#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3czr s GLN 21 N 0.00 3.86 0.67 3.69 2.00 -1.26 -4.98 119.66 123.64 3czr s GLN 21 Ca 0.00 0.36 -0.11 0.00 -2.00 0.00 0.00 55.36 53.61 3czr s GLN 21 Cb 0.00 -3.75 -0.01 0.00 0.80 0.00 0.00 33.01 30.05 3czr s GLN 21 CO 0.00 -0.68 1.06 -1.25 -0.50 0.00 0.00 175.29 173.92 3czr s PRO 22 N 2.82 3.19 0.07 1.67 0.04 -1.26 -4.90 135.00 136.64 3czr s PRO 22 Ca 0.28 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.74 3czr s PRO 22 Cb -0.14 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3czr s PRO 22 CO 0.13 -0.85 1.13 -0.51 0.04 0.00 0.00 177.00 176.94 3czr s LEU 23 N -5.34 4.40 -0.13 -3.56 1.43 -0.91 -4.93 118.68 109.64 3czr s LEU 23 Ca 0.57 1.95 0.01 0.00 -1.03 0.00 0.00 54.13 55.62 3czr s LEU 23 Cb -0.12 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.67 3czr s LEU 23 CO 0.54 -0.37 1.41 -3.20 0.23 0.00 0.00 176.35 174.96 3czr n ASN 24 N 3.59 3.83 -5.02 2.29 2.85 -1.26 -4.89 115.26 116.65 3czr n ASN 24 Ca 0.07 -2.49 -0.20 0.00 -0.11 0.00 0.00 54.58 51.86 3czr n ASN 24 Cb 0.47 -0.70 0.04 0.00 1.24 0.00 0.00 39.78 40.83 3czr n ASN 24 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 3czr s GLU 25 N -0.86 2.41 0.16 1.20 2.02 -1.26 -5.12 118.70 117.26 3czr s GLU 25 Ca 0.15 -1.59 -0.15 0.00 0.02 0.00 0.00 54.97 53.40 3czr s GLU 25 Cb 0.12 -2.62 -0.07 0.00 0.10 0.00 0.00 34.13 31.66 3czr s GLU 25 CO 0.02 -0.70 0.57 -2.00 0.02 0.00 0.00 175.26 173.17 3czr s GLU 26 N -4.56 4.00 0.53 1.61 2.56 -1.26 -5.06 118.70 116.53 3czr s GLU 26 Ca 0.58 0.53 -0.22 0.00 0.00 0.00 0.00 54.97 55.86 3czr s GLU 26 Cb -0.06 -2.90 -0.05 0.00 2.00 0.00 0.00 34.13 33.11 3czr s GLU 26 CO 0.36 0.46 1.28 0.12 -0.56 0.00 0.00 175.26 176.92 3czr s PHE 27 N -1.50 2.47 -0.06 5.30 5.36 -1.26 -5.03 117.98 123.26 3czr s PHE 27 Ca 0.39 1.44 -0.01 0.00 -0.96 0.00 0.00 56.93 57.79 3czr s PHE 27 Cb -0.15 -3.63 0.03 0.00 -0.34 0.00 0.00 43.02 38.92 3czr s PHE 27 CO 0.19 -2.41 0.01 1.03 -1.46 0.00 0.00 175.22 172.58 3czr s ARG 28 N -2.91 0.48 0.61 10.12 0.52 -1.26 -5.02 118.95 121.48 3czr s ARG 28 Ca 0.70 0.13 0.28 0.00 -0.52 0.00 0.00 55.73 56.32 3czr s ARG 28 Cb -0.36 -0.82 1.46 0.00 0.52 0.00 0.00 34.95 35.76 3czr s ARG 28 CO 0.42 -0.26 1.87 -1.00 0.02 0.00 0.00 175.30 176.34 3czr h PRO 29 N 8.09 0.00 0.00 3.54 0.13 -2.00 0.74 132.00 142.49 3czr h PRO 29 Ca -0.23 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.87 3czr h PRO 29 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 3czr h PRO 29 CO 0.29 0.00 -0.12 1.05 -0.23 0.00 0.00 178.00 178.99 3czr h GLU 30 N 0.00 0.00 -0.49 0.86 9.09 -1.95 -3.04 114.58 119.05 3czr h GLU 30 Ca 0.18 0.00 0.14 0.00 0.05 0.00 0.00 59.36 59.73 3czr h GLU 30 Cb 1.14 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.23 3czr h GLU 30 CO -0.00 0.12 0.74 0.52 0.05 0.00 0.00 179.01 180.44 3czr h MET 31 N 0.00 0.00 -0.01 1.06 2.86 -1.23 -0.52 114.93 117.08 3czr h MET 31 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3czr h MET 31 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3czr h MET 31 CO 0.02 0.00 -0.40 1.28 1.06 0.00 0.00 176.91 178.86 3czr n LEU 32 N -3.26 1.89 -4.69 1.22 7.99 -1.15 -4.83 117.00 114.17 3czr n LEU 32 Ca 0.10 -0.77 -0.42 0.00 -0.01 0.00 0.00 56.01 54.91 3czr n LEU 32 Cb 0.92 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 44.20 3czr n LEU 32 CO 0.20 0.35 1.24 -1.58 -1.51 0.00 0.00 177.39 176.10 3czr s GLN 33 N -2.21 4.23 0.00 3.23 0.74 -0.21 -1.91 119.66 123.53 3czr s GLN 33 Ca 0.16 2.21 0.00 0.00 0.05 0.00 0.00 55.36 57.79 3czr s GLN 33 Cb 0.16 -3.52 0.00 0.00 1.10 0.00 0.00 33.01 30.75 3czr s GLN 33 CO 0.49 -0.66 0.00 0.41 -0.55 0.00 0.00 175.29 174.99 3czr n GLY 34 N 3.84 1.96 3.79 2.59 0.00 0.11 -4.94 105.19 112.54 3czr n GLY 34 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3czr n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3czr s LYS 35 N -0.06 4.13 -0.22 1.61 -0.14 -0.80 -4.62 119.74 119.64 3czr s LYS 35 Ca 0.00 1.37 -0.07 0.00 -1.36 0.00 0.00 55.97 55.91 3czr s LYS 35 Cb 0.00 -2.38 -0.03 0.00 -1.68 0.00 0.00 37.83 33.74 3czr s LYS 35 CO 0.00 -0.15 0.07 0.15 -0.76 0.00 0.00 175.35 174.66 3czr s LYS 36 N -2.78 3.79 -0.03 1.68 1.02 -1.26 0.90 119.74 123.07 3czr s LYS 36 Ca 0.60 -0.42 0.01 0.00 0.02 0.00 0.00 55.97 56.18 3czr s LYS 36 Cb -0.18 -3.28 0.02 0.00 -0.52 0.00 0.00 37.83 33.87 3czr s LYS 36 CO 0.22 0.00 -0.01 0.08 -0.92 0.00 0.00 175.35 174.73 3czr s VAL 37 N 1.10 0.23 0.03 3.17 1.01 -0.30 -0.89 120.40 124.75 3czr s VAL 37 Ca 0.04 0.03 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 3czr s VAL 37 Cb -0.14 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 3czr s VAL 37 CO 0.03 0.15 0.35 -0.63 0.00 0.00 0.00 175.10 175.00 3czr s ILE 38 N 0.88 5.16 -0.05 2.22 1.01 -0.54 -1.76 121.20 128.13 3czr s ILE 38 Ca -0.09 0.45 -0.00 0.00 0.00 0.00 0.00 60.65 61.01 3czr s ILE 38 Cb -0.13 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.75 3czr s ILE 38 CO -0.01 0.40 -0.01 -0.69 0.00 0.00 0.00 174.94 174.63 3czr s VAL 39 N -1.27 0.32 0.37 2.92 1.01 -0.94 -1.47 120.40 121.35 3czr s VAL 39 Ca 0.28 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.40 3czr s VAL 39 Cb -0.14 -0.44 -0.00 0.00 0.00 0.00 0.00 36.38 35.80 3czr s VAL 39 CO 0.15 0.21 0.52 0.42 0.00 0.00 0.00 175.10 176.40 3czr s THR 40 N 1.43 3.64 -1.39 3.92 -4.23 -0.98 -2.80 115.64 115.25 3czr s THR 40 Ca -0.04 -0.98 -0.14 0.00 -1.18 0.00 0.00 61.69 59.36 3czr s THR 40 Cb -0.13 -3.25 0.02 0.00 1.34 0.00 0.00 72.50 70.47 3czr s THR 40 CO -0.03 -0.10 0.35 0.61 -0.54 0.00 0.00 174.62 174.91 3czr n GLY 41 N -1.74 -0.45 0.99 3.99 0.00 -1.03 -3.99 105.19 102.96 3czr n GLY 41 Ca 0.03 0.25 0.04 0.00 0.00 0.00 0.00 46.02 46.34 3czr n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3czr n ALA 42 N -4.72 3.40 1.10 4.61 0.00 -0.78 -4.01 120.51 120.10 3czr n ALA 42 Ca -0.23 -2.55 0.12 0.00 0.00 0.00 0.00 53.44 50.78 3czr n ALA 42 Cb 0.64 -0.74 0.28 0.00 0.00 0.00 0.00 19.45 19.63 3czr n ALA 42 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3czr n SER 43 N -0.70 0.76 -1.44 0.00 3.41 -1.26 -3.56 113.62 110.82 3czr n SER 43 Ca 0.26 -0.56 -0.01 0.00 -0.26 0.00 0.00 58.87 58.30 3czr n SER 43 Cb 0.95 0.24 0.00 0.00 -0.26 0.00 0.00 64.21 65.15 3czr n SER 43 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3czr n LYS 44 N -1.14 0.13 0.00 4.33 2.85 -1.26 -4.78 118.16 118.29 3czr n LYS 44 Ca 0.08 -0.30 0.00 0.00 -1.05 0.00 0.00 58.31 57.05 3czr n LYS 44 Cb 0.34 0.40 0.00 0.00 -0.65 0.00 0.00 35.03 35.12 3czr n LYS 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3czr n GLY 45 N -0.14 1.01 0.30 2.58 0.00 -1.26 -1.04 105.19 106.64 3czr n GLY 45 Ca -0.00 -0.61 0.01 0.00 0.00 0.00 0.00 46.02 45.42 3czr n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3czr h ILE 46 N 0.00 1.17 -0.02 -0.61 2.04 -1.90 -2.91 117.51 115.28 3czr h ILE 46 Ca 0.00 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.35 3czr h ILE 46 Cb 0.00 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3czr h ILE 46 CO 0.00 0.20 -0.08 1.23 0.00 0.00 0.00 178.15 179.50 3czr h GLY 47 N 0.77 -0.08 0.66 5.37 0.00 -1.67 0.58 103.07 108.71 3czr h GLY 47 Ca 0.15 0.10 0.06 0.00 0.00 0.00 0.00 47.33 47.64 3czr h GLY 47 CO -0.01 -0.09 0.31 -0.09 0.00 0.00 0.00 176.54 176.65 3czr h ARG 48 N -0.14 0.56 -0.37 4.80 2.43 -0.98 -1.38 114.38 119.30 3czr h ARG 48 Ca 0.04 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3czr h ARG 48 Cb 0.19 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3czr h ARG 48 CO -0.10 0.37 0.06 0.93 -1.51 0.00 0.00 179.97 179.73 3czr h GLU 49 N 0.58 0.56 -0.14 0.20 4.39 -1.27 -1.48 114.58 117.42 3czr h GLU 49 Ca 0.27 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 3czr h GLU 49 Cb 0.19 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3czr h GLU 49 CO -0.19 0.54 0.03 0.52 -1.16 0.00 0.00 179.01 178.75 3czr h MET 50 N 0.55 0.22 -0.45 2.33 2.86 -0.10 -1.59 114.93 118.74 3czr h MET 50 Ca 0.12 -0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.80 3czr h MET 50 Cb 0.25 -0.03 -0.10 0.00 0.06 0.00 0.00 31.60 31.79 3czr h MET 50 CO 0.00 0.39 -0.31 0.00 1.06 0.00 0.00 176.91 178.05 3czr h ALA 51 N 0.83 -0.09 -0.88 6.32 0.00 -0.97 -0.43 119.26 124.03 3czr h ALA 51 Ca 0.04 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.14 3czr h ALA 51 Cb 0.27 0.69 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 3czr h ALA 51 CO 0.00 -0.68 0.55 1.88 0.00 0.00 0.00 179.25 181.00 3czr h TYR 52 N -0.21 1.03 -0.59 0.00 0.05 -1.15 0.37 116.97 116.47 3czr h TYR 52 Ca 0.19 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.93 3czr h TYR 52 Cb 0.53 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 37.91 3czr h TYR 52 CO -0.55 0.53 0.07 0.45 -1.05 0.00 0.00 178.16 177.62 3czr h HIS 53 N 1.02 1.02 -0.31 4.88 3.86 -0.68 -1.15 115.15 123.79 3czr h HIS 53 Ca 0.38 -0.13 -0.11 0.00 -1.16 0.00 0.00 60.37 59.34 3czr h HIS 53 Cb 0.14 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3czr h HIS 53 CO -0.03 0.88 -0.25 -0.07 0.86 0.00 0.00 177.93 179.32 3czr h LEU 54 N 0.90 0.75 -0.04 2.43 3.38 -0.30 -2.63 115.31 119.80 3czr h LEU 54 Ca 0.18 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.73 