#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wri n LYS 8 N 0.00 0.00 -0.17 5.55 4.76 -1.26 -4.53 118.16 122.51 2wri n LYS 8 Ca 0.00 0.00 0.10 0.00 -2.87 0.00 0.00 58.31 55.54 2wri n LYS 8 Cb 0.00 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.39 2wri n LYS 8 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2wri n GLU 9 N 0.00 -0.04 -0.02 1.97 0.00 -1.26 0.33 120.64 121.62 2wri n GLU 9 Ca 0.00 0.72 -0.02 0.00 0.00 0.00 0.00 57.16 57.86 2wri n GLU 9 Cb 0.00 -1.20 0.24 0.00 0.00 0.00 0.00 31.44 30.49 2wri n GLU 9 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2wri h LEU 10 N 0.00 0.55 -0.03 -1.84 3.38 -2.02 -3.02 115.31 112.34 2wri h LEU 10 Ca 0.34 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.21 2wri h LEU 10 Cb 0.80 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2wri h LEU 10 CO -0.44 0.66 -0.12 -0.07 0.09 0.00 0.00 178.44 178.56 2wri h LEU 11 N 0.55 -0.35 0.00 1.67 3.38 0.53 -3.37 115.31 117.71 2wri h LEU 11 Ca 0.11 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2wri h LEU 11 Cb 0.43 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2wri h LEU 11 CO 0.02 -0.17 0.00 -0.62 0.09 0.00 0.00 178.44 177.76 2wri n GLU 12 N -5.25 0.00 0.00 1.13 4.71 -1.15 -4.26 120.64 115.81 2wri n GLU 12 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 2wri n GLU 12 Cb 0.17 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.60 2wri n GLU 12 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wri n ALA 13 N -3.00 0.00 -0.20 0.62 0.00 -1.16 -3.38 120.51 113.39 2wri n ALA 13 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2wri n ALA 13 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 2wri n ALA 13 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wri h GLY 14 N 0.00 0.85 -5.00 0.00 0.00 -1.76 -3.42 103.07 93.74 2wri h GLY 14 Ca 0.00 -0.26 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 2wri h GLY 14 CO 0.00 0.22 -0.16 3.33 0.00 0.00 0.00 176.54 179.93 2wri n VAL 15 N -4.76 0.00 -1.83 4.60 0.24 -1.22 -5.02 118.33 110.35 2wri n VAL 15 Ca 0.05 -1.12 0.00 0.00 -2.04 0.00 0.00 64.34 61.23 2wri n VAL 15 Cb 0.09 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 33.51 2wri n VAL 15 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2wri n HIS 16 N -0.10 0.00 0.00 6.34 -0.00 -1.26 -4.41 115.22 115.79 2wri n HIS 16 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 2wri n HIS 16 Cb 0.74 0.11 0.00 0.00 -0.00 0.00 0.00 29.99 30.85 2wri n HIS 16 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 2wri n PHE 17 N 0.00 0.00 0.00 4.41 -0.00 -1.26 -4.10 117.46 116.51 2wri n PHE 17 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2wri n PHE 17 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.03 2wri n PHE 17 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2wri n GLY 18 N 4.75 0.00 3.39 4.97 0.00 -1.26 -3.00 105.19 114.04 2wri n GLY 18 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2wri n GLY 18 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2wri n HIS 19 N 0.00 -1.73 -0.24 1.61 -0.00 -1.10 -4.74 115.22 109.03 2wri n HIS 19 Ca 0.00 -2.13 0.00 0.00 0.46 0.00 0.00 57.72 56.05 2wri n HIS 19 Cb 0.00 0.66 0.00 0.00 -0.12 0.00 0.00 29.99 30.53 2wri n HIS 19 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2wri n GLU 20 N -0.55 0.00 -3.40 1.57 -0.58 -1.26 -3.61 120.64 112.82 2wri n GLU 20 Ca -0.02 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.71 2wri n GLU 20 Cb 0.57 -0.21 -0.04 0.00 -0.57 0.00 0.00 31.44 31.19 2wri n GLU 20 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2wri s ARG 21 N -2.04 0.52 -1.09 3.49 1.70 -1.26 -2.03 118.95 118.25 2wri s ARG 21 Ca 0.00 1.10 0.00 0.00 -0.47 0.00 0.00 55.73 56.36 2wri s ARG 21 Cb 0.00 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.89 2wri s ARG 21 CO 0.00 -0.44 0.00 1.63 -1.08 0.00 0.00 175.30 175.41 2wri n LYS 22 N 5.42 -0.76 -0.09 3.89 4.76 -1.26 -4.75 118.16 125.37 2wri n LYS 22 Ca -0.06 0.80 0.00 0.00 -2.87 0.00 0.00 58.31 56.18 2wri n LYS 22 Cb 0.50 -4.78 0.00 0.00 -1.84 0.00 0.00 35.03 28.91 2wri n LYS 22 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2wri n ARG 23 N -2.55 0.14 0.00 1.97 3.00 -1.26 -5.09 116.66 112.87 2wri n ARG 23 Ca -0.11 -0.65 0.00 0.00 -0.00 0.00 0.00 57.85 57.09 2wri n ARG 23 Cb 0.40 -0.53 0.00 0.00 0.00 0.00 0.00 32.46 32.33 2wri n ARG 23 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.63 174.96 2wri n TRP 24 N -0.04 -1.39 -3.48 -0.14 4.27 -1.26 -4.79 117.44 110.61 2wri n TRP 24 Ca 0.00 0.00 -0.19 0.00 -3.89 0.00 0.00 57.50 53.42 2wri n TRP 24 Cb 0.53 0.00 -0.12 0.00 -1.36 0.00 0.00 31.31 30.35 2wri n TRP 24 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 2wri s ASN 25 N -1.93 1.61 0.41 -0.67 3.84 -0.99 -4.91 114.94 112.31 2wri s ASN 25 Ca 0.00 -0.42 0.04 0.00 0.21 0.00 0.00 52.86 52.70 2wri s ASN 25 Cb 0.00 0.35 0.23 0.00 -0.55 0.00 0.00 41.25 41.28 2wri s ASN 25 CO 0.00 -0.35 0.97 1.55 -2.79 0.00 0.00 177.10 176.48 2wri h PRO 26 N 8.31 0.00 0.00 0.43 0.13 -1.94 0.23 132.00 139.16 2wri h PRO 26 Ca -0.17 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.93 2wri h PRO 26 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2wri h PRO 26 CO 0.31 0.00 -0.18 0.87 -0.23 0.00 0.00 178.00 178.76 2wri h LYS 27 N 0.00 0.00 0.00 0.86 1.57 -1.95 -3.04 116.57 114.00 2wri h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wri h LYS 27 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 2wri h LYS 27 CO 0.00 0.18 0.00 0.35 -0.57 0.00 0.00 179.45 179.41 2wri h PHE 28 N 0.00 0.00 -0.03 -1.35 3.04 -0.81 -3.40 116.94 114.39 2wri h PHE 28 Ca -0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2wri h PHE 28 Cb 0.89 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.39 2wri h PHE 28 CO 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 178.31 176.27 2wri n ALA 29 N -2.03 -0.02 -0.26 2.41 0.00 -1.15 -0.13 120.51 119.33 2wri n ALA 29 Ca 0.02 0.02 0.33 0.00 0.00 0.00 0.00 53.44 53.81 2wri n ALA 29 Cb 0.36 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.53 2wri n ALA 29 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2wri h ARG 30 N 0.00 0.00 -0.75 0.00 0.11 -1.88 0.24 114.38 112.10 2wri h ARG 30 Ca 0.00 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.90 2wri h ARG 30 Cb 0.01 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 30.98 2wri h ARG 30 CO -0.02 0.00 0.24 0.66 0.10 0.00 0.00 179.97 180.94 2wri n TYR 31 N -3.99 2.37 -4.70 4.08 0.53 0.81 -4.89 117.16 111.37 2wri n TYR 31 Ca 0.23 -1.11 -0.29 0.00 -1.02 0.00 0.00 57.90 55.71 2wri n TYR 31 Cb 1.21 -0.66 -0.17 0.00 -1.03 0.00 0.00 39.34 38.69 2wri n TYR 31 CO 0.00 0.00 0.00 -1.50 -1.02 0.00 0.00 176.86 174.34 2wri s ILE 32 N -2.88 1.67 -0.12 -0.72 2.07 0.85 -3.21 121.20 118.86 2wri s ILE 32 Ca 0.54 -0.77 -0.06 0.00 -1.41 0.00 0.00 60.65 58.95 2wri s ILE 32 Cb 0.43 -1.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.48 2wri s ILE 32 CO 0.14 0.47 0.04 0.22 -1.91 0.00 0.00 174.94 173.90 2wri h TYR 33 N 7.15 0.00 -2.76 3.50 3.20 -1.21 -3.44 116.97 123.41 2wri h TYR 33 Ca -0.28 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.65 2wri h TYR 33 Cb 1.20 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 39.37 2wri h TYR 33 CO 0.48 0.17 0.31 0.00 -1.64 0.00 0.00 178.16 177.48 2wri s ALA 34 N -2.56 -1.55 -0.98 1.82 0.00 -0.89 -5.01 121.76 112.60 2wri s ALA 34 Ca -0.07 0.31 -0.03 0.00 0.00 0.00 0.00 51.96 52.16 2wri s ALA 34 Cb 0.01 0.75 0.27 0.00 0.00 0.00 0.00 23.12 24.14 2wri s ALA 34 CO 0.15 -0.87 1.07 -1.91 0.00 0.00 0.00 175.76 174.20 2wri n GLU 35 N -0.39 3.40 -3.56 0.00 2.13 -1.26 0.11 120.64 121.06 2wri n GLU 35 Ca -0.10 -4.52 -0.32 0.00 0.66 0.00 0.00 57.16 52.87 2wri n GLU 35 Cb 0.62 -2.46 -0.05 0.00 0.27 0.00 0.00 31.44 29.82 2wri n GLU 35 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2wri s ARG 36 N -1.92 3.72 -1.72 5.31 3.00 -0.96 -3.96 118.95 122.42 2wri s ARG 36 Ca 0.31 0.10 0.00 0.00 0.00 0.00 0.00 55.73 56.14 2wri s ARG 36 Cb -0.02 -2.82 0.00 0.00 0.00 0.00 0.00 34.95 32.11 2wri s ARG 36 CO -0.03 0.44 0.00 -1.71 0.00 0.00 0.00 175.30 174.00 2wri n ASN 37 N 0.23 -5.19 0.00 0.23 2.85 -1.26 -1.11 115.26 111.01 2wri n ASN 