0.25 3.37 1.00 1.97 0.00 0.00 0.00 173.10 179.68 1fax n PHE 41 N 10.83 0.00 -3.83 1.90 1.16 0.22 -4.95 117.46 122.80 1fax n PHE 41 Ca 0.24 0.00 -0.07 0.00 -1.87 0.00 0.00 57.45 55.75 1fax n PHE 41 Cb 0.47 -0.06 0.01 0.00 -1.61 0.00 0.00 39.48 38.30 1fax n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1fax n GLY 43 N -0.55 3.50 3.80 0.00 0.00 -0.00 -0.50 105.19 111.44 1fax n GLY 43 Ca -0.06 -2.36 -0.06 0.00 0.00 0.00 0.00 46.02 43.54 1fax n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fax s GLY 44 N -3.73 -0.17 -0.17 -0.02 0.00 -0.53 -3.84 107.32 98.86 1fax s GLY 44 Ca 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 44.72 44.66 1fax s GLY 44 CO 0.02 -0.04 -0.15 -1.59 0.00 0.00 0.00 173.10 171.35 1fax s THR 45 N -3.66 2.66 0.07 0.90 2.01 0.40 -0.80 115.64 117.22 1fax s THR 45 Ca 0.11 -0.76 -0.31 0.00 0.31 0.00 0.00 61.69 61.04 1fax s THR 45 Cb -0.04 -2.14 -0.08 0.00 0.01 0.00 0.00 72.50 70.26 1fax s THR 45 CO 0.04 0.51 1.55 -0.63 -0.69 0.00 0.00 174.62 175.40 1fax s ILE 46 N 0.96 3.20 -0.14 1.82 1.01 -0.67 -0.76 121.20 126.62 1fax s ILE 46 Ca -0.02 0.69 0.01 0.00 0.00 0.00 0.00 60.65 61.32 1fax s ILE 46 Cb -0.15 -3.44 -0.09 0.00 0.01 0.00 0.00 42.46 38.79 1fax s ILE 46 CO -0.02 0.01 -0.12 0.18 0.00 0.00 0.00 174.94 174.98 1fax n LEU 47 N 5.21 2.93 0.00 2.97 4.77 -0.47 -1.12 117.00 131.29 1fax n LEU 47 Ca 0.14 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1fax n LEU 47 Cb 0.41 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1fax n LEU 47 CO 0.61 0.72 0.00 -1.54 -1.33 0.00 0.00 177.39 175.85 1fax n SER 48 N -2.92 0.00 0.30 -1.43 3.41 -0.97 -4.64 113.62 107.37 1fax n SER 48 Ca -0.24 -0.63 0.19 0.00 -0.26 0.00 0.00 58.87 57.93 1fax n SER 48 Cb 0.75 0.00 0.89 0.00 -0.26 0.00 0.00 64.21 65.59 1fax n SER 48 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1fax h GLU 49 N 0.00 0.00 0.00 4.33 3.07 -1.99 -3.33 114.58 116.66 1fax h GLU 49 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1fax h GLU 49 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1fax h GLU 49 CO 0.00 0.01 -0.61 1.19 -1.40 0.00 0.00 179.01 178.20 1fax n PHE 50 N -3.11 0.00 -4.21 4.33 3.72 -1.26 -1.06 117.46 115.86 1fax n PHE 50 Ca -0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.05 1fax n PHE 50 Cb 0.22 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.65 1fax n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1fax s TYR 51 N -1.34 3.16 -0.13 1.38 1.51 -1.25 -0.31 117.35 120.37 1fax s TYR 51 Ca 0.00 -0.04 -0.00 0.00 -1.01 0.00 0.00 57.07 56.02 1fax s TYR 51 Cb 0.00 -1.98 -0.02 0.00 -0.11 0.00 0.00 41.96 39.85 1fax s TYR 51 CO 0.00 0.15 -0.13 0.42 -1.11 0.00 0.00 175.55 174.88 1fax s ILE 52 N 0.13 3.09 -0.10 2.71 -1.09 -0.17 -1.37 121.20 124.40 1fax s ILE 52 Ca 0.02 -0.65 -0.15 0.00 -2.23 0.00 0.00 60.65 57.64 1fax s ILE 52 Cb -0.13 -2.30 -0.05 0.00 -1.58 0.00 0.00 42.46 38.41 1fax s ILE 52 CO 0.02 0.53 0.39 -0.22 -1.23 0.00 0.00 174.94 174.42 1fax s LEU 53 N 0.29 4.33 0.00 2.97 2.96 0.06 -0.61 118.68 128.68 1fax s LEU 53 Ca -0.09 0.75 -0.02 0.00 -0.22 0.00 0.00 54.13 54.54 1fax s LEU 53 Cb -0.16 -2.54 0.01 0.00 0.50 0.00 0.00 46.19 44.00 1fax s LEU 53 CO 0.05 0.14 0.32 1.07 -1.32 0.00 0.00 176.35 176.62 1fax n THR 54 N 3.05 0.00 -3.88 3.68 5.66 0.04 -0.45 114.28 122.38 1fax n THR 54 Ca -0.11 -1.01 -0.36 0.00 -3.05 0.00 0.00 64.05 59.53 1fax n THR 54 Cb 0.52 0.65 -0.14 0.00 -1.55 0.00 0.00 70.33 69.82 1fax n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1fax s ALA 55 N -2.21 2.85 0.00 1.79 0.00 -1.26 -0.66 121.76 122.27 1fax s ALA 55 Ca 0.16 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1fax s ALA 55 Cb -0.01 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1fax s ALA 55 CO 0.12 -1.04 0.00 0.00 0.00 0.00 0.00 175.76 174.83 1fax n ALA 56 N 4.71 0.00 -0.10 0.00 0.00 -1.26 -0.88 120.51 122.98 1fax n ALA 56 Ca -0.15 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.44 1fax n ALA 56 Cb 0.46 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.44 1fax n ALA 56 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1fax h HIS 57 N 0.00 0.39 -0.57 0.00 2.07 -1.94 -1.73 115.15 113.37 1fax h HIS 57 Ca 0.00 0.01 0.17 0.00 -2.85 0.00 0.00 60.37 57.70 1fax h HIS 57 Cb 0.00 -0.13 -0.02 0.00 2.57 0.00 0.00 27.41 29.83 1fax h HIS 57 CO 0.00 0.17 0.47 0.00 -3.07 0.00 0.00 177.93 175.50 1fax h LEU 59 N 0.00 0.00 0.00 0.00 4.07 -1.53 -0.76 115.31 117.09 1fax h LEU 59 Ca 0.27 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.23 1fax h LEU 59 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 1fax h LEU 59 CO -0.00 0.00 -0.35 1.88 -1.08 0.00 0.00 178.44 178.88 1fax h TYR 60 N 0.00 0.00 -0.06 1.13 -1.99 -1.19 -3.37 116.97 111.49 1fax h TYR 60 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1fax h TYR 60 Cb 0.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.83 1fax h TYR 60 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 179.20 1fax n GLN 61 N -2.76 1.18 -3.55 4.88 3.00 -0.29 -4.75 117.38 115.09 1fax n GLN 61 Ca 0.03 -0.22 -0.16 0.00 -0.01 0.00 0.00 57.00 56.64 1fax n GLN 61 Cb 0.51 -1.19 -0.06 0.00 0.00 0.00 0.00 30.24 29.50 1fax n GLN 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1fax s ALA 61 N -1.70 -1.80 0.15 -1.58 0.00 -1.26 -4.99 121.76 110.57 1fax s ALA 61 Ca 0.04 1.52 -0.11 0.00 0.00 0.00 0.00 51.96 53.40 1fax s ALA 61 Cb 0.02 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1fax s ALA 61 CO 0.02 -0.35 1.56 0.87 0.00 0.00 0.00 175.76 177.86 1fax h LYS 62 N 3.38 0.92 -3.18 0.00 1.57 -1.88 -3.46 116.57 113.92 1fax h LYS 62 Ca -0.26 -0.36 -0.13 0.00 -1.87 0.00 0.00 60.65 58.04 1fax h LYS 62 Cb 1.15 -0.05 -0.20 0.00 0.08 0.00 0.00 32.23 33.21 1fax h LYS 62 CO 0.30 1.01 -0.34 -0.98 -0.57 0.00 0.00 179.45 178.87 1fax s ARG 63 N -4.80 0.61 0.22 3.15 1.70 -1.26 -5.12 118.95 113.45 1fax s ARG 63 Ca -0.12 -0.26 -0.06 0.00 -0.47 0.00 0.00 55.73 54.82 1fax s ARG 63 Cb 0.12 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.74 1fax s ARG 63 CO 0.85 -0.16 0.30 -0.59 -1.08 0.00 0.00 175.30 174.61 1fax s PHE 64 N -1.35 0.79 0.12 5.89 -0.12 -1.26 -3.24 117.98 118.81 1fax s PHE 64 Ca -0.14 -1.08 0.03 0.00 -0.05 0.00 0.00 56.93 55.69 1fax s PHE 64 Cb -0.06 -0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.08 1fax s PHE 64 CO 0.03 -0.81 -0.08 0.15 -0.05 0.00 0.00 175.22 174.46 1fax s LYS 65 N -4.08 0.94 -0.14 1.99 1.02 0.11 -4.52 119.74 115.07 1fax s LYS 65 Ca 0.31 -1.39 -0.04 0.00 0.02 0.00 0.00 55.97 54.87 1fax s LYS 65 Cb 0.03 -0.40 -0.03 0.00 -0.52 0.00 0.00 37.83 36.91 1fax s LYS 65 CO 0.11 0.03 -0.00 0.08 -0.92 0.00 0.00 175.35 174.64 1fax s VAL 66 N -3.48 4.24 -0.16 3.17 1.01 -0.33 -0.82 120.40 124.03 1fax s VAL 66 Ca 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1fax s VAL 66 Cb 0.04 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 1fax s VAL 66 CO -0.02 0.52 -0.09 -0.60 0.00 0.00 0.00 175.10 174.90 1fax s ARG 67 N -0.02 3.42 0.33 2.72 3.52 0.38 -0.44 118.95 128.87 1fax s ARG 67 Ca 