3czr h LEU 54 Cb 0.43 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 3czr h LEU 54 CO 0.01 1.04 -0.50 0.00 0.09 0.00 0.00 178.44 179.08 3czr h ALA 55 N 0.73 -0.84 0.00 1.53 0.00 -0.19 -0.51 119.26 119.98 3czr h ALA 55 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3czr h ALA 55 Cb 0.81 0.90 0.00 0.00 0.00 0.00 0.00 17.79 19.50 3czr h ALA 55 CO 0.06 -1.06 0.07 1.63 0.00 0.00 0.00 179.25 179.96 3czr n LYS 56 N -5.46 0.00 0.00 0.00 5.02 -0.44 -0.03 118.16 117.25 3czr n LYS 56 Ca -0.06 0.34 0.06 0.00 -2.02 0.00 0.00 58.31 56.62 3czr n LYS 56 Cb 0.39 -1.57 0.01 0.00 -0.02 0.00 0.00 35.03 33.84 3czr n LYS 56 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3czr n MET 57 N -1.32 1.65 -2.16 1.97 2.81 -0.26 -4.98 117.12 114.83 3czr n MET 57 Ca 0.00 -0.80 -0.05 0.00 -1.81 0.00 0.00 57.70 55.05 3czr n MET 57 Cb 0.07 -1.16 0.02 0.00 -0.71 0.00 0.00 33.22 31.45 3czr n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3czr n GLY 58 N 0.89 0.27 3.67 3.03 0.00 0.95 -3.50 105.19 110.50 3czr n GLY 58 Ca 0.05 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 3czr n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3czr s ALA 59 N -3.11 3.24 0.08 4.61 0.00 -1.01 0.04 121.76 125.60 3czr s ALA 59 Ca 0.08 -1.65 -0.22 0.00 0.00 0.00 0.00 51.96 50.17 3czr s ALA 59 Cb -0.01 -0.82 -0.07 0.00 0.00 0.00 0.00 23.12 22.23 3czr s ALA 59 CO 0.21 0.24 0.67 -1.01 0.00 0.00 0.00 175.76 175.88 3czr s HIS 60 N -2.32 3.80 -0.07 0.00 3.76 0.26 -1.32 115.29 119.40 3czr s HIS 60 Ca 0.32 1.40 -0.03 0.00 -0.15 0.00 0.00 55.06 56.61 3czr s HIS 60 Cb -0.06 -2.66 0.04 0.00 1.11 0.00 0.00 32.58 31.00 3czr s HIS 60 CO 0.21 0.45 0.14 0.08 -0.85 0.00 0.00 174.74 174.77 3czr s VAL 61 N -0.71 -0.09 -0.13 -0.90 1.01 -0.83 -1.15 120.40 117.59 3czr s VAL 61 Ca 0.33 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.56 3czr s VAL 61 Cb -0.20 -0.24 0.01 0.00 0.00 0.00 0.00 36.38 35.94 3czr s VAL 61 CO 0.21 0.09 -0.22 -0.69 0.00 0.00 0.00 175.10 174.50 3czr s VAL 62 N 1.41 2.10 0.23 2.92 1.01 -0.72 -1.42 120.40 125.93 3czr s VAL 62 Ca -0.06 -0.98 0.10 0.00 0.00 0.00 0.00 61.98 61.03 3czr s VAL 62 Cb -0.12 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3czr s VAL 62 CO -0.06 0.55 -0.06 0.68 0.00 0.00 0.00 175.10 176.22 3czr s VAL 63 N 0.70 3.26 0.08 2.92 -7.23 -0.60 -2.20 120.40 117.32 3czr s VAL 63 Ca -0.10 -1.87 -0.06 0.00 -1.81 0.00 0.00 61.98 58.15 3czr s VAL 63 Cb -0.16 -2.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.07 3czr s VAL 63 CO 0.01 -0.28 0.11 0.28 -0.31 0.00 0.00 175.10 174.91 3czr s THR 64 N -2.11 0.17 0.00 5.32 -1.32 -1.12 -2.14 115.64 114.44 3czr s THR 64 Ca 0.29 -1.44 0.00 0.00 -1.21 0.00 0.00 61.69 59.33 3czr s THR 64 Cb -0.07 -1.44 0.00 0.00 -1.51 0.00 0.00 72.50 69.48 3czr s THR 64 CO 0.18 -0.77 0.00 0.00 -2.21 0.00 0.00 174.62 171.82 3czr n ALA 65 N -0.00 0.00 -0.03 11.08 0.00 -1.25 -1.87 120.51 128.43 3czr n ALA 65 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.21 3czr n ALA 65 Cb 0.62 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.15 3czr n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3czr h ARG 66 N 0.00 0.65 -5.07 0.00 3.08 -1.91 -1.38 114.38 109.76 3czr h ARG 66 Ca 0.00 -0.33 -0.63 0.00 0.07 0.00 0.00 59.98 59.09 3czr h ARG 66 Cb 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 29.87 3czr h ARG 66 CO 0.00 0.93 -0.57 -1.54 -1.07 0.00 0.00 179.97 177.72 3czr s SER 67 N -6.85 5.60 0.16 7.04 1.04 -1.26 -3.99 113.70 115.45 3czr s SER 67 Ca -0.08 -0.03 -0.08 0.00 0.48 0.00 0.00 55.95 56.24 3czr s SER 67 Cb 0.12 -2.00 0.01 0.00 0.10 0.00 0.00 66.02 64.25 3czr s SER 67 CO 0.84 0.05 1.46 0.07 0.98 0.00 0.00 173.24 176.63 3czr h LYS 68 N 7.65 0.75 0.63 4.02 2.10 -1.99 -2.59 116.57 127.14 3czr h LYS 68 Ca -0.37 -0.46 -0.03 0.00 -2.00 0.00 0.00 60.65 57.79 3czr h LYS 68 Cb 1.18 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 3czr h LYS 68 CO 0.62 1.09 -0.34 1.49 -2.00 0.00 0.00 179.45 180.32 3czr h GLU 69 N 0.58 -0.86 -0.64 0.07 4.81 -2.00 0.85 114.58 117.40 3czr h GLU 69 Ca 0.02 0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3czr h GLU 69 Cb 1.10 0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.65 3czr h GLU 69 CO 0.11 -0.57 0.42 1.79 -0.73 0.00 0.00 179.01 180.03 3czr h THR 70 N -0.89 1.15 -0.70 0.32 1.35 -1.94 -2.52 112.91 109.69 3czr h THR 70 Ca -0.08 -0.29 -0.03 0.00 -0.55 0.00 0.00 66.41 65.46 3czr h THR 70 Cb 0.70 0.23 -0.03 0.00 -1.73 0.00 0.00 68.15 67.32 3czr h THR 70 CO 0.11 0.15 0.32 -0.07 -0.25 0.00 0.00 175.52 175.78 3czr h LEU 71 N 0.85 0.93 -0.45 3.87 3.38 -1.06 -3.02 115.31 119.80 3czr h LEU 71 Ca 0.24 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.11 3czr h LEU 71 Cb -0.07 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.39 3czr h LEU 71 CO -0.05 0.82 0.19 -0.61 0.09 0.00 0.00 178.44 178.87 3czr h GLN 72 N 0.98 0.37 -0.49 1.13 5.75 -0.39 -0.92 115.11 121.54 3czr h GLN 72 Ca 0.24 -0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.78 3czr h GLN 72 Cb 0.15 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 28.56 3czr h GLN 72 CO -0.03 0.24 0.17 0.87 -2.65 0.00 0.00 178.83 177.44 3czr h LYS 73 N 0.38 0.34 0.26 1.69 1.57 -1.43 0.26 116.57 119.63 3czr h LYS 73 Ca 0.21 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3czr h LYS 73 Cb 0.17 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3czr h LYS 73 CO -0.18 0.22 -0.17 0.28 -0.57 0.00 0.00 179.45 179.03 3czr h VAL 74 N 0.35 0.64 -0.24 0.50 2.07 -1.34 -0.18 116.25 118.06 3czr h VAL 74 Ca 0.23 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.81 3czr h VAL 74 Cb 0.24 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 3czr h VAL 74 CO -0.24 0.00 -0.29 0.58 0.02 0.00 0.00 177.57 177.64 3czr h VAL 75 N -0.42 0.32 -0.18 2.57 2.07 -0.58 0.16 116.25 120.19 3czr h VAL 75 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 3czr h VAL 75 Cb 0.35 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.37 3czr h VAL 75 CO 0.02 0.00 -0.28 0.28 0.02 0.00 0.00 177.57 177.61 3czr h SER 76 N -0.30 -0.88 0.53 0.57 0.02 -0.31 -1.87 113.55 111.31 3czr h SER 76 Ca 0.13 0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 61.16 3czr h SER 76 Cb 0.51 0.39 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 3czr h SER 76 CO -0.41 -0.32 -0.26 -0.74 -1.14 0.00 0.00 176.83 173.96 3czr h HIS 77 N -0.33 0.00 -0.12 3.45 6.17 -0.55 -0.84 115.15 122.94 3czr h HIS 77 Ca 0.11 0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.20 3czr h HIS 77 Cb 0.50 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.42 3czr h HIS 77 CO -0.39 0.26 0.06 0.00 0.71 0.00 0.00 177.93 178.57 3czr h LEU 79 N 0.13 -0.01 -1.62 0.00 3.38 -0.81 -1.26 115.31 115.12 3czr h LEU 79 Ca 0.05 -0.19 0.30 0.00 0.09 0.00 0.00 57.88 58.13 3czr h LEU 79 Cb 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 3czr h LEU 79 CO -0.03 0.18 0.75 -0.33 0.09 0.00 0.00 178.44 179.10 3czr h GLU 80 N -0.20 0.21 0.00 1.13 5.08 -1.06 -0.11 114.58 119.63 3czr h GLU 80 Ca -0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3czr h GLU 80 Cb 0.20 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3czr h GLU 80 CO 0.00 0.14 -0.16 1.28 -1.00 0.00 0.00 179.01 179.27 3czr n LEU 81 N -4.45 0.77 0.00 1.33 4.77 0.95 -4.92 117.00 115.44 3czr n LEU 81 Ca 0.26 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.72 3czr n LEU 81 Cb 1.05 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3czr n LEU 81 CO 0.31 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3czr n GLY 82 N 1.32 1.81 3.77 -0.72 0.00 -0.05 -4.08 105.19 107.25 3czr n GLY 82 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3czr n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3czr s ALA 83 N -2.00 3.52 0.23 4.61 0.00 -0.78 -3.78 121.76 123.57 3czr s ALA 83 Ca 0.00 1.40 -0.04 0.00 0.00 0.00 0.00 51.96 53.31 3czr s ALA 83 Cb 0.00 -3.54 0.24 0.00 0.00 0.00 0.00 23.12 19.83 3czr s ALA 83 CO 0.00 -0.83 1.72 0.00 0.00 0.00 0.00 175.76 176.65 3czr h ALA 84 N 3.18 1.01 -2.92 0.00 0.00 -1.39 -3.46 119.26 115.69 3czr h ALA 84 Ca -0.50 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.14 3czr h ALA 84 Cb 1.23 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.74 3czr h ALA 84 CO 0.65 0.61 0.08 -1.54 0.00 0.00 0.00 179.25 179.04 3czr s SER 85 N -6.61 -0.22 -0.29 0.00 1.04 -1.19 -4.91 113.70 101.51 3czr s SER 85 Ca -0.10 -0.64 -0.15 0.00 0.48 0.00 0.00 55.95 55.54 3czr s SER 85 Cb 0.14 0.64 0.11 0.00 0.10 0.00 0.00 66.02 67.02 3czr s SER 85 CO 0.83 -1.20 0.76 0.00 0.98 0.00 0.00 173.24 174.61 3czr s ALA 86 N -3.93 -2.05 0.30 5.32 0.00 -1.25 -1.97 121.76 118.18 3czr s ALA 86 Ca 0.13 2.34 0.04 0.00 0.00 0.00 0.00 51.96 54.47 3czr s ALA 86 Cb -0.03 -1.60 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 3czr s ALA 86 CO 0.04 -0.53 0.27 -1.01 0.00 0.00 0.00 175.76 174.54 3czr s HIS 87 N 1.90 1.50 0.03 0.00 3.76 -0.51 -4.97 115.29 117.00 3czr s HIS 87 Ca -0.08 -1.53 -0.02 0.00 -0.15 0.00 0.00 55.06 53.27 3czr s HIS 87 Cb -0.06 -0.58 -0.02 0.00 1.11 0.00 0.00 32.58 33.02 3czr s HIS 87 CO -0.19 -0.85 0.02 1.52 -0.85 0.00 0.00 174.74 174.39 3czr s TYR 88 N -3.59 0.31 -0.03 1.40 -0.85 -1.26 -1.55 117.35 111.78 3czr s TYR 88 Ca 0.39 -0.67 0.00 0.00 -0.52 0.00 0.00 57.07 56.27 3czr s TYR 88 Cb 0.03 -0.23 0.03 0.00 0.38 0.00 0.00 41.96 42.17 3czr s TYR 88 CO 0.23 -0.31 0.00 0.42 -1.52 0.00 0.00 175.55 174.37 3czr s ILE 89 N -2.56 0.20 0.20 -3.49 1.01 -0.91 -4.95 121.20 110.71 3czr s ILE 89 Ca -0.06 0.09 -0.04 0.00 0.00 0.00 0.00 60.65 60.65 3czr s ILE 89 Cb -0.02 -0.30 -0.05 0.00 0.01 0.00 0.00 42.46 42.10 3czr s ILE 89 CO -0.05 0.16 0.44 0.00 0.00 0.00 0.00 174.94 175.49 3czr s ALA 90 N 1.14 3.75 0.00 9.38 0.00 -1.26 -3.83 121.76 130.93 3czr s ALA 90 Ca -0.08 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.24 3czr s ALA 90 Cb -0.13 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.84 3czr s ALA 90 CO -0.02 0.47 0.00 0.41 0.00 0.00 0.00 175.76 176.63 3czr n GLY 91 N -0.44 2.33 3.74 0.00 0.00 -0.52 -4.94 105.19 105.36 3czr n GLY 91 Ca -0.03 -0.