37 Ca -0.03 0.19 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 2wri n ASN 37 Cb 0.52 -4.44 0.00 0.00 1.24 0.00 0.00 39.78 37.10 2wri n ASN 37 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2wri n GLY 38 N -0.74 1.63 3.81 8.20 0.00 -1.25 -4.98 105.19 111.86 2wri n GLY 38 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 2wri n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wri s ILE 39 N -2.65 4.99 -0.12 -0.61 1.01 -0.27 -4.64 121.20 118.92 2wri s ILE 39 Ca 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.19 2wri s ILE 39 Cb 0.00 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 2wri s ILE 39 CO 0.00 0.47 1.48 -1.00 0.00 0.00 0.00 174.94 175.89 2wri s HIS 40 N -1.11 2.37 -0.25 3.97 3.76 -0.86 -2.27 115.29 120.90 2wri s HIS 40 Ca 0.20 0.58 -0.09 0.00 -0.15 0.00 0.00 55.06 55.59 2wri s HIS 40 Cb -0.12 -3.75 -0.04 0.00 1.11 0.00 0.00 32.58 29.78 2wri s HIS 40 CO 0.10 -2.83 0.13 0.42 -0.85 0.00 0.00 174.74 171.71 2wri s ILE 41 N 3.92 4.93 0.46 0.60 1.09 0.31 -2.72 121.20 129.78 2wri s ILE 41 Ca 0.65 0.03 -0.21 0.00 -1.10 0.00 0.00 60.65 60.02 2wri s ILE 41 Cb -0.27 -3.31 -0.09 0.00 -1.06 0.00 0.00 42.46 37.73 2wri s ILE 41 CO 0.23 0.33 1.03 -0.51 -0.10 0.00 0.00 174.94 175.91 2wri s ILE 42 N 1.36 3.87 -0.48 2.92 2.07 -1.26 -0.81 121.20 128.86 2wri s ILE 42 Ca 0.06 1.21 -0.21 0.00 -1.41 0.00 0.00 60.65 60.30 2wri s ILE 42 Cb -0.15 -3.51 0.04 0.00 0.13 0.00 0.00 42.46 38.97 2wri s ILE 42 CO 0.06 -0.21 0.71 -0.62 -1.91 0.00 0.00 174.94 172.97 2wri s ASP 43 N -1.94 6.30 0.53 4.50 2.15 -1.20 -4.55 116.67 122.47 2wri s ASP 43 Ca 0.65 -0.51 0.32 0.00 0.43 0.00 0.00 52.55 53.44 2wri s ASP 43 Cb -0.16 -2.34 1.23 0.00 -0.30 0.00 0.00 42.92 41.35 2wri s ASP 43 CO 0.20 -0.92 1.94 -0.07 -0.17 0.00 0.00 175.17 176.15 2wri h LEU 44 N 9.99 0.00 -1.85 -1.34 4.07 -1.93 -2.29 115.31 121.95 2wri h LEU 44 Ca -0.26 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.67 2wri h LEU 44 Cb 1.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.83 2wri h LEU 44 CO 0.96 0.03 -0.13 -0.61 -1.08 0.00 0.00 178.44 177.61 2wri h GLN 45 N 0.00 0.00 0.01 1.13 4.15 -2.00 0.56 115.11 118.97 2wri h GLN 45 Ca -0.00 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.08 2wri h GLN 45 Cb 0.58 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.21 2wri h GLN 45 CO 0.00 0.13 -2.04 1.17 -1.93 0.00 0.00 178.83 176.17 2wri n LYS 46 N -3.64 0.67 0.02 1.69 4.81 -1.01 -3.61 118.16 117.09 2wri n LYS 46 Ca -0.02 0.18 -0.12 0.00 -0.87 0.00 0.00 58.31 57.48 2wri n LYS 46 Cb 0.25 -1.67 -0.06 0.00 0.02 0.00 0.00 35.03 33.57 2wri n LYS 46 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2wri h THR 47 N 0.01 0.19 -0.16 3.15 2.02 -0.67 -0.66 112.91 116.78 2wri h THR 47 Ca -0.42 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.79 2wri h THR 47 Cb 2.09 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 68.64 2wri h THR 47 CO 0.05 0.00 -0.28 -0.03 0.37 0.00 0.00 175.52 175.63 2wri h MET 48 N -0.50 -0.22 -0.88 6.66 1.85 -1.09 0.51 114.93 121.26 2wri h MET 48 Ca 0.07 0.02 0.36 0.00 -0.61 0.00 0.00 59.70 59.54 2wri h MET 48 Cb 0.61 0.05 -0.16 0.00 0.43 0.00 0.00 31.60 32.54 2wri h MET 48 CO -0.36 -0.15 0.45 0.39 -0.40 0.00 0.00 176.91 176.85 2wri n GLU 49 N -4.03 -0.05 -0.03 0.39 1.02 -0.67 0.50 120.64 117.77 2wri n GLU 49 Ca -0.02 1.22 -0.16 0.00 -0.02 0.00 0.00 57.16 58.18 2wri n GLU 49 Cb 0.18 -2.18 -0.09 0.00 -0.02 0.00 0.00 31.44 29.32 2wri n GLU 49 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2wri h GLU 50 N 0.00 0.39 -0.26 3.49 4.39 0.51 -3.12 114.58 119.98 2wri h GLU 50 Ca 0.74 -0.33 0.04 0.00 0.34 0.00 0.00 59.36 60.16 2wri h GLU 50 Cb 1.93 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 30.61 2wri h GLU 50 CO -0.69 0.97 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.05 2wri h LEU 51 N -0.09 -0.12 -1.03 1.33 3.38 0.16 0.22 115.31 119.17 2wri h LEU 51 Ca -0.03 0.06 0.24 0.00 0.09 0.00 0.00 57.88 58.24 2wri h LEU 51 Cb 1.05 0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.79 2wri h LEU 51 CO 0.08 -0.03 0.60 -0.08 0.09 0.00 0.00 178.44 179.11 2wri h GLU 52 N 0.07 0.59 0.09 1.13 4.81 -1.16 0.41 114.58 120.51 2wri h GLU 52 Ca 0.12 -0.04 -0.26 0.00 -0.13 0.00 0.00 59.36 59.06 2wri h GLU 52 Cb 0.16 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2wri h GLU 52 CO -0.21 0.39 -1.21 -0.09 -0.73 0.00 0.00 179.01 177.15 2wri h ARG 53 N 0.61 0.18 -0.11 1.92 2.43 -0.96 -2.80 114.38 115.64 2wri h ARG 53 Ca 0.63 -0.31 -0.21 0.00 -0.81 0.00 0.00 59.98 59.28 2wri h ARG 53 Cb 1.18 0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.86 2wri h ARG 53 CO -0.45 1.12 -0.75 1.15 -1.51 0.00 0.00 179.97 179.54 2wri h THR 54 N 0.05 1.30 0.00 0.20 2.02 0.51 -2.93 112.91 114.06 2wri h THR 54 Ca -0.11 -1.98 -0.01 0.00 0.77 0.00 0.00 66.41 65.07 2wri h THR 54 Cb 1.92 2.12 -0.00 0.00 -1.74 0.00 0.00 68.15 70.45 2wri h THR 54 CO 0.17 0.62 -0.06 -0.26 0.37 0.00 0.00 175.52 176.37 2wri h PHE 55 N 0.39 0.00 0.67 3.16 0.04 -0.34 0.13 116.94 121.00 2wri h PHE 55 Ca -0.06 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.67 2wri h PHE 55 Cb 1.39 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.55 2wri h PHE 55 CO 0.10 0.06 -0.32 0.00 -0.60 0.00 0.00 178.31 177.54 2wri h ARG 56 N 0.00 -0.87 -0.57 1.51 2.47 -1.35 0.16 114.38 115.73 2wri h ARG 56 Ca -0.00 0.06 0.11 0.00 -1.26 0.00 0.00 59.98 58.89 2wri h ARG 56 Cb 0.44 0.20 -0.11 0.00 -1.65 0.00 0.00 29.97 28.84 2wri h ARG 56 CO 0.01 -0.56 -0.22 0.35 0.56 0.00 0.00 179.97 180.10 2wri h PHE 57 N -1.19 -0.56 0.90 3.04 3.57 -1.20 0.22 116.94 121.72 2wri h PHE 57 Ca -0.09 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 2wri h PHE 57 Cb 0.72 0.33 0.01 0.00 2.79 0.00 0.00 35.95 39.80 2wri h PHE 57 CO 0.00 -0.31 -0.45 0.82 -2.23 0.00 0.00 178.31 176.13 2wri h ILE 58 N -0.08 0.00 -0.79 1.41 2.04 -0.97 0.12 117.51 119.23 2wri h ILE 58 Ca 0.26 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.31 2wri h ILE 58 Cb 0.49 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.44 2wri h ILE 58 CO -0.63 0.00 0.08 -0.08 0.00 0.00 0.00 178.15 177.52 2wri h GLU 59 N -1.24 0.14 0.00 2.37 4.81 -0.53 1.87 114.58 121.99 2wri h GLU 59 Ca -0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2wri h GLU 59 Cb 0.96 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.30 2wri h GLU 59 CO 0.19 0.09 0.00 -0.25 -0.73 0.00 0.00 179.01 178.31 2wri n ASP 60 N -5.31 0.00 -0.07 1.04 10.43 0.72 -1.65 116.55 121.71 2wri n ASP 60 Ca 0.16 0.02 -0.08 0.00 2.57 0.00 0.00 54.79 57.46 2wri n ASP 60 Cb 0.53 -0.30 -0.15 0.00 1.84 0.00 0.00 41.12 43.04 2wri n ASP 60 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 2wri n LEU 61 N -1.30 0.22 0.00 0.64 7.94 0.58 -4.43 117.00 120.66 2wri n LEU 61 Ca 0.09 0.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.10 2wri n LEU 61 Cb 0.17 0.39 0.00 0.00 0.53 0.00 0.00 43.42 44.51 2wri n LEU 61 CO 0.16 0.44 0.30 0.00 -1.11 0.00 0.00 177.39 177.17 2wri n ALA 62 N -2.67 -0.18 -0.34 1.96 0.00 0.17 -2.26 120.51 117.19 2wri n ALA 62 Ca -0.27 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.08 2wri n ALA 62 Cb 1.10 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.53 2wri n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wri n MET 63 N -1.13 0.90 0.00 0.00 0.00 -0.98 0.22 117.12 116.13 2wri n MET 63 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 57.70 56.91 2wri n MET 63 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 33.22 31.15 2wri n MET 63 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2wri n ARG 64 N 4.17 0.00 -2.65 3.17 0.63 -1.20 -4.95 116.66 115.84 2wri n ARG 64 Ca 0.19 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 57.08 2wri n ARG 64 Cb 0.11 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 32.98 2wri n ARG 64 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wri n GLY 65 N 0.00 -4.91 3.62 5.14 0.00 0.59 -5.06 105.19 104.57 2wri n GLY 65 Ca 0.00 1.53 -0.04 0.00 0.00 0.00 0.00 46.02 47.51 2wri n GLY 65 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wri s GLY 66 N -0.82 -0.36 0.52 -0.02 0.00 -1.24 -5.04 107.32 100.35 2wri s GLY 66 Ca -0.23 2.75 -0.23 0.00 0.00 0.00 0.00 44.72 