0.03 -0.64 0.09 0.00 -0.13 0.00 0.00 55.73 55.07 1fax s ARG 67 Cb -0.13 -2.78 -0.05 0.00 -1.56 0.00 0.00 34.95 30.43 1fax s ARG 67 CO 0.02 0.10 0.08 0.14 -0.81 0.00 0.00 175.30 174.83 1fax s VAL 68 N 0.68 2.94 0.00 7.11 -7.23 -0.35 -0.89 120.40 122.66 1fax s VAL 68 Ca -0.05 -1.82 0.00 0.00 -1.81 0.00 0.00 61.98 58.31 1fax s VAL 68 Cb -0.15 -2.90 0.00 0.00 0.56 0.00 0.00 36.38 33.89 1fax s VAL 68 CO 0.02 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 1fax n GLY 69 N -1.05 2.25 3.68 2.32 0.00 -1.26 -0.85 105.19 110.27 1fax n GLY 69 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1fax n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fax s ASP 70 N -3.62 6.98 -0.02 1.61 2.15 -1.26 -3.92 116.67 118.59 1fax s ASP 70 Ca 0.00 1.20 0.03 0.00 0.43 0.00 0.00 52.55 54.22 1fax s ASP 70 Cb 0.00 -2.46 -0.05 0.00 -0.30 0.00 0.00 42.92 40.11 1fax s ASP 70 CO 0.00 -0.38 0.04 -1.14 -0.17 0.00 0.00 175.17 173.52 1fax n ARG 71 N 5.08 2.23 -3.75 4.34 0.63 -1.26 -4.96 116.66 118.96 1fax n ARG 71 Ca 0.04 -0.01 -0.21 0.00 -0.92 0.00 0.00 57.85 56.75 1fax n ARG 71 Cb 0.49 -1.09 -0.18 0.00 0.45 0.00 0.00 32.46 32.14 1fax n ARG 71 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1fax s ASN 72 N -3.06 1.32 0.42 6.15 2.47 -1.26 -1.90 114.94 119.07 1fax s ASN 72 Ca -0.02 -0.02 0.09 0.00 0.42 0.00 0.00 52.86 53.33 1fax s ASN 72 Cb 0.02 -0.32 0.90 0.00 -1.45 0.00 0.00 41.25 40.40 1fax s ASN 72 CO 0.15 -0.20 2.05 0.74 -3.72 0.00 0.00 177.10 176.11 1fax h THR 73 N 6.36 1.07 0.25 -5.21 2.02 -1.17 -3.35 112.91 112.88 1fax h THR 73 Ca -0.19 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1fax h THR 73 Cb 1.12 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1fax h THR 73 CO 0.24 0.09 -0.12 0.00 0.37 0.00 0.00 175.52 176.10 1fax h ALA 74 N 1.74 -0.34 -2.85 6.16 0.00 -1.97 -3.46 119.26 118.55 1fax h ALA 74 Ca 0.17 -0.11 -0.59 0.00 0.00 0.00 0.00 54.91 54.37 1fax h ALA 74 Cb 0.04 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1fax h ALA 74 CO -0.04 -0.33 -0.54 0.00 0.00 0.00 0.00 179.25 178.34 1fax s ALA 75 N -3.48 3.75 -1.25 0.00 0.00 -1.26 -5.01 121.76 114.51 1fax s ALA 75 Ca -0.07 -1.04 -0.10 0.00 0.00 0.00 0.00 51.96 50.75 1fax s ALA 75 Cb 0.00 -1.57 0.18 0.00 0.00 0.00 0.00 23.12 21.73 1fax s ALA 75 CO 0.22 0.65 1.71 -1.91 0.00 0.00 0.00 175.76 176.43 1fax n GLU 76 N -0.04 3.60 -0.27 0.00 2.13 -1.26 -4.83 120.64 119.97 1fax n GLU 76 Ca -0.07 -3.70 -0.03 0.00 0.66 0.00 0.00 57.16 54.01 1fax n GLU 76 Cb 0.53 -2.92 0.02 0.00 0.27 0.00 0.00 31.44 29.33 1fax n GLU 76 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1fax n GLU 77 N 4.19 1.15 -0.61 5.31 1.02 -1.26 -4.96 120.64 125.48 1fax n GLU 77 Ca 0.38 -0.34 0.08 0.00 -0.02 0.00 0.00 57.16 57.26 1fax n GLU 77 Cb 0.38 -1.13 -0.02 0.00 -0.02 0.00 0.00 31.44 30.65 1fax n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fax n GLY 78 N 0.60 -1.74 4.15 0.62 0.00 -1.26 -4.87 105.19 102.69 1fax n GLY 78 Ca 0.07 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1fax n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fax n GLY 79 N -1.99 0.86 3.74 -0.02 0.00 -1.26 -4.92 105.19 101.61 1fax n GLY 79 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1fax n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fax s GLU 80 N 0.00 4.40 -0.10 1.61 2.02 -1.25 -4.31 118.70 121.07 1fax s GLU 80 Ca 0.00 2.05 -0.04 0.00 0.02 0.00 0.00 54.97 57.00 1fax s GLU 80 Cb 0.00 -3.18 0.05 0.00 0.10 0.00 0.00 34.13 31.10 1fax s GLU 80 CO 0.00 -0.21 0.20 0.00 0.02 0.00 0.00 175.26 175.26 1fax s ALA 81 N -0.10 -0.32 0.19 5.21 0.00 -0.03 -4.98 121.76 121.72 1fax s ALA 81 Ca 0.55 0.72 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1fax s ALA 81 Cb -0.36 -0.85 -0.07 0.00 0.00 0.00 0.00 23.12 21.83 1fax s ALA 81 CO 0.40 -0.54 0.56 0.08 0.00 0.00 0.00 175.76 176.26 1fax s VAL 82 N 2.20 4.87 0.00 0.00 1.01 -1.26 -1.21 120.40 126.02 1fax s VAL 82 Ca 0.01 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.69 1fax s VAL 82 Cb -0.12 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 1fax s VAL 82 CO -0.07 0.10 -0.01 -1.00 0.00 0.00 0.00 175.10 174.12 1fax s HIS 83 N -1.63 0.13 0.32 5.22 3.76 0.42 -4.98 115.29 118.54 1fax s HIS 83 Ca 0.42 -0.07 -0.21 0.00 -0.15 0.00 0.00 55.06 55.05 1fax s HIS 83 Cb -0.13 -0.09 -0.10 0.00 1.11 0.00 0.00 32.58 33.38 1fax s HIS 83 CO 0.20 -0.02 0.84 -1.21 -0.85 0.00 0.00 174.74 173.70 1fax s GLU 84 N -0.18 4.29 0.10 1.40 2.02 -1.26 -1.19 118.70 123.88 1fax s GLU 84 Ca -0.01 1.01 -0.25 0.00 0.02 0.00 0.00 54.97 55.75 1fax s GLU 84 Cb -0.01 -2.59 -0.07 0.00 0.10 0.00 0.00 34.13 31.56 1fax s GLU 84 CO -0.00 0.21 0.75 0.08 0.02 0.00 0.00 175.26 176.32 1fax s VAL 85 N -1.81 4.56 -0.11 2.63 1.01 -1.26 -0.71 120.40 124.71 1fax s VAL 85 Ca 0.52 1.63 -0.07 0.00 0.00 0.00 0.00 61.98 64.06 1fax s VAL 85 Cb -0.14 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 1fax s VAL 85 CO 0.19 0.46 -0.13 -0.08 0.00 0.00 0.00 175.10 175.54 1fax h GLU 86 N 4.94 0.00 -5.42 2.72 4.81 -0.72 -3.43 114.58 117.49 1fax h GLU 86 Ca -0.46 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.21 1fax h GLU 86 Cb 1.21 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.28 1fax h GLU 86 CO 0.68 0.00 -0.84 0.08 -0.73 0.00 0.00 179.01 178.20 1fax s VAL 87 N -1.96 1.44 -0.35 0.32 1.01 -0.79 -5.00 120.40 115.06 1fax s VAL 87 Ca -0.11 -0.73 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 1fax s VAL 87 Cb 0.01 -1.22 0.06 0.00 0.00 0.00 0.00 36.38 35.23 1fax s VAL 87 CO 0.16 0.41 0.11 -0.69 0.00 0.00 0.00 175.10 175.09 1fax s VAL 88 N -0.08 3.60 -0.39 2.92 1.01 -1.26 -0.37 120.40 125.82 1fax s VAL 88 Ca -0.01 -1.33 -0.15 0.00 0.00 0.00 0.00 61.98 60.48 1fax s VAL 88 Cb -0.10 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1fax s VAL 88 CO 0.01 -0.27 0.32 -0.63 0.00 0.00 0.00 175.10 174.54 1fax s ILE 89 N 1.34 5.22 0.03 2.22 1.01 0.37 -5.01 121.20 126.39 1fax s ILE 89 Ca -0.01 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.24 1fax s ILE 89 Cb -0.20 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1fax s ILE 89 CO 0.01 -0.25 0.01 -0.75 0.00 0.00 0.00 174.94 173.96 1fax s LYS 90 N 1.81 2.71 -0.53 2.79 2.20 -1.26 -0.17 119.74 127.29 1fax s LYS 90 Ca 0.07 -0.69 -0.27 0.00 -0.36 0.00 0.00 55.97 54.72 1fax s LYS 90 Cb -0.18 -2.63 -0.02 0.00 -1.51 0.00 0.00 37.83 33.49 1fax s LYS 90 CO 0.11 0.59 1.82 -1.58 -0.36 0.00 0.00 175.35 175.93 1fax s HIS 91 N -1.18 1.74 -0.15 4.03 5.65 -0.55 -4.84 115.29 119.99 1fax s HIS 91 Ca 0.22 0.75 0.01 0.00 0.25 0.00 0.00 55.06 56.29 1fax s HIS 91 Cb -0.12 -4.11 0.05 0.00 -1.18 0.00 0.00 32.58 27.22 1fax s HIS 91 CO 0.14 -2.44 0.68 0.27 -0.65 0.00 0.00 174.74 172.74 1fax n ASN 92 N 11.95 0.02 -0.80 9.88 6.94 -1.26 -0.82 115.26 141.16 1fax n ASN 92 Ca 0.21 0.16 0.09 0.00 -0.02 0.00 0.00 54.58 55.01 1fax n ASN 92 Cb 0.51 -0.13 0.14 0.00 -2.36 0.00 0.00 39.78 37.93 1fax n ASN 92 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1fax n ARG 93 N -1.25 1.93 -1.55 -3.83 5.12 -1.26 -4.95 116.66 110.87 1fax n ARG 93 Ca -0.00 -1.84 -0.40 0.00 -1.93 0.00 0.00 57.85 53.68 1fax n ARG 93 Cb 0.42 -1.36 -0.04 0.00 -1.16 0.00 0.00 32.46 30.32 1fax n ARG 93 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1fax n PHE 94 N 1.01 1.54 -2.95 -1.55 7.35 -0.00 -4.73 117.46 118.13 1fax n PHE 94 Ca 0.13 0.08 -0.44 0.00 -0.76 0.00 0.00 57.45 56.46 1fax n PHE 94 Cb 0.47 -2.64 -0.04 0.00 0.35 0.00 0.00 39.48 37.62 1fax n PHE 94 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1fax s THR 95 N 10.50 4.56 0.45 -2.13 2.01 -0.94 -4.92 115.64 125.17 1fax s THR 95 Ca 1.02 -0.81 0.28 0.00 0.31 0.00 0.00 61.69 62.49 1fax s THR 95 Cb -0.35 -4.65 0.47 0.00 0.01 0.00 0.00 72.50 67.99 1fax s THR 95 CO 0.32 -1.37 1.73 0.50 -0.69 0.00 0.00 174.62 175.11 1fax h LYS 96 N 9.29 0.19 0.00 4.92 3.64 -1.90 0.14 116.57 132.85 1fax h LYS 96 Ca -0.20 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1fax h LYS 96 Cb 1.07 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1fax h LYS 96 CO 1.14 0.12 -0.03 1.49 -2.27 0.00 0.00 179.45 179.90 1fax h GLU 97 N 0.19 0.00 0.00 1.90 4.57 -1.98 -3.29 114.58 115.98 1fax h GLU 97 Ca 0.67 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 58.50 1fax h GLU 97 Cb 2.10 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 30.62 1fax h GLU 97 CO -0.24 0.00 -2.31 0.25 -1.18 0.00 0.00 179.01 175.53 1fax n THR 98 N -3.08 1.31 -1.54 0.32 -2.24 0.01 -4.97 114.28 104.09 1fax n THR 98 Ca 0.04 -0.81 -0.06 0.00 -2.27 0.00 0.00 64.05 60.95 1fax n THR 98 Cb 0.53 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1fax n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1fax n TYR 99 N -2.71 -0.11 -2.60 4.78 4.02 0.27 -4.99 117.16 115.82 1fax n TYR 99 Ca -0.31 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.21 1fax n TYR 99 Cb 1.12 -1.59 -0.05 0.00 -0.02 0.00 0.00 39.34 38.81 1fax n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1fax s ASP 100 N -2.85 7.00 -1.35 7.72 2.15 -1.23 -3.33 116.67 124.77 1fax s ASP 100 Ca 0.00 2.02 -0.03 0.00 0.43 0.00 0.00 52.55 54.97 1fax s ASP 100 Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1fax s ASP 100 CO 0.00 -0.32 0.42 0.49 -0.17 0.00 0.00 175.17 175.60 1fax n PHE 101 N 0.31 -1.51 -2.28 -5.34 3.72 -1.26 -2.22 117.46 108.88 1fax n PHE 101 Ca 0.03 0.36 -0.34 0.00 -0.05 0.00 0.00 57.45 57.45 1fax n PHE 101 Cb 0.49 -3.89 -0.04 0.00 -0.94 0.00 0.00 39.48 35.11 1fax n PHE 101 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1fax s ASP 102 N -2.65 5.78 -0.23 4.37 2.15 -1.21 -4.32 116.67 120.56 1fax s ASP 102 Ca 0.21 -1.69 -0.21 0.00 0.43 0.00 0.00 52.55 51.29 1fax s ASP 102 Cb -0.09 -2.58 0.06 0.00 -0.30 0.00 0.00 42.92 40.01 1fax s ASP 102 CO 0.26 -2.25 0.61 -0.51 -0.17 0.00 0.00 175.17 173.11 1fax s ILE 103 N 8.04 -0.00 -0.05 4.11 2.07 -1.26 -4.28 121.20 129.83 1fax s ILE 103 Ca 0.61 0.00 -0.18 0.00 -1.41 0.00 0.00 60.65 59.68 1fax s ILE 103 Cb -0.00 -0.85 0.04 0.00 0.13 0.00 0.00 42.46 41.77 1fax s ILE 103 CO 0.06 0.00 0.41 0.00 -1.91 0.00 0.00 174.94 173.50 1fax s ALA 104 N 0.38 -1.03 -0.17 1.50 0.00 0.17 -1.48 121.76 121.12 1fax s ALA 104 Ca -0.00 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 52.64 1fax s ALA 104 Cb -0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 1fax s ALA 104 CO 0.00 -0.27 -0.08 0.08 0.00 0.00 0.00 175.76 175.49 1fax s VAL 105 N -0.97 3.37 -0.18 0.00 1.01 0.76 -0.78 120.40 123.61 1fax s VAL 105 Ca -0.10 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 1fax s VAL 105 Cb -0.04 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1fax s VAL 105 CO 0.05 0.48 0.04 -0.76 0.00 0.00 0.00 175.10 174.91 1fax s LEU 106 N 0.76 3.71 -0.27 3.92 1.43 0.22 -0.48 118.68 127.97 1fax s LEU 106 Ca -0.03 0.04 -0.09 0.00 -1.03 0.00 0.00 54.13 53.02 1fax s LEU 106 Cb -0.15 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1fax s LEU 106 CO 0.02 0.17 0.12 -0.60 0.23 0.00 0.00 176.35 176.30 1fax s ARG 107 N 0.36 3.65 0.43 1.70 3.52 0.50 -1.00 118.95 128.10 1fax s ARG 107 Ca 0.02 -0.50 -0.19 0.00 -0.13 0.00 0.00 55.73 54.93 1fax s ARG 107 Cb -0.13 -3.48 -0.10 0.00 -1.56 0.00 0.00 34.95 29.69 1fax s ARG 107 CO 0.01 -0.25 0.91 -0.51 -0.81 0.00 0.00 175.30 174.65 1fax s LEU 108 N 1.66 3.90 0.06 -0.88 1.02 0.57 -0.07 118.68 124.94 1fax s LEU 108 Ca 0.06 1.57 -0.18 0.00 0.02 0.00 0.00 54.13 55.60 1fax s LEU 108 Cb -0.16 -4.43 -0.14 0.00 0.02 0.00 0.00 46.19 41.49 1fax s LEU 108 CO 0.06 -0.38 1.33 0.11 0.02 0.00 0.00 176.35 177.50 1fax h LYS 109 N 1.76 0.52 -5.63 1.70 1.57 -1.19 -3.41 116.57 111.88 1fax h LYS 109 Ca -0.48 -0.32 -0.68 0.00 -1.87 0.00 0.00 60.65 57.30 1fax h LYS 109 Cb 1.18 0.03 -0.31 0.00 0.08 0.00 0.00 32.23 33.21 1fax h LYS 109 CO 0.62 0.92 -0.86 0.95 -0.57 0.00 0.00 179.45 180.50 1fax s THR 110 N -4.12 2.21 0.40 -0.16 -4.23 -1.26 -5.02 115.64 103.47 1fax s THR 110 Ca -0.13 -0.98 -0.27 0.00 -1.18 0.00 0.00 61.69 59.13 1fax s THR 110 Cb 0.06 -1.84 -0.10 0.00 1.34 0.00 0.00 72.50 71.96 1fax s THR 110 CO 0.80 0.56 1.33 -0.81 -0.54 0.00 0.00 174.62 175.96 1fax n PRO 111 N 3.26 2.15 -2.43 3.99 -0.04 -1.26 -4.89 135.00 135.78 1fax n PRO 111 Ca -0.18 0.76 -0.42 0.00 -0.04 0.00 0.00 63.50 63.61 1fax n PRO 111 Cb 0.53 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.51 1fax n PRO 111 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1fax s ILE 112 N -1.16 4.22 -0.25 0.52 2.07 -0.23 -5.02 121.20 121.36 1fax s ILE 112 Ca 0.58 1.54 -0.23 0.00 -1.41 0.00 0.00 60.65 61.13 1fax s ILE 112 Cb -0.51 -3.99 -0.01 0.00 0.13 0.00 0.00 42.46 38.08 1fax s ILE 112 CO 0.60 -0.03 0.75 -0.89 -1.91 0.00 0.00 174.94 173.46 1fax s THR 113 N 2.48 4.89 0.42 4.00 2.01 -1.26 -4.82 115.64 123.36 1fax s THR 113 Ca 0.56 1.38 -0.23 0.00 0.31 0.00 0.00 61.69 63.71 1fax s THR 113 Cb -0.25 -4.05 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 1fax s THR 113 CO 0.21 -0.04 1.04 -0.36 -0.69 0.00 0.00 174.62 174.78 1fax s PHE 114 N 2.72 3.20 0.12 4.92 0.08 -1.26 -4.91 117.98 122.85 1fax s PHE 114 Ca 0.31 1.63 -0.15 0.00 0.12 0.00 0.00 56.93 58.84 1fax s PHE 114 Cb -0.15 -3.10 0.05 0.00 -0.57 0.00 0.00 43.02 39.25 1fax s PHE 114 CO 0.08 -0.65 0.74 2.89 -0.10 0.00 0.00 175.22 178.17 1fax n ARG 115 N -0.30 0.43 -1.68 0.44 1.85 -0.96 -4.99 116.66 111.46 1fax n ARG 115 Ca 0.06 -1.01 -0.42 0.00 -1.00 0.00 0.00 57.85 55.48 1fax n ARG 115 Cb 0.50 1.38 -0.03 0.00 -1.05 0.00 0.00 32.46 33.26 1fax n ARG 115 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 1fax s MET 116 N -2.03 3.97 0.00 2.89 -2.45 -1.26 -0.17 119.30 120.24 1fax s MET 116 Ca 0.16 2.48 0.00 0.00 -1.25 0.00 0.00 55.69 57.09 1fax s MET 116 Cb -0.02 -4.19 0.00 0.00 1.25 0.00 0.00 34.83 31.87 1fax s MET 116 CO 0.04 -1.15 0.00 0.09 1.05 0.00 0.00 175.02 175.04 1fax n ASN 117 N 8.24 -1.53 -3.76 1.11 3.02 -1.26 -4.90 115.26 116.17 1fax n ASN 117 Ca 0.21 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.47 1fax n ASN 117 Cb 0.42 -0.26 -0.15 0.00 -0.61 0.00 0.00 39.78 39.18 1fax n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fax