#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f90 s TYR 4 N 0.00 1.75 0.01 5.64 1.51 -0.80 -5.00 117.35 120.45 2f90 s TYR 4 Ca 0.00 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.66 2f90 s TYR 4 Cb 0.00 -0.97 -0.01 0.00 -0.11 0.00 0.00 41.96 40.87 2f90 s TYR 4 CO 0.00 0.18 -0.05 0.15 -1.11 0.00 0.00 175.55 174.72 2f90 s LYS 5 N -1.77 0.36 0.05 -0.62 1.02 -1.26 -0.95 119.74 116.57 2f90 s LYS 5 Ca 0.06 -0.32 -0.01 0.00 0.02 0.00 0.00 55.97 55.72 2f90 s LYS 5 Cb -0.10 -0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 36.90 2f90 s LYS 5 CO 0.04 0.07 -0.03 -0.48 -0.92 0.00 0.00 175.35 174.02 2f90 s LEU 6 N -0.54 2.46 -0.09 3.17 0.05 -0.79 -4.45 118.68 118.49 2f90 s LEU 6 Ca -0.02 -0.94 0.01 0.00 0.05 0.00 0.00 54.13 53.22 2f90 s LEU 6 Cb -0.04 0.19 -0.03 0.00 -2.05 0.00 0.00 46.19 44.26 2f90 s LEU 6 CO -0.00 -0.56 -0.09 -0.63 -0.55 0.00 0.00 176.35 174.51 2f90 s ILE 7 N -3.62 3.45 0.06 1.48 -1.09 -0.51 -2.30 121.20 118.66 2f90 s ILE 7 Ca 0.04 -0.55 0.03 0.00 -2.23 0.00 0.00 60.65 57.94 2f90 s ILE 7 Cb 0.06 -2.42 -0.03 0.00 -1.58 0.00 0.00 42.46 38.49 2f90 s ILE 7 CO -0.09 0.56 -0.09 -0.32 -1.23 0.00 0.00 174.94 173.78 2f90 s MET 8 N -0.35 0.66 0.02 2.79 -2.45 -0.65 0.10 119.30 119.42 2f90 s MET 8 Ca 0.04 -0.92 -0.27 0.00 -1.25 0.00 0.00 55.69 53.29 2f90 s MET 8 Cb -0.12 -0.40 0.09 0.00 1.25 0.00 0.00 34.83 35.65 2f90 s MET 8 CO 0.02 0.07 0.79 -0.48 1.05 0.00 0.00 175.02 176.47 2f90 s LEU 9 N -1.91 -0.45 0.05 4.11 2.34 -0.76 -0.01 118.68 122.05 2f90 s LEU 9 Ca -0.04 0.11 -0.16 0.00 0.06 0.00 0.00 54.13 54.10 2f90 s LEU 9 Cb -0.07 2.23 -0.06 0.00 -0.56 0.00 0.00 46.19 47.72 2f90 s LEU 9 CO -0.00 -0.69 0.49 -0.60 -1.06 0.00 0.00 176.35 174.49 2f90 s ARG 10 N -2.90 4.04 0.80 1.48 3.52 -1.26 -1.49 118.95 123.14 2f90 s ARG 10 Ca 0.02 0.55 -0.15 0.00 -0.13 0.00 0.00 55.73 56.02 2f90 s ARG 10 Cb -0.01 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.19 2f90 s ARG 10 CO -0.07 0.64 0.56 -2.39 -0.81 0.00 0.00 175.30 173.23 2f90 n HIS 11 N 1.62 -0.79 -1.08 5.12 1.44 -0.78 -1.05 115.22 119.70 2f90 n HIS 11 Ca -0.11 0.32 -0.31 0.00 -2.01 0.00 0.00 57.72 55.61 2f90 n HIS 11 Cb 0.52 -1.90 0.12 0.00 0.12 0.00 0.00 29.99 28.85 2f90 n HIS 11 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2f90 s GLY 12 N -1.69 1.72 0.28 -1.39 0.00 -1.26 -2.57 107.32 102.41 2f90 s GLY 12 Ca 0.64 0.41 -0.28 0.00 0.00 0.00 0.00 44.72 45.49 2f90 s GLY 12 CO 0.60 0.79 0.92 -2.21 0.00 0.00 0.00 173.10 173.20 2f90 n GLU 13 N -3.71 1.12 -4.56 2.90 2.13 -1.26 -4.81 120.64 112.45 2f90 n GLU 13 Ca 0.10 0.39 -0.26 0.00 0.66 0.00 0.00 57.16 58.06 2f90 n GLU 13 Cb 0.53 -1.70 -0.11 0.00 0.27 0.00 0.00 31.44 30.42 2f90 n GLU 13 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2f90 s GLY 14 N -0.64 2.32 0.27 8.31 0.00 -1.26 -2.18 107.32 114.13 2f90 s GLY 14 Ca 0.60 -2.20 -0.00 0.00 0.00 0.00 0.00 44.72 43.12 2f90 s GLY 14 CO 0.59 -2.00 1.80 0.00 0.00 0.00 0.00 173.10 173.49 2f90 h ALA 15 N 1.92 1.39 0.00 3.20 0.00 -1.88 -1.09 119.26 122.79 2f90 h ALA 15 Ca -0.43 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2f90 h ALA 15 Cb 1.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2f90 h ALA 15 CO 0.76 0.06 -0.28 -1.49 0.00 0.00 0.00 179.25 178.30 2f90 h TRP 16 N 0.80 0.00 -0.40 0.00 4.06 -1.90 0.15 115.95 118.66 2f90 h TRP 16 Ca 0.48 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 61.28 2f90 h TRP 16 Cb 0.57 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.72 2f90 h TRP 16 CO -0.04 0.28 -0.31 -0.91 -3.56 0.00 0.00 178.44 173.90 2f90 h ASN 17 N 0.00 0.96 -0.38 -3.49 4.21 -1.46 0.12 115.58 115.54 2f90 h ASN 17 Ca -0.00 -0.44 -0.11 0.00 1.21 0.00 0.00 56.30 56.95 2f90 h ASN 17 Cb 0.53 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.45 2f90 h ASN 17 CO 0.04 1.20 -0.19 0.50 -1.29 0.00 0.00 177.43 177.68 2f90 h LYS 18 N 0.73 0.81 0.00 0.81 3.64 -1.00 -2.94 116.57 118.62 2f90 h LYS 18 Ca 0.08 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 2f90 h LYS 18 Cb 0.89 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2f90 h LYS 18 CO 0.08 0.99 0.00 0.39 -2.27 0.00 0.00 179.45 178.64 2f90 n GLU 19 N -4.25 0.18 -3.24 1.90 1.02 -0.02 -4.95 120.64 111.29 2f90 n GLU 19 Ca -0.02 0.01 -0.15 0.00 -0.02 0.00 0.00 57.16 56.98 2f90 n GLU 19 Cb 0.43 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.42 2f90 n GLU 19 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2f90 n ASN 20 N -1.41 -2.43 -4.23 1.62 5.15 0.25 -4.92 115.26 109.28 2f90 n ASN 20 Ca 0.10 -0.52 -0.30 0.00 -0.60 0.00 0.00 54.58 53.26 2f90 n ASN 20 Cb 0.29 -4.42 -0.16 0.00 -0.53 0.00 0.00 39.78 34.96 2f90 n ASN 20 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2f90 s ARG 21 N -5.26 2.29 0.13 1.20 0.52 -0.25 -0.98 118.95 116.59 2f90 s ARG 21 Ca 0.05 -0.82 -0.32 0.00 -0.52 0.00 0.00 55.73 54.12 2f90 s ARG 21 Cb -0.02 -1.97 -0.12 0.00 0.52 0.00 0.00 34.95 33.35 2f90 s ARG 21 CO 0.62 0.36 1.75 1.19 0.02 0.00 0.00 175.30 179.23 2f90 n PHE 22 N 2.96 2.53 -0.09 -0.53 3.72 -0.33 -4.58 117.46 121.13 2f90 n PHE 22 Ca -0.17 0.02 -0.19 0.00 -0.05 0.00 0.00 57.45 57.06 2f90 n PHE 22 Cb 0.52 -2.66 -0.06 0.00 -0.94 0.00 0.00 39.48 36.34 2f90 n PHE 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2f90 n SER 24 N -3.96 0.00 0.00 0.00 2.88 -1.26 -1.50 113.62 109.79 2f90 n SER 24 Ca -0.35 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.27 2f90 n SER 24 Cb 0.71 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.57 2f90 n SER 24 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2f90 n TRP 25 N 14.00 0.00 -2.10 0.66 7.02 -1.26 -4.72 117.44 131.04 2f90 n TRP 25 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2f90 n TRP 25 Cb 0.00 -0.32 -0.03 0.00 -2.42 0.00 0.00 31.31 28.54 2f90 n TRP 25 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 2f90 s VAL 26 N -2.64 3.09 -0.98 -0.99 1.01 -0.56 -4.87 120.40 114.46 2f90 s VAL 26 Ca 0.14 0.79 -0.08 0.00 0.00 0.00 0.00 61.98 62.83 2f90 s VAL 26 Cb 0.11 -3.51 -0.16 0.00 0.00 0.00 0.00 36.38 32.82 2f90 s VAL 26 CO 0.26 0.07 3.19 -0.67 0.00 0.00 0.00 175.10 177.94 2f90 n ASP 27 N 3.78 7.28 -4.76 3.32 4.64 -1.26 -4.97 116.55 124.58 2f90 n ASP 27 Ca 0.11 -2.52 -0.36 0.00 -1.38 0.00 0.00 54.79 50.64 2f90 n ASP 27 Cb 0.41 -1.49 0.03 0.00 -1.04 0.00 0.00 41.12 39.03 2f90 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2f90 s GLN 28 N 1.75 3.09 0.52 -0.67 -2.07 -1.26 -4.83 119.66 116.20 2f90 s GLN 28 Ca 0.68 1.83 0.02 0.00 -1.82 0.00 0.00 55.36 56.06 2f90 s GLN 28 Cb 0.23 -2.00 0.03 0.00 -1.09 0.00 0.00 33.01 30.18 2f90 s GLN 28 CO -0.04 -1.11 0.74 0.15 -1.32 0.00 0.00 175.29 173.71 2f90 s LYS 29 N -3.24 2.65 0.57 9.60 1.02 -1.26 -4.03 119.74 125.05 2f90 s LYS 29 Ca 0.75 -0.78 -0.17 0.00 0.02 0.00 0.00 55.97 55.79 2f90 s LYS 29 Cb -0.30 -2.52 -0.05 0.00 -0.52 0.00 0.00 37.83 34.44 2f90 s LYS 29 CO 0.33 -0.60 1.06 -0.51 -0.92 0.00 0.00 175.35 174.72 2f90 s LEU 30 N -4.69 3.59 0.00 3.17 1.43 -1.26 -3.96 118.68 116.96 2f90 s LEU 30 Ca 0.56 1.89 0.07 0.00 -1.03 0.00 0.00 54.13 55.62 2f90 s LEU 30 Cb -0.10 -4.55 0.07 0.00 0.03 0.00 0.00 46.19 41.65 2f90 s LEU 30 CO 0.38 -1.12 0.62 -0.46 0.23 0.00 0.00 176.35 176.00 2f90 n ASN 31 N -1.75 2.20 -0.19 2.29 0.23 -0.93 -4.82 115.26 112.29 2f90 n ASN 31 Ca 0.09 -2.55 -0.00 0.00 -0.53 0.00 0.00 54.58 51.59 2f90 n ASN 31 Cb 0.52 -0.27 0.09 0.00 -2.08 0.00 0.00 39.78 38.05 2f90 n ASN 31 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2f90 h SER 32 N 0.27 -0.06 -0.76 0.53 0.02 -1.97 -1.23 113.55 110.35 2f90 h SER 32 Ca -0.28 0.11 0.02 0.00 -0.84 0.00 0.00 61.79 60.80 2f90 h SER 32 Cb 1.17 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.84 2f90 h SER 32 CO 0.41 -0.01 0.50 -0.33 -1.14 0.00 0.00 176.83 176.25 2f90 h GLU 33 N 0.22 0.97 -0.38 3.45 3.07 -1.95 -2.14 114.58 117.82 2f90 h GLU 33 Ca 0.29 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 59.01 2f90 h GLU 33 Cb 0.44 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 2f90 h GLU 33 CO -0.40 0.64 -0.11 0.78 -1.40 0.00 0.00 179.01 178.52 2f90 h GLY 34 N 1.00 0.72 1.23 -3.84 0.00 -1.27 -0.53 103.07 100.37 2f90 h GLY 34 Ca 0.29 -0.52 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 2f90 h GLY 34 CO -0.08 0.48 -0.03 -0.33 0.00 0.00 0.00 176.54 176.58 2f90 h MET 35 N 0.61 0.92 -0.54 4.80 2.86 -0.91 -0.65 114.93 122.02 2f90 h MET 35 Ca 0.11 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.35 2f90 h MET 35 Cb 0.55 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 2f90 h MET 35 CO 0.03 0.93 -0.11 1.49 1.06 0.00 0.00 176.91 180.31 2f90 h GLU 36 N 0.84 1.02 -0.59 1.72 4.57 -0.97 -0.65 114.58 120.52 2f90 h GLU 36 Ca 0.15 -0.38 -0.02 0.00 -1.18 0.00 0.00 59.36 57.94 2f90 h GLU 36 Cb 0.54 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.04 2f90 h GLU 36 CO 0.03 1.07 0.31 0.93 -1.18 