47.02 2wri s GLY 66 CO 0.77 2.63 1.35 -1.30 0.00 0.00 0.00 173.10 176.55 2wri n THR 67 N 4.26 3.49 -3.95 0.90 -2.24 -1.26 -4.88 114.28 110.60 2wri n THR 67 Ca -0.18 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.81 2wri n THR 67 Cb 0.57 -1.68 -0.16 0.00 -2.10 0.00 0.00 70.33 66.96 2wri n THR 67 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wri s ILE 68 N -1.27 1.48 -0.35 2.28 1.01 -1.26 -2.50 121.20 120.59 2wri s ILE 68 Ca 0.69 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 2wri s ILE 68 Cb -0.43 -1.63 0.01 0.00 0.01 0.00 0.00 42.46 40.41 2wri s ILE 68 CO 0.52 0.08 1.34 -0.22 0.00 0.00 0.00 174.94 176.66 2wri s LEU 69 N 1.46 3.75 -0.36 2.97 2.96 -0.80 -4.19 118.68 124.46 2wri s LEU 69 Ca -0.02 1.02 -0.23 0.00 -0.22 0.00 0.00 54.13 54.69 2wri s LEU 69 Cb -0.17 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 42.99 2wri s LEU 69 CO -0.07 -1.23 0.75 -0.36 -1.32 0.00 0.00 176.35 174.12 2wri s PHE 70 N 4.81 3.12 -0.11 5.38 0.40 0.03 -1.12 117.98 130.49 2wri s PHE 70 Ca 0.58 0.50 0.01 0.00 -0.60 0.00 0.00 56.93 57.42 2wri s PHE 70 Cb -0.15 -3.35 -0.01 0.00 0.51 0.00 0.00 43.02 40.02 2wri s PHE 70 CO 0.27 -0.72 -0.15 0.08 0.70 0.00 0.00 175.22 175.41 2wri s VAL 71 N 3.02 2.90 -0.29 -0.44 1.01 -0.16 -0.99 120.40 125.45 2wri s VAL 71 Ca 0.30 -0.73 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 2wri s VAL 71 Cb -0.13 -2.19 0.16 0.00 0.00 0.00 0.00 36.38 34.22 2wri s VAL 71 CO 0.17 0.54 1.04 -0.83 0.00 0.00 0.00 175.10 176.01 2wri s GLY 72 N 0.16 0.09 0.00 4.51 0.00 -1.06 -2.76 107.32 108.26 2wri s GLY 72 Ca -0.08 3.27 0.00 0.00 0.00 0.00 0.00 44.72 47.90 2wri s GLY 72 CO 0.05 2.76 0.00 -1.30 0.00 0.00 0.00 173.10 174.62 2wri n THR 73 N 3.85 0.00 -1.46 0.90 -2.24 -1.26 -4.16 114.28 109.91 2wri n THR 73 Ca -0.16 0.00 -0.60 0.00 -2.27 0.00 0.00 64.05 61.01 2wri n THR 73 Cb 0.56 -0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 68.22 2wri n THR 73 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2wri n LYS 74 N -2.12 0.30 -0.09 -0.78 2.85 -1.26 -4.44 118.16 112.62 2wri n LYS 74 Ca 0.00 0.10 -0.02 0.00 -1.05 0.00 0.00 58.31 57.34 2wri n LYS 74 Cb 0.38 -1.72 -0.02 0.00 -0.65 0.00 0.00 35.03 33.03 2wri n LYS 74 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2wri n LYS 75 N 6.45 -0.09 -0.40 -1.58 0.00 -1.26 -0.01 118.16 121.28 2wri n LYS 75 Ca 0.43 0.33 0.34 0.00 0.00 0.00 0.00 58.31 59.41 2wri n LYS 75 Cb 0.02 -0.48 0.57 0.00 0.00 0.00 0.00 35.03 35.14 2wri n LYS 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2wri n GLN 76 N -4.28 -0.03 -0.25 1.64 6.02 -1.26 -1.02 117.38 118.20 2wri n GLN 76 Ca 0.01 1.07 0.07 0.00 -0.01 0.00 0.00 57.00 58.14 2wri n GLN 76 Cb 0.06 -2.10 0.10 0.00 1.02 0.00 0.00 30.24 29.32 2wri n GLN 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wri n ALA 77 N -2.53 2.27 -1.00 -1.58 0.00 0.99 -4.77 120.51 113.88 2wri n ALA 77 Ca 0.34 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 51.57 2wri n ALA 77 Cb 1.33 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 20.36 2wri n ALA 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2wri n GLN 78 N -0.98 0.00 0.00 0.00 6.02 -0.19 -2.85 117.38 119.38 2wri n GLN 78 Ca 0.11 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 2wri n GLN 78 Cb 0.67 -0.96 0.00 0.00 1.02 0.00 0.00 30.24 30.97 2wri n GLN 78 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2wri n ASP 79 N -0.48 0.00 -0.24 1.08 5.75 -1.26 0.14 116.55 121.54 2wri n ASP 79 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 54.79 54.94 2wri n ASP 79 Cb 0.00 0.00 0.46 0.00 -1.03 0.00 0.00 41.12 40.55 2wri n ASP 79 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2wri h ILE 80 N 0.00 0.75 -0.06 2.12 5.03 -1.87 -2.33 117.51 121.14 2wri h ILE 80 Ca 0.00 -0.17 -0.04 0.00 -0.12 0.00 0.00 64.86 64.53 2wri h ILE 80 Cb 0.00 0.20 -0.00 0.00 -3.03 0.00 0.00 36.82 33.99 2wri h ILE 80 CO 0.00 0.09 -0.11 0.58 -0.68 0.00 0.00 178.15 178.04 2wri h VAL 81 N 0.51 1.41 -0.51 1.67 2.07 0.13 -2.85 116.25 118.68 2wri h VAL 81 Ca 0.44 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.63 2wri h VAL 81 Cb 0.95 2.17 -0.07 0.00 -1.52 0.00 0.00 31.29 32.82 2wri h VAL 81 CO -0.18 0.38 -0.39 -0.09 0.02 0.00 0.00 177.57 177.31 2wri h ARG 82 N -0.29 -0.11 0.00 1.57 2.43 -1.35 0.55 114.38 117.17 2wri h ARG 82 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2wri h ARG 82 Cb 0.67 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 2wri h ARG 82 CO 0.02 -0.07 0.00 -1.33 -1.51 0.00 0.00 179.97 177.08 2wri n MET 83 N -4.53 0.00 -0.67 0.20 2.81 -1.13 -1.78 117.12 112.02 2wri n MET 83 Ca -0.00 0.14 0.50 0.00 -1.81 0.00 0.00 57.70 56.53 2wri n MET 83 Cb 0.20 -0.79 0.78 0.00 -0.71 0.00 0.00 33.22 32.69 2wri n MET 83 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2wri n GLU 84 N -0.44 0.00 0.07 0.03 -0.58 -1.07 -0.45 120.64 118.20 2wri n GLU 84 Ca 0.00 1.02 -0.09 0.00 -0.42 0.00 0.00 57.16 57.67 2wri n GLU 84 Cb 0.00 -2.36 -0.06 0.00 -0.57 0.00 0.00 31.44 28.45 2wri n GLU 84 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wri h ALA 85 N 0.93 -0.27 -0.86 0.62 0.00 -0.70 -3.26 119.26 115.72 2wri h ALA 85 Ca 0.89 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.60 2wri h ALA 85 Cb 3.57 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 21.43 2wri h ALA 85 CO -0.01 -0.30 0.48 0.93 0.00 0.00 0.00 179.25 180.34 2wri h GLU 86 N -0.97 1.19 0.00 0.00 5.08 -0.11 0.74 114.58 120.52 2wri h GLU 86 Ca -0.03 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2wri h GLU 86 Cb 0.45 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2wri h GLU 86 CO 0.05 0.87 0.01 -2.13 -1.00 0.00 0.00 179.01 176.80 2wri n ARG 87 N -4.38 0.00 0.00 2.33 0.00 0.40 0.15 116.66 115.17 2wri n ARG 87 Ca 0.09 0.03 0.00 0.00 -0.00 0.00 0.00 57.85 57.97 2wri n ARG 87 Cb 0.09 -1.51 0.00 0.00 0.00 0.00 0.00 32.46 31.05 2wri n ARG 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wri n ALA 88 N -0.96 0.35 -2.79 5.13 0.00 -0.26 -5.02 120.51 116.95 2wri n ALA 88 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.18 2wri n ALA 88 Cb 0.01 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.48 2wri n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wri n GLY 89 N 0.01 -0.38 3.80 0.00 0.00 0.39 -5.02 105.19 104.00 2wri n GLY 89 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2wri n GLY 89 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wri s MET 90 N -5.41 2.89 0.49 1.61 -1.94 -0.92 -4.99 119.30 111.05 2wri s MET 90 Ca 0.20 -0.93 -0.22 0.00 -1.71 0.00 0.00 55.69 53.03 2wri s MET 90 Cb -0.09 -2.61 -0.06 0.00 2.01 0.00 0.00 34.83 34.07 2wri s MET 90 CO 0.25 0.46 1.24 -2.14 -0.01 0.00 0.00 175.02 174.83 2wri s PRO 91 N -3.31 3.52 0.35 2.03 0.02 -1.26 -4.42 135.00 131.93 2wri s PRO 91 Ca 0.31 1.96 0.05 0.00 0.02 0.00 0.00 61.00 63.34 2wri s PRO 91 Cb -0.09 -2.35 -0.03 0.00 0.02 0.00 0.00 34.50 32.04 2wri s PRO 91 CO 0.24 -0.80 0.19 1.52 -0.33 0.00 0.00 177.00 177.82 2wri s TYR 92 N -1.45 1.71 -0.26 6.54 -0.85 -1.26 -0.79 117.35 121.00 2wri s TYR 92 Ca 0.67 -1.45 -0.01 0.00 -0.52 0.00 0.00 57.07 55.76 2wri s TYR 92 Cb -0.33 -0.91 0.14 0.00 0.38 0.00 0.00 41.96 41.23 2wri s TYR 92 CO 0.40 -0.57 0.35 0.08 -1.52 0.00 0.00 175.55 174.29 2wri s VAL 93 N -3.41 -0.55 -0.15 -3.49 1.01 -0.16 -0.61 120.40 113.04 2wri s VAL 93 Ca 0.33 -0.22 -0.11 0.00 0.00 0.00 0.00 61.98 61.98 2wri s VAL 93 Cb 0.03 -0.88 -0.07 0.00 0.00 0.00 0.00 36.38 35.46 2wri s VAL 93 CO 0.20 -0.24 -0.02 0.78 0.00 0.00 0.00 175.10 175.81 2wri h ASN 94 N 8.21 0.00 0.00 3.32 4.21 -1.88 -2.80 115.58 126.63 2wri h ASN 94 Ca -0.15 -0.15 0.00 0.00 1.21 0.00 0.00 56.30 57.21 2wri h ASN 94 Cb 1.13 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.33 2wri h ASN 94 CO 0.28 0.86 0.00 0.00 -1.29 0.00 0.00 177.43 177.29 2wri n GLN 95 N -4.61 0.00 -3.83 0.81 1.13 -1.26 -4.15 117.38 105.46 2wri n GLN 95 Ca -0.11 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.59 2wri n GLN 95 Cb 0.31 0.00 -0.13 0.00 0.11 0.00 0.00 30.24 30.53 2wri n GLN 95 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2wri s ARG 96 N 0.00 2.26 -0.69 -1.09 3.00 -1.26 -4.65 118.95 116.52 2wri s ARG 96 Ca 0.00 -1.50 -0.29 