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 3czr n GLY 91 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3czr s THR 92 N -2.00 5.21 -2.00 2.61 -1.32 -1.26 -3.14 115.64 113.73 3czr s THR 92 Ca 0.00 0.82 0.06 0.00 -1.21 0.00 0.00 61.69 61.36 3czr s THR 92 Cb 0.00 -3.75 0.17 0.00 -1.51 0.00 0.00 72.50 67.41 3czr s THR 92 CO 0.00 0.37 1.10 0.23 -2.21 0.00 0.00 174.62 174.11 3czr n MET 93 N 3.45 0.85 0.27 7.08 0.00 -1.26 -0.83 117.12 126.68 3czr n MET 93 Ca -0.09 0.00 0.16 0.00 0.00 0.00 0.00 57.70 57.77 3czr n MET 93 Cb 0.52 -1.11 0.62 0.00 0.00 0.00 0.00 33.22 33.24 3czr n MET 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 3czr h GLU 94 N 0.00 0.00 -4.47 0.03 5.08 -1.92 -3.42 114.58 109.88 3czr h GLU 94 Ca 0.00 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.63 3czr h GLU 94 Cb 0.00 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.04 3czr h GLU 94 CO 0.00 0.03 0.12 0.34 -1.00 0.00 0.00 179.01 178.50 3czr s ASP 95 N -5.80 6.32 0.36 1.42 2.15 -0.01 -4.89 116.67 116.23 3czr s ASP 95 Ca 0.01 -1.77 0.11 0.00 0.43 0.00 0.00 52.55 51.34 3czr s ASP 95 Cb 0.09 -2.28 0.90 0.00 -0.30 0.00 0.00 42.92 41.32 3czr s ASP 95 CO 0.56 -0.98 1.81 0.24 -0.17 0.00 0.00 175.17 176.64 3czr h MET 96 N 8.87 0.59 -0.37 4.34 2.86 -1.85 0.15 114.93 129.53 3czr h MET 96 Ca -0.18 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.36 3czr h MET 96 Cb 1.08 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 3czr h MET 96 CO 1.03 0.39 -0.00 1.15 1.06 0.00 0.00 176.91 180.54 3czr h THR 97 N 0.61 1.26 -0.22 2.22 2.02 -1.95 -0.99 112.91 115.86 3czr h THR 97 Ca 0.53 -1.00 0.02 0.00 0.77 0.00 0.00 66.41 66.73 3czr h THR 97 Cb 1.03 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 3czr h THR 97 CO -0.28 0.33 0.10 0.15 0.37 0.00 0.00 175.52 176.19 3czr h PHE 98 N 0.47 0.18 -0.00 3.16 3.57 -1.26 -1.41 116.94 121.66 3czr h PHE 98 Ca 0.10 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 3czr h PHE 98 Cb 0.47 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 3czr h PHE 98 CO 0.04 0.10 -0.47 0.00 -2.23 0.00 0.00 178.31 175.75 3czr h ALA 99 N 1.12 -0.79 -0.29 2.41 0.00 -0.53 0.68 119.26 121.85 3czr h ALA 99 Ca 0.09 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3czr h ALA 99 Cb 0.03 0.84 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3czr h ALA 99 CO -0.07 -1.03 0.08 1.49 0.00 0.00 0.00 179.25 179.72 3czr h GLU 100 N -0.62 0.19 -0.75 0.00 4.81 -1.16 -2.61 114.58 114.44 3czr h GLU 100 Ca 0.03 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3czr h GLU 100 Cb 0.69 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.99 3czr h GLU 100 CO -0.34 0.13 0.43 1.96 -0.73 0.00 0.00 179.01 180.46 3czr h GLN 101 N 0.20 1.03 -0.79 1.92 4.20 -0.86 -3.03 115.11 117.78 3czr h GLN 101 Ca 0.13 -0.11 0.15 0.00 0.06 0.00 0.00 58.65 58.89 3czr h GLN 101 Cb 0.12 -0.21 -0.10 0.00 0.30 0.00 0.00 27.48 27.60 3czr h GLN 101 CO -0.16 0.75 0.34 0.35 -0.67 0.00 0.00 178.83 179.44 3czr h PHE 102 N 1.03 0.57 -0.40 2.96 3.57 0.75 -0.76 116.94 124.66 3czr h PHE 102 Ca 0.27 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.72 3czr h PHE 102 Cb 0.00 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 3czr h PHE 102 CO -0.00 0.07 -0.10 0.28 -2.23 0.00 0.00 178.31 176.33 3czr h VAL 103 N 0.47 1.25 0.77 1.41 2.07 -1.39 -0.88 116.25 119.95 3czr h VAL 103 Ca 0.44 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.82 3czr h VAL 103 Cb 0.68 1.05 0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3czr h VAL 103 CO -0.41 0.37 -0.37 0.00 0.02 0.00 0.00 177.57 177.18 3czr h ALA 104 N 1.26 -1.06 -0.79 1.67 0.00 -1.20 0.69 119.26 119.83 3czr h ALA 104 Ca 0.11 -0.23 0.19 0.00 0.00 0.00 0.00 54.91 54.99 3czr h ALA 104 Cb 0.54 0.40 -0.13 0.00 0.00 0.00 0.00 17.79 18.60 3czr h ALA 104 CO 0.03 -0.99 0.10 1.96 0.00 0.00 0.00 179.25 180.35 3czr h GLN 105 N -1.23 0.16 -0.36 0.00 4.20 -1.20 -0.46 115.11 116.21 3czr h GLN 105 Ca -0.11 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 3czr h GLN 105 Cb 0.79 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.52 3czr h GLN 105 CO 0.17 0.10 -0.10 0.00 -0.67 0.00 0.00 178.83 178.34 3czr h ALA 106 N 1.71 1.16 -0.45 3.87 0.00 -1.10 -1.90 119.26 122.55 3czr h ALA 106 Ca 0.45 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3czr h ALA 106 Cb 0.83 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3czr h ALA 106 CO -0.64 0.54 0.19 0.78 0.00 0.00 0.00 179.25 180.12 3czr h GLY 107 N 0.95 0.71 0.97 0.00 0.00 0.75 -2.89 103.07 103.56 3czr h GLY 107 Ca 0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3czr h GLY 107 CO 0.03 0.36 -0.21 0.50 0.00 0.00 0.00 176.54 177.21 3czr h LYS 108 N 0.58 -0.58 -0.98 4.80 1.57 -1.15 0.21 116.57 121.02 3czr h LYS 108 Ca 0.15 0.04 0.35 0.00 -1.87 0.00 0.00 60.65 59.32 3czr h LYS 108 Cb 0.18 0.13 -0.17 0.00 0.08 0.00 0.00 32.23 32.45 3czr h LYS 108 CO -0.01 -0.37 0.45 -0.07 -0.57 0.00 0.00 179.45 178.88 3czr h LEU 109 N -0.64 0.25 0.00 2.94 4.07 -1.31 -0.37 115.31 120.24 3czr h LEU 109 Ca -0.06 0.23 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3czr h LEU 109 Cb 0.48 0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.47 3czr h LEU 109 CO 0.10 -0.29 -1.10 0.23 -1.08 0.00 0.00 178.44 176.30 3czr n MET 110 N -5.21 1.30 -2.69 1.13 2.81 -1.10 -5.00 117.12 108.36 3czr n MET 110 Ca 0.32 -0.05 -0.09 0.00 -1.81 0.00 0.00 57.70 56.07 3czr n MET 110 Cb 1.04 -1.30 0.05 0.00 -0.71 0.00 0.00 33.22 32.30 3czr n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3czr n GLY 111 N 1.44 -0.07 0.00 3.03 0.00 0.67 -4.94 105.19 105.31 3czr n GLY 111 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3czr n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3czr n GLY 112 N -1.16 0.91 3.34 -0.02 0.00 -0.75 -5.05 105.19 102.47 3czr n GLY 112 Ca -0.12 -2.10 -0.07 0.00 0.00 0.00 0.00 46.02 43.72 3czr n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3czr s LEU 113 N 0.00 -0.67 -0.20 0.99 2.96 -1.26 -4.65 118.68 115.85 3czr s LEU 113 Ca 0.00 1.09 0.04 0.00 -0.22 0.00 0.00 54.13 55.04 3czr s LEU 113 Cb 0.00 1.53 -0.21 0.00 0.50 0.00 0.00 46.19 48.01 3czr s LEU 113 CO 0.00 -0.23 0.04 0.47 -1.32 0.00 0.00 176.35 175.31 3czr n ASP 114 N 5.24 1.51 -3.75 3.68 8.00 -0.07 -4.29 116.55 126.87 3czr n ASP 114 Ca -0.11 0.01 -0.14 0.00 0.71 0.00 0.00 54.79 55.26 3czr n ASP 114 Cb 0.50 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.27 3czr n ASP 114 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3czr s MET 115 N -2.53 0.05 -0.30 -1.24 1.75 -0.79 -1.89 119.30 114.35 3czr s MET 115 Ca -0.25 0.31 -0.05 0.00 -1.25 0.00 0.00 55.69 54.46 3czr s MET 115 Cb 0.08 -0.21 0.03 0.00 2.84 0.00 0.00 34.83 37.57 3czr s MET 115 CO 0.70 -0.17 0.05 -1.17 -0.65 0.00 0.00 175.02 173.78 3czr s LEU 116 N 1.16 3.83 -0.34 4.11 2.96 0.76 -1.46 118.68 129.70 3czr s LEU 116 Ca -0.09 -0.92 -0.10 0.00 -0.22 0.00 0.00 54.13 52.80 3czr s LEU 116 Cb -0.12 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.77 3czr s LEU 116 CO -0.05 -0.22 0.17 -0.63 -1.32 0.00 0.00 176.35 174.30 3czr s ILE 117 N 1.41 4.52 -0.34 6.68 1.01 -0.54 -0.50 121.20 133.42 3czr s ILE 117 Ca -0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 60.65 59.91 3czr s ILE 117 Cb -0.18 -3.40 0.02 0.00 0.01 0.00 0.00 42.46 38.91 3czr s ILE 117 CO 0.01 -0.06 0.16 -0.76 0.00 0.00 0.00 174.94 174.29 3czr s LEU 118 N 1.57 4.41 0.00 2.97 1.43 0.15 -2.32 118.68 126.90 3czr s LEU 118 Ca 0.03 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 3czr s LEU 118 Cb -0.18 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.06 3czr s LEU 118 CO 0.06 -0.31 0.00 -3.20 0.23 0.00 0.00 176.35 173.13 3czr n ASN 119 N 4.95 2.16 -4.83 2.29 2.85 -1.26 -1.09 115.26 120.33 3czr n ASN 119 Ca -0.13 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.03 3czr n ASN 119 Cb 0.47 0.27 0.02 0.00 1.24 0.00 0.00 39.78 41.78 3czr n ASN 119 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 3czr s HIS 120 N -1.28 3.25 0.13 1.20 -3.43 -1.26 -4.85 115.29 109.05 3czr s HIS 120 Ca 0.00 1.42 -0.03 0.00 -0.80 0.00 0.00 55.06 55.65 3czr s HIS 120 Cb 0.00 -2.86 -0.03 0.00 -1.43 0.00 0.00 32.58 28.26 3czr s HIS 120 CO 0.00 -0.95 0.11 0.96 -2.00 0.00 0.00 174.74 172.86 3czr s ILE 121 N -2.86 0.11 0.51 -5.38 -4.36 -1.26 -4.78 