s VAL 118 N -2.00 0.97 -0.12 2.41 1.01 0.76 -4.14 120.40 119.29 1fax s VAL 118 Ca 0.00 -1.43 -0.22 0.00 0.00 0.00 0.00 61.98 60.33 1fax s VAL 118 Cb 0.00 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.71 1fax s VAL 118 CO 0.00 -0.64 0.54 0.00 0.00 0.00 0.00 175.10 174.99 1fax s ALA 119 N 1.57 -1.36 0.44 5.51 0.00 0.12 -2.25 121.76 125.79 1fax s ALA 119 Ca 0.09 1.23 -0.22 0.00 0.00 0.00 0.00 51.96 53.06 1fax s ALA 119 Cb -0.17 -0.44 -0.08 0.00 0.00 0.00 0.00 23.12 22.42 1fax s ALA 119 CO -0.23 -0.29 1.06 -1.25 0.00 0.00 0.00 175.76 175.05 1fax s PRO 120 N -0.48 3.95 0.54 0.00 0.04 -1.26 -2.95 135.00 134.84 1fax s PRO 120 Ca -0.06 1.49 -0.07 0.00 0.04 0.00 0.00 61.00 62.40 1fax s PRO 120 Cb -0.03 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 1fax s PRO 120 CO 0.04 -0.33 0.87 0.00 0.04 0.00 0.00 177.00 177.63 1fax s ALA 121 N -1.77 3.31 0.02 8.56 0.00 -0.27 -4.90 121.76 126.70 1fax s ALA 121 Ca 0.63 -0.50 -0.18 0.00 0.00 0.00 0.00 51.96 51.91 1fax s ALA 121 Cb -0.21 -2.68 -0.06 0.00 0.00 0.00 0.00 23.12 20.17 1fax s ALA 121 CO 0.25 -0.57 0.52 0.00 0.00 0.00 0.00 175.76 175.96 1fax s LEU 123 N -0.76 4.38 0.00 0.00 1.43 -1.26 -0.92 118.68 121.55 1fax s LEU 123 Ca 0.27 1.58 0.00 0.00 -1.03 0.00 0.00 54.13 54.96 1fax s LEU 123 Cb -0.18 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.57 1fax s LEU 123 CO 0.16 -0.20 0.00 -0.81 0.23 0.00 0.00 176.35 175.74 1fax n PRO 124 N 3.68 0.27 -4.42 1.29 -0.04 -1.26 -4.96 135.00 129.55 1fax n PRO 124 Ca 0.04 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.21 1fax n PRO 124 Cb 0.51 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.84 1fax n PRO 124 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1fax s GLU 124 N -1.91 1.42 0.14 0.54 2.02 -1.18 -5.03 118.70 114.70 1fax s GLU 124 Ca 0.00 -1.33 -0.32 0.00 0.02 0.00 0.00 54.97 53.35 1fax s GLU 124 Cb 0.00 -1.89 -0.08 0.00 0.10 0.00 0.00 34.13 32.26 1fax s GLU 124 CO 0.00 0.45 1.55 -0.09 0.02 0.00 0.00 175.26 177.19 1fax h ARG 125 N 3.95 -0.30 -6.05 1.61 2.43 -1.97 -3.27 114.38 110.78 1fax h ARG 125 Ca -0.51 0.02 -0.58 0.00 -0.81 0.00 0.00 59.98 58.11 1fax h ARG 125 Cb 1.17 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.72 1fax h ARG 125 CO 0.39 -0.20 0.67 -0.51 -1.51 0.00 0.00 179.97 178.81 1fax s ASP 126 N -5.14 7.06 0.00 -3.80 1.01 -1.26 -1.62 116.67 112.92 1fax s ASP 126 Ca -0.14 1.33 0.00 0.00 0.71 0.00 0.00 52.55 54.45 1fax s ASP 126 Cb 0.10 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.51 1fax s ASP 126 CO 0.62 -0.58 0.00 1.87 0.21 0.00 0.00 175.17 177.29 1fax n TRP 127 N 5.96 0.00 0.00 4.23 -0.00 -1.24 -4.90 117.44 121.48 1fax n TRP 127 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.60 1fax n TRP 127 Cb 0.47 -1.36 0.00 0.00 -0.00 0.00 0.00 31.31 30.42 1fax n TRP 127 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1fax n ALA 128 N -0.74 0.00 -2.14 5.87 0.00 -1.23 -3.12 120.51 119.15 1fax n ALA 128 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1fax n ALA 128 Cb 0.29 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.71 1fax n ALA 128 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1fax s GLU 129 N 0.00 4.11 0.10 0.00 2.02 -0.64 -1.16 118.70 123.14 1fax s GLU 129 Ca 0.00 1.95 0.00 0.00 0.02 0.00 0.00 54.97 56.94 1fax s GLU 129 Cb 0.00 -3.94 0.00 0.00 0.10 0.00 0.00 34.13 30.29 1fax s GLU 129 CO 0.00 -0.90 0.00 -1.13 0.02 0.00 0.00 175.26 173.25 1fax n SER 130 N 7.27 -1.57 0.00 -0.19 3.41 -1.26 -4.62 113.62 116.66 1fax n SER 130 Ca 0.17 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1fax n SER 130 Cb 0.44 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1fax n SER 130 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1fax n THR 131 N -1.61 0.00 -0.05 6.66 -1.04 -1.26 -4.19 114.28 112.79 1fax n THR 131 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1fax n THR 131 Cb 0.07 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.51 1fax n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1fax h LEU 131 N 0.00 0.38 0.00 -4.42 4.07 -1.86 -0.58 115.31 112.89 1fax h LEU 131 Ca 0.00 -0.52 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1fax h LEU 131 Cb 0.00 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.63 1fax h LEU 131 CO 0.00 0.83 0.00 0.23 -1.08 0.00 0.00 178.44 178.42 1fax n MET 131 N -4.53 0.50 0.02 1.13 2.81 -0.31 -3.02 117.12 113.72 1fax n MET 131 Ca -0.07 0.02 -0.03 0.00 -1.81 0.00 0.00 57.70 55.82 1fax n MET 131 Cb 0.39 -1.50 -0.09 0.00 -0.71 0.00 0.00 33.22 31.31 1fax n MET 131 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1fax h THR 132 N 0.00 0.66 -2.98 2.03 2.02 -1.58 -3.47 112.91 109.60 1fax h THR 132 Ca 0.00 -2.27 -0.59 0.00 0.77 0.00 0.00 66.41 64.33 1fax h THR 132 Cb 0.21 2.20 0.13 0.00 -1.74 0.00 0.00 68.15 68.94 1fax h THR 132 CO 0.00 0.38 0.14 0.00 0.37 0.00 0.00 175.52 176.41 1fax n GLN 133 N -2.97 1.33 0.24 6.66 1.13 -0.31 -4.92 117.38 118.53 1fax n GLN 133 Ca -0.11 0.48 0.14 0.00 -1.94 0.00 0.00 57.00 55.57 1fax n GLN 133 Cb 0.90 -2.01 0.41 0.00 0.11 0.00 0.00 30.24 29.65 1fax n GLN 133 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 1fax h LYS 134 N 1.56 0.00 -3.76 -1.09 2.10 -1.89 -3.44 116.57 110.05 1fax h LYS 134 Ca -0.44 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.02 1fax h LYS 134 Cb 1.34 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 32.43 1fax h LYS 134 CO 0.57 0.00 -0.66 0.99 -2.00 0.00 0.00 179.45 178.35 1fax s THR 135 N -3.41 0.05 0.40 0.07 2.01 -1.26 -1.21 115.64 112.30 1fax s THR 135 Ca 0.05 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.64 1fax s THR 135 Cb 0.07 -0.19 -0.05 0.00 0.01 0.00 0.00 72.50 72.34 1fax s THR 135 CO 0.61 -0.25 0.04 -0.83 -0.69 0.00 0.00 174.62 173.50 1fax s GLY 136 N -0.74 2.48 -0.06 4.40 0.00 -0.17 -4.65 107.32 108.57 1fax s GLY 136 Ca -0.08 -1.72 0.02 0.00 0.00 0.00 0.00 44.72 42.94 1fax s GLY 136 CO -0.00 -1.99 -0.10 -0.42 0.00 0.00 0.00 173.10 170.59 1fax s ILE 137 N -3.00 3.47 0.11 0.90 -1.09 0.59 -0.50 121.20 121.68 1fax s ILE 137 Ca 0.28 -0.59 0.05 0.00 -2.23 0.00 0.00 60.65 58.17 1fax s ILE 137 Cb 0.07 -2.40 -0.04 0.00 -1.58 0.00 0.00 42.46 38.51 1fax s ILE 137 CO 0.14 0.58 -0.13 0.54 -1.23 0.00 0.00 174.94 174.84 1fax s VAL 138 N -0.79 1.25 0.15 2.92 0.11 -0.17 -0.40 120.40 123.46 1fax s VAL 138 Ca 0.12 -1.67 -0.23 0.00 -2.93 0.00 0.00 61.98 57.27 1fax s VAL 138 Cb -0.11 -1.47 0.07 0.00 -1.53 0.00 0.00 36.38 33.35 1fax s VAL 138 CO 0.01 -0.42 0.61 -0.94 -3.33 0.00 0.00 175.10 171.03 1fax s SER 139 N -2.39 -0.57 0.00 3.54 1.04 -1.17 -0.48 113.70 113.67 1fax s SER 139 Ca 0.07 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1fax s SER 139 Cb -0.05 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1fax s SER 139 CO 0.02 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.91 1fax n GLY 140 N -0.33 2.56 2.57 7.32 0.00 -0.87 -4.29 105.19 112.15 1fax n GLY 140 Ca -0.17 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1fax