0.00 0.00 0.00 0.00 55.73 53.94 2wri s ARG 96 Cb 0.00 -3.39 -0.14 0.00 0.00 0.00 0.00 34.95 31.42 2wri s ARG 96 CO 0.00 -0.83 2.51 1.87 0.00 0.00 0.00 175.30 178.85 2wri n TRP 97 N 4.63 1.09 -1.83 -0.53 -0.00 -1.26 -4.86 117.44 114.67 2wri n TRP 97 Ca -0.08 0.25 -0.42 0.00 -0.00 0.00 0.00 57.50 57.25 2wri n TRP 97 Cb 0.43 -2.52 -0.02 0.00 -0.00 0.00 0.00 31.31 29.19 2wri n TRP 97 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2wri s LEU 98 N 10.33 4.36 0.32 5.87 1.43 -1.26 -4.93 118.68 134.80 2wri s LEU 98 Ca 1.15 2.82 -0.29 0.00 -1.03 0.00 0.00 54.13 56.78 2wri s LEU 98 Cb -0.71 -3.61 -0.10 0.00 0.03 0.00 0.00 46.19 41.80 2wri s LEU 98 CO 0.38 -0.88 1.29 -0.83 0.23 0.00 0.00 176.35 176.54 2wri s GLY 99 N 0.81 2.98 0.00 -3.19 0.00 -1.26 -2.07 107.32 104.60 2wri s GLY 99 Ca 0.67 1.23 0.00 0.00 0.00 0.00 0.00 44.72 46.62 2wri s GLY 99 CO 0.39 1.89 0.00 0.61 0.00 0.00 0.00 173.10 175.99 2wri n GLY 100 N 0.89 0.73 0.01 0.20 0.00 -1.26 -4.89 105.19 100.87 2wri n GLY 100 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2wri n GLY 100 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2wri n MET 101 N -2.03 0.01 0.10 1.61 1.56 -0.88 -0.29 117.12 117.19 2wri n MET 101 Ca 0.00 0.49 0.00 0.00 -0.27 0.00 0.00 57.70 57.92 2wri n MET 101 Cb 0.00 -1.55 0.00 0.00 2.15 0.00 0.00 33.22 33.82 2wri n MET 101 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 2wri n LEU 102 N -1.54 0.38 -0.21 -0.89 4.32 -1.26 -4.11 117.00 113.70 2wri n LEU 102 Ca -0.00 0.31 0.13 0.00 -0.02 0.00 0.00 56.01 56.43 2wri n LEU 102 Cb 0.02 0.07 0.44 0.00 -1.62 0.00 0.00 43.42 42.33 2wri n LEU 102 CO 0.01 -0.76 1.21 0.71 -1.22 0.00 0.00 177.39 177.34 2wri h THR 103 N 0.00 0.82 -0.30 -5.08 1.35 -1.91 0.23 112.91 108.03 2wri h THR 103 Ca 0.00 -0.19 -0.18 0.00 -0.55 0.00 0.00 66.41 65.49 2wri h THR 103 Cb 0.00 0.22 -0.12 0.00 -1.73 0.00 0.00 68.15 66.52 2wri h THR 103 CO 0.00 0.10 -0.30 -3.20 -0.25 0.00 0.00 175.52 171.87 2wri n ASN 104 N -4.52 2.68 -0.20 5.36 5.15 0.60 -4.84 115.26 119.49 2wri n ASN 104 Ca 0.16 -3.83 -0.12 0.00 -0.60 0.00 0.00 54.58 50.18 2wri n ASN 104 Cb 0.49 -0.57 -0.09 0.00 -0.53 0.00 0.00 39.78 39.08 2wri n ASN 104 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2wri h PHE 105 N 1.19 -1.63 -1.74 1.20 3.57 0.12 -1.27 116.94 118.38 2wri h PHE 105 Ca 0.18 0.09 0.53 0.00 3.53 0.00 0.00 57.97 62.29 2wri h PHE 105 Cb 1.38 0.78 -0.10 0.00 2.79 0.00 0.00 35.95 40.81 2wri h PHE 105 CO 0.94 -0.42 1.22 -0.22 -2.23 0.00 0.00 178.31 177.59 2wri h LYS 106 N -0.26 0.01 0.07 1.11 3.64 -1.87 0.16 116.57 119.43 2wri h LYS 106 Ca 0.09 -0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.17 2wri h LYS 106 Cb 0.50 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2wri h LYS 106 CO -0.64 0.01 -1.61 1.15 -2.27 0.00 0.00 179.45 176.08 2wri h THR 107 N 0.01 1.03 0.00 1.00 2.02 -1.58 -3.23 112.91 112.16 2wri h THR 107 Ca 0.89 -2.75 0.00 0.00 0.77 0.00 0.00 66.41 65.32 2wri h THR 107 Cb 3.36 2.62 0.00 0.00 -1.74 0.00 0.00 68.15 72.40 2wri h THR 107 CO -0.15 0.75 0.00 -0.38 0.37 0.00 0.00 175.52 176.11 2wri n ILE 108 N -3.32 0.45 -0.04 3.11 2.08 0.40 -3.41 119.36 118.62 2wri n ILE 108 Ca -0.18 0.04 -0.13 0.00 0.56 0.00 0.00 62.75 63.05 2wri n ILE 108 Cb 1.04 -0.71 -0.08 0.00 -0.75 0.00 0.00 39.64 39.13 2wri n ILE 108 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2wri h SER 109 N 0.00 0.22 -0.96 4.38 0.02 -1.17 -3.02 113.55 113.02 2wri h SER 109 Ca 0.00 -0.50 0.25 0.00 -0.84 0.00 0.00 61.79 60.69 2wri h SER 109 Cb 0.46 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.87 2wri h SER 109 CO 0.00 0.68 0.65 1.56 -1.14 0.00 0.00 176.83 178.58 2wri h GLN 110 N -0.23 0.26 0.00 3.45 4.20 -1.66 1.52 115.11 122.65 2wri h GLN 110 Ca 0.01 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2wri h GLN 110 Cb 0.62 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2wri h GLN 110 CO 0.02 0.17 -0.00 0.00 -0.67 0.00 0.00 178.83 178.35 2wri h ARG 111 N 0.27 0.00 0.00 1.46 2.47 -1.68 -1.25 114.38 115.65 2wri h ARG 111 Ca 0.50 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 59.16 2wri h ARG 111 Cb 1.49 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.80 2wri h ARG 111 CO -0.15 0.00 -0.41 0.28 0.56 0.00 0.00 179.97 180.25 2wri h VAL 112 N 0.00 0.75 0.00 2.04 2.07 0.20 -2.51 116.25 118.80 2wri h VAL 112 Ca -0.00 -1.68 0.00 0.00 0.82 0.00 0.00 66.70 65.84 2wri h VAL 112 Cb 0.13 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2wri h VAL 112 CO 0.00 0.25 0.45 0.45 0.02 0.00 0.00 177.57 178.74 2wri h HIS 113 N -1.00 0.00 0.04 1.57 3.86 -0.66 0.91 115.15 119.87 2wri h HIS 113 Ca -0.09 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.77 2wri h HIS 113 Cb 0.71 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.14 2wri h HIS 113 CO 0.06 0.00 -2.03 -2.13 0.86 0.00 0.00 177.93 174.69 2wri n ARG 114 N -2.21 0.65 -0.31 2.45 3.00 -0.54 -3.89 116.66 115.81 2wri n ARG 114 Ca -0.01 0.32 0.19 0.00 -0.00 0.00 0.00 57.85 58.35 2wri n ARG 114 Cb 0.47 -1.63 0.44 0.00 0.00 0.00 0.00 32.46 31.74 2wri n ARG 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2wri h LEU 115 N -0.45 0.56 -1.36 6.15 5.85 0.12 0.99 115.31 127.16 2wri h LEU 115 Ca -0.50 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2wri h LEU 115 Cb 1.73 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.74 2wri h LEU 115 CO -0.14 0.16 0.00 -1.84 -0.34 0.00 0.00 178.44 176.28 2wri n GLU 116 N -4.66 1.92 -0.13 1.25 0.28 -0.33 -2.60 120.64 116.38 2wri n GLU 116 Ca 0.23 -1.22 -0.27 0.00 -0.16 0.00 0.00 57.16 55.74 2wri n GLU 116 Cb 0.73 -1.35 -0.10 0.00 1.43 0.00 0.00 31.44 32.16 2wri n GLU 116 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2wri n GLU 117 N 0.43 0.56 -0.23 3.44 1.02 0.33 -4.02 120.64 122.17 2wri n GLU 117 Ca 0.11 0.23 0.01 0.00 -0.02 0.00 0.00 57.16 57.49 2wri n GLU 117 Cb 0.34 -1.43 0.12 0.00 -0.02 0.00 0.00 31.44 30.45 2wri n GLU 117 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2wri h LEU 118 N -0.85 0.40 -1.79 -4.62 3.38 -1.18 0.46 115.31 111.10 2wri h LEU 118 Ca -0.65 0.06 0.10 0.00 0.09 0.00 0.00 57.88 57.48 2wri h LEU 118 Cb 1.61 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.33 2wri h LEU 118 CO -0.37 0.23 0.35 -0.08 0.09 0.00 0.00 178.44 178.66 2wri h GLU 119 N 0.55 0.23 -1.66 1.13 4.81 -1.70 -0.76 114.58 117.17 2wri h GLU 119 Ca 0.33 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2wri h GLU 119 Cb 0.35 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2wri h GLU 119 CO -0.27 0.15 0.00 0.00 -0.73 0.00 0.00 179.01 178.16 2wri n ALA 120 N -2.56 2.84 0.00 2.92 0.00 0.16 -2.38 120.51 121.48 2wri n ALA 120 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2wri n ALA 120 Cb 0.42 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2wri n ALA 120 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wri n LEU 121 N 1.17 0.00 -0.37 0.00 4.77 -0.29 -4.72 117.00 117.55 2wri n LEU 121 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 2wri n LEU 121 Cb 0.37 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.59 2wri n LEU 121 CO 0.00 0.00 1.29 0.15 -1.33 0.00 0.00 177.39 177.50 2wri h PHE 122 N 0.00 1.25 -2.83 -1.77 3.57 -1.49 -3.15 116.94 112.52 2wri h PHE 122 Ca 0.00 0.03 -0.61 0.00 3.53 0.00 0.00 57.97 60.92 2wri h PHE 122 Cb 0.00 -0.42 -0.41 0.00 2.79 0.00 0.00 35.95 37.91 2wri h PHE 122 CO 0.00 0.75 -0.70 0.00 -2.23 0.00 0.00 178.31 176.13 2wri n ALA 123 N -2.38 3.27 -3.53 2.41 0.00 -1.26 -5.00 120.51 114.02 2wri n ALA 123 Ca 0.13 -4.11 -0.10 0.00 0.00 0.00 0.00 53.44 49.36 2wri n ALA 123 Cb 0.05 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 18.54 2wri n ALA 123 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wri s SER 124 N -1.06 -0.43 0.32 0.00 0.15 -1.19 -4.95 113.70 106.54 2wri s SER 124 Ca 0.28 -0.25 0.02 0.00 0.70 0.00 0.00 55.95 56.69 2wri s SER 124 Cb -0.01 0.63 0.54 0.00 -1.71 0.00 0.00 66.02 65.47 2wri s SER 124 CO -0.17 -1.09 1.90 1.55 1.20 0.00 0.00 173.24 176.62 2wri h PRO 125 N 2.03 0.73 -1.08 5.44 0.13 -1.92 -3.09 132.00 134.25 2wri h PRO 125 Ca -0.29 -0.12 0.31 0.00 -0.87 0.00 0.00 66.00 65.04 2wri h PRO 125 Cb 1.28 -0.13 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 