121.20 103.18 3czr s ILE 121 Ca 0.59 -1.73 -0.17 0.00 -0.26 0.00 0.00 60.65 59.08 3czr s ILE 121 Cb -0.13 -1.88 -0.08 0.00 1.25 0.00 0.00 42.46 41.62 3czr s ILE 121 CO 0.47 -0.51 0.99 0.28 0.24 0.00 0.00 174.94 176.41 3czr s THR 122 N -4.00 4.42 0.06 8.37 -1.32 -1.26 -4.97 115.64 116.94 3czr s THR 122 Ca 0.19 1.21 -0.33 0.00 -1.21 0.00 0.00 61.69 61.56 3czr s THR 122 Cb 0.06 -3.66 -0.11 0.00 -1.51 0.00 0.00 72.50 67.27 3czr s THR 122 CO -0.01 -0.62 1.81 0.59 -2.21 0.00 0.00 174.62 174.19 3czr n ASN 123 N -1.50 3.68 -3.78 8.08 3.02 -1.26 -4.97 115.26 118.53 3czr n ASN 123 Ca 0.07 0.99 -0.13 0.00 -0.03 0.00 0.00 54.58 55.48 3czr n ASN 123 Cb 0.54 -1.46 -0.09 0.00 -0.61 0.00 0.00 39.78 38.15 3czr n ASN 123 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3czr s THR 124 N 2.97 0.06 0.11 3.41 -1.32 -1.26 -5.12 115.64 114.49 3czr s THR 124 Ca 0.85 -0.51 0.00 0.00 -1.21 0.00 0.00 61.69 60.82 3czr s THR 124 Cb -0.58 -0.57 -0.04 0.00 -1.51 0.00 0.00 72.50 69.79 3czr s THR 124 CO 0.42 -0.28 -0.01 -0.94 -2.21 0.00 0.00 174.62 171.60 3czr s SER 125 N -1.32 0.74 0.07 8.08 1.04 -1.26 -5.02 113.70 116.03 3czr s SER 125 Ca -0.14 -1.09 -0.31 0.00 0.48 0.00 0.00 55.95 54.89 3czr s SER 125 Cb -0.06 0.18 -0.07 0.00 0.10 0.00 0.00 66.02 66.17 3czr s SER 125 CO 0.04 -0.60 1.47 -0.76 0.98 0.00 0.00 173.24 174.37 3czr s LEU 126 N -3.03 4.35 -0.03 2.42 1.43 -1.26 -4.95 118.68 117.61 3czr s LEU 126 Ca 0.16 2.32 -0.29 0.00 -1.03 0.00 0.00 54.13 55.29 3czr s LEU 126 Cb 0.07 -3.57 0.08 0.00 0.03 0.00 0.00 46.19 42.80 3czr s LEU 126 CO -0.03 -0.74 0.73 0.20 0.23 0.00 0.00 176.35 176.75 3czr s ASN 127 N 1.63 -0.58 0.82 2.29 0.01 -1.02 -5.07 114.94 113.02 3czr s ASN 127 Ca 0.67 0.49 -0.11 0.00 -0.71 0.00 0.00 52.86 53.20 3czr s ASN 127 Cb -0.36 0.50 0.09 0.00 0.41 0.00 0.00 41.25 41.88 3czr s ASN 127 CO 0.30 -0.63 1.13 -0.76 -1.51 0.00 0.00 177.10 175.63 3czr s LEU 128 N -1.53 3.02 -0.26 0.60 1.43 -1.26 -4.25 118.68 116.43 3czr s LEU 128 Ca -0.06 2.06 -0.11 0.00 -1.03 0.00 0.00 54.13 54.99 3czr s LEU 128 Cb -0.00 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.62 3czr s LEU 128 CO 0.03 -2.49 0.19 0.12 0.23 0.00 0.00 176.35 174.43 3czr s PHE 129 N -2.64 3.28 0.05 0.29 5.36 -1.26 -4.96 117.98 118.10 3czr s PHE 129 Ca 0.66 0.20 -0.02 0.00 -0.96 0.00 0.00 56.93 56.81 3czr s PHE 129 Cb -0.21 -2.33 -0.01 0.00 -0.34 0.00 0.00 43.02 40.13 3czr s PHE 129 CO 0.54 -0.04 -0.04 1.58 -1.46 0.00 0.00 175.22 175.81 3czr n HIS 130 N 4.65 0.00 -1.33 10.12 -0.00 -1.26 -4.97 115.22 122.43 3czr n HIS 130 Ca -0.14 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.58 3czr n HIS 130 Cb 0.52 -0.05 0.01 0.00 -0.00 0.00 0.00 29.99 30.47 3czr n HIS 130 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 3czr n ASP 131 N -3.39 0.29 -3.47 0.26 9.92 -1.26 -5.00 116.55 113.90 3czr n ASP 131 Ca -0.01 -1.60 -0.40 0.00 -0.53 0.00 0.00 54.79 52.25 3czr n ASP 131 Cb 0.05 -0.11 -0.00 0.00 -0.64 0.00 0.00 41.12 40.42 3czr n ASP 131 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3czr n ASP 132 N -0.13 7.95 -0.03 -2.24 -0.08 -1.26 -4.58 116.55 116.18 3czr n ASP 132 Ca 0.01 -3.20 0.12 0.00 -1.51 0.00 0.00 54.79 50.21 3czr n ASP 132 Cb 0.57 -1.34 0.53 0.00 2.34 0.00 0.00 41.12 43.22 3czr n ASP 132 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 3czr h ILE 133 N 2.54 0.91 -0.66 5.18 2.04 -1.99 0.18 117.51 125.71 3czr h ILE 133 Ca 0.68 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 66.42 3czr h ILE 133 Cb 0.31 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3czr h ILE 133 CO 1.43 0.06 0.40 -0.74 0.00 0.00 0.00 178.15 179.31 3czr h HIS 134 N 0.34 0.85 0.01 1.37 2.76 -2.00 0.16 115.15 118.64 3czr h HIS 134 Ca 0.24 0.01 -0.25 0.00 -2.20 0.00 0.00 60.37 58.17 3czr h HIS 134 Cb 0.49 -0.28 0.01 0.00 1.55 0.00 0.00 27.41 29.18 3czr h HIS 134 CO -0.00 0.56 -1.01 1.25 -1.30 0.00 0.00 177.93 177.43 3czr h HIS 135 N 0.90 0.77 -0.59 5.26 -0.00 -1.37 -2.06 115.15 118.06 3czr h HIS 135 Ca 0.24 -0.43 -0.00 0.00 -0.00 0.00 0.00 60.37 60.18 3czr h HIS 135 Cb -0.05 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 27.25 3czr h HIS 135 CO 0.00 1.26 0.36 0.28 -0.00 0.00 0.00 177.93 179.83 3czr h VAL 136 N 0.28 1.17 -0.08 5.26 2.07 -0.73 -0.80 116.25 123.43 3czr h VAL 136 Ca -0.10 -0.39 -0.20 0.00 0.82 0.00 0.00 66.70 66.83 3czr h VAL 136 Cb 1.66 0.36 0.01 0.00 -1.52 0.00 0.00 31.29 31.80 3czr h VAL 136 CO 0.18 0.18 -0.74 -0.09 0.02 0.00 0.00 177.57 177.12 3czr h ARG 137 N 0.80 0.64 0.00 1.57 2.43 -1.02 -1.33 114.38 117.47 3czr h ARG 137 Ca 0.21 -0.58 -0.03 0.00 -0.81 0.00 0.00 59.98 58.77 3czr h ARG 137 Cb -0.02 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3czr h ARG 137 CO -0.04 1.20 -0.16 -0.22 -1.51 0.00 0.00 179.97 179.23 3czr h LYS 138 N 0.29 0.00 0.11 0.20 3.64 -1.36 0.33 116.57 119.79 3czr h LYS 138 Ca -0.07 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 3czr h LYS 138 Cb 1.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 3czr h LYS 138 CO 0.15 0.16 -0.05 0.77 -2.27 0.00 0.00 179.45 178.21 3czr h SER 139 N 0.00 -0.13 -0.57 4.20 0.02 -0.77 0.16 113.55 116.47 3czr h SER 139 Ca -0.00 -0.41 0.11 0.00 -0.84 0.00 0.00 61.79 60.65 3czr h SER 139 Cb 0.29 0.03 -0.09 0.00 0.14 0.00 0.00 62.40 62.78 3czr h SER 139 CO 0.02 0.38 0.08 0.24 -1.14 0.00 0.00 176.83 176.42 3czr h MET 140 N -0.68 0.20 0.29 3.45 2.86 -1.00 1.32 114.93 121.36 3czr h MET 140 Ca -0.02 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3czr h MET 140 Cb 0.52 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.14 3czr h MET 140 CO 0.02 0.13 -0.14 0.93 1.06 0.00 0.00 176.91 178.92 3czr h GLU 141 N 0.21 -0.37 0.07 1.72 4.39 -0.22 0.17 114.58 120.55 3czr h GLU 141 Ca 0.30 0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.88 3czr h GLU 141 Cb 0.45 0.09 0.01 0.00 -0.10 0.00 0.00 28.75 29.20 3czr h GLU 141 CO -0.42 -0.15 -0.59 0.28 -1.16 0.00 0.00 179.01 176.97 3czr h VAL 142 N -0.54 1.54 0.00 3.13 2.07 -0.50 -1.15 116.25 120.80 3czr h VAL 142 Ca -0.04 -2.34 -0.19 0.00 0.82 0.00 0.00 66.70 64.95 3czr h VAL 142 Cb 0.40 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.20 3czr h VAL 142 CO 0.07 0.66 -0.86 0.78 0.02 0.00 0.00 177.57 178.23 3czr h ASN 143 N -0.42 0.20 0.00 0.57 2.35 0.16 -3.38 115.58 115.07 3czr h ASN 143 Ca -0.09 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 3czr h ASN 143 Cb 1.41 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.71 3czr h ASN 143 CO 0.11 0.97 0.00 0.33 -1.65 0.00 0.00 177.43 177.19 3czr n PHE 144 N -3.64 0.00 -0.28 1.19 7.35 -0.64 -4.68 117.46 116.76 3czr n PHE 144 Ca -0.03 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.75 3czr n PHE 144 Cb 0.80 0.00 0.24 0.00 0.35 0.00 0.00 39.48 40.87 3czr n PHE 144 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 3czr h LEU 145 N 0.00 0.28 -1.85 -2.13 3.38 -0.65 0.23 115.31 114.57 3czr h LEU 145 Ca 0.00 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3czr h LEU 145 Cb 0.00 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3czr h LEU 145 CO 0.00 0.05 -0.14 0.77 0.09 0.00 0.00 178.44 179.22 3czr h SER 146 N 0.42 0.00 -0.10 -0.43 4.64 -1.38 -0.26 113.55 116.43 3czr h SER 146 Ca 0.48 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.65 3czr h SER 146 Cb 0.81 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 3czr h SER 146 CO -0.47 0.14 -0.46 1.88 -0.87 0.00 0.00 176.83 177.05 3czr h TYR 147 N 0.00 0.80 0.06 4.77 -1.99 -0.78 -1.42 116.97 118.40 3czr h TYR 147 Ca -0.00 -0.25 -0.00 0.00 2.00 0.00 0.00 58.73 60.47 3czr h TYR 147 Cb 0.30 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.87 3czr h TYR 147 CO 0.00 0.99 -0.03 0.28 -0.00 0.00 0.00 178.16 179.40 3czr h VAL 148 N 0.53 1.18 -0.78 -2.88 2.07 -0.86 -1.81 116.25 113.70 3czr h VAL 148 Ca 0.03 -0.85 0.09 0.00 0.82 0.00 0.00 66.70 66.80 3czr h VAL 148 Cb 1.00 1.