0.00 0.00 179.01 180.16 2f90 h GLU 37 N 0.91 0.84 -0.44 1.92 5.08 -0.69 0.46 114.58 122.66 2f90 h GLU 37 Ca 0.14 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2f90 h GLU 37 Cb 0.68 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2f90 h GLU 37 CO 0.05 0.66 0.16 0.00 -1.00 0.00 0.00 179.01 178.89 2f90 h ALA 38 N 1.14 0.57 -0.25 3.43 0.00 -0.86 -1.20 119.26 122.09 2f90 h ALA 38 Ca 0.21 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2f90 h ALA 38 Cb 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2f90 h ALA 38 CO -0.03 0.19 -0.07 0.00 0.00 0.00 0.00 179.25 179.33 2f90 h ARG 39 N 0.56 0.40 -0.27 0.00 3.08 -0.78 -1.56 114.38 115.81 2f90 h ARG 39 Ca 0.14 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 2f90 h ARG 39 Cb 0.21 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2f90 h ARG 39 CO -0.01 0.49 -0.35 -0.91 -1.07 0.00 0.00 179.97 178.12 2f90 h ASN 40 N 0.38 0.61 -0.62 7.04 2.35 -0.42 -1.39 115.58 123.54 2f90 h ASN 40 Ca 0.08 -0.25 -0.03 0.00 -0.55 0.00 0.00 56.30 55.55 2f90 h ASN 40 Cb 0.37 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 2f90 h ASN 40 CO 0.02 0.91 0.28 0.00 -1.65 0.00 0.00 177.43 176.99 2f90 h GLY 42 N 0.85 0.98 1.07 0.00 0.00 -0.91 -1.32 103.07 103.75 2f90 h GLY 42 Ca 0.21 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 2f90 h GLY 42 CO -0.02 0.40 0.14 0.50 0.00 0.00 0.00 176.54 177.56 2f90 h LYS 43 N 0.92 1.14 -0.42 4.80 1.57 -0.90 -1.12 116.57 122.55 2f90 h LYS 43 Ca 0.24 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2f90 h LYS 43 Cb -0.02 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 2f90 h LYS 43 CO -0.04 1.02 0.11 1.96 -0.57 0.00 0.00 179.45 181.93 2f90 h GLN 44 N 1.07 0.67 -0.25 3.15 4.20 -0.94 -1.67 115.11 121.34 2f90 h GLN 44 Ca 0.22 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 2f90 h GLN 44 Cb 0.41 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2f90 h GLN 44 CO 0.01 0.68 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.65 2f90 h LEU 45 N 0.55 0.39 -0.39 1.46 3.38 -1.03 -2.51 115.31 117.16 2f90 h LEU 45 Ca 0.13 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2f90 h LEU 45 Cb 0.30 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2f90 h LEU 45 CO -0.00 0.55 -0.34 0.50 0.09 0.00 0.00 178.44 179.24 2f90 h LYS 46 N 0.38 0.92 -0.03 1.13 3.64 -0.97 -1.56 116.57 120.08 2f90 h LYS 46 Ca 0.07 -0.47 0.01 0.00 -1.27 0.00 0.00 60.65 59.00 2f90 h LYS 46 Cb 0.45 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2f90 h LYS 46 CO 0.03 1.12 0.03 0.00 -2.27 0.00 0.00 179.45 178.36 2f90 h ALA 47 N 0.78 1.78 -0.42 5.00 0.00 -0.90 0.67 119.26 126.18 2f90 h ALA 47 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2f90 h ALA 47 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2f90 h ALA 47 CO 0.09 -0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.57 2f90 n LEU 48 N -4.15 2.65 -1.63 0.00 4.77 -0.97 -4.94 117.00 112.73 2f90 n LEU 48 Ca -0.02 -1.25 -0.16 0.00 -0.03 0.00 0.00 56.01 54.54 2f90 n LEU 48 Cb 0.12 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2f90 n LEU 48 CO 0.30 0.63 -0.19 0.59 -1.33 0.00 0.00 177.39 177.39 2f90 n ASN 49 N 0.95 -4.91 -4.74 -1.43 5.03 0.23 -4.95 115.26 105.44 2f90 n ASN 49 Ca 0.17 0.15 -0.41 0.00 0.87 0.00 0.00 54.58 55.36 2f90 n ASN 49 Cb 0.44 -3.95 -0.02 0.00 -1.02 0.00 0.00 39.78 35.23 2f90 n ASN 49 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2f90 s PHE 50 N -2.74 2.92 -0.41 3.10 0.40 -0.63 -4.98 117.98 115.66 2f90 s PHE 50 Ca 0.00 0.91 0.02 0.00 -0.60 0.00 0.00 56.93 57.25 2f90 s PHE 50 Cb 0.00 -3.92 0.13 0.00 0.51 0.00 0.00 43.02 39.74 2f90 s PHE 50 CO 0.00 -3.06 0.20 -1.21 0.70 0.00 0.00 175.22 171.85 2f90 s GLU 51 N -0.31 1.18 0.44 0.44 2.02 -1.26 -4.84 118.70 116.37 2f90 s GLU 51 Ca 0.62 -1.82 -0.23 0.00 0.02 0.00 0.00 54.97 53.55 2f90 s GLU 51 Cb -0.44 -2.30 -0.08 0.00 0.10 0.00 0.00 34.13 31.41 2f90 s GLU 51 CO 0.44 -1.12 1.14 -0.06 0.02 0.00 0.00 175.26 175.68 2f90 s PHE 52 N 0.61 2.99 -0.09 1.61 0.40 -1.26 -4.68 117.98 117.57 2f90 s PHE 52 Ca 0.16 1.56 0.12 0.00 -0.60 0.00 0.00 56.93 58.18 2f90 s PHE 52 Cb -0.23 -3.32 -0.18 0.00 0.51 0.00 0.00 43.02 39.80 2f90 s PHE 52 CO -0.04 -1.27 0.14 -0.25 0.70 0.00 0.00 175.22 174.49 2f90 n ASP 53 N -0.35 1.83 -3.66 1.36 10.43 -0.68 -4.91 116.55 120.56 2f90 n ASP 53 Ca 0.06 0.00 -0.15 0.00 2.57 0.00 0.00 54.79 57.28 2f90 n ASP 53 Cb 0.48 1.11 -0.08 0.00 1.84 0.00 0.00 41.12 44.48 2f90 n ASP 53 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2f90 s LEU 54 N -4.59 0.09 -0.05 0.64 1.43 -1.24 -4.27 118.68 110.70 2f90 s LEU 54 Ca -0.06 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 53.71 2f90 s LEU 54 Cb 0.06 1.84 -0.00 0.00 0.03 0.00 0.00 46.19 48.11 2f90 s LEU 54 CO 0.54 -0.40 -0.18 -0.69 0.23 0.00 0.00 176.35 175.86 2f90 s VAL 55 N -0.71 1.48 -0.05 -1.59 1.01 -0.09 -2.72 120.40 117.73 2f90 s VAL 55 Ca -0.08 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.23 2f90 s VAL 55 Cb -0.03 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 35.06 2f90 s VAL 55 CO 0.05 0.43 -0.25 -0.36 0.00 0.00 0.00 175.10 174.96 2f90 s PHE 56 N 0.09 2.37 0.30 5.22 0.40 -0.40 -0.74 117.98 125.22 2f90 s PHE 56 Ca -0.05 -0.63 0.04 0.00 -0.60 0.00 0.00 56.93 55.69 2f90 s PHE 56 Cb -0.12 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.83 2f90 s PHE 56 CO 0.03 -0.16 0.25 0.95 0.70 0.00 0.00 175.22 176.99 2f90 s THR 57 N -0.29 0.00 0.23 0.64 -4.23 -0.30 -0.64 115.64 111.05 2f90 s THR 57 Ca 0.00 -1.97 -0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2f90 s THR 57 Cb -0.13 -2.51 0.05 0.00 1.34 0.00 0.00 72.50 71.25 2f90 s THR 57 CO 0.02 0.00 0.31 -1.54 -0.54 0.00 0.00 174.62 172.88 2f90 n SER 58 N -1.19 0.43 -1.04 3.99 3.41 -1.24 -1.24 113.62 116.74 2f90 n SER 58 Ca 0.06 -1.36 0.11 0.00 -0.26 0.00 0.00 58.87 57.41 2f90 n SER 58 Cb 0.63 -0.20 0.26 0.00 -0.26 0.00 0.00 64.21 64.64 2f90 n SER 58 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2f90 n VAL 59 N -1.84 0.57 -3.03 -3.33 0.24 -1.20 -4.23 118.33 105.52 2f90 n VAL 59 Ca 0.05 -0.70 -0.40 0.00 -2.04 0.00 0.00 64.34 61.25 2f90 n VAL 59 Cb 0.19 0.64 -0.05 0.00 -1.47 0.00 0.00 33.84 33.15 2f90 n VAL 59 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2f90 s LEU 60 N -1.31 4.22 0.61 1.34 1.43 -1.26 -4.95 118.68 118.77 2f90 s LEU 60 Ca 0.38 1.07 0.32 0.00 -1.03 0.00 0.00 54.13 54.87 2f90 s LEU 60 Cb 0.21 -3.06 1.79 0.00 0.03 0.00 0.00 46.19 45.16 2f90 s LEU 60 CO 0.29 -0.24 2.13 -0.55 0.23 0.00 0.00 176.35 178.20 2f90 h ASN 61 N 7.14 0.00 0.56 2.29 -1.07 -1.88 -2.07 115.58 120.55 2f90 h ASN 61 Ca -0.35 0.00 -0.06 0.00 0.07 0.00 0.00 56.30 55.96 2f90 h ASN 61 Cb 1.16 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.40 2f90 h ASN 61 CO 0.78 0.00 -0.30 0.08 0.07 0.00 0.00 177.43 178.07 2f90 h ARG 62 N 0.00 0.00 0.06 4.14 0.11 -1.91 0.19 114.38 116.97 2f90 h ARG 62 Ca 0.06 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 59.89 2f90 h ARG 62 Cb 0.42 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.48 2f90 h ARG 62 CO -0.00 0.30 -1.19 0.66 0.10 0.00 0.00 179.97 179.84 2f90 h SER 63 N 0.00 0.19 0.00 0.08 4.64 -1.67 -2.73 113.55 114.06 2f90 h SER 63 Ca -0.00 -0.22 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2f90 h SER 63 Cb 0.66 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2f90 h SER 63 CO 0.04 1.17 -0.00 0.40 -0.87 0.00 0.00 176.83 177.57 2f90 h ILE 64 N 0.03 1.39 -0.47 0.95 2.04 -1.41 -2.34 117.51 117.70 2f90 h ILE 64 Ca -0.10 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 2f90 h ILE 64 Cb 1.88 2.17 -0.02 0.00 -0.74 0.00 0.00 36.82 40.11 2f90 h ILE 64 CO 0.16 0.30 0.26 0.45 0.00 0.00 0.00 178.15 179.31 2f90 h HIS 65 N -0.49 0.62 -0.42 1.37 3.86 -0.74 0.67 115.15 120.03 2f90 h HIS 65 Ca -0.00 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2f90 h HIS 65 Cb 0.49 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.74 2f90 h HIS 65 CO 0.10 0.44 0.19 1.15 0.86 0.00 0.00 177.93 180.66 2f90 h THR 66 N 0.65 1.19 -0.40 2.45 2.02 -1.43 -1.08 112.91 116.30 2f90 h THR 66 Ca 0.17 -0.55 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 2f90 h THR 66 Cb 0.02 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 2f90 h THR 66 CO -0.03 0.20 0.10 0.00 0.37 0.00 0.00 175.52 176.17 2f90 h ALA 67 N 1.03 0.53 -0.83 6.16 0.00 -0.78 -1.80 119.26 123.58 2f90 h ALA 67 Ca 0.14 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2f90 h ALA 67 Cb 0.15 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2f90 h ALA 67 CO -0.02 0.21 0.54 -1.49 0.00 0.00 0.00 179.25 178.49 2f90 h TRP 68 N 0.51 1.02 -0.60 0.00 6.55 -0.68 0.88 115.95 123.63 2f90 h TRP 68 Ca 0.13 0.03 -0.09 0.00 0.95 0.00 0.00 58.89 59.90 2f90 h TRP 68 Cb 0.31 -0.34 -0.02 0.00 -0.86 0.00 0.00 29.16 28.25 2f90 h TRP 68 CO 0.02 0.62 0.03 -0.07 -1.05 0.00 0.00 178.44 177.98 2f90 h LEU 69 N 1.08 1.01 -0.29 -4.49 3.38 -1.06 -0.87 115.31 114.06 2f90 h LEU 69 Ca 0.31 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2f90 h LEU 69 Cb -0.