2wri h PRO 125 CO 0.33 0.62 0.77 0.93 -0.23 0.00 0.00 178.00 180.43 2wri h GLU 126 N 0.72 0.04 -0.73 0.86 5.08 -1.93 -2.77 114.58 115.85 2wri h GLU 126 Ca 0.17 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.60 2wri h GLU 126 Cb 0.19 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.34 2wri h GLU 126 CO -0.01 0.03 -0.42 -0.89 -1.00 0.00 0.00 179.01 176.71 2wri n ILE 127 N -4.25 -0.49 0.00 3.13 2.08 -1.17 -2.38 119.36 116.28 2wri n ILE 127 Ca 0.23 1.77 0.00 0.00 0.56 0.00 0.00 62.75 65.31 2wri n ILE 127 Cb 1.12 -2.19 0.00 0.00 -0.75 0.00 0.00 39.64 37.82 2wri n ILE 127 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2wri n GLU 128 N -4.92 0.00 -0.12 0.38 4.07 -1.04 -4.71 120.64 114.29 2wri n GLU 128 Ca 0.02 0.25 -0.08 0.00 -0.06 0.00 0.00 57.16 57.28 2wri n GLU 128 Cb 0.20 -0.82 0.08 0.00 -0.06 0.00 0.00 31.44 30.84 2wri n GLU 128 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 2wri n GLU 129 N -0.56 -1.85 -1.76 5.31 -0.00 -1.00 -4.83 120.64 115.95 2wri n GLU 129 Ca 0.00 -0.39 -0.01 0.00 -0.00 0.00 0.00 57.16 56.76 2wri n GLU 129 Cb 0.00 -0.58 -0.01 0.00 -0.00 0.00 0.00 31.44 30.85 2wri n GLU 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2wri n ARG 130 N -2.32 -1.81 -1.19 3.44 1.74 -1.26 -4.94 116.66 110.32 2wri n ARG 130 Ca 0.04 1.66 -0.38 0.00 -0.77 0.00 0.00 57.85 58.39 2wri n ARG 130 Cb 0.16 -2.37 0.01 0.00 -1.02 0.00 0.00 32.46 29.25 2wri n ARG 130 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2wri n PRO 131 N 0.66 0.00 -0.32 5.56 -0.04 -1.26 -4.33 135.00 135.27 2wri n PRO 131 Ca -0.10 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.49 2wri n PRO 131 Cb 0.16 -0.98 0.31 0.00 -0.04 0.00 0.00 33.50 32.95 2wri n PRO 131 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2wri h LYS 132 N -0.15 0.49 -0.11 0.54 3.64 -1.94 -0.07 116.57 118.97 2wri h LYS 132 Ca -0.41 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 58.98 2wri h LYS 132 Cb 1.40 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 33.05 2wri h LYS 132 CO 0.38 0.32 -0.48 0.87 -2.27 0.00 0.00 179.45 178.28 2wri h LYS 133 N 0.51 -0.54 -0.38 1.90 1.79 -1.99 0.44 116.57 118.30 2wri h LYS 133 Ca 0.56 0.04 0.08 0.00 -2.18 0.00 0.00 60.65 59.15 2wri h LYS 133 Cb 1.01 0.12 -0.09 0.00 -1.58 0.00 0.00 32.23 31.70 2wri h LYS 133 CO -0.48 -0.36 -0.23 0.93 -1.08 0.00 0.00 179.45 178.24 2wri h GLU 134 N -0.56 -0.16 -0.19 3.15 4.39 -1.36 0.27 114.58 120.11 2wri h GLU 134 Ca 0.05 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.82 2wri h GLU 134 Cb 0.67 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.30 2wri h GLU 134 CO -0.41 -0.11 -0.18 1.96 -1.16 0.00 0.00 179.01 179.12 2wri h GLN 135 N -0.17 -0.18 -0.64 2.33 4.20 0.15 0.13 115.11 120.93 2wri h GLN 135 Ca 0.18 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.82 2wri h GLN 135 Cb 0.46 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 2wri h GLN 135 CO -0.48 -0.12 0.07 0.28 -0.67 0.00 0.00 178.83 177.91 2wri h VAL 136 N -0.19 1.26 0.15 -0.54 2.07 0.29 -2.60 116.25 116.69 2wri h VAL 136 Ca 0.12 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 2wri h VAL 136 Cb 0.37 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2wri h VAL 136 CO -0.31 0.39 -0.16 -0.09 0.02 0.00 0.00 177.57 177.43 2wri h ARG 137 N 1.00 -0.30 -0.80 1.57 1.12 0.40 -2.87 114.38 114.50 2wri h ARG 137 Ca 0.19 0.02 0.16 0.00 -1.11 0.00 0.00 59.98 59.24 2wri h ARG 137 Cb 0.47 0.07 -0.10 0.00 -0.01 0.00 0.00 29.97 30.40 2wri h ARG 137 CO 0.02 -0.20 0.33 -0.07 -3.11 0.00 0.00 179.97 176.94 2wri h LEU 138 N -0.31 0.32 -0.15 3.80 3.38 -0.81 -2.48 115.31 119.06 2wri h LEU 138 Ca -0.02 0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2wri h LEU 138 Cb 0.27 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2wri h LEU 138 CO -0.02 0.10 -0.33 0.11 0.09 0.00 0.00 178.44 178.38 2wri h LYS 139 N 0.46 -0.29 -0.89 1.13 1.79 -1.35 0.30 116.57 117.72 2wri h LYS 139 Ca 0.45 0.02 0.22 0.00 -2.18 0.00 0.00 60.65 59.16 2wri h LYS 139 Cb 0.71 0.07 -0.12 0.00 -1.58 0.00 0.00 32.23 31.30 2wri h LYS 139 CO -0.42 -0.20 0.39 0.45 -1.08 0.00 0.00 179.45 178.59 2wri h HIS 140 N -0.31 0.65 0.16 -1.35 3.86 -1.24 1.29 115.15 118.22 2wri h HIS 140 Ca 0.03 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 2wri h HIS 140 Cb 0.39 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2wri h HIS 140 CO -0.59 -0.04 -0.08 1.49 0.86 0.00 0.00 177.93 179.57 2wri h GLU 141 N 0.40 -0.21 -0.72 2.45 4.81 -0.61 -1.43 114.58 119.28 2wri h GLU 141 Ca 0.56 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.75 2wri h GLU 141 Cb 1.05 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 2wri h GLU 141 CO -0.53 -0.12 0.25 1.25 -0.73 0.00 0.00 179.01 179.13 2wri h LEU 142 N -0.24 1.02 -0.24 1.64 6.46 0.13 -0.43 115.31 123.67 2wri h LEU 142 Ca -0.02 -0.18 0.02 0.00 -0.12 0.00 0.00 57.88 57.58 2wri h LEU 142 Cb 0.18 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.81 2wri h LEU 142 CO 0.04 0.94 -0.17 -0.33 -0.62 0.00 0.00 178.44 178.30 2wri h GLU 143 N 1.06 -0.03 0.09 1.25 4.39 0.23 0.58 114.58 122.15 2wri h GLU 143 Ca 0.24 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.93 2wri h GLU 143 Cb 0.27 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2wri h GLU 143 CO -0.01 -0.02 -0.04 0.07 -1.16 0.00 0.00 179.01 177.84 2wri h ARG 144 N -0.03 -0.11 -1.00 2.33 0.11 -1.15 -0.17 114.38 114.35 2wri h ARG 144 Ca 0.04 0.01 0.33 0.00 0.10 0.00 0.00 59.98 60.45 2wri h ARG 144 Cb 0.13 0.03 -0.15 0.00 1.11 0.00 0.00 29.97 31.09 2wri h ARG 144 CO -0.24 0.04 0.56 -0.07 0.10 0.00 0.00 179.97 180.37 2wri h LEU 145 N -0.25 0.50 0.21 0.08 -0.00 -0.51 0.31 115.31 115.66 2wri h LEU 145 Ca -0.01 0.19 -0.01 0.00 -0.00 0.00 0.00 57.88 58.05 2wri h LEU 145 Cb 0.21 0.14 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 2wri h LEU 145 CO 0.02 -0.15 -0.10 -0.61 -0.00 0.00 0.00 178.44 177.60 2wri h GLN 146 N 0.31 -0.27 -0.91 1.13 4.15 0.79 -2.29 115.11 118.01 2wri h GLN 146 Ca 0.74 0.02 0.14 0.00 0.77 0.00 0.00 58.65 60.31 2wri h GLN 146 Cb 1.69 0.06 -0.07 0.00 0.21 0.00 0.00 27.48 29.37 2wri h GLN 146 CO -0.61 0.08 0.58 -0.22 -1.93 0.00 0.00 178.83 176.73 2wri h LYS 147 N -0.68 0.73 -0.02 1.69 3.64 0.14 -1.75 116.57 120.31 2wri h LYS 147 Ca -0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2wri h LYS 147 Cb 0.48 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2wri h LYS 147 CO 0.05 0.48 -0.23 0.66 -2.27 0.00 0.00 179.45 178.14 2wri n TYR 148 N -4.57 0.00 -0.44 1.91 4.01 -0.01 -4.50 117.16 113.55 2wri n TYR 148 Ca 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2wri n TYR 148 Cb 0.44 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 2wri n TYR 148 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2wri n LEU 149 N 0.59 1.06 -0.10 7.72 4.77 -0.86 -4.83 117.00 125.35 2wri n LEU 149 Ca 0.12 -1.06 -0.03 0.00 -0.03 0.00 0.00 56.01 55.00 2wri n LEU 149 Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2wri n LEU 149 CO 0.22 0.27 0.50 0.28 -1.33 0.00 0.00 177.39 177.32 2wri h SER 150 N 0.00 -0.58 0.00 -1.43 0.02 -1.55 -3.34 113.55 106.67 2wri h SER 150 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2wri h SER 150 Cb 0.67 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2wri h SER 150 CO 0.00 -0.08 0.00 0.61 -1.14 0.00 0.00 176.83 176.22 2wri n GLY 151 N -1.08 -1.98 2.99 -3.77 0.00 -1.26 -4.38 105.19 95.70 2wri n GLY 151 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2wri n GLY 151 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2wri n PHE 152 N 0.00 0.39 0.00 1.61 -0.00 0.22 -2.50 117.46 117.17 2wri n PHE 152 Ca 0.00 0.26 0.00 0.00 -0.00 0.00 0.00 57.45 57.71 2wri n PHE 152 Cb 0.00 -1.73 0.00 0.00 -0.00 0.00 0.00 39.48 37.75 2wri n PHE 152 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2wri n ARG 153 N 6.77 0.00 0.00 -4.13 0.63 -1.26 -4.74 116.66 113.93 2wri n ARG 153 Ca 0.57 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 57.51 2wri n ARG 153 Cb 0.04 0.00 0.11 0.00 0.45 0.00 0.00 32.46 33.06 2wri n ARG 153 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2wri n LEU 154 N -2.29 0.00 -4.29 6.15 4.77 -1.04 -4.41 117.00 115.89 2wri n LEU 