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 3czr h VAL 148 CO 0.09 0.21 0.51 0.58 0.02 0.00 0.00 177.57 178.98 3czr h VAL 149 N -0.46 0.95 -0.01 2.57 2.07 -1.22 -0.52 116.25 119.63 3czr h VAL 149 Ca -0.01 -0.24 -0.16 0.00 0.82 0.00 0.00 66.70 67.11 3czr h VAL 149 Cb 0.40 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3czr h VAL 149 CO 0.01 0.13 -0.75 -0.07 0.02 0.00 0.00 177.57 176.91 3czr h LEU 150 N 0.71 0.08 0.04 2.57 3.38 -1.13 -2.09 115.31 118.88 3czr h LEU 150 Ca 0.36 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 3czr h LEU 150 Cb 0.44 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3czr h LEU 150 CO -0.13 0.80 -0.02 0.74 0.09 0.00 0.00 178.44 179.91 3czr h THR 151 N 0.04 1.29 -0.49 0.22 2.02 -0.40 -2.64 112.91 112.95 3czr h THR 151 Ca -0.01 -1.15 0.10 0.00 0.77 0.00 0.00 66.41 66.11 3czr h THR 151 Cb 1.32 2.04 -0.08 0.00 -1.74 0.00 0.00 68.15 69.69 3czr h THR 151 CO 0.10 0.29 -0.02 0.58 0.37 0.00 0.00 175.52 176.84 3czr h VAL 152 N -0.58 0.60 0.00 3.16 2.07 -1.16 -0.62 116.25 119.72 3czr h VAL 152 Ca -0.01 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3czr h VAL 152 Cb 0.52 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3czr h VAL 152 CO 0.01 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.62 3czr h ALA 153 N 1.44 1.00 0.00 1.67 0.00 -1.36 -3.20 119.26 118.82 3czr h ALA 153 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3czr h ALA 153 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3czr h ALA 153 CO -0.42 0.00 -0.97 0.00 0.00 0.00 0.00 179.25 177.86 3czr n ALA 154 N -2.02 2.90 -0.00 0.00 0.00 -0.44 -4.68 120.51 116.26 3czr n ALA 154 Ca -0.01 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.06 3czr n ALA 154 Cb 0.15 -0.37 -0.04 0.00 0.00 0.00 0.00 19.45 19.19 3czr n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3czr h LEU 155 N 0.00 -0.26 -0.32 0.00 5.85 -1.16 -0.12 115.31 119.30 3czr h LEU 155 Ca 0.00 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.85 3czr h LEU 155 Cb 0.36 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.45 3czr h LEU 155 CO 0.00 -0.11 -0.22 -0.65 -0.34 0.00 0.00 178.44 177.12 3czr h PRO 156 N -0.08 -0.18 -0.94 5.25 0.11 -1.83 1.14 132.00 135.47 3czr h PRO 156 Ca 0.07 0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.26 3czr h PRO 156 Cb 0.19 0.04 -0.06 0.00 0.11 0.00 0.00 31.00 31.28 3czr h PRO 156 CO -0.17 -0.12 0.61 0.52 -0.21 0.00 0.00 178.00 178.62 3czr h MET 157 N -0.19 1.05 -0.11 1.05 2.86 -1.80 -2.62 114.93 115.17 3czr h MET 157 Ca 0.16 -0.06 -0.18 0.00 -2.06 0.00 0.00 59.70 57.56 3czr h MET 157 Cb 0.44 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 3czr h MET 157 CO -0.43 0.69 -0.68 -0.07 1.06 0.00 0.00 176.91 177.48 3czr h LEU 158 N 1.08 0.54 -0.93 1.22 3.38 0.14 -2.44 115.31 118.30 3czr h LEU 158 Ca 0.40 -0.34 0.08 0.00 0.09 0.00 0.00 57.88 58.11 3czr h LEU 158 Cb 0.18 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 3czr h LEU 158 CO -0.15 1.07 0.58 0.11 0.09 0.00 0.00 178.44 180.14 3czr h LYS 159 N 0.33 1.00 -0.07 1.13 1.57 0.14 0.23 116.57 120.90 3czr h LYS 159 Ca -0.02 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3czr h LYS 159 Cb 1.25 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 3czr h LYS 159 CO 0.12 0.66 0.05 1.96 -0.57 0.00 0.00 179.45 181.67 3czr h GLN 160 N 1.03 0.10 0.00 3.15 4.20 -1.14 -2.99 115.11 119.46 3czr h GLN 160 Ca 0.42 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.12 3czr h GLN 160 Cb 0.24 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.00 3czr h GLN 160 CO -0.20 0.07 -0.07 -1.13 -0.67 0.00 0.00 178.83 176.83 3czr n SER 161 N -5.04 0.44 -2.72 1.46 3.41 -0.95 -4.91 113.62 105.32 3czr n SER 161 Ca -0.06 0.47 -0.16 0.00 -0.26 0.00 0.00 58.87 58.86 3czr n SER 161 Cb 0.03 -0.55 0.06 0.00 -0.26 0.00 0.00 64.21 63.49 3czr n SER 161 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3czr n ASN 162 N -1.89 -4.69 -0.81 4.04 5.03 0.61 -5.01 115.26 112.54 3czr n ASN 162 Ca 0.06 -0.39 0.00 0.00 0.87 0.00 0.00 54.58 55.12 3czr n ASN 162 Cb 0.39 -3.76 0.00 0.00 -1.02 0.00 0.00 39.78 35.39 3czr n ASN 162 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3czr n GLY 163 N -1.51 -0.41 3.64 7.41 0.00 -0.01 -4.69 105.19 109.62 3czr n GLY 163 Ca -0.03 -1.23 -0.06 0.00 0.00 0.00 0.00 46.02 44.71 3czr n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3czr s SER 164 N -1.29 -0.69 -0.16 1.61 0.01 -0.79 -2.13 113.70 110.25 3czr s SER 164 Ca 0.00 1.14 -0.05 0.00 1.31 0.00 0.00 55.95 58.36 3czr s SER 164 Cb 0.00 1.26 -0.03 0.00 0.21 0.00 0.00 66.02 67.46 3czr s SER 164 CO 0.00 -0.18 -0.01 -0.63 0.41 0.00 0.00 173.24 172.83 3czr s ILE 165 N 1.27 4.13 -0.18 1.44 1.01 0.29 -0.17 121.20 128.98 3czr s ILE 165 Ca -0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 3czr s ILE 165 Cb -0.04 -2.82 0.01 0.00 0.01 0.00 0.00 42.46 39.61 3czr s ILE 165 CO -0.15 0.49 -0.14 -0.69 0.00 0.00 0.00 174.94 174.45 3czr s VAL 166 N 0.35 2.61 -0.21 2.92 1.01 0.34 -0.45 120.40 126.97 3czr s VAL 166 Ca -0.02 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 3czr s VAL 166 Cb -0.14 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 3czr s VAL 166 CO 0.02 0.50 -0.04 -0.69 0.00 0.00 0.00 175.10 174.89 3czr s VAL 167 N 1.21 3.52 -0.23 2.92 1.01 0.46 0.29 120.40 129.57 3czr s VAL 167 Ca 0.02 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 3czr s VAL 167 Cb -0.14 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3czr s VAL 167 CO -0.06 0.43 0.56 -0.69 0.00 0.00 0.00 175.10 175.34 3czr s VAL 168 N 1.23 5.05 0.00 2.92 1.01 -0.25 -0.59 120.40 129.77 3czr s VAL 168 Ca 0.03 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.02 3czr s VAL 168 Cb -0.14 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3czr s VAL 168 CO -0.01 0.10 0.00 -0.24 0.00 0.00 0.00 175.10 174.95 3czr n SER 169 N 5.33 1.09 -3.63 3.32 2.88 0.26 -4.86 113.62 118.00 3czr n SER 169 Ca -0.03 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.40 3czr n SER 169 Cb 0.50 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.91 3czr n SER 169 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3czr s SER 170 N 1.00 -0.25 0.30 -3.46 0.01 -1.24 -2.74 113.70 107.32 3czr s SER 170 Ca 0.00 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.00 3czr s SER 170 Cb 0.00 0.47 0.57 0.00 0.21 0.00 0.00 66.02 67.27 3czr s SER 170 CO 0.00 -0.84 1.87 -0.07 0.41 0.00 0.00 173.24 174.61 3czr h LEU 171 N 2.42 0.89 0.00 2.44 3.38 -1.59 0.73 115.31 123.58 3czr h LEU 171 Ca -0.34 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3czr h LEU 171 Cb 1.25 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3czr h LEU 171 CO 0.46 0.52 0.00 0.00 0.09 0.00 0.00 178.44 179.51 3czr n ALA 172 N -2.38 2.03 -0.11 1.53 0.00 -1.26 -0.77 120.51 119.55 3czr n ALA 172 Ca 0.17 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.63 3czr n ALA 172 Cb 0.30 -1.24 0.28 0.00 0.00 0.00 0.00 19.45 18.80 3czr n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3czr n GLY 173 N -0.08 2.21 0.00 0.00 0.00 0.25 -4.47 105.19 103.10 3czr n GLY 173 Ca 0.11 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.36 3czr n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3czr n LYS 174 N 1.58 5.05 -4.13 1.61 4.76 -0.53 -4.26 118.16 122.23 3czr n LYS 174 Ca 0.22 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.56 3czr n LYS 174 Cb 0.62 -0.49 -0.09 0.00 -1.84 0.00 0.00 35.03 33.22 3czr n LYS 174 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3czr s VAL 175 N -0.14 0.06 -0.00 -0.18 -7.23 0.05 -5.12 120.40 107.84 3czr s VAL 175 Ca 0.00 -1.85 -0.15 0.00 -1.81 0.00 0.00 61.98 58.17 3czr s VAL 175 Cb 0.00 -2.18 -0.06 0.00 0.56 0.00 0.00 36.38 34.71 3czr s VAL 175 CO 0.00 -0.27 0.41 0.00 -0.31 0.00 0.00 175.10 174.93 3czr s ALA 176 N -4.07 3.69 0.06 1.32 0.00 -1.26 -4.12 121.76 117.38 3czr s ALA 176 Ca 0.28 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.04 3czr s ALA 176 Cb 0.06 -2.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 3czr s ALA 176 CO 0.05 0.47 -0.07 0.71 0.00 0.00 0.00 175.76 176.93 3czr s TYR 177 N -1.04 0.72 0.76 0.00 1.51 -1.26 -5.06 117.35 112.97 3czr s TYR 177 Ca 0.24 -0.73 -0.12 0.00 -1.01 0.00 0.00 57.07 55.45 3czr s TYR 177 Cb -0.17 -0.43 0.05 0.00 -0.11 0.00 0.00 41.96 41.30 3czr s TYR 177 CO 0.13 -0.15 1.12 -1.25 -1.11 0.00 0.00 175.55 174.30 3czr s PRO 178 N -2.73 2.42 0.00 -1.71 0.05 -1.26 -4.18 135.00 127.60 3czr s PRO 178 Ca 0.00 0.39 0.00 0.00 0.05 0.00 0.00 61.00 61.45 3czr s PRO 178 Cb -0.02 -1.98 0.00 0.00 0.05 0.00 0.00 34.50 32.55 3czr s PRO 178 CO -0.03 -1.33 0.00 -1.33 0.05 0.00 0.00 177.00 174.36 3czr n MET 179 N -3.19 0.00 -2.57 4.56 2.81 -1.26 -4.82 117.12 112.65 3czr n MET 179 Ca 0.07 0.00 -0.08 0.00 -1.81 0.00 0.00 57.70 55.88 3czr n MET 179 Cb 0.58 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.63 3czr n MET 179 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3czr n VAL 180 N -2.00 1.68 0.14 2.03 0.24 -1.26 -2.44 118.33 116.72 3czr n VAL 180 Ca 0.00 -3.37 -0.13 0.00 -2.04 0.00 0.00 64.34 58.79 3czr n VAL 180 Cb 0.00 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 32.77 3czr n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3czr h ALA 181 N 2.49 -0.34 -0.33 2.33 0.00 -1.87 0.32 119.26 121.86 3czr h ALA 181 Ca 0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 3czr h ALA 181 Cb 1.34 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3czr h ALA 181 CO 0.39 -0.71 -0.40 0.00 0.00 0.00 0.00 179.25 178.53 3czr h ALA 182 N 0.42 0.49 -0.44 0.00 0.00 -1.94 -1.16 119.26 116.63 3czr h ALA 182 Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.46 3czr h ALA 182 Cb 0.32 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3czr h ALA 182 CO -0.01 0.61 0.26 -0.92 0.00 0.00 0.00 179.25 179.18 3czr h TYR 183 N 0.64 0.48 -0.17 0.00 3.20 -1.89 -2.26 116.97 116.98 3czr h TYR 183 Ca 0.04 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3czr h TYR 183 Cb 1.00 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 3czr h TYR 183 CO 0.07 0.27 0.06 1.03 -1.64 0.00 0.00 178.16 177.95 3czr h SER 184 N 0.52 0.25 -0.56 -2.11 0.87 -0.04 -1.87 113.55 110.61 3czr h SER 184 Ca 0.18 -0.19 0.11 0.00 -1.23 0.00 0.00 61.79 60.65 3czr h SER 184 Cb 0.02 -0.07 -0.11 0.00 -0.44 0.00 0.00 62.40 61.81 3czr h SER 184 CO -0.09 0.37 -0.26 0.00 -0.53 0.00 0.00 176.83 176.32 3czr h ALA 185 N 0.89 0.10 -0.28 6.23 0.00 -1.05 0.61 119.26 125.75 3czr h ALA 185 Ca 0.06 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 