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 2f90 h LEU 69 CO -0.09 1.05 0.15 0.40 0.09 0.00 0.00 178.44 180.05 2f90 h ILE 70 N 0.93 1.14 -0.49 1.22 2.04 -0.69 -1.98 117.51 119.69 2f90 h ILE 70 Ca 0.17 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 2f90 h ILE 70 Cb 0.52 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 2f90 h ILE 70 CO 0.03 0.14 0.11 -0.07 0.00 0.00 0.00 178.15 178.36 2f90 h LEU 71 N 0.35 0.69 -0.47 1.44 3.38 -0.63 -2.15 115.31 117.92 2f90 h LEU 71 Ca 0.10 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2f90 h LEU 71 Cb 0.09 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2f90 h LEU 71 CO -0.01 0.68 -0.03 -0.08 0.09 0.00 0.00 178.44 179.09 2f90 h GLU 72 N 0.72 0.85 -0.31 1.13 4.81 -0.90 0.16 114.58 121.03 2f90 h GLU 72 Ca 0.16 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2f90 h GLU 72 Cb 0.27 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2f90 h GLU 72 CO -0.00 0.91 0.19 0.93 -0.73 0.00 0.00 179.01 180.30 2f90 h GLU 73 N 0.69 0.42 0.00 1.92 4.39 -1.00 -1.84 114.58 119.16 2f90 h GLU 73 Ca 0.13 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2f90 h GLU 73 Cb 0.55 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2f90 h GLU 73 CO 0.03 0.30 -0.44 1.28 -1.16 0.00 0.00 179.01 179.01 2f90 n LEU 74 N -4.47 0.65 -0.77 1.33 4.77 -0.84 -4.86 117.00 112.81 2f90 n LEU 74 Ca 0.02 0.29 -0.07 0.00 -0.03 0.00 0.00 56.01 56.21 2f90 n LEU 74 Cb 0.08 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2f90 n LEU 74 CO 0.35 -0.05 -0.09 0.61 -1.33 0.00 0.00 177.39 176.88 2f90 n GLY 75 N 1.36 0.30 1.26 -0.72 0.00 0.25 -4.93 105.19 102.70 2f90 n GLY 75 Ca 0.04 -0.61 -0.08 0.00 0.00 0.00 0.00 46.02 45.37 2f90 n GLY 75 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2f90 n GLN 76 N -1.99 2.25 0.32 1.61 6.02 0.31 -4.78 117.38 121.12 2f90 n GLN 76 Ca -0.08 -3.49 0.19 0.00 -0.01 0.00 0.00 57.00 53.60 2f90 n GLN 76 Cb 0.48 -1.89 0.99 0.00 1.02 0.00 0.00 30.24 30.84 2f90 n GLN 76 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2f90 h GLU 77 N 1.36 0.00 0.00 -1.09 3.07 -1.92 -0.94 114.58 115.06 2f90 h GLU 77 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2f90 h GLU 77 Cb 1.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 2f90 h GLU 77 CO 0.42 0.00 0.00 -2.67 -1.40 0.00 0.00 179.01 175.36 2f90 n TRP 78 N -2.92 0.39 -1.93 4.33 4.27 -1.26 -4.86 117.44 115.47 2f90 n TRP 78 Ca -0.02 0.11 -0.42 0.00 -3.89 0.00 0.00 57.50 53.28 2f90 n TRP 78 Cb 0.20 -0.69 -0.03 0.00 -1.36 0.00 0.00 31.31 29.44 2f90 n TRP 78 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2f90 s VAL 79 N -3.04 2.63 0.26 -1.67 1.01 -0.36 -4.92 120.40 114.31 2f90 s VAL 79 Ca 0.13 0.43 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 2f90 s VAL 79 Cb 0.16 -3.28 -0.13 0.00 0.00 0.00 0.00 36.38 33.13 2f90 s VAL 79 CO 0.55 0.03 1.33 -2.65 0.00 0.00 0.00 175.10 174.36 2f90 n PRO 80 N 4.09 1.90 -5.19 2.72 -0.02 -1.26 -4.80 135.00 132.45 2f90 n PRO 80 Ca 0.14 0.67 -0.30 0.00 -2.02 0.00 0.00 63.50 62.00 2f90 n PRO 80 Cb 0.39 -2.28 -0.16 0.00 -0.02 0.00 0.00 33.50 31.43 2f90 n PRO 80 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2f90 s VAL 81 N -0.35 1.90 -0.03 -1.45 1.01 -1.26 -0.91 120.40 119.31 2f90 s VAL 81 Ca 0.65 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2f90 s VAL 81 Cb -0.66 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2f90 s VAL 81 CO 0.53 0.54 -0.12 -0.70 0.00 0.00 0.00 175.10 175.34 2f90 s GLU 82 N -0.40 1.31 -0.03 2.72 2.12 0.08 -4.97 118.70 119.54 2f90 s GLU 82 Ca 0.04 -0.43 0.07 0.00 0.36 0.00 0.00 54.97 55.02 2f90 s GLU 82 Cb -0.11 -1.18 -0.02 0.00 0.26 0.00 0.00 34.13 33.09 2f90 s GLU 82 CO 0.01 0.16 -0.23 -1.12 -0.54 0.00 0.00 175.26 173.53 2f90 s SER 83 N 0.16 2.75 -0.01 -1.70 0.01 -1.26 -1.16 113.70 112.50 2f90 s SER 83 Ca -0.04 -0.43 -0.05 0.00 1.31 0.00 0.00 55.95 56.74 2f90 s SER 83 Cb -0.10 -0.43 0.00 0.00 0.21 0.00 0.00 66.02 65.70 2f90 s SER 83 CO 0.01 0.27 0.11 -0.55 0.41 0.00 0.00 173.24 173.49 2f90 s SER 84 N -0.43 0.01 0.55 2.44 0.15 -0.37 -4.86 113.70 111.18 2f90 s SER 84 Ca 0.06 -0.09 0.35 0.00 0.70 0.00 0.00 55.95 56.97 2f90 s SER 84 Cb -0.10 0.21 1.63 0.00 -1.71 0.00 0.00 66.02 66.05 2f90 s SER 84 CO 0.00 -0.24 2.06 4.11 1.20 0.00 0.00 173.24 180.37 2f90 h TRP 85 N 4.94 0.00 0.00 3.44 5.08 -1.90 -2.30 115.95 125.20 2f90 h TRP 85 Ca -0.29 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.68 2f90 h TRP 85 Cb 1.20 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 2f90 h TRP 85 CO 0.54 0.00 0.00 0.54 -1.28 0.00 0.00 178.44 178.24 2f90 n ARG 86 N -2.96 0.08 -0.02 0.12 1.74 -1.26 -0.97 116.66 113.39 2f90 n ARG 86 Ca -0.00 0.23 0.07 0.00 -0.77 0.00 0.00 57.85 57.37 2f90 n ARG 86 Cb 0.22 -1.50 0.07 0.00 -1.02 0.00 0.00 32.46 30.23 2f90 n ARG 86 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2f90 n LEU 87 N -1.41 2.28 -4.60 0.55 4.77 -0.87 -4.26 117.00 113.46 2f90 n LEU 87 Ca 0.05 -1.09 -0.35 0.00 -0.03 0.00 0.00 56.01 54.58 2f90 n LEU 87 Cb 0.13 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.29 2f90 n LEU 87 CO 0.11 0.43 0.48 0.59 -1.33 0.00 0.00 177.39 177.68 2f90 n ASN 88 N 0.81 0.24 -4.71 -1.43 4.13 -0.14 -4.42 115.26 109.74 2f90 n ASN 88 Ca 0.09 0.63 -0.32 0.00 1.68 0.00 0.00 54.58 56.67 2f90 n ASN 88 Cb 0.37 -1.39 0.13 0.00 -1.54 0.00 0.00 39.78 37.35 2f90 n ASN 88 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2f90 s GLU 89 N -3.38 1.57 0.39 3.52 2.56 -1.26 -4.63 118.70 117.48 2f90 s GLU 89 Ca 0.72 1.49 -0.27 0.00 0.00 0.00 0.00 54.97 56.91 2f90 s GLU 89 Cb -0.33 -1.79 -0.11 0.00 2.00 0.00 0.00 34.13 33.90 2f90 s GLU 89 CO 0.52 -2.21 1.37 -2.13 -0.56 0.00 0.00 175.26 172.25 2f90 n ARG 90 N -3.73 2.26 -2.66 4.30 0.00 -1.26 -4.76 116.66 110.80 2f90 n ARG 90 Ca 0.11 0.80 -0.43 0.00 -0.00 0.00 0.00 57.85 58.33 2f90 n ARG 90 Cb 0.52 -2.49 -0.03 0.00 0.00 0.00 0.00 32.46 30.46 2f90 n ARG 90 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 2f90 s HIS 91 N -1.14 2.81 -2.00 -0.14 5.65 -1.26 -4.56 115.29 114.64 2f90 s HIS 91 Ca 0.57 0.55 0.11 0.00 0.25 0.00 0.00 55.06 56.54 2f90 s HIS 91 Cb -0.51 -4.33 0.64 0.00 -1.18 0.00 0.00 32.58 27.20 2f90 s HIS 91 CO 0.61 -1.29 1.31 0.66 -0.65 0.00 0.00 174.74 175.39 2f90 n TYR 92 N 7.76 0.00 -1.07 3.88 0.53 -1.26 -0.54 117.16 126.46 2f90 n TYR 92 Ca 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.98 2f90 n TYR 92 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.80 2f90 n TYR 92 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2f90 n GLY 93 N 0.53 2.75 0.33 2.72 0.00 -1.25 -1.63 105.19 108.64 2f90 n GLY 93 Ca 0.08 -0.16 0.22 0.00 0.00 0.00 0.00 46.02 46.16 2f90 n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f90 h ALA 94 N -0.54 1.01 0.00 4.61 0.00 -0.69 -1.91 119.26 121.74 2f90 h ALA 94 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2f90 h ALA 94 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2f90 h ALA 94 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.18 2f90 h LEU 95 N 0.00 0.00 -9.51 0.00 3.38 -1.52 -3.45 115.31 104.20 2f90 h LEU 95 Ca -0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 2f90 h LEU 95 Cb 0.06 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.88 2f90 h LEU 95 CO 0.00 0.00 0.69 -0.38 0.09 0.00 0.00 178.44 178.84 2f90 n ILE 96 N -2.58 0.37 0.00 1.22 5.41 -0.72 -1.55 119.36 121.51 2f90 n ILE 96 Ca 0.02 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.68 2f90 n ILE 96 Cb 0.28 -1.44 0.00 0.00 -0.71 0.00 0.00 39.64 37.77 2f90 n ILE 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2f90 n GLY 97 N 2.85 2.84 3.83 7.39 0.00 0.94 -4.96 105.19 118.08 2f90 n GLY 97 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2f90 n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f90 s LEU 98 N 0.00 4.11 -0.01 0.99 1.43 -0.59 -4.72 118.68 119.89 2f90 s LEU 98 Ca 0.00 1.47 -0.30 0.00 -1.03 0.00 0.00 54.13 54.27 2f90 s LEU 98 Cb 0.00 -4.10 -0.04 0.00 0.03 0.00 0.00 46.19 42.08 2f90 s LEU 98 CO 0.00 -0.19 1.10 0.21 0.23 0.00 0.00 176.35 177.70 2f90 s ASN 99 N -2.06 7.19 0.14 2.29 3.84 -1.26 -1.18 114.94 123.89 2f90 s ASN 99 Ca 0.54 1.79 -0.17 0.00 0.21 0.00 0.00 52.86 55.22 2f90 s ASN 99 Cb -0.12 -2.57 0.01 0.00 -0.55 0.00 0.00 41.25 38.02 2f90 s ASN 99 CO 0.18 -0.42 1.77 0.03 -2.79 0.00 0.00 177.10 175.86 2f90 h ARG 100 N 6.99 0.29 -0.47 0.43 3.08 -1.31 -1.15 114.38 122.23 2f90 h ARG 100 Ca -0.38 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.59 2f90 h ARG 100 Cb 1.20 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.16 2f90 h ARG 100 CO 0.81 0.19 0.05 1.49 -1.07 0.00 0.00 179.97 181.44 2f90 h GLU 101 N 0.30 0.75 -0.57 0.04 4.81 -1.69 -1.59 114.58 116.63 2f90 h GLU 101 Ca 0.13 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 2f90 h GLU 101 Cb 0.05 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 2f90 h GLU 101 CO -0.10 0.73 0.16 0.37 -0.73 0.00 0.00 179.01 179.45 2f90 h GLN 102 N 0.72 0.87 -0.20 1.92 5.75 -1.78 -0.56 115.11 121.82 2f90 h GLN 102 Ca 0.15 -0.17 -0.10 0.00 -0.15 0.00 0.00 58.65 58.38 2f90 h GLN 102 Cb 0.37 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 2f90 h GLN 102 CO 0.01 0.76 -0.32 0.52 -2.65 0.00 0.00 178.83 177.15 2f90 h MET 103 N 0.84 0.41 -0.42 1.69 2.86 -0.54 0.28 114.93 120.06 2f90 h MET 103 Ca 0.19 -0.17 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 2f90 h MET 103 Cb 0.27 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 2f90 h MET 103 CO -0.01 0.69 -0.16 0.00 1.06 0.00 0.00 176.91 178.49 2f90 h ALA 104 N 1.31 0.93 -0.22 6.32 0.00 -0.54 0.25 119.26 127.31 2f90 h ALA 104 Ca 0.04 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2f90 h ALA 104 Cb 0.74 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2f90 h ALA 104 CO 0.06 0.62 -0.18 -0.07 0.00 0.00 0.00 179.25 179.67 2f90 h LEU 105 N 0.70 0.54 -0.26 0.00 3.38 -0.63 0.29 115.31 119.33 2f90 h LEU 105 Ca 0.11 -0.46 -0.21 0.00 0.09 0.00 0.00 57.88 57.41 2f90 h LEU 105 Cb 0.66 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2f90 h LEU 105 CO 0.05 0.89 -0.84 0.78 0.09 0.00 0.00 178.44 179.40 2f90 h ASN 106 N 0.21 0.55 -0.00 -0.43 4.21 -0.80 -3.37 115.58 115.94 2f90 h ASN 106 Ca 0.04 -0.40 0.00 0.00 1.21 0.00 0.00 56.30 57.15 2f90 h ASN 106 Cb 0.72 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 2f90 h ASN 106 CO 0.05 1.17 -0.03 1.41 -1.29 0.00 0.00 177.43 178.74 2f90 n HIS 107 N -3.80 0.00 0.00 1.19 8.25 0.88 -5.09 115.22 116.66 2f90 n HIS 107 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2f90 n HIS 107 Cb 0.78 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.89 2f90 n HIS 107 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2f90 n GLY 108 N 0.44 0.65 0.26 -1.41 0.00 0.10 -4.47 105.19 100.76 2f90 n GLY 108 Ca 0.01 -1.62 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 2f90 n GLY 108 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2f90 h GLU 109 N 0.00 0.89 -0.25 1.61 5.08 -1.83 -2.89 114.58 117.19 2f90 h GLU 109 Ca 0.00 -0.16 0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2f90 h GLU 109 Cb 0.00 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 2f90 h GLU 109 CO 0.00 0.76 -0.05 0.93 -1.00 0.00 0.00 179.01 179.66 2f90 h GLU 110 N 0.82 0.02 -0.43 2.33 5.08 -1.92 -0.34 114.58 120.14 2f90 h GLU 110 Ca 0.20 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 2f90 h GLU 110 Cb 0.21 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2f90 h GLU 110 CO -0.01 0.01 0.16 0.37 -1.00 0.00 0.00 179.01 178.54 2f90 h GLN 111 N 0.02 0.66 -0.97 2.33 5.75 -1.77 -1.89 115.11 119.23 2f90 h GLN 111 Ca 0.12 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2f90 h GLN 111 Cb 0.18 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 2f90 h GLN 111 CO -0.24 0.62 0.61 0.28 -2.65 0.00 0.00 178.83 177.44 2f90 h VAL 112 N 0.56 1.26 -0.79 2.39 2.07 -1.27 0.09 116.25 120.56 2f90 h VAL 112 Ca 0.14 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2f90 h VAL 112 Cb 0.22 -0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 29.82 2f90 h VAL 112 CO -0.01 0.26 0.43 -0.09 0.02 0.00 0.00 177.57 178.18 2f90 h ARG 113 N 1.32 1.10 -0.13 1.57 2.43 -0.75 0.72 114.38 120.64 2f90 h ARG 113 Ca 0.35 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 2f90 h ARG 113 Cb -0.10 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.23 2f90 h ARG 113 CO -0.07 0.81 0.06 -0.07 -1.51 0.00 0.00 179.97 179.19 2f90 h LEU 114 N 1.09 0.18 -0.71 3.80 3.38 -0.45 0.35 115.31 122.94 2f90 h LEU 114 Ca 0.28 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.18 2f90 h LEU 114 Cb 0.03 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 2f90 h LEU 114 CO -0.04 0.26 0.40 -0.50 0.09 0.00 0.00 178.44 178.65 2f90 h TRP 115 N 0.08 0.73 0.16 1.13 6.55 -0.47 -1.84 115.95 122.29 2f90 h TRP 115 Ca 0.05 0.03 -0.27 0.00 0.95 0.00 0.00 58.89 59.64 2f90 h TRP 115 Cb 0.14 -0.22 0.03 0.00 -0.86 0.00 0.00 29.16 28.24 2f90 h TRP 115 CO -0.02 0.34 -1.14 0.00 -1.05 0.00 0.00 178.44 176.57 2f90 h ARG 116 N 0.73 0.49 0.00 0.49 3.08 -0.70 -3.43 114.38 115.04 2f90 h ARG 116 Ca 0.32 -0.74 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2f90 h ARG 116 Cb 0.21 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2f90 h ARG 116 CO -0.19 1.34 -0.79 0.54 -1.07 0.00 0.00 179.97 179.80 2f90 n ARG 117 N -3.91 2.16 -0.87 0.04 5.12 0.10 -5.03 116.66 114.27 2f90 n ARG 117 Ca -0.15 -0.02 -0.30 0.00 -1.93 0.00 0.00 57.85 55.45 2f90 n ARG 117 Cb 0.95 -0.92 0.16 0.00 -1.16 0.00 0.00 32.46 31.49 2f90 n ARG 117 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2f90 s SER 118 N -1.97 2.95 -0.12 0.55 1.04 -0.70 -3.73 113.70 111.74 2f90 s SER 118 Ca -0.00 1.87 -0.13 0.00 0.48 0.00 0.00 55.95 58.17 2f90 s SER 118 Cb 0.02 -2.44 -0.26 0.00 0.10 0.00 0.00 66.02 63.44 2f90 s SER 118 CO 0.12 -3.03 0.44 0.22 0.98 0.00 0.00 173.24 171.98 2f90 h TYR 119 N -1.82 0.43 0.00 5.02 3.20 -1.87 -3.37 116.97 118.57 2f90 h TYR 119 Ca -0.48 -0.31 -0.02 0.00 3.14 0.00 0.00 58.73 61.06 2f90 h TYR 119 Cb 1.28 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.52 2f90 h TYR 119 CO 0.46 1.65 -1.58 0.09 -1.64 0.00 0.00 178.16 177.14 2f90 n ASN 120 N -3.79 0.39 -4.72 -2.11 4.13 -1.26 -0.95 115.26 106.95 2f90 n ASN 120 Ca -0.29 0.15 -0.42 0.00 1.68 0.00 0.00 54.58 55.71 2f90 n ASN 120 Cb 0.95 1.24 -0.03 0.00 -1.54 0.00 0.00 39.78 40.39 2f90 n ASN 120 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2f90 s VAL 121 N -3.38 3.22 -0.17 2.41 1.01 -1.26 -4.85 120.40 117.38 2f90 s VAL 121 Ca -0.05 0.91 -0.06 0.00 0.00 0.00 0.00 61.98 62.78 2f90 s VAL 121 Cb 0.12 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 2f90 s VAL 121 CO 0.85 0.09 0.02 -0.89 0.00 0.00 0.00 175.10 175.17 2f90 s THR 122 N 0.86 4.45 0.74 3.92 2.01 -1.26 -4.29 115.64 122.06 2f90 s THR 122 Ca 0.63 -0.16 -0.13 0.00 0.31 0.00 0.00 61.69 62.34 2f90 s THR 122 Cb -0.37 -2.99 0.04 0.00 0.01 0.00 0.00 72.50 69.20 2f90 s THR 122 CO 0.32 0.48 1.14 -2.84 -0.69 0.00 0.00 174.62 173.03 2f90 s PRO 123 N 0.33 2.24 0.41 4.92 0.02 -1.26 -4.94 135.00 136.73 2f90 s PRO 123 Ca 0.01 1.46 -0.27 0.00 0.02 0.00 0.00 61.00 62.22 2f90 s PRO 123 Cb -0.13 -1.87 -0.09 0.00 0.02 0.00 0.00 34.50 32.42 2f90 s PRO 123 CO 0.01 -1.70 1.44 -2.14 -0.33 0.00 0.00 177.00 174.28 2f90 s PRO 124 N -4.30 3.89 0.48 5.54 0.02 -1.26 -4.74 135.00 134.63 2f90 s PRO 124 Ca 0.68 2.45 -0.23 0.00 0.02 0.00 0.00 61.00 63.92 2f90 s PRO 124 Cb -0.22 -2.80 -0.07 0.00 0.02 0.00 0.00 34.50 31.43 2f90 s PRO 124 CO 0.48 -0.66 1.23 -1.25 -0.33 0.00 0.00 177.00 176.46 2f90 s PRO 125 N -2.28 3.59 0.27 5.54 0.04 -1.26 -0.24 135.00 140.66 2f90 s PRO 125 Ca 0.57 1.93 -0.29 0.00 0.04 0.00 0.00 61.00 63.25 2f90 s PRO 125 Cb -0.44 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 31.62 2f90 s PRO 125 CO 0.58 -0.73 1.00 -1.50 0.04 0.00 0.00 177.00 176.39 2f90 s ILE 126 N -1.46 3.87 0.31 0.56 2.07 -0.50 -3.70 121.20 122.36 2f90 s ILE 126 Ca 0.65 1.82 0.10 0.00 -1.41 0.00 0.00 60.65 61.82 2f90 s ILE 126 Cb -0.33 -4.13 -0.05 0.00 0.13 0.00 0.00 42.46 38.08 2f90 s ILE 126 CO 0.39 0.38 -0.08 -1.61 -1.91 0.00 0.00 174.94 172.12 2f90 s GLU 127 N -1.44 1.92 0.57 3.50 2.02 -1.26 -4.88 118.70 119.13 2f90 s GLU 127 Ca 0.44 -1.76 0.28 0.00 0.02 0.00 0.00 54.97 53.95 2f90 s GLU 127 Cb -0.27 -1.85 1.50 0.00 0.10 0.00 0.00 34.13 33.62 2f90 s GLU 127 CO 0.34 0.22 1.98 0.93 0.02 0.00 0.00 175.26 178.75 2f90 h GLU 128 N 2.01 0.00 0.00 1.61 5.08 -1.97 0.13 114.58 121.44 2f90 h GLU 128 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2f90 h GLU 128 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2f90 h GLU 128 CO 0.65 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 179.32 2f90 h SER 129 N 0.00 0.00 -3.32 1.42 4.64 -2.01 -3.44 113.55 110.83 2f90 h SER 129 Ca 0.20 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.99 2f90 h SER 129 Cb 0.96 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.12 2f90 h SER 129 CO -0.00 0.00 0.83 -2.28 -0.87 0.00 0.00 176.83 174.51 2f90 s HIS 130 N -3.20 2.89 0.65 4.77 5.04 0.45 -4.89 115.29 120.99 2f90 s HIS 130 Ca 0.08 0.88 0.30 0.00 -1.54 0.00 0.00 55.06 54.78 2f90 s HIS 130 Cb 0.11 -3.95 1.62 0.00 0.04 0.00 0.00 32.58 30.39 2f90 s HIS 130 CO 0.54 -3.18 1.94 -1.00 -2.34 0.00 0.00 174.74 170.69 2f90 h PRO 131 N 5.04 0.00 -0.13 2.88 0.13 -1.88 -1.85 132.00 136.19 2f90 h PRO 131 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2f90 h PRO 131 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2f90 h PRO 131 CO 0.79 