n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fax n PHE 141 N -0.75 2.75 -4.30 1.61 3.01 -1.26 -4.13 117.46 114.39 1fax n PHE 141 Ca 0.00 -2.90 -0.16 0.00 1.01 0.00 0.00 57.45 55.40 1fax n PHE 141 Cb 0.00 -2.11 -0.10 0.00 -0.01 0.00 0.00 39.48 37.26 1fax n PHE 141 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1fax s GLY 142 N 1.26 1.46 0.01 1.37 0.00 -1.22 -4.54 107.32 105.66 1fax s GLY 142 Ca 0.53 -1.72 -0.33 0.00 0.00 0.00 0.00 44.72 43.21 1fax s GLY 142 CO -0.06 -1.62 0.85 0.54 0.00 0.00 0.00 173.10 172.81 1fax n ARG 143 N -0.36 0.00 0.00 2.90 1.74 0.20 0.14 116.66 121.27 1fax n ARG 143 Ca -0.05 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.16 1fax n ARG 143 Cb 0.64 -1.22 0.39 0.00 -1.02 0.00 0.00 32.46 31.25 1fax n ARG 143 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1fax n THR 144 N 1.14 0.00 -1.58 0.55 -1.04 -0.80 -0.71 114.28 111.85 1fax n THR 144 Ca 0.17 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1fax n THR 144 Cb 0.08 0.64 0.00 0.00 -1.82 0.00 0.00 70.33 69.23 1fax n THR 144 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1fax n HIS 145 N 0.03 0.00 -1.82 -1.42 8.25 -1.26 -4.20 115.22 114.79 1fax n HIS 145 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1fax n HIS 145 Cb 0.39 0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.53 1fax n HIS 145 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1fax n GLU 147 N 0.00 -4.69 -3.35 -0.41 2.13 -1.26 -4.80 120.64 108.26 1fax n GLU 147 Ca 0.00 3.41 -0.16 0.00 0.66 0.00 0.00 57.16 61.07 1fax n GLU 147 Cb 0.19 -3.59 0.04 0.00 0.27 0.00 0.00 31.44 28.34 1fax n GLU 147 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1fax n LYS 148 N 1.60 -1.68 -3.63 5.31 5.02 -1.26 -5.02 118.16 118.50 1fax n LYS 148 Ca 0.00 0.93 -0.02 0.00 -2.02 0.00 0.00 58.31 57.20 1fax n LYS 148 Cb 0.00 -5.14 -0.01 0.00 -0.02 0.00 0.00 35.03 29.86 1fax n LYS 148 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1fax s GLY 149 N -3.27 -0.35 0.92 0.72 0.00 -1.26 -5.11 107.32 98.97 1fax s GLY 149 Ca 0.31 0.81 -0.10 0.00 0.00 0.00 0.00 44.72 45.74 1fax s GLY 149 CO 0.78 0.22 1.13 0.50 0.00 0.00 0.00 173.10 175.73 1fax s ARG 150 N -2.72 1.00 0.00 2.90 0.52 -1.26 -4.67 118.95 114.71 1fax s ARG 150 Ca 0.11 1.42 0.00 0.00 -0.52 0.00 0.00 55.73 56.74 1fax s ARG 150 Cb 0.01 -1.73 0.00 0.00 0.52 0.00 0.00 34.95 33.75 1fax s ARG 150 CO -0.03 -2.60 0.10 0.94 0.02 0.00 0.00 175.30 173.73 1fax n GLN 151 N -4.20 0.00 0.11 3.54 7.27 -1.26 -2.06 117.38 120.78 1fax n GLN 151 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.18 1fax n GLN 151 Cb 0.52 -0.47 0.00 0.00 2.41 0.00 0.00 30.24 32.71 1fax n GLN 151 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1fax n SER 152 N -0.19 -2.03 0.00 1.69 7.64 -1.26 -1.91 113.62 117.56 1fax n SER 152 Ca 0.00 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1fax n SER 152 Cb 0.00 2.15 0.00 0.00 -1.01 0.00 0.00 64.21 65.35 1fax n SER 152 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1fax n THR 153 N -2.95 0.00 -3.39 0.44 -1.04 -1.26 -4.86 114.28 101.21 1fax n THR 153 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 1fax n THR 153 Cb 0.00 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 1fax n THR 153 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1fax s ARG 154 N 0.00 4.14 -0.29 -2.82 1.81 -1.26 -0.50 118.95 120.02 1fax s ARG 154 Ca 0.00 0.47 -0.29 0.00 -1.72 0.00 0.00 55.73 54.19 1fax s ARG 154 Cb 0.00 -3.31 -0.02 0.00 -0.45 0.00 0.00 34.95 31.17 1fax s ARG 154 CO 0.00 0.47 1.73 -1.17 -0.68 0.00 0.00 175.30 175.65 1fax s LEU 155 N -0.39 3.64 -0.11 2.53 2.96 -0.80 -4.87 118.68 121.65 1fax s LEU 155 Ca 0.25 1.41 -0.07 0.00 -0.22 0.00 0.00 54.13 55.50 1fax s LEU 155 Cb -0.16 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1fax s LEU 155 CO 0.13 -1.54 0.16 -0.54 -1.32 0.00 0.00 176.35 173.23 1fax s LYS 156 N 5.30 3.47 0.11 1.98 1.02 -1.26 -1.26 119.74 129.10 1fax s LYS 156 Ca 0.77 -0.10 0.09 0.00 0.02 0.00 0.00 55.97 56.75 1fax s LYS 156 Cb -0.23 -3.19 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 1fax s LYS 156 CO 0.33 0.77 -0.21 0.00 -0.92 0.00 0.00 175.35 175.31 1fax s MET 157 N -1.06 1.68 -0.03 1.68 0.23 -0.15 -2.04 119.30 119.61 1fax s MET 157 Ca 0.16 -1.22 -0.02 0.00 -1.03 0.00 0.00 55.69 53.58 1fax s MET 157 Cb -0.12 -2.05 0.01 0.00 -1.53 0.00 0.00 34.83 31.14 1fax s MET 157 CO 0.05 0.48 0.08 -1.17 -2.03 0.00 0.00 175.02 172.42 1fax s LEU 158 N -2.03 1.60 -0.32 0.18 0.20 0.37 -0.66 118.68 118.02 1fax s LEU 158 Ca 0.16 0.15 -0.29 0.00 0.69 0.00 0.00 54.13 54.84 1fax s LEU 158 Cb -0.10 0.23 0.01 0.00 -0.43 0.00 0.00 46.19 45.90 1fax s LEU 158 CO 0.08 -0.04 1.17 -1.61 -0.29 0.00 0.00 176.35 175.65 1fax s GLU 159 N 0.20 3.99 -0.23 1.98 2.02 -1.26 -1.00 118.70 124.40 1fax s GLU 159 Ca -0.01 1.11 0.01 0.00 0.02 0.00 0.00 54.97 56.09 1fax s GLU 159 Cb -0.02 -3.80 0.03 0.00 0.10 0.00 0.00 34.13 30.44 1fax s GLU 159 CO -0.01 -1.01 -0.13 0.14 0.02 0.00 0.00 175.26 174.27 1fax s VAL 160 N 3.97 2.35 0.47 2.63 -7.23 0.35 -4.98 120.40 117.96 1fax s VAL 160 Ca 0.50 -1.19 -0.23 0.00 -1.81 0.00 0.00 61.98 59.25 1fax s VAL 160 Cb -0.14 -2.18 -0.07 0.00 0.56 0.00 0.00 36.38 34.55 1fax s VAL 160 CO 0.19 0.25 1.20 -2.16 -0.31 0.00 0.00 175.10 174.27 1fax s PRO 161 N 1.24 3.67 0.19 4.82 0.04 -1.26 -1.00 135.00 142.69 1fax s PRO 161 Ca -0.01 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 1fax s PRO 161 Cb -0.16 -2.39 -0.09 0.00 0.04 0.00 0.00 34.50 31.90 1fax s PRO 161 CO -0.08 -0.64 1.36 0.71 0.04 0.00 0.00 177.00 178.39 1fax s TYR 162 N -1.50 3.21 -0.08 0.56 2.02 -0.35 -2.26 117.35 118.95 1fax s TYR 162 Ca 0.65 1.11 0.02 0.00 -0.37 0.00 0.00 57.07 58.47 1fax s TYR 162 Cb -0.30 -3.67 -0.02 0.00 -0.40 0.00 0.00 41.96 37.56 1fax s TYR 162 CO 0.37 -2.17 -0.12 0.08 -1.57 0.00 0.00 175.55 172.13 1fax s VAL 163 N 0.36 3.23 0.41 0.71 1.01 -0.60 -4.93 120.40 120.60 1fax s VAL 163 Ca 0.59 -0.64 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 1fax s VAL 163 Cb -0.38 -2.30 -0.08 0.00 0.00 0.00 0.00 36.38 33.62 1fax s VAL 163 CO 0.37 0.57 1.20 1.51 0.00 0.00 0.00 175.10 178.75 1fax s ASP 164 N -0.47 6.41 0.24 3.32 1.47 -1.26 -4.43 116.67 121.95 1fax s ASP 164 Ca 0.06 2.41 -0.14 0.00 1.18 0.00 0.00 52.55 56.06 1fax s ASP 164 Cb -0.12 -2.62 0.30 0.00 -0.34 0.00 0.00 42.92 40.14 1fax s ASP 164 CO 0.02 -0.76 1.58 -0.09 0.68 0.00 0.00 175.17 176.60 1fax h ARG 165 N 2.55 -0.03 -0.04 2.11 2.43 -1.99 -1.80 114.38 117.62 1fax h ARG 165 Ca -0.49 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1fax h ARG 165 Cb 1.24 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1fax h ARG 165 CO 0.62 -0.02 0.01 -0.91 -1.51 0.00 0.00 179.97 178.16 1fax h ASN 166 N -0.03 0.06 -0.66 -3.80 4.21 -2.00 -1.16 115.58 112.20 1fax h ASN 166 Ca 0.37 -0.23 0.04 0.00 1.21 0.00 0.00 56.30 57.69 1fax h ASN 166 Cb 0.61 -0.02 -0.05 0.00 -1.12 0.00 0.00 38.32 37.75 1fax h ASN 166 CO -0.87 0.27 0.40 0.28 -1.29 0.00 0.00 177.43 176.22 1fax h SER 167 N -0.16 0.63 -0.26 5.81 0.02 -1.81 -0.50 113.55 117.28 1fax h SER 167 Ca 0.01 0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1fax h SER 167 Cb 0.23 -0.12 -0.08 0.00 0.14 0.00 0.00 62.40 62.58 1fax h SER 167 CO 0.00 0.43 -0.30 0.00 -1.14 0.00 0.00 176.83 175.82 1fax h LYS 169 N -0.30 -0.04 0.00 0.00 1.57 -0.75 -1.58 116.57 115.47 1fax h LYS 169 Ca 0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1fax h LYS 169 Cb 0.52 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1fax h LYS 169 CO -0.43 -0.03 -0.05 1.25 -0.57 0.00 0.00 179.45 179.62 1fax h LEU 170 N -0.04 0.00 0.07 2.94 7.12 0.09 -3.07 115.31 122.43 1fax h LEU 170 Ca 0.11 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.91 1fax h LEU 170 Cb 0.21 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.33 1fax h LEU 170 CO -0.24 0.05 -1.08 0.77 -0.13 0.00 0.00 178.44 177.80 1fax h SER 171 N 0.00 0.24 -3.40 1.25 4.64 -0.25 -3.47 113.55 112.57 1fax h SER 171 Ca -0.00 -0.81 -0.52 0.00 -0.47 0.00 0.00 61.79 59.98 1fax h SER 171 Cb 0.09 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1fax h SER 171 CO 0.01 1.46 0.57 -0.55 -0.87 0.00 0.00 176.83 177.45 1fax s SER 172 N -6.84 7.06 0.00 4.97 0.15 -0.66 -4.89 113.70 113.49 1fax s SER 172 Ca -0.21 2.21 0.22 0.00 0.70 0.00 0.00 55.95 58.87 1fax s SER 172 Cb 0.03 -2.60 1.29 0.00 -1.71 0.00 0.00 66.02 63.03 1fax s SER 172 CO 0.72 -0.42 1.70 -1.20 1.20 0.00 0.00 173.24 175.24 1fax n SER 173 N 2.84 0.00 -4.16 5.45 7.64 -1.26 -4.72 113.62 119.41 1fax n SER 173 Ca 0.06 -0.86 -0.20 0.00 1.01 0.00 0.00 58.87 58.88 1fax n SER 173 Cb 0.45 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.52 1fax n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1fax s PHE 174 N -2.00 1.24 -0.09 1.43 0.08 -1.26 -5.10 117.98 112.28 1fax s PHE 174 Ca 0.32 -0.39 -0.35 0.00 0.12 0.00 0.00 56.93 56.64 1fax s PHE 174 Cb 0.15 -0.72 -0.12 0.00 -0.57 0.00 0.00 43.02 41.76 1fax s PHE 174 CO 0.25 0.05 1.85 1.51 -0.10 0.00 0.00 175.22 178.77 1fax n ILE 175 N 1.69 0.52 -3.25 0.64 3.06 -1.26 -4.96 119.36 115.79 1fax n ILE 175 Ca -0.19 -0.09 -0.40 0.00 -2.50 0.00 0.00 62.75 59.57 1fax n ILE 175 Cb 0.54 -1.79 -0.08 0.00 0.54 0.00 0.00 39.64 38.86 1fax n ILE 175 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 1fax s ILE 176 N 3.81 5.07 0.54 9.51 -1.09 -1.26 -5.03 121.20 132.75 1fax s ILE 176 Ca 0.92 0.79 0.04 0.00 -2.23 0.00 0.00 60.65 60.17 1fax s ILE 176 Cb -0.73 -3.83 0.05 0.00 -1.58 0.00 0.00 42.46 36.36 1fax s ILE 176 CO 0.52 0.05 0.76 0.42 -1.23 0.00 0.00 174.94 175.46 1fax s THR 177 N 2.31 2.62 -2.00 2.92 -4.23 -1.26 -4.96 115.64 111.03 1fax s THR 177 Ca 0.20 -0.77 0.08 0.00 -1.18 0.00 0.00 61.69 60.03 1fax s THR 177 Cb -0.16 -2.85 0.24 0.00 1.34 0.00 0.00 72.50 71.07 1fax s THR 177 CO 0.10 0.00 0.92 0.00 -0.54 0.00 0.00 174.62 175.10 1fax n GLN 178 N -2.28 0.38 -0.12 3.99 6.02 -1.26 -0.88 117.38 123.23 1fax n GLN 178 Ca 0.10 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.21 1fax n GLN 178 Cb 0.60 -1.35 0.24 0.00 1.02 0.00 0.00 30.24 30.74 1fax n GLN 178 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1fax n ASN 179 N -0.85 2.93 -4.37 1.08 3.02 -1.26 -4.89 115.26 110.92 1fax n ASN 179 Ca 0.06 -1.92 -0.22 0.00 -0.03 0.00 0.00 54.58 52.48 1fax n ASN 179 Cb 0.03 -0.16 -0.11 0.00 -0.61 0.00 0.00 39.78 38.94 1fax n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1fax s MET 180 N -1.69 1.38 0.00 3.52 -1.94 -0.06 -0.75 119.30 119.76 1fax s MET 180 Ca 0.35 -1.53 -0.11 0.00 -1.71 0.00 0.00 55.69 52.69 1fax s MET 180 Cb 0.21 -1.39 0.01 0.00 2.01 0.00 0.00 34.83 35.68 1fax s MET 180 CO 0.30 0.27 0.23 -0.59 -0.01 0.00 0.00 175.02 175.22 1fax s PHE 181 N -2.37 -0.06 -0.09 -0.03 -0.71 0.26 -4.68 117.98 110.30 1fax s PHE 181 Ca 0.21 0.02 -0.12 0.00 -1.04 0.00 0.00 56.93 56.00 1fax s PHE 181 Cb -0.04 0.02 -0.05 0.00 -1.21 0.00 0.00 43.02 41.74 1fax s PHE 181 CO 0.08 -0.36 0.29 0.00 -1.34 0.00 0.00 175.22 173.90 1fax s ALA 183 N -0.55 -0.59 0.00 0.00 0.00 0.28 -1.56 121.76 119.35 1fax s ALA 183 Ca 0.19 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1fax s ALA 183 Cb -0.14 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1fax s ALA 183 CO 0.08 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1fax n GLY 184 N 4.56 -1.66 3.58 0.00 0.00 -0.96 -2.64 105.19 108.06 1fax n GLY 184 Ca -0.20 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.30 1fax n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fax s TYR 185 N -2.77 2.97 0.06 1.61 1.51 -1.26 -4.53 117.35 114.94 1fax s TYR 185 Ca 0.00 -0.01 -0.29 0.00 -1.01 0.00 0.00 57.07 55.76 1fax s TYR 185 Cb 0.00 -1.75 -0.18 0.00 -0.11 0.00 0.00 41.96 39.92 1fax s TYR 185 CO 0.00 0.29 1.53 0.22 -1.11 0.00 0.00 175.55 176.48 1fax h ASP 185 N 5.46 -0.54 0.00 2.29 1.82 -1.91 -3.41 116.42 120.12 1fax h ASP 185 Ca -0.46 -0.03 -0.05 0.00 -0.39 0.00 0.00 57.03 56.10 1fax h ASP 185 Cb 1.18 0.14 -0.01 0.00 0.68 0.00 0.00 39.33 41.32 1fax h ASP 185 CO 0.54 -0.31 -1.19 0.41 -1.61 0.00 0.00 179.24 177.08 1fax n THR 185 N -5.33 0.19 -1.99 2.25 -1.04 -1.26 -0.35 114.28 106.76 1fax n THR 185 Ca -0.11 -0.11 -0.43 0.00 -2.04 0.00 0.00 64.05 61.36 1fax n THR 185 Cb 0.28 -0.85 -0.03 0.00 -1.82 0.00 0.00 70.33 67.92 1fax n THR 185 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1fax s LYS 186 N -2.07 3.74 -0.93 -2.82 2.20 -1.26 -4.79 119.74 113.81 1fax s LYS 186 Ca -0.02 1.82 -0.24 0.00 -0.36 0.00 0.00 55.97 57.16 1fax s LYS 186 Cb 0.01 -4.10 -0.05 0.00 -1.51 0.00 0.00 37.83 32.18 1fax s LYS 186 CO 0.10 -1.38 1.93 -0.65 -0.36 0.00 0.00 175.35 174.99 1fax s GLN 187 N 4.90 2.59 -0.28 4.03 -0.21 -1.26 -4.57 119.66 124.86 1fax s GLN 187 Ca 0.77 -0.39 -0.20 0.00 0.02 0.00 0.00 55.36 55.56 1fax s GLN 187 Cb -0.28 -5.09 0.11 0.00 1.00 0.00 0.00 33.01 28.75 1fax s GLN 187 CO 0.32 -3.38 0.87 -1.21 -2.12 0.00 0.00 175.29 169.77 1fax s GLU 188 N 6.88 0.59 0.00 2.91 2.02 -1.26 -4.75 118.70 125.10 1fax s GLU 188 Ca 0.69 0.85 0.00 0.00 0.02 0.00 0.00 54.97 56.53 1fax s GLU 188 Cb -0.06 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.38 1fax s GLU 188 CO -0.00 -0.10 0.00 -3.47 0.02 0.00 0.00 175.26 171.71 1fax n ASP 189 N 3.22 0.00 -4.74 -0.19 2.03 -0.53 -4.25 116.55 112.10 1fax n ASP 189 Ca -0.16 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.84 1fax n ASP 189 Cb 0.57 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.08 1fax n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fax s ALA 190 N -2.00 1.99 0.00 -1.67 0.00 -1.26 -0.72 121.76 118.10 1fax s ALA 190 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.31 1fax s ALA 190 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1fax s ALA 190 CO 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 175.76 173.67 1fax n GLN 192 N 0.00 2.65 -0.29 0.00 6.02 -1.26 -2.54 117.38 121.96 1fax n GLN 192 Ca 0.00 0.94 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 1fax n GLN 192 Cb 0.00 -2.72 0.00 0.00 1.02 0.00 0.00 30.24 28.54 1fax n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1fax