3czr h ALA 185 Cb 0.21 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3czr h ALA 185 CO -0.00 -0.59 -0.09 0.66 0.00 0.00 0.00 179.25 179.23 3czr h SER 186 N -0.12 0.43 0.26 0.00 4.64 -1.20 -0.33 113.55 117.23 3czr h SER 186 Ca 0.25 -0.10 -0.27 0.00 -0.47 0.00 0.00 61.79 61.20 3czr h SER 186 Cb 0.51 -0.11 0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3czr h SER 186 CO -0.63 0.56 -1.13 0.11 -0.87 0.00 0.00 176.83 174.87 3czr h LYS 187 N 0.43 0.51 -0.71 4.77 1.79 -0.24 -2.30 116.57 120.81 3czr h LYS 187 Ca 0.09 -0.64 0.06 0.00 -2.18 0.00 0.00 60.65 57.97 3czr h LYS 187 Cb 0.42 0.20 -0.06 0.00 -1.58 0.00 0.00 32.23 31.22 3czr h LYS 187 CO 0.02 1.26 0.41 0.74 -1.08 0.00 0.00 179.45 180.80 3czr h PHE 188 N 0.24 0.75 -0.40 -1.35 0.04 0.35 -3.03 116.94 113.55 3czr h PHE 188 Ca -0.14 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.70 3czr h PHE 188 Cb 1.79 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 39.67 3czr h PHE 188 CO 0.09 0.37 0.18 0.00 -0.60 0.00 0.00 178.31 178.34 3czr h ALA 189 N 1.36 0.49 -0.84 2.45 0.00 -0.92 -0.90 119.26 120.89 3czr h ALA 189 Ca 0.32 0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.39 3czr h ALA 189 Cb 0.18 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 3czr h ALA 189 CO -0.18 -0.20 0.55 -0.07 0.00 0.00 0.00 179.25 179.35 3czr h LEU 190 N 0.36 0.59 -0.05 0.00 3.38 -1.30 -0.19 115.31 118.10 3czr h LEU 190 Ca 0.18 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 3czr h LEU 190 Cb 0.12 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3czr h LEU 190 CO -0.15 0.31 -0.24 -0.78 0.09 0.00 0.00 178.44 177.67 3czr h ASP 191 N 0.63 0.30 -0.87 -0.43 3.58 -1.09 -1.37 116.42 117.17 3czr h ASP 191 Ca 0.41 -0.66 0.00 0.00 0.42 0.00 0.00 57.03 57.21 3czr h ASP 191 Cb 0.70 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 3czr h ASP 191 CO -0.17 0.91 0.56 1.23 -2.88 0.00 0.00 179.24 178.89 3czr h GLY 192 N -0.29 1.24 0.39 -0.78 0.00 -0.90 -0.02 103.07 102.72 3czr h GLY 192 Ca -0.02 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 3czr h GLY 192 CO 0.05 0.47 -0.19 -2.75 0.00 0.00 0.00 176.54 174.12 3czr h PHE 193 N 1.19 -0.49 0.00 5.60 3.04 -1.06 -2.97 116.94 122.25 3czr h PHE 193 Ca 0.32 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.21 3czr h PHE 193 Cb -0.11 0.16 -0.01 0.00 2.56 0.00 0.00 35.95 38.56 3czr h PHE 193 CO -0.01 -0.30 -0.22 0.74 -2.02 0.00 0.00 178.31 176.51 3czr h PHE 194 N -1.14 0.00 -0.06 0.41 -1.00 -1.30 -0.69 116.94 113.16 3czr h PHE 194 Ca -0.05 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.53 3czr h PHE 194 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.96 3czr h PHE 194 CO 0.00 0.22 -0.79 0.77 -1.61 0.00 0.00 178.31 176.89 3czr h SER 195 N 0.00 0.54 -0.17 2.17 0.02 -1.11 -1.74 113.55 113.26 3czr h SER 195 Ca -0.00 -0.38 -0.07 0.00 -0.84 0.00 0.00 61.79 60.50 3czr h SER 195 Cb 0.71 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 3czr h SER 195 CO 0.03 1.14 -0.16 -1.28 -1.14 0.00 0.00 176.83 175.42 3czr h SER 196 N 0.29 0.43 0.78 3.07 0.87 -1.26 -3.15 113.55 114.59 3czr h SER 196 Ca -0.05 -0.47 -0.03 0.00 -1.23 0.00 0.00 61.79 60.01 3czr h SER 196 Cb 1.39 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.23 3czr h SER 196 CO 0.14 0.82 -0.15 0.16 -0.53 0.00 0.00 176.83 177.27 3czr h ILE 197 N 0.06 0.42 -0.66 2.23 3.07 -1.16 -1.50 117.51 119.97 3czr h ILE 197 Ca 0.03 -0.82 -0.01 0.00 1.55 0.00 0.00 64.86 65.60 3czr h ILE 197 Cb 0.69 1.59 -0.03 0.00 -0.27 0.00 0.00 36.82 38.80 3czr h ILE 197 CO 0.04 0.14 0.36 -0.09 -1.05 0.00 0.00 178.15 177.55 3czr h ARG 198 N 0.00 0.92 -0.67 0.16 2.43 -1.30 0.17 114.38 116.08 3czr h ARG 198 Ca -0.00 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 3czr h ARG 198 Cb 0.58 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 3czr h ARG 198 CO 0.02 0.70 0.14 0.87 -1.51 0.00 0.00 179.97 180.18 3czr h LYS 199 N 0.90 1.09 -0.57 0.20 1.57 -1.40 -2.47 116.57 115.89 3czr h LYS 199 Ca 0.23 -0.27 0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3czr h LYS 199 Cb 0.04 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 3czr h LYS 199 CO -0.04 0.97 0.35 0.93 -0.57 0.00 0.00 179.45 181.09 3czr h GLU 200 N 1.03 0.67 0.00 3.15 5.08 -0.91 -2.51 114.58 121.08 3czr h GLU 200 Ca 0.21 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 3czr h GLU 200 Cb 0.39 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3czr h GLU 200 CO 0.01 0.44 -0.10 1.88 -1.00 0.00 0.00 179.01 180.24 3czr h TYR 201 N 0.69 0.00 0.00 4.33 -1.99 -0.44 -0.61 116.97 118.94 3czr h TYR 201 Ca 0.23 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.85 3czr h TYR 201 Cb 0.02 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 3czr h TYR 201 CO -0.06 0.10 -0.94 1.03 -0.00 0.00 0.00 178.16 178.29 3czr h SER 202 N 0.00 0.00 0.14 3.88 0.87 -1.10 0.26 113.55 117.60 3czr h SER 202 Ca -0.00 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.28 3czr h SER 202 Cb 0.48 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.44 3czr h SER 202 CO 0.01 0.43 -1.35 -0.37 -0.53 0.00 0.00 176.83 175.02 3czr h VAL 203 N 0.00 1.13 0.00 2.23 -1.51 -1.00 -3.31 116.25 113.80 3czr h VAL 203 Ca -0.07 -2.47 0.00 0.00 -1.23 0.00 0.00 66.70 62.93 3czr h VAL 203 Cb 1.40 2.84 0.00 0.00 -2.13 0.00 0.00 31.29 33.40 3czr h VAL 203 CO 0.04 0.74 0.00 -1.20 -1.23 0.00 0.00 177.57 175.92 3czr n SER 204 N -3.90 0.00 -3.67 4.19 7.64 -0.29 -4.89 113.62 112.70 3czr n SER 204 Ca -0.22 0.49 -0.23 0.00 1.01 0.00 0.00 58.87 59.92 3czr n SER 204 Cb 0.93 -0.49 0.05 0.00 -1.01 0.00 0.00 64.21 63.69 3czr n SER 204 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3czr n ARG 205 N -1.49 -5.91 -2.84 1.43 1.74 -0.37 -4.97 116.66 104.26 3czr n ARG 205 Ca 0.03 0.70 -0.42 0.00 -0.77 0.00 0.00 57.85 57.39 3czr n ARG 205 Cb 0.13 -5.51 -0.04 0.00 -1.02 0.00 0.00 32.46 26.02 3czr n ARG 205 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3czr s VAL 206 N -3.47 4.78 -0.99 1.55 1.01 0.79 -4.97 120.40 119.09 3czr s VAL 206 Ca 0.23 1.63 -0.04 0.00 0.00 0.00 0.00 61.98 63.80 3czr s VAL 206 Cb -0.11 -4.18 0.15 0.00 0.00 0.00 0.00 36.38 32.24 3czr s VAL 206 CO 0.78 -0.14 2.40 0.59 0.00 0.00 0.00 175.10 178.73 3czr n ASN 207 N 6.15 7.46 -4.27 3.32 3.02 -1.26 -4.63 115.26 125.04 3czr n ASN 207 Ca 0.07 -3.29 -0.34 0.00 -0.03 0.00 0.00 54.58 50.99 3czr n ASN 207 Cb 0.47 -1.28 -0.15 0.00 -0.61 0.00 0.00 39.78 38.22 3czr n ASN 207 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3czr s VAL 208 N -2.21 2.94 0.43 2.41 1.01 -1.26 -4.07 120.40 119.65 3czr s VAL 208 Ca 0.53 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.67 3czr s VAL 208 Cb 0.26 -2.29 -0.10 0.00 0.00 0.00 0.00 36.38 34.25 3czr s VAL 208 CO -0.16 0.48 0.92 -0.94 0.00 0.00 0.00 175.10 175.39 3czr s SER 209 N 1.20 6.85 -0.17 3.32 1.04 -0.90 -4.93 113.70 120.11 3czr s SER 209 Ca 0.02 1.59 0.00 0.00 0.48 0.00 0.00 55.95 58.04 3czr s SER 209 Cb -0.14 -2.50 0.03 0.00 0.10 0.00 0.00 66.02 63.50 3czr s SER 209 CO -0.04 -0.38 -0.12 -0.63 0.98 0.00 0.00 173.24 173.05 3czr s ILE 210 N -2.23 1.55 -0.24 -1.02 1.01 -1.26 -0.55 121.20 118.46 3czr s ILE 210 Ca 0.60 -0.75 -0.04 0.00 0.00 0.00 0.00 60.65 60.46 3czr s ILE 210 Cb -0.09 -1.53 -0.00 0.00 0.01 0.00 0.00 42.46 40.84 3czr s ILE 210 CO 0.17 0.34 -0.01 -0.89 0.00 0.00 0.00 174.94 174.55 3czr s THR 211 N 1.47 3.50 -0.20 2.92 2.01 0.40 -4.43 115.64 121.31 3czr s THR 211 Ca 0.03 -0.55 -0.13 0.00 0.31 0.00 0.00 61.69 61.34 3czr s THR 211 Cb -0.14 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 3czr s THR 211 CO -0.10 0.33 0.29 -0.22 -0.69 0.00 0.00 174.62 174.24 3czr s LEU 212 N 1.48 4.17 -0.24 4.42 2.96 0.17 -0.41 118.68 131.23 3czr s LEU 212 Ca 0.05 0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 54.25 3czr s LEU 212 Cb -0.15 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 3czr s LEU 212 CO -0.02 0.02 0.09 0.00 -1.32 0.00 0.00 176.35 175.12 3czr s VAL 214 N 1.34 4.58 -0.04 0.00 1.01 0.85 0.91 120.40 129.05 3czr s VAL 214 Ca 0.05 -1.55 -0.03 0.00 0.00 0.00 0.00 61.98 60.45 3czr s VAL 214 Cb -0.15 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3czr s VAL 214 CO 0.04 -0.72 0.12 -0.76 0.00 0.00 0.00 175.10 173.78 3czr s LEU 215 N 1.47 4.15 0.00 3.92 1.43 -1.11 -1.80 118.68 126.73 3czr s LEU 215 Ca 0.04 0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 53.44 3czr s LEU 215 Cb -0.26 -2.28 0.00 0.00 0.03 0.00 0.00 46.19 43.68 3czr s LEU 215 CO 0.02 0.32 0.02 0.61 0.23 0.00 0.00 176.35 177.54 3czr n GLY 216 N 1.41 -0.12 3.67 -3.19 0.00 0.74 -1.55 105.19 106.16 3czr n GLY 216 Ca -0.15 -1.82 -0.51 0.00 0.00 0.00 0.00 46.02 43.54 3czr n GLY 216 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3czr n LEU 217 N 0.00 2.70 -4.35 0.99 7.94 -1.26 -4.91 117.00 118.12 3czr n LEU 217 Ca 0.00 1.06 -0.28 0.00 -1.11 0.00 0.00 56.01 55.68 3czr n LEU 217 Cb 0.01 -1.29 -0.13 0.00 0.53 0.00 0.00 43.42 42.54 3czr n LEU 217 CO 0.01 -0.43 -0.56 -0.63 -1.11 0.00 0.00 177.39 174.67 3czr s ILE 218 N 2.36 2.09 -0.02 1.96 -1.09 -1.26 -0.88 121.20 124.35 3czr s ILE 218 Ca 0.89 -1.59 0.00 0.00 -2.23 0.00 0.00 60.65 57.72 3czr s ILE 218 Cb -0.84 -1.84 0.02 