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.22 2f90 n TYR 132 N -3.11 0.17 0.23 1.56 4.02 -1.26 -4.72 117.16 114.04 2f90 n TYR 132 Ca 0.00 -0.18 -0.15 0.00 -0.01 0.00 0.00 57.90 57.56 2f90 n TYR 132 Cb 0.43 -0.01 -0.07 0.00 -0.02 0.00 0.00 39.34 39.66 2f90 n TYR 132 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 2f90 h TYR 133 N 2.19 -0.78 -0.13 -0.72 3.20 -1.59 -3.14 116.97 115.99 2f90 h TYR 133 Ca 0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 2f90 h TYR 133 Cb 0.57 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 39.09 2f90 h TYR 133 CO 0.08 -0.43 -0.10 1.96 -1.64 0.00 0.00 178.16 178.03 2f90 h GLN 134 N -0.66 -0.11 0.00 1.82 4.20 -1.84 -2.28 115.11 116.24 2f90 h GLN 134 Ca -0.03 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2f90 h GLN 134 Cb 0.58 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2f90 h GLN 134 CO -0.02 -0.07 0.00 1.05 -0.67 0.00 0.00 178.83 179.12 2f90 h GLU 135 N -0.12 0.00 0.00 1.46 4.11 -1.88 -1.58 114.58 116.57 2f90 h GLU 135 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.52 2f90 h GLU 135 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2f90 h GLU 135 CO -0.21 0.00 -0.29 0.82 0.07 0.00 0.00 179.01 179.41 2f90 h ILE 136 N 0.00 0.00 0.00 -1.06 2.04 -1.37 -3.36 117.51 113.75 2f90 h ILE 136 Ca 0.00 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2f90 h ILE 136 Cb 0.17 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2f90 h ILE 136 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.93 2f90 n TYR 137 N -4.62 0.00 1.04 1.37 4.02 -0.92 -2.89 117.16 115.16 2f90 n TYR 137 Ca -0.04 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.96 2f90 n TYR 137 Cb 0.15 -0.40 0.04 0.00 -0.02 0.00 0.00 39.34 39.11 2f90 n TYR 137 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2f90 n ASN 138 N -1.40 1.62 -4.74 7.72 3.02 -0.60 -4.94 115.26 115.93 2f90 n ASN 138 Ca 0.08 -1.27 -0.41 0.00 -0.03 0.00 0.00 54.58 52.95 2f90 n ASN 138 Cb 0.24 0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 39.89 2f90 n ASN 138 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2f90 s ASP 139 N -2.60 6.86 0.55 6.41 -1.08 -1.14 -4.92 116.67 120.74 2f90 s ASP 139 Ca 0.17 2.44 0.23 0.00 -0.52 0.00 0.00 52.55 54.88 2f90 s ASP 139 Cb 0.18 -2.61 1.46 0.00 -1.46 0.00 0.00 42.92 40.49 2f90 s ASP 139 CO 0.63 -0.56 2.11 -0.09 0.52 0.00 0.00 175.17 177.78 2f90 h ARG 140 N 5.34 0.00 -0.03 4.34 2.43 -1.92 -2.45 114.38 122.09 2f90 h ARG 140 Ca -0.45 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.73 2f90 h ARG 140 Cb 1.21 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2f90 h ARG 140 CO 0.77 0.00 0.03 0.07 -1.51 0.00 0.00 179.97 179.33 2f90 h ARG 141 N 0.00 0.00 -0.18 0.20 0.11 -1.95 -0.85 114.38 111.71 2f90 h ARG 141 Ca 0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.17 2f90 h ARG 141 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 2f90 h ARG 141 CO -0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 2f90 n TYR 142 N -4.11 0.22 1.02 4.08 4.01 -0.92 -3.58 117.16 117.89 2f90 n TYR 142 Ca -0.02 -0.11 0.11 0.00 -0.16 0.00 0.00 57.90 57.72 2f90 n TYR 142 Cb 0.12 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.17 2f90 n TYR 142 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2f90 n LYS 143 N 0.50 1.10 -0.77 -0.72 5.02 -0.33 -4.22 118.16 118.75 2f90 n LYS 143 Ca 0.17 -0.90 0.05 0.00 -2.02 0.00 0.00 58.31 55.61 2f90 n LYS 143 Cb 0.38 -1.48 0.18 0.00 -0.02 0.00 0.00 35.03 34.08 2f90 n LYS 143 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2f90 n VAL 144 N -0.17 1.86 -2.49 -0.18 0.24 -1.23 -4.96 118.33 111.40 2f90 n VAL 144 Ca 0.09 -2.90 -0.23 0.00 -2.04 0.00 0.00 64.34 59.26 2f90 n VAL 144 Cb 0.45 -0.05 0.05 0.00 -1.47 0.00 0.00 33.84 32.82 2f90 n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f90 n ASP 146 N -2.57 0.05 -3.90 0.00 5.68 -1.26 -4.68 116.55 109.87 2f90 n ASP 146 Ca 0.09 -1.84 -0.16 0.00 -0.50 0.00 0.00 54.79 52.37 2f90 n ASP 146 Cb 0.60 -0.01 -0.15 0.00 -1.14 0.00 0.00 41.12 40.42 2f90 n ASP 146 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2f90 s VAL 147 N -1.99 0.31 0.48 2.12 1.01 -1.26 -5.14 120.40 115.94 2f90 s VAL 147 Ca 0.08 -0.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 2f90 s VAL 147 Cb 0.04 -0.31 -0.08 0.00 0.00 0.00 0.00 36.38 36.02 2f90 s VAL 147 CO 0.06 0.13 1.11 -2.65 0.00 0.00 0.00 175.10 173.75 2f90 n PRO 148 N 3.48 1.42 -0.32 2.72 -0.02 -1.26 -4.82 135.00 136.21 2f90 n PRO 148 Ca -0.19 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 61.92 2f90 n PRO 148 Cb 0.55 -2.23 0.29 0.00 -0.02 0.00 0.00 33.50 32.09 2f90 n PRO 148 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2f90 h LEU 149 N 1.39 0.53 -1.22 2.45 5.85 -1.94 0.18 115.31 122.55 2f90 h LEU 149 Ca -0.47 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2f90 h LEU 149 Cb 1.33 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2f90 h LEU 149 CO 0.56 0.14 0.00 -2.24 -0.34 0.00 0.00 178.44 176.56 2f90 h ASP 150 N 0.57 0.00 0.10 1.25 2.03 -1.94 -2.88 116.42 115.55 2f90 h ASP 150 Ca 0.54 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.84 2f90 h ASP 150 Cb 0.92 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 2f90 h ASP 150 CO -0.44 0.00 -0.31 0.00 -1.03 0.00 0.00 179.24 177.46 2f90 n GLN 151 N -2.86 1.13 -2.19 4.15 6.02 0.61 -4.93 117.38 119.31 2f90 n GLN 151 Ca 0.01 -0.81 -0.36 0.00 -0.01 0.00 0.00 57.00 55.83 2f90 n GLN 151 Cb 0.29 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.07 2f90 n GLN 151 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2f90 s LEU 152 N -2.42 3.86 0.65 1.08 1.43 -1.06 -4.95 118.68 117.26 2f90 s LEU 152 Ca 0.23 2.31 -0.17 0.00 -1.03 0.00 0.00 54.13 55.47 2f90 s LEU 152 Cb 0.19 -4.41 -0.01 0.00 0.03 0.00 0.00 46.19 41.99 2f90 s LEU 152 CO 0.51 -1.17 1.24 -2.16 0.23 0.00 0.00 176.35 175.00 2f90 s PRO 153 N -3.01 2.61 0.00 1.29 0.04 -1.26 -4.94 135.00 129.73 2f90 s PRO 153 Ca 0.69 1.89 0.11 0.00 0.04 0.00 0.00 61.00 63.73 2f90 s PRO 153 Cb -0.28 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 2f90 s PRO 153 CO 0.33 -1.50 0.54 0.54 0.04 0.00 0.00 177.00 176.95 2f90 n ARG 154 N -2.00 2.89 -3.60 4.56 3.00 -1.26 -5.01 116.66 115.25 2f90 n ARG 154 Ca 0.14 -0.24 -0.06 0.00 -0.01 0.00 0.00 57.85 57.69 2f90 n ARG 154 Cb 0.49 -1.05 -0.04 0.00 0.00 0.00 0.00 32.46 31.86 2f90 n ARG 154 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2f90 s SER 155 N -1.82 -0.18 -0.12 0.55 1.04 -1.26 -1.41 113.70 110.50 2f90 s SER 155 Ca 0.06 0.13 -0.10 0.00 0.48 0.00 0.00 55.95 56.52 2f90 s SER 155 Cb 0.09 0.16 0.03 0.00 0.10 0.00 0.00 66.02 66.40 2f90 s SER 155 CO 0.39 -0.22 0.30 -1.61 0.98 0.00 0.00 173.24 173.08 2f90 s GLU 156 N -1.64 0.34 0.58 4.02 2.02 0.30 -4.90 118.70 119.43 2f90 s GLU 156 Ca 0.06 0.46 -0.05 0.00 0.02 0.00 0.00 54.97 55.46 2f90 s GLU 156 Cb -0.01 0.13 0.01 0.00 0.10 0.00 0.00 34.13 34.36 2f90 s GLU 156 CO -0.04 -0.06 0.88 -1.54 0.02 0.00 0.00 175.26 174.52 2f90 s SER 157 N 0.37 5.52 0.48 -0.19 1.04 -1.26 -4.43 113.70 115.23 2f90 s SER 157 Ca -0.02 0.60 0.14 0.00 0.48 0.00 0.00 55.95 57.16 2f90 s SER 157 Cb -0.03 -1.59 1.13 0.00 0.10 0.00 0.00 66.02 65.63 2f90 s SER 157 CO -0.02 -1.08 2.07 0.25 0.98 0.00 0.00 173.24 175.45 2f90 h LEU 158 N -0.14 0.20 -0.53 2.42 5.85 -1.65 -0.99 115.31 120.46 2f90 h LEU 158 Ca -0.45 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 2f90 h LEU 158 Cb 1.26 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2f90 h LEU 158 CO 0.60 0.13 0.14 0.50 -0.34 0.00 0.00 178.44 179.47 2f90 h LYS 159 N 0.23 0.85 -0.82 1.25 3.64 -1.36 -2.06 116.57 118.30 2f90 h LYS 159 Ca 0.12 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2f90 h LYS 159 Cb 0.22 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 2f90 h LYS 159 CO -0.02 0.80 0.48 -0.44 -2.27 0.00 0.00 179.45 177.99 2f90 h ASP 160 N 0.74 0.99 -0.00 4.20 3.32 -1.48 -1.87 116.42 122.32 2f90 h ASP 160 Ca 0.17 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.16 2f90 h ASP 160 Cb 0.32 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2f90 h ASP 160 CO -0.00 0.78 -0.07 0.58 -1.72 0.00 0.00 179.24 178.81 2f90 h VAL 161 N 1.13 0.81 -0.90 -1.35 2.07 -0.98 -2.44 116.25 114.58 2f90 h VAL 161 Ca 0.29 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.83 2f90 h VAL 161 Cb -0.02 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 2f90 h VAL 161 CO -0.05 0.00 0.59 0.25 0.02 0.00 0.00 177.57 178.38 2f90 h LEU 162 N -0.13 1.00 -1.74 2.57 5.85 -1.13 0.74 115.31 122.48 2f90 h LEU 162 Ca 0.03 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.81 2f90 h LEU 162 Cb 0.16 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2f90 h LEU 162 CO -0.08 0.70 0.31 -0.33 -0.34 0.00 0.00 178.44 178.71 2f90 h GLU 163 N 1.17 0.30 0.00 1.25 5.08 -0.89 0.53 114.58 122.02 2f90 h GLU 163 