154 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 2wri n LEU 154 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2wri n LEU 154 CO 0.00 0.00 -0.24 -0.22 -1.33 0.00 0.00 177.39 175.60 2wri s LEU 155 N -1.21 4.37 -0.11 2.23 1.98 -1.26 -4.82 118.68 119.86 2wri s LEU 155 Ca 0.06 -1.11 0.01 0.00 -2.89 0.00 0.00 54.13 50.19 2wri s LEU 155 Cb 0.03 -1.89 0.02 0.00 0.66 0.00 0.00 46.19 45.00 2wri s LEU 155 CO 0.04 -0.33 -0.12 -0.75 -1.89 0.00 0.00 176.35 173.30 2wri s LYS 156 N 1.43 1.89 0.00 1.98 2.20 -1.26 -4.98 119.74 120.99 2wri s LYS 156 Ca -0.01 -0.42 0.00 0.00 -0.36 0.00 0.00 55.97 55.18 2wri s LYS 156 Cb -0.19 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.40 2wri s LYS 156 CO 0.03 -0.15 0.00 -2.13 -0.36 0.00 0.00 175.35 172.74 2wri n ARG 157 N 4.50 0.00 -0.88 4.03 0.63 -1.26 -4.97 116.66 118.71 2wri n ARG 157 Ca -0.17 0.43 -0.30 0.00 -0.92 0.00 0.00 57.85 56.89 2wri n ARG 157 Cb 0.51 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.40 2wri n ARG 157 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2wri n LEU 158 N -0.02 -1.08 -4.41 6.15 4.77 -1.26 -4.91 117.00 116.25 2wri n LEU 158 Ca 0.00 0.67 -0.31 0.00 -0.03 0.00 0.00 56.01 56.34 2wri n LEU 158 Cb 0.00 -0.59 0.20 0.00 -2.33 0.00 0.00 43.42 40.70 2wri n LEU 158 CO 0.00 -2.12 0.06 -2.65 -1.33 0.00 0.00 177.39 171.36 2wri n PRO 159 N 0.70 -1.69 0.00 3.23 -0.02 -1.26 -4.92 135.00 131.04 2wri n PRO 159 Ca 0.10 -0.46 0.09 0.00 -2.02 0.00 0.00 63.50 61.21 2wri n PRO 159 Cb 0.19 -1.98 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 2wri n PRO 159 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2wri n ASP 160 N -3.24 2.03 0.00 2.55 8.00 -1.04 -4.97 116.55 119.88 2wri n ASP 160 Ca 0.03 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 54.02 2wri n ASP 160 Cb 0.57 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.97 2wri n ASP 160 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wri n ALA 161 N 0.32 0.00 -2.45 2.24 0.00 -1.25 -4.43 120.51 114.94 2wri n ALA 161 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.26 2wri n ALA 161 Cb 0.41 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.73 2wri n ALA 161 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2wri s ILE 162 N -1.80 1.99 -0.19 0.00 -4.36 -0.89 -1.91 121.20 114.04 2wri s ILE 162 Ca 0.00 -1.59 0.01 0.00 -0.26 0.00 0.00 60.65 58.81 2wri s ILE 162 Cb 0.00 -1.77 0.03 0.00 1.25 0.00 0.00 42.46 41.97 2wri s ILE 162 CO 0.00 0.07 -0.19 0.12 0.24 0.00 0.00 174.94 175.18 2wri s PHE 163 N -1.05 2.86 0.24 1.37 5.99 -0.27 -1.48 117.98 125.63 2wri s PHE 163 Ca 0.10 -1.76 0.09 0.00 0.00 0.00 0.00 56.93 55.37 2wri s PHE 163 Cb -0.10 -1.92 -0.04 0.00 0.00 0.00 0.00 43.02 40.96 2wri s PHE 163 CO 0.05 -0.82 -0.04 0.08 -0.00 0.00 0.00 175.22 174.49 2wri s VAL 164 N 1.26 3.36 0.00 3.12 1.01 0.91 -0.98 120.40 129.08 2wri s VAL 164 Ca 0.03 -1.83 0.00 0.00 0.00 0.00 0.00 61.98 60.18 2wri s VAL 164 Cb -0.14 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2wri s VAL 164 CO -0.12 -0.29 0.00 1.33 0.00 0.00 0.00 175.10 176.03 2wri n VAL 165 N -0.58 0.00 -2.61 2.92 0.24 -1.11 -1.35 118.33 115.85 2wri n VAL 165 Ca -0.08 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.81 2wri n VAL 165 Cb 0.58 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.92 2wri n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2wri s ASP 166 N -1.00 6.23 0.16 -1.34 3.68 -1.26 -3.08 116.67 120.06 2wri s ASP 166 Ca 0.00 -0.39 -0.28 0.00 2.13 0.00 0.00 52.55 54.01 2wri s ASP 166 Cb 0.00 -2.53 -0.02 0.00 -1.45 0.00 0.00 42.92 38.92 2wri s ASP 166 CO 0.00 -1.68 1.56 1.55 0.13 0.00 0.00 175.17 176.73 2wri h PRO 167 N 9.83 -0.23 -0.16 4.34 0.13 -1.87 -1.45 132.00 142.59 2wri h PRO 167 Ca -0.27 0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.91 2wri h PRO 167 Cb 1.06 0.05 -0.07 0.00 0.13 0.00 0.00 31.00 32.17 2wri h PRO 167 CO 1.24 -0.15 -0.54 1.79 -0.23 0.00 0.00 178.00 180.11 2wri h THR 168 N -0.24 0.01 -1.58 1.56 1.35 -1.96 0.88 112.91 112.92 2wri h THR 168 Ca 0.15 0.00 0.47 0.00 -0.55 0.00 0.00 66.41 66.48 2wri h THR 168 Cb 0.55 0.01 -0.08 0.00 -1.73 0.00 0.00 68.15 66.90 2wri h THR 168 CO -0.71 0.00 1.12 0.50 -0.25 0.00 0.00 175.52 176.18 2wri h LYS 169 N -0.56 0.03 -0.12 4.72 3.11 -1.70 0.28 116.57 122.32 2wri h LYS 169 Ca 0.04 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 2wri h LYS 169 Cb 0.67 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.90 2wri h LYS 169 CO -0.45 0.02 0.00 0.39 -2.81 0.00 0.00 179.45 176.60 2wri n GLU 170 N -4.18 2.45 -0.39 1.90 4.71 0.78 -4.81 120.64 121.10 2wri n GLU 170 Ca 0.37 -2.21 0.35 0.00 -0.01 0.00 0.00 57.16 55.66 2wri n GLU 170 Cb 1.63 -1.38 0.60 0.00 -1.01 0.00 0.00 31.44 31.29 2wri n GLU 170 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wri n ALA 171 N -0.58 1.17 -0.32 0.62 0.00 0.27 0.19 120.51 121.86 2wri n ALA 171 Ca 0.11 0.86 0.07 0.00 0.00 0.00 0.00 53.44 54.49 2wri n ALA 171 Cb 0.53 -0.98 0.28 0.00 0.00 0.00 0.00 19.45 19.28 2wri n ALA 171 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2wri h ILE 172 N 0.00 0.95 -0.00 0.00 5.03 -1.85 0.69 117.51 122.33 2wri h ILE 172 Ca 0.81 -0.32 -0.00 0.00 -0.12 0.00 0.00 64.86 65.23 2wri h ILE 172 Cb 2.46 -0.06 0.00 0.00 -3.03 0.00 0.00 36.82 36.19 2wri h ILE 172 CO -0.53 0.17 -0.00 0.00 -0.68 0.00 0.00 178.15 177.10 2wri h ALA 173 N 1.54 0.00 -0.65 1.87 0.00 0.17 -1.87 119.26 120.33 2wri h ALA 173 Ca 0.44 -0.36 0.13 0.00 0.00 0.00 0.00 54.91 55.13 2wri h ALA 173 Cb 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2wri h ALA 173 CO -0.21 -0.14 0.44 0.28 0.00 0.00 0.00 179.25 179.63 2wri h VAL 174 N -0.71 0.81 0.05 0.00 2.07 -0.88 -0.69 116.25 116.90 2wri h VAL 174 Ca -0.00 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 2wri h VAL 174 Cb 0.72 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2wri h VAL 174 CO 0.00 0.06 -0.03 -0.09 0.02 0.00 0.00 177.57 177.53 2wri h ARG 175 N 0.31 -0.07 0.05 1.57 2.43 0.40 -2.22 114.38 116.84 2wri h ARG 175 Ca 0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2wri h ARG 175 Cb 0.80 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 2wri h ARG 175 CO -0.08 0.51 -0.16 0.93 -1.51 0.00 0.00 179.97 179.66 2wri h GLU 176 N -0.72 -0.23 -0.85 0.20 5.08 -0.51 -0.71 114.58 116.84 2wri h GLU 176 Ca -0.01 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.52 2wri h GLU 176 Cb 0.61 0.05 -0.15 0.00 0.50 0.00 0.00 28.75 29.76 2wri h GLU 176 CO 0.01 -0.15 -0.27 0.00 -1.00 0.00 0.00 179.01 177.60 2wri n ALA 177 N -2.58 0.06 -0.27 3.43 0.00 -0.34 0.55 120.51 121.37 2wri n ALA 177 Ca -0.03 0.90 -0.02 0.00 0.00 0.00 0.00 53.44 54.29 2wri n ALA 177 Cb 0.13 -0.48 0.10 0.00 0.00 0.00 0.00 19.45 19.20 2wri n ALA 177 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wri h ARG 178 N 0.00 0.87 0.00 0.00 9.65 -0.73 -0.64 114.38 123.53 2wri h ARG 178 Ca 0.36 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 2wri h ARG 178 Cb 0.57 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 2wri h ARG 178 CO -0.86 0.57 0.00 -0.22 2.80 0.00 0.00 179.97 182.26 2wri h LYS 179 N 0.89 0.00 -0.24 0.20 3.64 0.16 -1.08 116.57 120.14 2wri h LYS 179 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2wri h LYS 179 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2wri h LYS 179 CO -0.13 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.33 2wri n LEU 180 N -2.45 3.46 -1.54 5.20 4.77 -0.34 -4.97 117.00 121.13 2wri n LEU 180 Ca -0.01 -2.79 -0.19 0.00 -0.03 0.00 0.00 56.01 52.99 2wri n LEU 180 Cb 0.07 -0.45 -0.08 0.00 -2.33 0.00 0.00 43.42 40.63 2wri n LEU 180 CO 0.13 0.68 -0.18 0.49 -1.33 0.00 0.00 177.39 177.19 2wri n PHE 181 N -0.42 -0.09 -2.69 -1.77 3.72 -0.41 -4.93 117.46 110.87 2wri n PHE 181 Ca 0.18 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.18 2wri n PHE 181 Cb 0.75 -3.25 -0.05 0.00 -0.94 0.00 0.00 39.48 35.99 2wri n PHE 181 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2wri s ILE 182 N -2.60 4.14 0.26 4.37 1.01 -0.66 -4.99 121.20 122.74 2wri s ILE 182 Ca 0.00 1.97 -0.29 0.00 0.00 0.00 0.00 60.65 62.33 2wri s ILE 182 Cb 0.00 -4.26 -0.09 0.00 0.01 0.00 0.00 42.46 38.12 2wri s ILE 182 CO 0.00 0.39 1.24 -2.84 