0.00 -1.58 0.00 0.00 42.46 38.22 3czr s ILE 218 CO 0.50 0.14 1.55 -0.90 -1.23 0.00 0.00 174.94 175.00 3czr n ASP 219 N 1.22 4.31 -4.74 3.58 3.85 -0.06 -4.54 116.55 120.17 3czr n ASP 219 Ca -0.18 -2.26 -0.32 0.00 -0.71 0.00 0.00 54.79 51.32 3czr n ASP 219 Cb 0.53 -0.84 0.11 0.00 -1.35 0.00 0.00 41.12 39.57 3czr n ASP 219 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 3czr s THR 220 N -0.12 2.83 0.13 2.12 -4.23 -1.26 -4.74 115.64 110.36 3czr s THR 220 Ca 0.02 0.30 -0.15 0.00 -1.18 0.00 0.00 61.69 60.68 3czr s THR 220 Cb 0.01 -2.67 -0.00 0.00 1.34 0.00 0.00 72.50 71.18 3czr s THR 220 CO 0.00 -0.32 1.64 -0.08 -0.54 0.00 0.00 174.62 175.33 3czr h GLU 221 N -1.07 0.65 -0.50 3.99 4.81 -1.97 0.25 114.58 120.74 3czr h GLU 221 Ca -0.44 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 58.65 3czr h GLU 221 Cb 1.25 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3czr h GLU 221 CO 0.49 0.66 0.31 1.15 -0.73 0.00 0.00 179.01 180.88 3czr h THR 222 N 0.53 1.08 -0.29 0.32 2.02 -1.96 -0.49 112.91 114.12 3czr h THR 222 Ca 0.13 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 3czr h THR 222 Cb 0.28 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3czr h THR 222 CO -0.00 0.11 -0.23 0.00 0.37 0.00 0.00 175.52 175.77 3czr h ALA 223 N 1.20 0.42 -0.99 6.16 0.00 -1.74 -0.79 119.26 123.54 3czr h ALA 223 Ca 0.19 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.78 3czr h ALA 223 Cb -0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.61 3czr h ALA 223 CO -0.07 0.39 0.64 0.52 0.00 0.00 0.00 179.25 180.73 3czr h MET 224 N 0.42 1.15 -0.54 0.00 2.07 -0.35 -1.92 114.93 115.76 3czr h MET 224 Ca 0.05 -0.07 -0.10 0.00 -2.07 0.00 0.00 59.70 57.51 3czr h MET 224 Cb 0.78 -0.26 -0.02 0.00 -1.87 0.00 0.00 31.60 30.23 3czr h MET 224 CO 0.06 0.76 -0.07 0.87 1.07 0.00 0.00 176.91 179.60 3czr h LYS 225 N 1.19 0.98 0.00 1.72 6.56 -0.79 0.32 116.57 126.55 3czr h LYS 225 Ca 0.41 -0.33 -0.07 0.00 -1.06 0.00 0.00 60.65 59.60 3czr h LYS 225 Cb 0.11 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 31.68 3czr h LYS 225 CO -0.16 1.00 -0.32 0.00 -2.06 0.00 0.00 179.45 177.91 3czr h ALA 226 N 1.03 1.02 0.00 3.86 0.00 -0.65 -3.17 119.26 121.36 3czr h ALA 226 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3czr h ALA 226 Cb 0.61 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3czr h ALA 226 CO 0.04 0.40 -1.00 1.33 0.00 0.00 0.00 179.25 180.02 3czr n VAL 227 N -3.51 0.00 -0.24 0.00 0.24 -0.77 -4.62 118.33 109.42 3czr n VAL 227 Ca -0.00 -0.25 0.19 0.00 -2.04 0.00 0.00 64.34 62.24 3czr n VAL 227 Cb 0.47 0.65 0.35 0.00 -1.47 0.00 0.00 33.84 33.85 3czr n VAL 227 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3czr n SER 228 N -1.57 0.13 0.00 -1.34 3.41 0.11 -4.46 113.62 109.91 3czr n SER 228 Ca 0.00 1.23 0.00 0.00 -0.26 0.00 0.00 58.87 59.84 3czr n SER 228 Cb 0.24 -0.54 0.01 0.00 -0.26 0.00 0.00 64.21 63.66 3czr n SER 228 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3czr n GLY 229 N -1.26 -0.12 0.00 5.00 0.00 -1.26 -5.06 105.19 102.48 3czr n GLY 229 Ca 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3czr n GLY 229 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3czr n VAL 231 N -0.53 0.00 -2.69 1.61 0.31 -1.26 -5.09 118.33 110.68 3czr n VAL 231 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 3czr n VAL 231 Cb 0.00 -1.70 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 3czr n VAL 231 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 3czr s HIS 232 N -0.03 3.11 -0.10 3.52 2.46 -1.26 -4.98 115.29 118.01 3czr s HIS 232 Ca 0.00 1.04 0.01 0.00 0.47 0.00 0.00 55.06 56.57 3czr s HIS 232 Cb 0.00 -3.71 0.02 0.00 -0.13 0.00 0.00 32.58 28.76 3czr s HIS 232 CO 0.00 -0.81 -0.10 1.41 -2.47 0.00 0.00 174.74 172.77 3czr s MET 233 N 3.64 1.71 -0.17 2.88 0.00 -1.26 -5.12 119.30 120.98 3czr s MET 233 Ca 0.43 -0.36 -0.28 0.00 0.00 0.00 0.00 55.69 55.48 3czr s MET 233 Cb -0.12 -1.61 -0.00 0.00 0.00 0.00 0.00 34.83 33.10 3czr s MET 233 CO 0.17 -0.16 0.97 -1.14 0.00 0.00 0.00 175.02 174.87 3czr s GLN 234 N 1.30 4.33 0.30 4.11 0.74 -1.26 -5.04 119.66 124.14 3czr s GLN 234 Ca -0.02 1.28 -0.06 0.00 0.05 0.00 0.00 55.36 56.61 3czr s GLN 234 Cb -0.14 -3.59 -0.05 0.00 1.10 0.00 0.00 33.01 30.33 3czr s GLN 234 CO -0.04 -0.44 0.58 0.00 -0.55 0.00 0.00 175.29 174.84 3czr s ALA 235 N 2.50 3.58 0.21 1.58 0.00 -1.26 -4.78 121.76 123.59 3czr s ALA 235 Ca 0.44 -0.49 0.05 0.00 0.00 0.00 0.00 51.96 51.96 3czr s ALA 235 Cb -0.17 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.56 3czr s ALA 235 CO 0.12 0.23 0.27 0.00 0.00 0.00 0.00 175.76 176.38 3czr s ALA 236 N -2.10 3.80 -0.10 0.00 0.00 -0.06 -4.80 121.76 118.50 3czr s ALA 236 Ca 0.45 -1.23 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 3czr s ALA 236 Cb -0.11 -1.59 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 3czr s ALA 236 CO 0.29 0.35 1.49 -2.14 0.00 0.00 0.00 175.76 175.75 3czr s PRO 237 N -3.64 4.20 0.43 0.00 0.02 -1.26 -0.88 135.00 133.87 3czr s PRO 237 Ca 0.33 1.97 0.21 0.00 0.02 0.00 0.00 61.00 63.53 3czr s PRO 237 Cb -0.09 -3.89 1.17 0.00 0.02 0.00 0.00 34.50 31.71 3czr s PRO 237 CO 0.27 -0.79 1.82 1.57 -0.33 0.00 0.00 177.00 179.54 3czr h LYS 238 N 8.96 0.31 -0.20 5.54 2.10 -1.92 -2.31 116.57 129.06 3czr h LYS 238 Ca -0.34 -0.02 -0.04 0.00 -2.00 0.00 0.00 60.65 58.25 3czr h LYS 238 Cb 1.15 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 32.40 3czr h LYS 238 CO 0.96 0.21 -0.03 0.93 -2.00 0.00 0.00 179.45 179.52 3czr h GLU 239 N 0.32 0.37 -0.41 0.07 3.07 -1.96 -1.09 114.58 114.96 3czr h GLU 239 Ca 0.52 -0.13 -0.13 0.00 -0.50 0.00 0.00 59.36 59.12 3czr h GLU 239 Cb 1.46 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.33 3czr h GLU 239 CO -0.19 0.60 -0.25 1.49 -1.40 0.00 0.00 179.01 179.26 3czr h GLU 240 N 0.11 0.89 0.09 2.33 4.81 -1.86 -2.81 114.58 118.13 3czr h GLU 240 Ca 0.05 -0.42 0.01 0.00 -0.13 0.00 0.00 59.36 58.87 3czr h GLU 240 Cb 0.45 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 3czr h GLU 240 CO 0.02 1.07 -0.32 0.00 -0.73 0.00 0.00 179.01 179.04 3czr h ALA 242 N -0.97 1.70 -0.06 0.00 0.00 -1.21 0.14 119.26 118.87 3czr h ALA 242 Ca -0.01 0.27 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 3czr h ALA 242 Cb 0.46 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3czr h ALA 242 CO -0.17 -0.70 -0.71 1.25 0.00 0.00 0.00 179.25 178.92 3czr h LEU 243 N 0.09 0.37 -1.01 0.00 5.85 -1.16 -2.23 115.31 117.22 3czr h LEU 243 Ca 0.71 -0.24 -0.07 0.00 0.84 0.00 0.00 57.88 59.12 3czr h LEU 243 Cb 1.68 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 3czr h LEU 243 CO -0.77 0.96 -0.02 -0.33 -0.34 0.00 0.00 178.44 177.94 3czr h GLU 244 N 0.21 0.69 -0.48 1.25 4.39 0.70 0.59 114.58 121.93 3czr h GLU 244 Ca -0.02 -0.18 -0.08 0.00 0.34 0.00 0.00 59.36 59.42 3czr h GLU 244 Cb 1.27 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 3czr h GLU 244 CO 0.12 0.72 -0.01 0.82 -1.16 0.00 0.00 179.01 179.49 3czr h ILE 245 N 0.64 1.26 -0.32 3.13 2.04 -1.15 -1.81 117.51 121.31 3czr h ILE 245 Ca 0.13 -1.09 -0.16 0.00 1.00 0.00 0.00 64.86 64.74 3czr h ILE 245 Cb 0.43 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 3czr h ILE 245 CO 0.02 0.38 -0.43 0.40 0.00 0.00 0.00 178.15 178.51 3czr h ILE 246 N 0.70 1.28 -0.78 -0.67 2.04 -1.14 -2.65 117.51 116.30 3czr h ILE 246 Ca 0.13 -1.61 -0.03 0.00 1.00 0.00 0.00 64.86 64.35 3czr h ILE 246 Cb 0.53 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 3czr h ILE 246 CO 0.03 0.53 0.36 0.11 0.00 0.00 0.00 178.15 179.17 3czr h LYS 247 N 0.66 1.12 -0.46 2.37 1.57 -0.75 -0.94 116.57 120.14 3czr h LYS 247 Ca 0.04 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 3czr h LYS 247 Cb 1.01 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 3czr h LYS 247 CO 0.10 0.88 -0.02 0.78 -0.57 0.00 0.00 179.45 180.61 3czr h GLY 248 N 1.14 0.89 0.96 3.86 0.00 -1.23 -1.75 103.07 106.95 3czr h GLY 248 Ca 0.27 -0.67 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3czr h GLY 248 CO -0.03 0.62 -0.21 -1.33 0.00 0.00 0.00 176.54 175.59 3czr h GLY 249 N 0.67 -0.62 -0.14 4.60 0.00 -1.18 -1.51 103.07 104.90 3czr h GLY 249 Ca 0.13 0.23 0.22 0.00 0.00 0.00 0.00 47.33 47.91 3czr h GLY 249 CO 0.03 -0.23 0.48 0.00 0.00 0.00 0.00 176.54 176.82 3czr h ALA 250 N -0.10 1.56 -0.09 3.60 0.00 -1.14 -0.39 119.26 122.70 3czr h ALA 250 Ca -0.06 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3czr h ALA 250 Cb 0.48 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3czr h ALA 250 CO 0.10 -0.29 0.00 1.28 0.00 0.00 0.00 179.25 180.34 3czr n LEU 251 N -4.96 1.72 -2.27 0.00 4.77 -0.66 -4.88 117.00 110.71 3czr n LEU 251 Ca 0.23 -0.65 -0.20 0.00 -0.03 0.00 0.00 56.01 55.37 3czr n LEU 251 Cb 0.67 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.69 3czr n LEU 251 CO 0.15 0.32 -0.26 0.54 -1.33 0.00 0.00 177.39 176.82 3czr n ARG 252 N 0.35 -1.59 -1.90 3.23 1.74 -0.16 -2.15 116.66 116.18 3czr n ARG 252 Ca 0.18 0.97 -0.33 0.00 -0.77 0.00 0.00 57.85 57.89 3czr n ARG 252 Cb 0.37 -5.58 0.03 0.00 -1.02 0.00 0.00 32.46 26.26 3czr n ARG 252 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3czr s GLN 253 N -4.99 2.97 0.01 5.56 -0.21 -0.86 -4.10 119.66 118.05 