Ca 0.35 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2f90 h GLU 163 Cb -0.06 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2f90 h GLU 163 CO -0.10 0.20 -1.04 2.89 -1.00 0.00 0.00 179.01 179.96 2f90 n ARG 164 N -4.47 0.06 -0.05 2.33 -4.01 -0.73 -4.36 116.66 105.42 2f90 n ARG 164 Ca 0.07 -0.01 -0.16 0.00 -1.04 0.00 0.00 57.85 56.70 2f90 n ARG 164 Cb 0.31 -1.50 -0.14 0.00 -3.04 0.00 0.00 32.46 28.09 2f90 n ARG 164 CO 0.00 0.00 0.00 -0.11 -3.04 0.00 0.00 177.63 174.48 2f90 n LEU 165 N -1.57 1.95 -0.17 2.89 0.00 0.18 -4.44 117.00 115.84 2f90 n LEU 165 Ca 0.03 0.13 -0.01 0.00 0.00 0.00 0.00 56.01 56.16 2f90 n LEU 165 Cb 0.35 -0.55 0.08 0.00 0.00 0.00 0.00 43.42 43.31 2f90 n LEU 165 CO 0.43 0.73 0.91 0.25 0.00 0.00 0.00 177.39 179.70 2f90 h LEU 166 N 0.03 -0.01 -1.04 -1.96 5.85 -0.16 -1.76 115.31 116.25 2f90 h LEU 166 Ca -0.46 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.43 2f90 h LEU 166 Cb 2.03 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 43.13 2f90 h LEU 166 CO 0.03 0.02 0.64 -0.65 -0.34 0.00 0.00 178.44 178.13 2f90 h PRO 167 N 0.24 1.11 -0.46 5.25 0.11 -1.78 0.27 132.00 136.74 2f90 h PRO 167 Ca 0.27 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.25 2f90 h PRO 167 Cb 0.39 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 2f90 h PRO 167 CO -0.36 0.73 0.02 -0.92 -0.21 0.00 0.00 178.00 177.26 2f90 h TYR 168 N 1.14 0.87 0.28 0.65 3.20 -1.56 -0.32 116.97 121.22 2f90 h TYR 168 Ca 0.42 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 2f90 h TYR 168 Cb 0.18 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.23 2f90 h TYR 168 CO -0.00 0.83 -0.13 2.35 -1.64 0.00 0.00 178.16 179.57 2f90 h TRP 169 N 0.65 -0.35 -0.20 -3.82 2.91 -0.75 0.18 115.95 114.58 2f90 h TRP 169 Ca 0.13 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.18 2f90 h TRP 169 Cb 0.48 0.12 -0.04 0.00 -0.51 0.00 0.00 29.16 29.20 2f90 h TRP 169 CO 0.04 -0.10 -0.06 -0.91 -1.03 0.00 0.00 178.44 176.38 2f90 h ASN 170 N -0.55 -0.20 0.97 2.65 -0.26 -0.92 0.26 115.58 117.53 2f90 h ASN 170 Ca -0.04 0.06 -0.21 0.00 -0.56 0.00 0.00 56.30 55.55 2f90 h ASN 170 Cb 0.40 0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 37.76 2f90 h ASN 170 CO 0.06 -0.07 -1.06 -0.33 -1.06 0.00 0.00 177.43 174.97 2f90 h GLU 171 N -0.01 0.00 0.00 0.81 5.08 -1.08 -3.38 114.58 116.00 2f90 h GLU 171 Ca 0.10 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2f90 h GLU 171 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2f90 h GLU 171 CO -0.21 0.90 -1.01 0.54 -1.00 0.00 0.00 179.01 178.22 2f90 n ARG 172 N -3.30 2.82 -0.13 2.33 1.74 0.05 -4.77 116.66 115.39 2f90 n ARG 172 Ca -0.02 -0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.81 2f90 n ARG 172 Cb 0.94 -1.01 -0.08 0.00 -1.02 0.00 0.00 32.46 31.29 2f90 n ARG 172 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2f90 n ILE 173 N -1.86 1.52 -0.28 0.55 5.41 -0.87 -4.49 119.36 119.34 2f90 n ILE 173 Ca -0.00 -0.27 0.10 0.00 1.00 0.00 0.00 62.75 63.57 2f90 n ILE 173 Cb 0.36 -1.98 0.24 0.00 -0.71 0.00 0.00 39.64 37.56 2f90 n ILE 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2f90 h ALA 174 N -1.00 1.18 -0.88 -1.39 0.00 -0.70 -0.59 119.26 115.88 2f90 h ALA 174 Ca -0.55 0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.60 2f90 h ALA 174 Cb 1.48 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 2f90 h ALA 174 CO -0.34 -0.36 0.57 -1.35 0.00 0.00 0.00 179.25 177.77 2f90 h PRO 175 N 0.30 0.95 -0.34 0.00 0.11 -1.79 -1.25 132.00 129.98 2f90 h PRO 175 Ca 0.49 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 66.40 2f90 h PRO 175 Cb 0.91 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 2f90 h PRO 175 CO -0.55 0.63 -0.36 0.93 -0.21 0.00 0.00 178.00 178.44 2f90 h GLU 176 N 0.98 0.78 -0.66 1.05 4.39 -1.35 -2.53 114.58 117.23 2f90 h GLU 176 Ca 0.38 -0.39 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 2f90 h GLU 176 Cb 0.21 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 2f90 h GLU 176 CO -0.14 1.01 0.23 0.28 -1.16 0.00 0.00 179.01 179.24 2f90 h VAL 177 N 0.65 1.25 0.00 3.13 2.07 -0.84 -1.53 116.25 120.97 2f90 h VAL 177 Ca 0.06 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 2f90 h VAL 177 Cb 0.91 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2f90 h VAL 177 CO 0.08 0.32 -0.01 -0.07 0.02 0.00 0.00 177.57 177.91 2f90 h LEU 178 N 0.95 0.00 -0.69 2.57 3.38 -1.11 -0.63 115.31 119.78 2f90 h LEU 178 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2f90 h LEU 178 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2f90 h LEU 178 CO -0.01 0.01 0.00 0.54 0.09 0.00 0.00 178.44 179.07 2f90 n ARG 179 N -3.13 1.47 -0.63 1.13 1.74 -0.75 -4.90 116.66 111.59 2f90 n ARG 179 Ca -0.01 -0.69 0.00 0.00 -0.77 0.00 0.00 57.85 56.38 2f90 n ARG 179 Cb 0.23 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2f90 n ARG 179 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f90 n GLY 180 N 1.12 0.70 3.77 -0.13 0.00 -0.24 -5.04 105.19 105.36 2f90 n GLY 180 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2f90 n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f90 s LYS 181 N -0.37 3.98 -0.39 1.61 -0.14 -0.65 -4.99 119.74 118.78 2f90 s LYS 181 Ca 0.00 1.70 -0.19 0.00 -1.36 0.00 0.00 55.97 56.12 2f90 s LYS 181 Cb 0.00 -2.53 0.01 0.00 -1.68 0.00 0.00 37.83 33.64 2f90 s LYS 181 CO 0.00 -0.35 0.56 0.99 -0.76 0.00 0.00 175.35 175.79 2f90 s THR 182 N -1.55 4.95 0.04 2.17 2.01 -1.26 -4.51 115.64 117.49 2f90 s THR 182 Ca 0.60 0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.79 2f90 s THR 182 Cb -0.27 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 2f90 s THR 182 CO 0.33 -0.40 0.03 -0.63 -0.69 0.00 0.00 174.62 173.27 2f90 s ILE 183 N 2.53 4.28 -0.13 1.82 -1.09 -1.26 -1.69 121.20 125.66 2f90 s ILE 183 Ca 0.19 -0.73 0.02 0.00 -2.23 0.00 0.00 60.65 57.91 2f90 s ILE 183 Cb -0.15 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.75 2f90 s ILE 183 CO 0.16 0.24 -0.19 -0.22 -1.23 0.00 0.00 174.94 173.70 2f90 s LEU 184 N -2.00 1.91 -0.38 2.97 2.96 -1.10 -1.42 118.68 121.61 2f90 s LEU 184 Ca 0.24 -0.52 -0.05 0.00 -0.22 0.00 0.00 54.13 53.59 2f90 s LEU 184 Cb -0.12 -1.27 0.08 0.00 0.50 0.00 0.00 46.19 45.39 2f90 s LEU 184 CO 0.16 0.04 0.17 -0.63 -1.32 0.00 0.00 176.35 174.77 2f90 s ILE 185 N 0.92 3.51 -0.59 6.68 1.01 0.12 -1.27 121.20 131.57 2f90 s ILE 185 Ca -0.06 -1.66 -0.19 0.00 0.00 0.00 0.00 60.65 58.74 2f90 s ILE 185 Cb -0.15 -3.22 0.10 0.00 0.01 0.00 0.00 42.46 39.20 2f90 s ILE 185 CO -0.02 -0.47 0.70 -0.55 0.00 0.00 0.00 174.94 174.60 2f90 s SER 186 N 1.75 6.18 0.00 3.58 0.15 0.19 -1.82 113.70 123.73 2f90 s SER 186 Ca 0.03 -1.41 0.00 0.00 0.70 0.00 0.00 55.95 55.27 2f90 s SER 186 Cb -0.22 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2f90 s SER 186 CO -0.01 -1.11 0.00 0.00 1.20 0.00 0.00 173.24 173.32 2f90 n ALA 187 N 6.34 0.00 -2.47 5.45 0.00 -0.55 -3.70 120.51 125.58 2f90 n ALA 187 Ca -0.09 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.12 2f90 n ALA 187 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 2f90 n ALA 187 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2f90 s HIS 188 N 3.24 1.91 0.12 0.00 3.76 -1.26 -1.87 115.29 121.18 2f90 s HIS 188 Ca 0.00 -1.04 -0.29 0.00 -0.15 0.00 0.00 55.06 53.58 2f90 s HIS 188 Cb 0.00 -1.25 -0.08 0.00 1.11 0.00 0.00 32.58 32.36 2f90 s HIS 188 CO 0.00 -0.07 1.61 0.78 -0.85 0.00 0.00 174.74 176.21 2f90 h GLY 189 N 2.03 -0.66 1.63 -2.22 0.00 -1.92 -1.16 103.07 100.77 2f90 h GLY 189 Ca -0.40 0.42 -0.24 0.00 0.00 0.00 0.00 47.33 47.11 2f90 h GLY 189 CO 0.67 -0.25 -1.25 3.43 0.00 0.00 0.00 176.54 179.13 2f90 h ASN 190 N -0.55 0.04 0.25 0.19 2.35 -1.96 -2.37 115.58 113.53 2f90 h ASN 190 Ca 0.04 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 2f90 h ASN 190 Cb 0.60 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 2f90 h ASN 190 CO -0.23 1.04 -0.39 0.77 -1.65 0.00 0.00 177.43 176.97 2f90 h SER 191 N 0.01 0.19 -0.17 5.81 4.64 -1.81 -0.28 113.55 121.93 2f90 h SER 191 Ca -0.11 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 60.99 2f90 h SER 191 Cb 1.87 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2f90 h SER 191 CO 0.12 0.57 -0.44 0.28 -0.87 0.00 0.00 176.83 176.48 2f90 h SER 192 N 0.16 0.69 -0.85 4.97 0.02 -1.25 -2.54 113.55 114.76 2f90 h SER 192 Ca 0.02 -0.58 0.04 0.00 -0.84 0.00 0.00 61.79 60.43 2f90 h SER 192 Cb 0.76 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 63.05 2f90 h SER 192 CO 0.06 1.14 0.56 0.03 -1.14 0.00 0.00 176.83 177.48 2f90 h ARG 193 N 0.27 1.01 -0.07 3.45 3.08 -1.07 0.02 114.38 121.07 2f90 h ARG 193 Ca -0.01 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2f90 h ARG 193 Cb 1.06 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.88 2f90 h ARG 193 CO 0.10 0.67 0.04 0.00 -1.07 0.00 0.00 179.97 179.71 2f90 h ALA 194 N 1.51 0.09 -0.54 0.04 0.00 -0.90 -0.65 119.26 118.80 2f90 h ALA 194 Ca 0.34 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2f90 h ALA 194 Cb 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2f90 h ALA 194 CO -0.10 -0.41 0.10 1.25 0.00 0.00 0.00 179.25 180.09 2f90 h LEU 195 N 0.07 0.84 -1.10 0.00 5.85 -0.98 -2.72 115.31 117.27 2f90 h LEU 195 Ca 0.02 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2f90 h LEU 195 Cb 0.02 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 2f90 h LEU 195 CO -0.00 0.88 0.50 -0.07 -0.34 0.00 0.00 178.44 179.40 2f90 h LEU 196 N 0.77 0.98 -0.40 2.25 3.38 -0.84 0.01 115.31 121.47 2f90 h LEU 196 Ca 0.17 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2f90 h LEU 196 Cb 0.38 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2f90 h LEU 196 CO 0.01 0.75 0.24 0.50 0.09 0.00 0.00 178.44 180.03 2f90 h LYS 197 N 1.13 0.48 0.32 1.13 3.64 -0.83 -0.14 116.57 122.30 2f90 h LYS 197 Ca 0.30 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 2f90 h LYS 197 Cb -0.05 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2f90 h LYS 197 CO -0.06 0.32 -0.16 1.25 -2.27 0.00 0.00 179.45 178.54 2f90 h HIS 198 N 0.49 -0.40 -0.64 1.91 2.76 -1.13 -0.15 115.15 117.99 2f90 h HIS 198 Ca 0.15 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.28 2f90 h HIS 198 Cb -0.01 0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 2f90 h HIS 198 CO -0.07 -0.11 0.25 -0.07 -1.30 0.00 0.00 177.93 176.64 2f90 h LEU 199 N -0.69 0.85 -0.79 0.26 3.38 -0.94 -2.87 115.31 114.52 2f90 h LEU 199 Ca -0.04 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2f90 h LEU 199 Cb 0.48 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2f90 h LEU 199 CO 0.07 0.77 -0.27 -0.62 0.09 0.00 0.00 178.44 178.48 2f90 n GLU 200 N -4.31 1.15 -3.35 1.13 1.02 -0.07 -0.67 120.64 115.54 2f90 n GLU 200 Ca 0.05 -0.79 -0.18 0.00 -0.02 0.00 0.00 57.16 56.22 2f90 n GLU 200 Cb 0.17 -1.48 0.06 0.00 -0.02 0.00 0.00 31.44 30.17 2f90 n GLU 200 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2f90 n GLY 201 N 1.34 -0.22 3.74 0.62 0.00 -0.34 -4.92 105.19 105.42 2f90 n GLY 201 Ca 0.12 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2f90 n GLY 201 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f90 s ILE 202 N -3.25 4.01 0.77 -0.61 1.01 -0.22 -5.02 121.20 117.89 2f90 s ILE 202 Ca 0.43 1.78 -0.12 0.00 0.00 0.00 0.00 60.65 62.74 2f90 s ILE 202 Cb -0.19 -4.13 0.06 0.00 0.01 0.00 0.00 42.46 38.21 2f90 s ILE 202 CO 0.57 0.32 1.11 -0.94 0.00 0.00 0.00 174.94 176.01 2f90 s SER 203 N -0.29 4.34 0.38 3.58 1.04 -1.26 -4.80 113.70 116.69 2f90 s SER 203 Ca 0.47 1.95 0.07 0.00 0.48 0.00 0.00 55.95 58.92 2f90 s SER 203 Cb -0.28 -2.54 0.79 0.00 0.10 0.00 0.00 66.02 64.09 2f90 s SER 203 CO 0.34 -2.15 1.97 0.44 0.98 0.00 0.00 173.24 174.83 2f90 h ASP 204 N -0.99 0.61 0.13 7.02 5.19 -1.99 -1.82 116.42 124.57 2f90 h ASP 204 Ca -0.44 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 55.96 2f90 h ASP 204 Cb 1.24 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.62 2f90 h ASP 204 CO 0.50 0.40 -0.06 -0.33 -3.12 0.00 0.00 179.24 176.63 2f90 h GLU 205 N 0.69 -0.17 0.00 3.56 3.07 -2.01 -3.35 114.58 116.38 2f90 h GLU 205 Ca 0.29 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 59.10 2f90 h GLU 205 Cb 0.24 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 2f90 h GLU 205 CO -0.09 0.27 -0.27 -0.44 -1.40 0.00 0.00 179.01 177.08 2f90 h ASP 206 N -0.69 0.00 -0.05 1.42 3.32 -1.85 -3.18 116.42 115.40 2f90 h ASP 206 Ca -0.02 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.05 2f90 h ASP 206 Cb 0.51 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 2f90 h ASP 206 CO 0.03 0.27 0.05 -0.29 -1.72 0.00 0.00 179.24 177.57 2f90 h ILE 207 N 0.00 0.58 0.00 0.35 6.09 -1.47 -1.64 117.51 121.43 2f90 h ILE 207 Ca -0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.48 2f90 h ILE 207 Cb 0.60 0.96 -0.00 0.00 0.47 0.00 0.00 36.82 38.85 2f90 h ILE 207 CO 0.03 0.00 -0.02 -0.29 -3.07 0.00 0.00 178.15 174.81 2f90 h ILE 208 N 0.00 0.43 -0.04 2.19 2.10 -1.63 -1.45 117.51 119.11 2f90 h ILE 208 Ca 0.02 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.88 2f90 h ILE 208 Cb 0.12 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 2f90 h ILE 208 CO -0.00 0.02 0.00 0.59 -1.08 0.00 0.00 178.15 177.68 2f90 n ASN 209 N -3.67 1.52 -4.60 2.19 3.02 -0.62 -4.80 115.26 108.31 2f90 n ASN 209 Ca -0.03 -1.53 -0.39 0.00 -0.03 0.00 0.00 54.58 52.60 2f90 n ASN 209 Cb 0.10 -0.01 -0.09 0.00 -0.61 0.00 0.00 39.78 39.17 2f90 n ASN 209 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2f90 s ILE 210 N -1.97 5.16 -0.06 2.41 -1.09 -0.55 -5.06 121.20 120.04 2f90 s ILE 210 Ca 0.37 0.54 0.04 0.00 -2.23 0.00 0.00 60.65 59.37 2f90 s ILE 210 Cb 0.21 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 2f90 s ILE 210 CO 0.33 0.12 -0.18 -0.89 -1.23 0.00 0.00 174.94 173.09 2f90 s THR 211 N 2.09 1.51 -0.12 2.92 2.01 -1.26 -5.04 115.64 117.75 2f90 s THR 211 Ca 0.15 -0.73 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 2f90 s THR 211 Cb -0.16 -1.32 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 2f90 s THR 211 CO 0.10 0.44 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.66 2f90 s LEU 212 N 0.27 3.23 0.51 4.42 1.43 -1.26 -4.95 118.68 122.32 2f90 s LEU 212 Ca -0.10 -0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 52.82 2f90 s LEU 212 Cb -0.14 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 2f90 s LEU 212 CO 0.04 0.24 0.87 -2.16 0.23 0.00 0.00 176.35 175.57 2f90 s PRO 213 N -0.05 3.65 0.46 1.29 0.04 -1.26 -4.95 135.00 134.18 2f90 s PRO 213 Ca 0.01 0.49 -0.22 0.00 0.04 0.00 0.00 61.00 61.32 2f90 s PRO 213 Cb -0.13 -2.27 -0.08 0.00 0.04 0.00 0.00 34.50 32.06 2f90 s PRO 213 CO 0.03 -0.28 1.09 0.95 0.04 0.00 0.00 177.00 178.83 2f90 s THR 214 N -2.78 3.47 -1.50 1.26 -4.23 -1.26 -4.08 115.64 106.52 2f90 s THR 214 Ca 0.52 1.04 -0.10 0.00 -1.18 0.00 0.00 61.69 61.96 2f90 s THR 214 Cb -0.10 -3.49 0.07 0.00 1.34 0.00 0.00 72.50 70.32 2f90 s THR 214 CO 0.43 -0.08 0.84 0.61 -0.54 0.00 0.00 174.62 175.88 2f90 n GLY 215 N 0.20 -0.42 2.97 3.99 0.00 -0.21 -4.83 105.19 106.89 2f90 n GLY 215 Ca 0.08 0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 2f90 n GLY 215 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f90 s VAL 216 N -3.44 1.25 0.27 1.61 1.01 -1.26 -4.72 120.40 115.13 2f90 s VAL 216 Ca 0.48 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.70 2f90 s VAL 216 Cb -0.24 -1.20 -0.11 0.00 0.00 0.00 0.00 36.38 34.82 2f90 s VAL 216 CO 0.85 0.40 1.59 -2.84 0.00 0.00 0.00 175.10 175.09 2f90 s PRO 217 N 1.42 4.14 -0.26 2.72 0.02 -1.26 -4.45 135.00 137.33 2f90 s PRO 217 Ca 0.01 2.54 -0.02 0.00 0.02 0.00 0.00 61.00 63.54 2f90 s PRO 217 Cb -0.13 -3.04 0.03 0.00 0.02 0.00 0.00 34.50 31.37 2f90 s PRO 217 CO -0.06 -0.62 -0.04 0.42 -0.33 0.00 0.00 177.00 176.37 2f90 s ILE 218 N 0.15 3.00 -0.07 2.83 1.01 0.99 -1.24 121.20 127.87 2f90 s ILE 218 Ca 0.64 -1.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.05 2f90 s ILE 218 Cb -0.47 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 2f90 s ILE 218 CO 0.45 0.13 0.48 -0.22 0.00 0.00 0.00 174.94 175.78 2f90 s LEU 219 N 1.33 4.35 -0.02 2.97 2.96 0.57 -1.64 118.68 129.20 2f90 s LEU 219 Ca -0.01 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 54.83 2f90 s LEU 219 Cb -0.17 -2.71 0.01 0.00 0.50 0.00 0.00 46.19 43.83 2f90 s LEU 219 CO -0.03 0.11 -0.03 -0.22 -1.32 0.00 0.00 176.35 174.86 2f90 s LEU 220 N 0.02 1.53 -0.14 -0.68 2.96 -0.97 -1.43 118.68 119.97 2f90 s LEU 220 Ca 0.26 -0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 54.08 2f90 s LEU 220 Cb -0.16 -0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.23 2f90 s LEU 220 CO 0.12 -0.03 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.37 2f90 s GLU 221 N 0.55 3.53 0.12 1.98 2.12 -1.26 -1.89 118.70 123.85 2f90 s GLU 221 Ca -0.06 -0.54 0.09 0.00 0.36 0.00 0.00 54.97 54.81 2f90 s GLU 221 Cb -0.09 -2.84 -0.04 0.00 0.26 0.00 0.00 34.13 31.42 2f90 s GLU 221 CO -0.01 0.29 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.34 2f90 s LEU 222 N 0.22 2.80 0.00 2.70 1.43 -0.12 -0.57 118.68 125.14 2f90 s LEU 222 Ca -0.03 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 2f90 s LEU 222 Cb -0.14 -1.62 0.06 0.00 0.03 0.00 0.00 46.19 44.52 2f90 s LEU 222 CO 0.03 0.17 0.39 -0.90 0.23 0.00 0.00 176.35 176.27 2f90 n ASP 223 N 0.70 0.45 0.29 2.29 5.68 0.71 -1.91 116.55 124.77 2f90 n ASP 223 Ca -0.15 -1.40 0.18 0.00 -0.50 0.00 0.00 54.79 52.93 2f90 n ASP 223 Cb 0.53 -0.26 0.99 0.00 -1.14 0.00 0.00 41.12 41.24 2f90 n ASP 223 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2f90 h GLU 224 N 0.00 0.00 -0.72 0.11 4.11 -1.98 0.15 114.58 116.24 2f90 h GLU 224 Ca -0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.30 2f90 h GLU 224 