n GLY 193 N 2.14 0.75 0.64 1.08 0.00 -1.26 -0.63 105.19 107.90 1fax n GLY 193 Ca 0.09 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.17 1fax n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fax n ASP 194 N 0.00 2.78 -4.66 1.61 8.00 -1.05 -3.44 116.55 119.78 1fax n ASP 194 Ca 0.00 -1.90 -0.45 0.00 0.71 0.00 0.00 54.79 53.15 1fax n ASP 194 Cb 0.00 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 1fax n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1fax n SER 195 N 0.60 2.75 0.00 -2.24 7.64 -1.26 -0.90 113.62 120.20 1fax n SER 195 Ca 0.11 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.12 1fax n SER 195 Cb 0.41 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 1fax n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fax n GLY 196 N 2.45 2.45 3.77 0.23 0.00 0.15 -0.82 105.19 113.42 1fax n GLY 196 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1fax n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fax s GLY 197 N -1.87 1.76 0.10 -0.02 0.00 -0.08 -3.53 107.32 103.68 1fax s GLY 197 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 44.72 44.71 1fax s GLY 197 CO 0.00 0.64 1.28 2.56 0.00 0.00 0.00 173.10 177.58 1fax s PRO 198 N -4.77 4.39 -0.50 2.90 0.04 -1.26 -0.89 135.00 134.91 1fax s PRO 198 Ca 0.62 1.91 -0.08 0.00 0.04 0.00 0.00 61.00 63.49 1fax s PRO 198 Cb -0.17 -3.29 0.13 0.00 0.04 0.00 0.00 34.50 31.20 1fax s PRO 198 CO 0.53 -0.31 0.36 -1.58 0.04 0.00 0.00 177.00 176.04 1fax s HIS 199 N 0.95 3.47 0.14 0.56 2.46 0.65 -3.05 115.29 120.47 1fax s HIS 199 Ca 0.60 -2.04 0.02 0.00 0.47 0.00 0.00 55.06 54.12 1fax s HIS 199 Cb -0.33 -3.46 -0.04 0.00 -0.13 0.00 0.00 32.58 28.63 1fax s HIS 199 CO 0.31 -0.98 0.26 0.54 -2.47 0.00 0.00 174.74 172.40 1fax s VAL 200 N 1.12 5.26 -0.05 0.89 0.11 0.46 -1.46 120.40 126.73 1fax s VAL 200 Ca 0.08 -0.69 0.05 0.00 -2.93 0.00 0.00 61.98 58.49 1fax s VAL 200 Cb -0.24 -3.69 -0.01 0.00 -1.53 0.00 0.00 36.38 30.91 1fax s VAL 200 CO -0.02 -0.07 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.59 1fax s THR 201 N -1.72 1.71 -0.11 5.04 2.01 0.50 -0.30 115.64 122.76 1fax s THR 201 Ca 0.34 -0.87 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 1fax s THR 201 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1fax s THR 201 CO 0.28 0.48 0.57 -0.60 -0.69 0.00 0.00 174.62 174.67 1fax s ARG 202 N -0.03 4.35 -0.15 4.92 3.52 -1.26 -0.82 118.95 129.48 1fax s ARG 202 Ca -0.04 0.62 -0.01 0.00 -0.13 0.00 0.00 55.73 56.16 1fax s ARG 202 Cb -0.13 -3.46 0.04 0.00 -1.56 0.00 0.00 34.95 29.84 1fax s ARG 202 CO 0.03 0.06 -0.03 0.12 -0.81 0.00 0.00 175.30 174.67 1fax s PHE 203 N 0.90 1.44 -1.13 5.12 5.36 0.16 -4.87 117.98 124.96 1fax s PHE 203 Ca 0.30 -0.89 -0.24 0.00 -0.96 0.00 0.00 56.93 55.14 1fax s PHE 203 Cb -0.16 -1.19 0.01 0.00 -0.34 0.00 0.00 43.02 41.34 1fax s PHE 203 CO 0.13 -0.56 0.74 1.63 -1.46 0.00 0.00 175.22 175.69 1fax n LYS 204 N 4.95 -0.86 0.00 10.12 5.02 -1.26 -1.18 118.16 134.95 1fax n LYS 204 Ca -0.11 0.36 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1fax n LYS 204 Cb 0.48 -3.41 0.00 0.00 -0.02 0.00 0.00 35.03 32.08 1fax n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1fax n ASP 205 N -2.44 0.00 -4.76 4.39 8.00 -1.26 -4.94 116.55 115.54 1fax n ASP 205 Ca -0.11 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 54.99 1fax n ASP 205 Cb 0.58 -0.33 -0.05 0.00 -0.02 0.00 0.00 41.12 41.30 1fax n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1fax s THR 206 N -0.35 4.48 -0.24 -3.53 2.01 -0.32 -5.04 115.64 112.65 1fax s THR 206 Ca 0.00 1.77 -0.09 0.00 0.31 0.00 0.00 61.69 63.68 1fax s THR 206 Cb 0.00 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 1fax s THR 206 CO 0.00 0.44 0.12 -0.31 -0.69 0.00 0.00 174.62 174.18 1fax s TYR 207 N -0.62 3.22 -0.14 4.92 1.51 -1.26 -0.66 117.35 124.32 1fax s TYR 207 Ca 0.39 0.01 -0.02 0.00 -1.01 0.00 0.00 57.07 56.44 1fax s TYR 207 Cb -0.23 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.37 1fax s TYR 207 CO 0.26 -0.06 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.51 1fax s PHE 208 N 1.16 2.94 -0.03 2.71 0.08 -0.00 -1.30 117.98 123.54 1fax s PHE 208 Ca 0.06 -0.41 -0.30 0.00 0.12 0.00 0.00 56.93 56.40 1fax s PHE 208 Cb -0.14 -1.90 -0.05 0.00 -0.57 0.00 0.00 43.02 40.35 1fax s PHE 208 CO 0.05 -0.08 1.53 0.08 -0.10 0.00 0.00 175.22 176.69 1fax s VAL 209 N 0.30 3.63 -0.07 -0.44 1.01 -0.10 -0.37 120.40 124.37 1fax s VAL 209 Ca -0.06 0.90 0.08 0.00 0.00 0.00 0.00 61.98 62.90 1fax s VAL 209 Cb -0.15 -3.58 -0.12 0.00 0.00 0.00 0.00 36.38 32.53 1fax s VAL 209 CO 0.04 -0.04 0.08 0.35 0.00 0.00 0.00 175.10 175.53 1fax n THR 210 N 5.11 0.43 -3.74 3.92 -2.24 -0.63 -4.53 114.28 112.60 1fax n THR 210 Ca 0.15 -0.33 -0.09 0.00 -2.27 0.00 0.00 64.05 61.52 1fax n THR 210 Cb 0.43 -0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.17 1fax n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1fax s GLY 211 N -3.79 -0.22 -0.02 3.38 0.00 -0.54 -0.58 107.32 105.55 1fax s GLY 211 Ca -0.04 -0.10 0.08 0.00 0.00 0.00 0.00 44.72 44.66 1fax s GLY 211 CO 0.37 -0.04 -0.25 -0.26 0.00 0.00 0.00 173.10 172.92 1fax s ILE 212 N -3.87 1.99 -0.03 0.90 -4.36 -0.90 -0.25 121.20 114.67 1fax s ILE 212 Ca 0.08 -1.09 -0.30 0.00 -0.26 0.00 0.00 60.65 59.09 1fax s ILE 212 Cb -0.04 -1.65 -0.08 0.00 1.25 0.00 0.00 42.46 41.94 1fax s ILE 212 CO 0.01 0.55 1.96 -0.69 0.24 0.00 0.00 174.94 177.01 1fax s VAL 213 N -0.60 3.12 0.00 8.37 1.01 -0.07 -0.51 120.40 131.72 1fax s VAL 213 Ca 0.10 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.22 1fax s VAL 213 Cb -0.10 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1fax s VAL 213 CO -0.01 -0.03 0.00 -0.24 0.00 0.00 0.00 175.10 174.83 1fax n SER 214 N 8.24 0.00 -0.89 3.32 2.88 -1.11 -0.68 113.62 125.39 1fax n SER 214 Ca 0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 1fax n SER 214 Cb 0.42 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1fax n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1fax n TRP 215 N -1.87 -0.53 0.00 0.66 4.27 -1.18 -4.75 117.44 114.05 1fax n TRP 215 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1fax n TRP 215 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1fax n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1fax n GLY 216 N 0.00 3.02 3.56 -1.67 0.00 -1.26 -2.07 105.19 106.76 1fax n GLY 216 Ca 0.00 -0.64 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 1fax n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fax s GLU 217 N -2.00 3.16 4.99 1.61 2.02 -1.26 -4.79 118.70 122.43 1fax s GLU 217 Ca 0.00 -0.51 0.00 0.00 0.02 0.00 0.00 54.97 54.48 1fax s GLU 217 Cb 0.00 -4.86 0.00 0.00 0.10 0.00 0.00 34.13 29.37 1fax s GLU 217 CO 0.00 -2.48 0.00 0.41 0.02 0.00 0.00 175.26 173.21 1fax n GLY 218 N 6.32 1.73 3.12 -1.39 0.00 -1.26 -4.57 105.19 109.14 1fax n GLY 218 Ca 0.25 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 1fax n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fax n ALA 221 N 3.50 -0.54 -2.27 0.00 0.00 -1.26 -4.85 120.51 115.09 1fax n ALA 221 Ca -0.18 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 1fax n ALA 221 Cb 0.56 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1fax n ALA 221 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1fax s ARG 222 N -4.24 4.30 -0.32 0.00 3.52 -1.26 -4.56 118.95 116.39 1fax s ARG 222 Ca 0.00 1.91 -0.29 0.00 -0.13 0.00 0.00 55.73 57.21 1fax s ARG 222 Cb 0.00 -3.55 -0.07 0.00 -1.56 0.00 0.00 34.95 29.76 1fax s ARG 222 CO 0.00 -0.54 2.27 1.17 -0.81 0.00 0.00 175.30 177.39 1fax n LYS 223 N 5.26 1.55 0.00 5.12 4.81 -1.26 -1.06 118.16 132.58 1fax n LYS 223 Ca 0.13 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 1fax n LYS 223 Cb 0.44 -3.08 0.00 0.00 0.02 0.00 0.00 35.03 32.41 1fax n LYS 223 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fax n GLY 223 N 6.00 2.33 3.75 3.14 0.00 0.53 -5.02 105.19 115.92 1fax n GLY 223 Ca 0.35 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.10 1fax n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fax s LYS 224 N -0.10 2.18 0.17 1.61 -0.14 -0.22 -4.86 119.74 118.39 1fax s LYS 224 Ca 0.00 -2.01 0.06 0.00 -1.36 0.00 0.00 55.97 52.66 1fax s LYS 224 Cb 0.00 -1.86 -0.04 0.00 -1.68 0.00 0.00 37.83 34.24 1fax s LYS 224 CO 0.00 -0.23 -0.12 0.71 -0.76 0.00 0.00 175.35 174.95 1fax s TYR 225 N -2.69 1.48 0.21 3.18 2.02 -1.26 -4.36 117.35 115.92 1fax s TYR 225 Ca 0.33 -0.66 -0.28 0.00 -0.37 0.00 0.00 57.07 56.09 1fax s TYR 225 Cb 0.04 -0.72 -0.09 0.00 -0.40 0.00 0.00 41.96 40.79 1fax s TYR 225 CO 0.18 0.21 0.87 0.20 -1.57 0.00 0.00 175.55 175.45 1fax s GLY 226 N -3.17 3.04 0.11 0.71 0.00 -1.08 -4.51 107.32 102.41 1fax s GLY 226 Ca 0.19 0.51 0.08 0.00 0.00 0.00 0.00 44.72 45.50 1fax s GLY 226 CO 0.04 1.06 -0.15 -0.26 0.00 0.00 0.00 173.10 173.79 1fax s ILE 227 N -1.16 3.03 0.11 0.90 -5.25 -0.88 -0.56 121.20 117.40 1fax s ILE 227 Ca 0.39 -1.40 0.07 0.00 -0.99 0.00 0.00 60.65 58.72 1fax s ILE 227 Cb -0.25 -2.39 -0.04 0.00 2.95 0.00 0.00 42.46 42.73 1fax s ILE 227 CO 0.30 0.12 -0.17 -0.31 -1.79 0.00 0.00 174.94 173.08 1fax s TYR 228 N -1.15 1.59 0.16 1.37 2.02 0.34 -2.73 117.35 118.94 1fax s TYR 228 Ca 0.19 -0.47 -0.30 0.00 -0.37 0.00 0.00 57.07 56.12 1fax s TYR 228 Cb -0.11 -0.85 -0.07 0.00 -0.40 0.00 0.00 41.96 40.53 1fax s TYR 228 CO 0.11 0.19 1.18 0.99 -1.57 0.00 0.00 175.55 176.45 1fax s THR 229 N -1.61 3.71 -0.64 -0.71 2.01 0.33 -0.57 115.64 118.15 1fax s THR 229 Ca 0.07 1.39 -0.27 0.00 0.31 0.00 0.00 61.69 63.20 1fax s THR 229 Cb -0.08 -3.89 0.02 0.00 0.01 0.00 0.00 72.50 68.56 1fax s THR 229 CO 0.04 0.20 1.39 -0.75 -0.69 0.00 0.00 174.62 174.81 1fax s LYS 230 N 0.00 3.19 0.52 4.92 2.20 0.07 -2.12 119.74 128.52 1fax s LYS 230 Ca 0.53 0.16 0.22 0.00 -0.36 0.00 0.00 55.97 56.53 1fax s LYS 230 Cb -0.31 -4.17 1.40 0.00 -1.51 0.00 0.00 37.83 33.23 1fax s LYS 230 CO 0.35 -2.10 2.11 0.28 -0.36 0.00 0.00 175.35 175.63 1fax h VAL 231 N 6.27 0.79 -0.41 4.02 2.07 -1.17 -1.62 116.25 126.21 1fax h VAL 231 Ca -0.27 -0.32 0.12 0.00 0.82 0.00 0.00 66.70 67.05 1fax h VAL 231 Cb 1.08 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1fax h VAL 231 CO 1.23 0.08 0.35 0.74 0.02 0.00 0.00 177.57 179.99 1fax h THR 232 N 0.00 0.58 -0.01 2.57 2.02 -1.89 0.13 112.91 116.32 1fax h THR 232 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1fax h THR 232 Cb 0.18 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1fax h THR 232 CO 0.01 0.00 -0.11 0.00 0.37 0.00 0.00 175.52 175.79 1fax n ALA 233 N -2.49 2.79 0.00 6.16 0.00 -0.61 -4.26 120.51 122.10 1fax n ALA 233 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1fax n ALA 233 Cb 0.53 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1fax n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1fax n PHE 234 N -0.61 0.00 -0.31 0.00 3.72 0.42 -4.80 117.46 115.88 1fax n PHE 234 Ca 0.16 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.79 1fax n PHE 234 Cb 0.30 0.00 0.43 0.00 -0.94 0.00 0.00 39.48 39.27 1fax n PHE 234 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1fax n LEU 235 N -0.74 0.13 -0.14 4.37 7.99 -0.93 0.37 117.00 128.06 1fax n LEU 235 Ca 0.00 1.57 -0.09 0.00 -0.01 0.00 0.00 56.01 57.47 1fax n LEU 235 Cb 0.00 -0.68 -0.01 0.00 -0.11 0.00 0.00 43.42 42.62 1fax n LEU 235 CO 0.00 -1.68 0.88 0.11 -1.51 0.00 0.00 177.39 175.19 1fax h LYS 236 N 0.00 0.63 -0.92 3.23 1.57 -1.91 -0.70 116.57 118.47 1fax h LYS 236 Ca 0.69 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 59.35 1fax h LYS 236 Cb 1.69 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.86 1fax h LYS 236 CO -0.79 0.63 0.61 2.35 -0.57 0.00 0.00 179.45 181.68 1fax h TRP 237 N 0.50 1.15 0.41 -1.35 7.01 -0.42 0.31 115.95 123.56 1fax h TRP 237 Ca 0.13 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.14 1fax h TRP 237 Cb 0.27 -0.39 -0.00 0.00 -2.10 0.00 0.00 29.16 26.94 1fax h TRP 237 CO 0.01 0.71 -0.22 0.82 -2.79 0.00 0.00 178.44 176.97 1fax h ILE 238 N 1.23 0.54 -0.28 2.65 2.04 -0.31 -1.65 117.51 121.75 1fax h ILE 238 Ca 0.34 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.18 1fax h ILE 238 Cb -0.11 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1fax h ILE 238 CO -0.08 0.00 0.05 0.44 0.00 0.00 0.00 178.15 178.56 1fax h ASP 239 N -0.59 0.36 -0.12 1.72 3.32 -0.60 0.13 116.42 120.64 1fax h ASP 239 Ca -0.05 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 56.98 1fax h ASP 239 Cb 0.47 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 1fax h ASP 239 CO 0.07 0.38 -0.39 0.03 -1.72 0.00 0.00 179.24 177.61 1fax h ARG 240 N 0.39 -0.38 -0.29 3.56 3.08 -0.65 -0.55 114.38 119.55 1fax h ARG 240 Ca 0.09 0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1fax h ARG 240 Cb 0.18 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 1fax h ARG 240 CO -0.00 -0.25 -0.10 0.66 -1.07 0.00 0.00 179.97 179.20 1fax h SER 241 N -0.40 0.46 0.33 7.04 4.64 -0.57 0.83 113.55 125.87 1fax h SER 241 Ca 0.03 -0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.17 1fax h SER 241 Cb 0.47 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 1fax h SER 241 CO -0.33 0.60 -0.32 0.24 -0.87 0.00 0.00 176.83 176.15 1fax h MET 242 N 0.44 0.00 -0.10 4.77 2.86 -0.42 -1.00 114.93 121.48 1fax h MET 242 Ca 0.09 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.51 1fax h MET 242 Cb 0.45 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.12 1fax h MET 242 CO 0.02 0.32 -0.81 0.87 1.06 0.00 0.00 176.91 178.38 1fax h LYS 243 N 0.00 0.65 0.00 1.72 1.79 -0.20 -3.49 116.57 117.04 1fax h LYS 243 Ca -0.00 -0.56 0.00 0.00 -2.18 0.00 0.00 60.65 57.91 1fax h LYS 243 Cb 0.57 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1fax h LYS 243 CO 0.04 1.17 0.00 2.41 -1.08 0.00 0.00 179.45 182.00 1fax n THR 244 N -3.88 0.00 -0.92 -0.16 -1.04 0.20 -5.12 114.28 103.35 1fax n THR 244 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1fax n THR 244 Cb 0.76 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.27 1fax n THR 244 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29