3czr s GLN 253 Ca 0.00 1.43 -0.18 0.00 0.02 0.00 0.00 55.36 56.63 3czr s GLN 253 Cb 0.00 -1.97 -0.29 0.00 1.00 0.00 0.00 33.01 31.75 3czr s GLN 253 CO 0.00 -1.12 1.04 0.93 -2.12 0.00 0.00 175.29 174.02 3czr h GLU 254 N 0.35 0.47 -4.27 2.91 5.08 -1.90 -3.35 114.58 113.87 3czr h GLU 254 Ca -0.48 -0.65 -0.29 0.00 -1.00 0.00 0.00 59.36 56.95 3czr h GLU 254 Cb 1.25 0.22 -0.26 0.00 0.50 0.00 0.00 28.75 30.46 3czr h GLU 254 CO 0.55 1.27 -0.74 -1.21 -1.00 0.00 0.00 179.01 177.88 3czr s GLU 255 N -2.86 0.38 -0.10 2.33 2.02 -1.26 0.43 118.70 119.64 3czr s GLU 255 Ca -0.12 -0.34 0.04 0.00 0.02 0.00 0.00 54.97 54.57 3czr s GLU 255 Cb 0.04 -0.28 -0.00 0.00 0.10 0.00 0.00 34.13 33.98 3czr s GLU 255 CO 0.88 0.07 -0.23 0.08 0.02 0.00 0.00 175.26 176.07 3czr s VAL 256 N -0.53 2.13 -0.09 2.63 1.01 -0.30 -4.93 120.40 120.31 3czr s VAL 256 Ca -0.03 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 60.97 3czr s VAL 256 Cb -0.04 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 3czr s VAL 256 CO -0.00 0.56 -0.14 -0.31 0.00 0.00 0.00 175.10 175.21 3czr s TYR 257 N 0.31 2.75 -0.21 5.22 1.51 -1.26 -0.10 117.35 125.57 3czr s TYR 257 Ca -0.18 -0.43 -0.04 0.00 -1.01 0.00 0.00 57.07 55.41 3czr s TYR 257 Cb -0.18 -1.74 0.11 0.00 -0.11 0.00 0.00 41.96 40.04 3czr s TYR 257 CO 0.08 -0.04 0.33 -0.47 -1.11 0.00 0.00 175.55 174.35 3czr s TYR 258 N -0.14 -0.64 0.16 2.71 6.14 -0.75 -4.98 117.35 119.86 3czr s TYR 258 Ca -0.01 0.82 -0.08 0.00 0.64 0.00 0.00 57.07 58.43 3czr s TYR 258 Cb -0.14 -0.03 -0.01 0.00 0.42 0.00 0.00 41.96 42.20 3czr s TYR 258 CO 0.03 -0.60 0.27 0.34 0.64 0.00 0.00 175.55 176.23 3czr s ASP 259 N 2.49 0.06 0.29 4.32 -1.08 -1.26 -0.18 116.67 121.30 3czr s ASP 259 Ca 0.08 -0.90 0.15 0.00 -0.52 0.00 0.00 52.55 51.36 3czr s ASP 259 Cb -0.14 0.43 0.12 0.00 -1.46 0.00 0.00 42.92 41.86 3czr s ASP 259 CO -0.13 -0.88 1.47 0.77 0.52 0.00 0.00 175.17 176.91 3czr h SER 260 N 2.57 0.00 -3.35 -0.34 4.64 -1.87 -3.45 113.55 111.76 3czr h SER 260 Ca -0.32 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.44 3czr h SER 260 Cb 1.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.26 3czr h SER 260 CO 0.49 0.50 0.02 -0.55 -0.87 0.00 0.00 176.83 176.42 3czr s SER 261 N -6.46 6.93 0.33 4.97 0.15 -1.26 -4.96 113.70 113.40 3czr s SER 261 Ca 0.04 1.11 0.14 0.00 0.70 0.00 0.00 55.95 57.94 3czr s SER 261 Cb 0.08 -2.38 0.57 0.00 -1.71 0.00 0.00 66.02 62.58 3czr s SER 261 CO 0.74 -0.04 1.71 -0.07 1.20 0.00 0.00 173.24 176.78 3czr h LEU 262 N 6.45 0.00 -0.18 3.45 3.38 -1.99 -1.73 115.31 124.68 3czr h LEU 262 Ca -0.42 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 3czr h LEU 262 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3czr h LEU 262 CO 0.74 0.48 -0.07 -0.50 0.09 0.00 0.00 178.44 179.18 3czr h TRP 263 N 0.00 0.42 -0.09 1.13 4.06 -1.99 -3.04 115.95 116.44 3czr h TRP 263 Ca -0.00 -0.10 -0.00 0.00 2.06 0.00 0.00 58.89 60.85 3czr h TRP 263 Cb 0.92 -0.10 -0.00 0.00 -1.00 0.00 0.00 29.16 28.98 3czr h TRP 263 CO 0.00 0.65 0.04 1.15 -3.56 0.00 0.00 178.44 176.72 3czr h THR 264 N 0.06 1.10 -0.82 1.49 2.02 -1.94 -0.56 112.91 114.25 3czr h THR 264 Ca 0.04 -0.27 0.24 0.00 0.77 0.00 0.00 66.41 67.19 3czr h THR 264 Cb 0.53 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3czr h THR 264 CO 0.02 0.08 0.64 0.74 0.37 0.00 0.00 175.52 177.38 3czr h THR 265 N 0.03 0.48 0.07 3.16 2.02 -1.37 -1.30 112.91 116.01 3czr h THR 265 Ca 0.03 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.91 3czr h THR 265 Cb 0.09 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 3czr h THR 265 CO -0.00 0.00 -1.60 0.25 0.37 0.00 0.00 175.52 174.53 3czr h LEU 266 N 0.00 0.24 -0.01 2.58 6.46 -1.30 -3.38 115.31 119.89 3czr h LEU 266 Ca 0.39 -0.75 0.00 0.00 -0.12 0.00 0.00 57.88 57.40 3czr h LEU 266 Cb 1.67 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.52 3czr h LEU 266 CO -0.00 1.67 -0.06 0.18 -0.62 0.00 0.00 178.44 179.61 3czr n LEU 267 N -3.95 0.08 0.01 2.25 4.77 -0.27 -2.63 117.00 117.26 3czr n LEU 267 Ca -0.31 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.17 3czr n LEU 267 Cb 0.87 -0.42 0.33 0.00 -2.33 0.00 0.00 43.42 41.87 3czr n LEU 267 CO 0.32 0.02 0.57 0.00 -1.33 0.00 0.00 177.39 176.97 3czr n ILE 268 N -1.43 0.06 -1.85 -0.08 0.13 -0.54 -4.84 119.36 110.81 3czr n ILE 268 Ca 0.09 -0.04 -0.30 0.00 -1.10 0.00 0.00 62.75 61.39 3czr n ILE 268 Cb 0.32 0.01 0.03 0.00 -0.84 0.00 0.00 39.64 39.16 3czr n ILE 268 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3czr s ARG 269 N -3.02 3.11 -0.54 9.51 3.03 -1.08 -5.02 118.95 124.93 3czr s ARG 269 Ca 0.11 0.60 0.04 0.00 2.03 0.00 0.00 55.73 58.51 3czr s ARG 269 Cb 0.17 -2.04 0.17 0.00 -1.03 0.00 0.00 34.95 32.22 3czr s ARG 269 CO 0.66 -0.88 0.40 1.21 -1.13 0.00 0.00 175.30 175.55 3czr s ASN 270 N -4.25 3.19 0.45 -2.89 3.84 -1.26 -4.98 114.94 109.04 3czr s ASN 270 Ca 0.57 -3.36 0.13 0.00 0.21 0.00 0.00 52.86 50.42 3czr s ASN 270 Cb -0.11 -1.03 1.01 0.00 -0.55 0.00 0.00 41.25 40.56 3czr s ASN 270 CO 0.53 -0.14 2.02 1.55 -2.79 0.00 0.00 177.10 178.26 3czr h PRO 271 N 5.67 0.08 -0.97 0.43 0.13 -1.97 -2.14 132.00 133.23 3czr h PRO 271 Ca 0.18 -0.01 0.08 0.00 -0.87 0.00 0.00 66.00 65.38 3czr h PRO 271 Cb 0.84 -0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.89 3czr h PRO 271 CO 0.54 0.19 0.62 0.77 -0.23 0.00 0.00 178.00 179.89 3czr h SER 272 N 0.08 0.96 -0.22 1.44 0.02 -2.00 -1.94 113.55 111.88 3czr h SER 272 Ca 0.02 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 3czr h SER 272 Cb 0.24 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.60 3czr h SER 272 CO 0.01 0.59 -0.41 -0.09 -1.14 0.00 0.00 176.83 175.79 3czr h ARG 273 N 1.07 0.67 -0.86 3.45 2.43 -1.82 -2.15 114.38 117.16 3czr h ARG 273 Ca 0.44 -0.42 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3czr h ARG 273 Cb 0.28 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 3czr h ARG 273 CO -0.19 1.04 0.56 0.87 -1.51 0.00 0.00 179.97 180.75 3czr h LYS 274 N 0.38 1.08 0.40 0.20 1.57 -1.22 -1.17 116.57 117.82 3czr h LYS 274 Ca 0.01 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3czr h LYS 274 Cb 1.01 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3czr h LYS 274 CO 0.09 0.72 -0.19 0.82 -0.57 0.00 0.00 179.45 180.32 3czr h ILE 275 N 1.12 0.58 -0.45 1.86 2.04 -1.20 -1.49 117.51 119.96 3czr h ILE 275 Ca 0.33 -0.37 0.09 0.00 1.00 0.00 0.00 64.86 65.91 3czr h ILE 275 Cb -0.06 0.76 -0.08 0.00 -0.74 0.00 0.00 36.82 36.70 3czr h ILE 275 CO -0.09 0.07 -0.09 0.25 0.00 0.00 0.00 178.15 178.28 3czr h LEU 276 N -0.76 -0.38 -1.38 1.44 5.85 -1.36 0.73 115.31 119.45 3czr h LEU 276 Ca -0.06 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3czr h LEU 276 Cb 0.52 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3czr h LEU 276 CO 0.09 -0.13 0.12 -0.33 -0.34 0.00 0.00 178.44 177.85 3czr h GLU 277 N 0.02 0.54 -0.15 1.25 5.08 -1.17 -0.76 114.58 119.40 3czr h GLU 277 Ca 0.22 -0.08 -0.21 0.00 -1.00 0.00 0.00 59.36 58.29 3czr h GLU 277 Cb 0.34 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.49 3czr h GLU 277 CO -0.45 0.48 -0.75 0.35 -1.00 0.00 0.00 179.01 177.64 3czr h PHE 278 N 0.54 0.95 -0.54 4.33 3.57 -0.12 -1.30 116.94 124.36 3czr h PHE 278 Ca 0.13 -0.41 -0.11 0.00 3.53 0.00 0.00 57.97 61.11 3czr h PHE 278 Cb 0.16 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 3czr h PHE 278 CO 0.01 1.22 -0.08 -0.07 -2.23 0.00 0.00 178.31 177.16 3czr h LEU 279 N 0.49 0.99 -0.52 0.59 3.38 -0.45 -2.27 115.31 117.52 3czr h LEU 279 Ca -0.04 -0.31 -0.12 0.00 0.09 0.00 0.00 57.88 57.50 3czr h LEU 279 Cb 1.36 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 3czr h LEU 279 CO 0.15 1.08 -0.13 0.22 0.09 0.00 0.00 178.44 179.85 3czr h TYR 280 N 0.90 1.13 0.00 1.13 3.20 -1.08 -3.15 116.97 119.10 3czr h TYR 280 Ca 0.15 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.77 3czr h TYR 280 Cb 0.63 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.62 3czr h TYR 280 CO 0.04 1.06 -0.02 0.66 -1.64 0.00 0.00 178.16 178.27 3czr h SER 281 N 0.88 0.00 -0.91 -2.11 4.64 -1.10 -2.02 113.55 112.93 3czr h SER 281 Ca 0.13 -0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 61.03 3czr h SER 281 Cb 0.70 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.54 3czr h SER 281 CO 0.05 0.00 0.53 0.35 -0.87 0.00 0.00 176.83 176.89 3czr n THR 282 N -3.07 3.11 0.00 2.95 -2.24 -0.87 -4.28 114.28 109.88 3czr n THR 282 Ca 0.04 -1.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.02 3czr n THR 282 Cb 0.53 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 3czr n THR 282 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3czr n SER 283 N -0.80 1.53 -0.04 3.42 2.88 -0.90 -5.02 113.62 114.68 3czr n SER 283 Ca 0.53 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 58.00 3czr n SER 283 Cb 1.58 0.11 -0.02 0.00 -0.75 0.00 0.00 64.21 65.12 3czr n SER 283 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 3czr n TYR 284 N -1.28 0.00 -0.73 0.66 4.02 -0.81 -5.08 117.16 113.94 3czr n TYR 284 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 3czr n TYR 284 Cb 0.16 -0.35 0.00 0.00 -0.02 0.00 0.00 39.34 39.13 3czr n TYR 284 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14