0.00 0.00 0.00 174.94 173.74 2wri s PRO 183 N -0.68 4.45 -0.12 2.79 0.02 -1.26 -4.38 135.00 135.82 2wri s PRO 183 Ca 0.44 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.51 2wri s PRO 183 Cb -0.26 -3.16 0.01 0.00 0.02 0.00 0.00 34.50 31.12 2wri s PRO 183 CO 0.32 -0.09 -0.18 0.08 -0.33 0.00 0.00 177.00 176.80 2wri s VAL 184 N -0.66 1.72 0.04 3.83 1.01 -1.26 -2.09 120.40 122.99 2wri s VAL 184 Ca 0.50 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.79 2wri s VAL 184 Cb -0.36 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2wri s VAL 184 CO 0.44 0.49 -0.22 0.27 0.00 0.00 0.00 175.10 176.07 2wri s ILE 185 N 0.91 2.47 0.10 2.22 -4.36 -0.55 -1.30 121.20 120.71 2wri s ILE 185 Ca -0.07 -1.26 -0.23 0.00 -0.26 0.00 0.00 60.65 58.84 2wri s ILE 185 Cb -0.15 -2.00 0.06 0.00 1.25 0.00 0.00 42.46 41.62 2wri s ILE 185 CO -0.02 0.37 0.56 0.00 0.24 0.00 0.00 174.94 176.09 2wri s ALA 186 N -0.85 -1.44 -0.87 2.27 0.00 -1.15 -0.06 121.76 119.66 2wri s ALA 186 Ca 0.13 0.52 -0.20 0.00 0.00 0.00 0.00 51.96 52.41 2wri s ALA 186 Cb -0.10 0.64 0.12 0.00 0.00 0.00 0.00 23.12 23.77 2wri s ALA 186 CO 0.03 -0.64 1.08 -1.17 0.00 0.00 0.00 175.76 175.07 2wri s LEU 187 N -2.40 4.91 0.41 0.00 1.98 -0.45 -1.91 118.68 121.22 2wri s LEU 187 Ca -0.01 -1.81 0.06 0.00 -2.89 0.00 0.00 54.13 49.47 2wri s LEU 187 Cb -0.00 -2.40 0.01 0.00 0.66 0.00 0.00 46.19 44.45 2wri s LEU 187 CO -0.08 -1.15 0.58 0.00 -1.89 0.00 0.00 176.35 173.81 2wri s ALA 188 N 2.99 4.26 0.35 5.97 0.00 -1.12 -4.20 121.76 130.00 2wri s ALA 188 Ca 0.30 -1.48 -0.06 0.00 0.00 0.00 0.00 51.96 50.71 2wri s ALA 188 Cb -0.08 -1.77 0.03 0.00 0.00 0.00 0.00 23.12 21.30 2wri s ALA 188 CO -0.05 -0.27 0.57 -0.40 0.00 0.00 0.00 175.76 175.60 2wri n ASP 189 N -1.87 -1.62 0.00 0.00 5.75 -1.26 0.14 116.55 117.68 2wri n ASP 189 Ca 0.04 -2.68 0.00 0.00 -0.01 0.00 0.00 54.79 52.15 2wri n ASP 189 Cb 0.59 2.86 0.00 0.00 -1.03 0.00 0.00 41.12 43.54 2wri n ASP 189 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2wri n THR 190 N -0.53 0.06 -0.02 2.12 -2.24 -1.26 -2.40 114.28 110.01 2wri n THR 190 Ca -0.03 0.07 -0.01 0.00 -2.27 0.00 0.00 64.05 61.82 2wri n THR 190 Cb 0.56 -1.07 -0.00 0.00 -2.10 0.00 0.00 70.33 67.71 2wri n THR 190 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2wri h ASP 191 N 0.00 0.00 -3.19 3.42 1.82 -1.91 -2.63 116.42 113.93 2wri h ASP 191 Ca 0.00 0.00 -0.47 0.00 -0.39 0.00 0.00 57.03 56.17 2wri h ASP 191 Cb 0.11 0.00 0.04 0.00 0.68 0.00 0.00 39.33 40.16 2wri h ASP 191 CO 0.00 0.25 0.04 -0.94 -1.61 0.00 0.00 179.24 176.99 2wri s SER 192 N -4.24 5.70 -0.16 2.28 1.04 -1.01 -4.12 113.70 113.19 2wri s SER 192 Ca -0.02 0.49 -0.22 0.00 0.48 0.00 0.00 55.95 56.68 2wri s SER 192 Cb 0.00 -1.60 -0.02 0.00 0.10 0.00 0.00 66.02 64.50 2wri s SER 192 CO 0.02 -0.90 0.69 1.51 0.98 0.00 0.00 173.24 175.55 2wri s ASP 193 N -4.27 6.81 0.02 7.02 3.84 -1.26 -4.70 116.67 124.13 2wri s ASP 193 Ca 0.51 0.98 -0.06 0.00 -0.00 0.00 0.00 52.55 53.98 2wri s ASP 193 Cb -0.10 -2.38 -0.03 0.00 -1.38 0.00 0.00 42.92 39.03 2wri s ASP 193 CO 0.42 -0.27 1.10 1.55 -0.00 0.00 0.00 175.17 177.97 2wri h PRO 194 N 7.28 -0.13 0.00 2.11 0.13 -1.95 -3.31 132.00 136.14 2wri h PRO 194 Ca -0.33 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2wri h PRO 194 Cb 1.15 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wri h PRO 194 CO 0.79 -0.09 0.00 -0.25 -0.23 0.00 0.00 178.00 178.22 2wri n ASP 195 N -3.03 0.00 -1.98 1.44 9.92 -1.26 0.50 116.55 122.14 2wri n ASP 195 Ca -0.01 0.00 -0.20 0.00 -0.53 0.00 0.00 54.79 54.04 2wri n ASP 195 Cb 0.08 0.00 0.05 0.00 -0.64 0.00 0.00 41.12 40.61 2wri n ASP 195 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2wri n LEU 196 N 0.00 6.65 -3.89 0.64 -0.00 -1.25 -4.76 117.00 114.39 2wri n LEU 196 Ca 0.00 -3.47 -0.30 0.00 -0.00 0.00 0.00 56.01 52.24 2wri n LEU 196 Cb 0.00 -1.02 -0.16 0.00 -0.00 0.00 0.00 43.42 42.25 2wri n LEU 196 CO 0.00 1.25 -0.40 -0.69 -0.00 0.00 0.00 177.39 177.55 2wri s VAL 197 N -2.81 1.38 0.52 1.47 1.01 0.18 -4.97 120.40 117.18 2wri s VAL 197 Ca 0.38 -1.24 0.16 0.00 0.00 0.00 0.00 61.98 61.29 2wri s VAL 197 Cb 0.30 -1.75 0.28 0.00 0.00 0.00 0.00 36.38 35.21 2wri s VAL 197 CO -0.00 -0.22 2.14 0.44 0.00 0.00 0.00 175.10 177.46 2wri h ASP 198 N 7.98 0.01 -1.84 3.32 3.45 -1.49 -3.39 116.42 124.47 2wri h ASP 198 Ca -0.16 -0.00 -0.18 0.00 0.43 0.00 0.00 57.03 57.11 2wri h ASP 198 Cb 1.07 -0.00 -0.30 0.00 -0.56 0.00 0.00 39.33 39.54 2wri h ASP 198 CO 0.42 0.01 -0.52 -0.31 -1.57 0.00 0.00 179.24 177.27 2wri s TYR 199 N -5.08 -0.87 0.31 4.55 1.51 -1.01 -4.96 117.35 111.80 2wri s TYR 199 Ca -0.05 0.51 -0.05 0.00 -1.01 0.00 0.00 57.07 56.47 2wri s TYR 199 Cb 0.17 -0.10 -0.05 0.00 -0.11 0.00 0.00 41.96 41.87 2wri s TYR 199 CO 0.68 -0.86 0.59 0.42 -1.11 0.00 0.00 175.55 175.27 2wri s ILE 200 N 2.53 5.00 -0.48 2.71 1.01 -1.26 -2.93 121.20 127.78 2wri s ILE 200 Ca 0.11 0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.93 2wri s ILE 200 Cb -0.14 -3.74 0.25 0.00 0.01 0.00 0.00 42.46 38.84 2wri s ILE 200 CO -0.24 -0.37 0.60 -0.38 0.00 0.00 0.00 174.94 174.54 2wri n ILE 201 N -1.07 0.35 -1.68 2.92 2.08 -0.80 -4.35 119.36 116.81 2wri n ILE 201 Ca -0.01 -4.42 -0.47 0.00 0.56 0.00 0.00 62.75 58.41 2wri n ILE 201 Cb 0.54 -2.01 -0.04 0.00 -0.75 0.00 0.00 39.64 37.38 2wri n ILE 201 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2wri n PRO 202 N 1.23 2.31 0.00 0.38 -0.04 -1.26 -2.80 135.00 134.83 2wri n PRO 202 Ca 0.24 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.55 2wri n PRO 202 Cb 0.49 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.25 2wri n PRO 202 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wri n GLY 203 N 4.27 3.10 0.86 0.55 0.00 0.37 -4.78 105.19 109.57 2wri n GLY 203 Ca 0.21 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2wri n GLY 203 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wri n ASN 204 N 0.00 0.27 -1.12 1.61 4.05 -1.16 -4.31 115.26 114.60 2wri n ASN 204 Ca 0.00 0.27 0.10 0.00 0.45 0.00 0.00 54.58 55.40 2wri n ASN 204 Cb 0.00 -0.20 0.27 0.00 1.23 0.00 0.00 39.78 41.07 2wri n ASN 204 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2wri n ASP 205 N 0.90 3.24 0.00 1.20 5.75 -1.26 -4.39 116.55 121.99 2wri n ASP 205 Ca 0.07 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 2wri n ASP 205 Cb -0.01 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 2wri n ASP 205 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2wri n ASP 206 N 1.27 3.27 -4.55 -1.12 9.92 -1.26 -4.63 116.55 119.46 2wri n ASP 206 Ca 0.20 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 54.09 2wri n ASP 206 Cb 0.51 0.33 -0.04 0.00 -0.64 0.00 0.00 41.12 41.28 2wri n ASP 206 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2wri n ALA 207 N -1.48 0.88 -0.38 2.24 0.00 -1.26 -4.73 120.51 115.77 2wri n ALA 207 Ca 0.00 -0.83 0.29 0.00 0.00 0.00 0.00 53.44 52.90 2wri n ALA 207 Cb 0.33 -3.13 0.56 0.00 0.00 0.00 0.00 19.45 17.21 2wri n ALA 207 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2wri h ILE 208 N 7.65 0.30 0.22 0.00 2.04 -1.95 0.88 117.51 126.64 2wri h ILE 208 Ca -0.25 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 2wri h ILE 208 Cb 1.27 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2wri h ILE 208 CO 1.15 0.04 -0.34 0.03 0.00 0.00 0.00 178.15 179.03 2wri h ARG 209 N 0.24 -0.56 -0.55 2.37 2.47 -1.88 0.16 114.38 116.63 2wri h ARG 209 Ca 0.72 0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 59.47 2wri h ARG 209 Cb 2.01 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 30.43 2wri h ARG 209 CO -0.42 -0.38 0.27 1.03 0.56 0.00 0.00 179.97 181.04 2wri h SER 210 N -0.58 0.71 -0.48 7.04 0.87 0.31 -2.02 113.55 119.40 2wri h SER 210 Ca -0.02 -0.12 0.02 0.00 -1.23 0.00 0.00 61.79 60.44 2wri h SER 210 Cb 0.54 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 2wri h SER 210 CO -0.11 0.63 0.28 0.40 -0.53 0.00 0.00 176.83 177.50 2wri h ILE 211 N 0.74 1.04 0.00 2.23 2.04 -0.16 -1.37 117.51 122.03 2wri h ILE 211 Ca 0.19 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2wri h ILE 211 Cb 0.10 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 2wri h ILE 211 CO -0.03 0.10 0.00 