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2f90 h GLU 224 CO 0.13 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.30 2f90 n ASN 225 N -2.83 4.08 -2.66 3.06 3.02 -1.26 -4.94 115.26 113.73 2f90 n ASN 225 Ca -0.02 -2.07 -0.19 0.00 -0.03 0.00 0.00 54.58 52.27 2f90 n ASN 225 Cb 0.13 -0.50 0.04 0.00 -0.61 0.00 0.00 39.78 38.83 2f90 n ASN 225 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2f90 n LEU 226 N 1.58 -2.63 -4.38 3.41 4.77 0.53 -5.02 117.00 115.26 2f90 n LEU 226 Ca 0.25 -0.28 -0.30 0.00 -0.03 0.00 0.00 56.01 55.65 2f90 n LEU 226 Cb 0.66 -2.60 -0.14 0.00 -2.33 0.00 0.00 43.42 39.01 2f90 n LEU 226 CO 0.18 0.26 -0.55 -0.13 -1.33 0.00 0.00 177.39 175.82 2f90 s ARG 227 N -5.61 1.85 0.24 3.23 1.81 -1.26 -4.82 118.95 114.39 2f90 s ARG 227 Ca 0.30 -1.09 -0.31 0.00 -1.72 0.00 0.00 55.73 52.90 2f90 s ARG 227 Cb -0.13 -2.03 -0.13 0.00 -0.45 0.00 0.00 34.95 32.21 2f90 s ARG 227 CO 0.37 0.52 1.49 0.00 -0.68 0.00 0.00 175.30 176.99 2f90 n ALA 228 N 1.63 1.60 0.08 2.13 0.00 0.15 -0.21 120.51 125.90 2f90 n ALA 228 Ca -0.17 0.41 -0.09 0.00 0.00 0.00 0.00 53.44 53.58 2f90 n ALA 228 Cb 0.52 -2.34 -0.09 0.00 0.00 0.00 0.00 19.45 17.54 2f90 n ALA 228 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2f90 h VAL 229 N 3.23 1.60 -3.53 0.00 2.07 -1.16 -3.45 116.25 115.01 2f90 h VAL 229 Ca -0.45 -3.09 -0.15 0.00 0.82 0.00 0.00 66.70 63.83 2f90 h VAL 229 Cb 1.26 2.75 -0.03 0.00 -1.52 0.00 0.00 31.29 33.75 2f90 h VAL 229 CO 0.79 0.89 0.06 -0.83 0.02 0.00 0.00 177.57 178.50 2f90 s GLY 230 N -4.64 0.93 0.92 2.17 0.00 -1.26 -5.10 107.32 100.34 2f90 s GLY 230 Ca -0.01 -1.14 -0.11 0.00 0.00 0.00 0.00 44.72 43.47 2f90 s GLY 230 CO 0.84 -0.64 1.12 2.56 0.00 0.00 0.00 173.10 176.97 2f90 s PRO 231 N -2.58 1.03 0.61 2.90 0.04 -1.26 -4.78 135.00 130.95 2f90 s PRO 231 Ca 0.23 1.32 -0.18 0.00 0.04 0.00 0.00 61.00 62.41 2f90 s PRO 231 Cb -0.03 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.74 2f90 s PRO 231 CO 0.16 -2.55 1.15 -3.38 0.04 0.00 0.00 177.00 172.42 2f90 s HIS 232 N -2.70 2.52 -0.03 0.56 -3.43 -1.26 -4.88 115.29 106.07 2f90 s HIS 232 Ca 0.66 1.54 0.06 0.00 -0.80 0.00 0.00 55.06 56.52 2f90 s HIS 232 Cb -0.22 -3.33 -0.01 0.00 -1.43 0.00 0.00 32.58 27.60 2f90 s HIS 232 CO 0.58 -1.88 -0.21 -0.65 -2.00 0.00 0.00 174.74 170.58 2f90 s GLN 233 N -3.58 1.96 -0.08 -0.38 -0.21 -0.51 -4.97 119.66 111.88 2f90 s GLN 233 Ca 0.73 -0.75 -0.19 0.00 0.02 0.00 0.00 55.36 55.17 2f90 s GLN 233 Cb -0.25 -1.77 -0.04 0.00 1.00 0.00 0.00 33.01 31.95 2f90 s GLN 233 CO 0.34 0.38 0.50 -0.06 -2.12 0.00 0.00 175.29 174.33 2f90 s PHE 234 N -0.25 3.57 -0.14 0.91 0.40 -1.26 -0.32 117.98 120.88 2f90 s PHE 234 Ca 0.02 0.97 -0.22 0.00 -0.60 0.00 0.00 56.93 57.10 2f90 s PHE 234 Cb -0.11 -2.55 -0.03 0.00 0.51 0.00 0.00 43.02 40.84 2f90 s PHE 234 CO 0.01 0.24 0.66 -0.51 0.70 0.00 0.00 175.22 176.32 2f90 s LEU 235 N 0.34 4.22 0.00 -0.37 1.43 -0.37 -4.93 118.68 118.99 2f90 s LEU 235 Ca 0.27 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.36 2f90 s LEU 235 Cb -0.16 -2.97 0.00 0.00 0.03 0.00 0.00 46.19 43.09 2f90 s LEU 235 CO 0.12 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.10 2f90 n GLY 236 N 3.48 0.69 3.63 -3.19 0.00 -1.26 -4.47 105.19 104.06 2f90 n GLY 236 Ca -0.01 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 2f90 n GLY 236 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2f90 s ASP 237 N -4.00 6.22 0.44 1.61 -1.08 -1.26 -4.88 116.67 113.71 2f90 s ASP 237 Ca 0.00 1.72 0.12 0.00 -0.52 0.00 0.00 52.55 53.87 2f90 s ASP 237 Cb 0.00 -2.53 1.01 0.00 -1.46 0.00 0.00 42.92 39.94 2f90 s ASP 237 CO 0.00 -1.38 2.04 1.56 0.52 0.00 0.00 175.17 177.91 2f90 h GLN 238 N 11.49 0.38 -0.31 4.34 1.08 -1.95 -0.64 115.11 129.49 2f90 h GLN 238 Ca -0.36 -0.02 -0.17 0.00 -1.45 0.00 0.00 58.65 56.65 2f90 h GLN 238 Cb 1.17 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 28.52 2f90 h GLN 238 CO 0.99 0.25 -0.45 0.93 -0.95 0.00 0.00 178.83 179.60 2f90 h GLU 239 N 0.39 0.86 -0.17 1.46 3.07 -1.99 -0.03 114.58 118.18 2f90 h GLU 239 Ca 0.18 -0.51 -0.12 0.00 -0.50 0.00 0.00 59.36 58.41 2f90 h GLU 239 Cb 0.23 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 2f90 h GLU 239 CO -0.04 1.15 -0.42 0.00 -1.40 0.00 0.00 179.01 178.29 2f90 h ALA 240 N 0.71 0.96 -0.30 3.43 0.00 -1.81 -0.59 119.26 121.65 2f90 h ALA 240 Ca 0.03 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.38 2f90 h ALA 240 Cb 1.06 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2f90 h ALA 240 CO 0.11 0.63 -0.32 0.82 0.00 0.00 0.00 179.25 180.48 2f90 h ILE 241 N 0.33 1.30 -0.57 0.00 2.04 -1.03 -1.69 117.51 117.89 2f90 h ILE 241 Ca 0.03 -1.50 -0.08 0.00 1.00 0.00 0.00 64.86 64.31 2f90 h ILE 241 Cb 0.88 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 2f90 h ILE 241 CO 0.07 0.48 0.04 1.56 0.00 0.00 0.00 178.15 180.31 2f90 h GLN 242 N 0.50 0.95 -0.76 2.37 1.08 -0.83 -1.22 115.11 117.20 2f90 h GLN 242 Ca 0.04 -0.26 -0.05 0.00 -1.45 0.00 0.00 58.65 56.93 2f90 h GLN 242 Cb 0.90 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 28.19 2f90 h GLN 242 CO 0.08 0.91 0.29 0.00 -0.95 0.00 0.00 178.83 179.16 2f90 h ALA 243 N 1.15 0.99 -0.53 3.87 0.00 -0.99 -0.57 119.26 123.18 2f90 h ALA 243 Ca 0.17 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2f90 h ALA 243 Cb 0.47 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2f90 h ALA 243 CO 0.02 0.64 -0.07 0.00 0.00 0.00 0.00 179.25 179.84 2f90 h ALA 244 N 1.15 0.87 -0.60 0.00 0.00 -0.94 -1.49 119.26 118.26 2f90 h ALA 244 Ca 0.25 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2f90 h ALA 244 Cb 0.24 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2f90 h ALA 244 CO -0.02 0.65 0.18 0.82 0.00 0.00 0.00 179.25 180.88 2f90 h ILE 245 N 0.87 1.24 -0.70 0.00 2.04 -0.86 -1.92 117.51 118.19 2f90 h ILE 245 Ca 0.15 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.12 2f90 h ILE 245 Cb 0.60 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 2f90 h ILE 245 CO 0.04 0.32 0.27 0.50 0.00 0.00 0.00 178.15 179.27 2f90 h LYS 246 N 0.85 1.05 -0.93 2.37 3.64 -0.87 -1.60 116.57 121.08 2f90 h LYS 246 Ca 0.19 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2f90 h LYS 246 Cb 0.30 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 2f90 h LYS 246 CO -0.00 0.86 0.60 -0.22 -2.27 0.00 0.00 179.45 178.42 2f90 h LYS 247 N 1.02 1.23 -0.45 1.90 3.64 -0.84 0.75 116.57 123.83 2f90 h LYS 247 Ca 0.23 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.45 2f90 h LYS 247 Cb 0.22 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2f90 h LYS 247 CO -0.02 0.83 -0.04 0.28 -2.27 0.00 0.00 179.45 178.23 2f90 h VAL 248 N 1.26 1.27 -0.59 2.00 2.07 -0.74 -2.63 116.25 118.88 2f90 h VAL 248 Ca 0.34 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 2f90 h VAL 248 Cb -0.12 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2f90 h VAL 248 CO -0.07 0.39 0.06 -0.33 0.02 0.00 0.00 177.57 177.64 2f90 h GLU 249 N 0.66 0.98 0.00 1.57 5.08 -0.89 -2.71 114.58 119.28 2f90 h GLU 249 Ca 0.12 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2f90 h GLU 249 Cb 0.56 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2f90 h GLU 249 CO 0.03 0.93 0.00 -0.25 -1.00 0.00 0.00 179.01 178.72 2f90 n ASP 250 N -4.21 0.64 0.29 1.42 8.00 0.22 -2.59 116.55 120.32 2f90 n ASP 250 Ca 0.04 0.65 0.17 0.00 0.71 0.00 0.00 54.79 56.36 2f90 n ASP 250 Cb 0.30 -0.79 0.87 0.00 -0.02 0.00 0.00 41.12 41.47 2f90 n ASP 250 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 2f90 h GLN 251 N 0.00 0.00 -0.41 -1.24 4.20 -1.12 -2.04 115.11 114.49 2f90 h GLN 251 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2f90 h GLN 251 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2f90 h GLN 251 CO 0.00 0.05 0.00 0.41 -0.67 0.00 0.00 178.83 178.62 2f90 n GLY 252 N -0.61 3.52 3.42 3.46 0.00 -1.07 -2.34 105.19 111.57 2f90 n GLY 252 Ca -0.02 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 2f90 n GLY 252 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f90 s LYS 253 N -2.70 1.55 0.29 1.61 1.02 -0.77 -4.67 119.74 116.07 2f90 s LYS 253 Ca 0.47 -1.28 -0.29 0.00 0.02 0.00 0.00 55.97 54.89 2f90 s LYS 253 Cb 0.36 -1.97 -0.10 0.00 -0.52 0.00 0.00 37.83 35.61 2f90 s LYS 253 CO 0.13 0.47 1.10 0.08 -0.92 0.00 0.00 175.35 176.20 2f90 s VAL 254 N -1.06 3.50 -0.01 3.17 1.01 -1.26 -4.88 120.40 120.86 2f90 s VAL 254 Ca 0.15 1.49 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 2f90 s VAL 254 Cb -0.10 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.27 2f90 s VAL 254 CO 0.07 0.34 1.82 -1.59 0.00 0.00 0.00 175.10 175.74 2f90 s LYS 255 N -1.50 4.14 0.00 2.72 0.00 -1.26 -5.17 119.74 118.66 2f90 s LYS 255 Ca 0.45 2.39 0.18 0.00 0.00 0.00 0.00 55.97 58.99 2f90 s LYS 255 Cb -0.31 -4.08 0.14 0.00 0.00 0.00 0.00 37.83 33.57 2f90 s LYS 255 CO 0.40 -0.93 1.06 1.04 0.00 0.00 0.00 175.35 176.92