1.67 0.00 0.00 0.00 178.15 179.90 2wri n GLN 212 N -4.83 0.00 -0.34 2.37 0.00 0.56 -0.61 117.38 114.53 2wri n GLN 212 Ca 0.03 0.59 0.10 0.00 -0.00 0.00 0.00 57.00 57.72 2wri n GLN 212 Cb 0.08 -1.32 0.20 0.00 0.00 0.00 0.00 30.24 29.21 2wri n GLN 212 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 2wri n LEU 213 N -1.89 -0.24 0.12 1.69 0.00 -0.81 0.90 117.00 116.78 2wri n LEU 213 Ca 0.00 1.65 -0.13 0.00 0.00 0.00 0.00 56.01 57.53 2wri n LEU 213 Cb 0.00 -0.55 -0.08 0.00 0.00 0.00 0.00 43.42 42.79 2wri n LEU 213 CO 0.00 -1.62 0.56 0.40 0.00 0.00 0.00 177.39 176.73 2wri h ILE 214 N 0.00 0.79 -0.48 1.96 1.08 -0.69 -1.56 117.51 118.61 2wri h ILE 214 Ca 0.52 -0.67 -0.04 0.00 -0.39 0.00 0.00 64.86 64.28 2wri h ILE 214 Cb 0.94 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 35.82 2wri h ILE 214 CO -0.95 0.14 0.14 -0.07 -0.69 0.00 0.00 178.15 176.71 2wri h LEU 215 N -0.70 0.71 0.00 1.44 -0.00 -0.13 -0.09 115.31 116.55 2wri h LEU 215 Ca -0.03 -0.22 0.00 0.00 -0.00 0.00 0.00 57.88 57.63 2wri h LEU 215 Cb 0.48 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2wri h LEU 215 CO 0.06 0.75 0.00 -0.24 -0.00 0.00 0.00 178.44 179.00 2wri n SER 216 N -4.50 0.00 -0.37 -0.43 2.88 0.26 0.65 113.62 112.11 2wri n SER 216 Ca 0.01 0.30 0.38 0.00 -1.33 0.00 0.00 58.87 58.22 2wri n SER 216 Cb 0.20 0.00 0.76 0.00 -0.75 0.00 0.00 64.21 64.42 2wri n SER 216 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2wri h ARG 217 N 0.00 0.00 0.40 -1.46 2.47 -1.35 0.38 114.38 114.82 2wri h ARG 217 Ca 0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 2wri h ARG 217 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2wri h ARG 217 CO 0.00 0.00 -0.19 0.00 0.56 0.00 0.00 179.97 180.34 2wri h ALA 218 N 1.33 -0.54 -0.49 0.04 0.00 0.70 -1.11 119.26 119.19 2wri h ALA 218 Ca 0.61 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.44 2wri h ALA 218 Cb 2.49 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 20.43 2wri h ALA 218 CO -0.01 -0.77 0.21 0.28 0.00 0.00 0.00 179.25 178.96 2wri h VAL 219 N -0.61 0.89 -0.08 0.00 2.07 0.45 -2.37 116.25 116.60 2wri h VAL 219 Ca -0.06 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.33 2wri h VAL 219 Cb 0.45 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2wri h VAL 219 CO 0.09 0.08 -0.11 0.44 0.02 0.00 0.00 177.57 178.08 2wri h ASP 220 N 0.41 -0.38 -0.41 0.57 5.19 -1.12 0.17 116.42 120.84 2wri h ASP 220 Ca 0.23 0.05 0.12 0.00 -0.62 0.00 0.00 57.03 56.81 2wri h ASP 220 Cb 0.20 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 2wri h ASP 220 CO -0.20 -0.08 1.08 -0.11 -3.12 0.00 0.00 179.24 176.81 2wri n LEU 221 N -3.25 0.00 0.10 1.55 -0.00 -0.44 0.34 117.00 115.29 2wri n LEU 221 Ca -0.01 0.60 -0.14 0.00 -0.00 0.00 0.00 56.01 56.46 2wri n LEU 221 Cb 0.07 -0.10 -0.13 0.00 -0.00 0.00 0.00 43.42 43.25 2wri n LEU 221 CO 0.00 -0.60 -0.01 0.40 -0.00 0.00 0.00 177.39 177.18 2wri h ILE 222 N 0.00 1.54 0.13 1.96 1.08 -0.52 -3.33 117.51 118.36 2wri h ILE 222 Ca 0.20 -3.12 -0.01 0.00 -0.39 0.00 0.00 64.86 61.54 2wri h ILE 222 Cb 2.36 2.93 0.00 0.00 -3.07 0.00 0.00 36.82 39.03 2wri h ILE 222 CO -0.00 0.91 -0.06 0.40 -0.69 0.00 0.00 178.15 178.70 2wri h ILE 223 N 0.06 1.02 0.00 -0.67 2.04 0.59 -3.11 117.51 117.45 2wri h ILE 223 Ca -0.11 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.60 2wri h ILE 223 Cb 1.93 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 2wri h ILE 223 CO 0.19 0.25 0.00 1.67 0.00 0.00 0.00 178.15 180.26 2wri n GLN 224 N -4.91 0.00 -2.27 2.37 7.27 -0.59 0.25 117.38 119.49 2wri n GLN 224 Ca -0.08 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 56.97 2wri n GLN 224 Cb 0.27 -1.33 0.06 0.00 2.41 0.00 0.00 30.24 31.65 2wri n GLN 224 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2wri n ALA 225 N -0.60 2.87 0.12 1.69 0.00 -1.21 -4.89 120.51 118.50 2wri n ALA 225 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 51.75 2wri n ALA 225 Cb 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2wri n ALA 225 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wri n ARG 226 N -0.70 0.00 0.00 0.00 0.63 0.69 -3.83 116.66 113.45 2wri n ARG 226 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2wri n ARG 226 Cb 0.86 -0.07 0.00 0.00 0.45 0.00 0.00 32.46 33.70 2wri n ARG 226 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wri n GLY 227 N 1.79 1.19 0.00 5.14 0.00 -0.56 -5.07 105.19 107.68 2wri n GLY 227 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2wri n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wri n GLY 228 N 0.00 0.94 3.35 -0.02 0.00 -1.26 -5.07 105.19 103.13 2wri n GLY 228 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2wri n GLY 228 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wri n VAL 229 N 0.00 0.72 -2.16 1.61 0.31 -1.26 -5.00 118.33 112.54 2wri n VAL 229 Ca 0.00 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2wri n VAL 229 Cb 0.00 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2wri n VAL 229 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2wri n VAL 230 N -2.78 0.00 -3.19 2.52 0.24 -1.26 -5.11 118.33 108.75 2wri n VAL 230 Ca 0.07 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.16 2wri n VAL 230 Cb 0.52 0.00 0.04 0.00 -1.47 0.00 0.00 33.84 32.93 2wri n VAL 230 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2wri s GLU 231 N 1.81 2.39 0.00 7.34 -1.05 -1.26 -5.12 118.70 122.80 2wri s GLU 231 Ca 0.00 -1.63 0.00 0.00 -0.15 0.00 0.00 54.97 53.19 2wri s GLU 231 Cb 0.00 -2.57 0.00 0.00 -0.44 0.00 0.00 34.13 31.12 2wri s GLU 231 CO 0.00 -0.70 0.00 -2.30 0.95 0.00 0.00 175.26 173.21 2wri n PRO 232 N -2.08 -0.11 0.00 -4.83 -0.02 -1.26 -5.10 135.00 121.60 2wri n PRO 232 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2wri n PRO 232 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.10 2wri n PRO 232 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2wri n SER 233 N -1.36 0.00 -4.78 2.55 3.41 -1.26 -5.10 113.62 107.08 2wri n SER 233 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 2wri n SER 233 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 2wri n SER 233 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2wri s PRO 234 N 3.01 4.60 0.00 4.33 0.04 -1.26 -4.92 135.00 140.80 2wri s PRO 234 Ca 0.00 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2wri s PRO 234 Cb 0.00 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.62 2wri s PRO 234 CO 0.00 0.35 0.00 -1.13 0.04 0.00 0.00 177.00 176.26 2wri n SER 235 N 0.81 0.00 -2.50 6.66 3.41 -1.26 -4.88 113.62 115.87 2wri n SER 235 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.59 2wri n SER 235 Cb 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2wri n SER 235 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2wri n TYR 236 N -0.22 0.06 -0.23 7.33 4.02 -1.26 -4.56 117.16 122.30 2wri n TYR 236 Ca 0.00 -0.35 0.22 0.00 -0.01 0.00 0.00 57.90 57.76 2wri n TYR 236 Cb 0.00 -0.65 0.40 0.00 -0.02 0.00 0.00 39.34 39.07 2wri n TYR 236 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wri n ALA 237 N 3.15 0.70 -1.14 -0.72 0.00 -1.26 -3.69 120.51 117.56 2wri n ALA 237 Ca 0.08 0.73 0.00 0.00 0.00 0.00 0.00 53.44 54.25 2wri n ALA 237 Cb 0.14 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2wri n ALA 237 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2wri n LEU 238 N -4.63 0.00 -0.37 0.00 -0.00 -1.26 -5.08 117.00 105.66 2wri n LEU 238 Ca 0.26 -0.27 -0.01 0.00 -0.00 0.00 0.00 56.01 55.99 2wri n LEU 238 Cb 0.89 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 44.30 2wri n LEU 238 CO 0.00 0.57 0.13 0.52 -0.00 0.00 0.00 177.39 178.61 2wri n VAL 239 N 0.00 0.00 0.00 1.47 0.31 -1.24 -1.43 118.33 117.44 2wri n VAL 239 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2wri n VAL 239 Cb 0.16 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 2wri n VAL 239 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2wri n GLN 240 N 0.43 0.00 0.00 5.55 7.27 -1.26 -5.15 117.38 124.22 2wri n GLN 240 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.10 2wri n GLN 240 Cb 0.03 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.68 2wri n GLN 240 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28