#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3czr s PRO 22 N 0.00 2.53 -0.09 -1.09 0.02 -1.26 -4.86 135.00 130.26 3czr s PRO 22 Ca 0.00 1.16 -0.30 0.00 0.02 0.00 0.00 61.00 61.89 3czr s PRO 22 Cb 0.00 -1.93 -0.02 0.00 0.02 0.00 0.00 34.50 32.57 3czr s PRO 22 CO 0.00 -1.43 1.10 -0.51 -0.33 0.00 0.00 177.00 175.83 3czr s LEU 23 N -5.60 4.26 -1.47 -5.54 1.43 0.83 -4.95 118.68 107.64 3czr s LEU 23 Ca 0.62 1.66 -0.13 0.00 -1.03 0.00 0.00 54.13 55.25 3czr s LEU 23 Cb -0.17 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.53 3czr s LEU 23 CO 0.52 -0.52 2.33 -3.20 0.23 0.00 0.00 176.35 175.71 3czr n ASN 24 N 5.16 4.88 -3.81 2.29 5.15 -1.26 -4.85 115.26 122.82 3czr n ASN 24 Ca 0.10 -2.83 -0.10 0.00 -0.60 0.00 0.00 54.58 51.16 3czr n ASN 24 Cb 0.47 -1.62 -0.05 0.00 -0.53 0.00 0.00 39.78 38.05 3czr n ASN 24 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3czr s GLU 25 N 2.69 1.28 0.60 1.20 2.02 -1.26 -5.15 118.70 120.08 3czr s GLU 25 Ca 0.50 -0.97 -0.15 0.00 0.02 0.00 0.00 54.97 54.38 3czr s GLU 25 Cb 0.14 0.47 -0.03 0.00 0.10 0.00 0.00 34.13 34.81 3czr s GLU 25 CO -0.08 -0.52 1.05 -2.00 0.02 0.00 0.00 175.26 173.73 3czr s GLU 26 N -3.90 3.34 0.28 1.61 2.56 -1.26 -5.03 118.70 116.29 3czr s GLU 26 Ca 0.12 1.11 -0.29 0.00 0.00 0.00 0.00 54.97 55.90 3czr s GLU 26 Cb 0.01 -2.04 -0.10 0.00 2.00 0.00 0.00 34.13 34.00 3czr s GLU 26 CO -0.02 -0.79 1.16 0.12 -0.56 0.00 0.00 175.26 175.17 3czr s PHE 27 N -2.61 3.44 -0.02 5.30 5.36 -1.26 -5.05 117.98 123.15 3czr s PHE 27 Ca 0.62 1.60 -0.00 0.00 -0.96 0.00 0.00 56.93 58.18 3czr s PHE 27 Cb -0.15 -3.39 0.01 0.00 -0.34 0.00 0.00 43.02 39.16 3czr s PHE 27 CO 0.40 -0.93 0.03 -0.98 -1.46 0.00 0.00 175.22 172.28 3czr s ARG 28 N -1.34 0.00 0.35 10.12 1.70 -1.26 -5.06 118.95 123.45 3czr s ARG 28 Ca 0.47 0.11 0.11 0.00 -0.47 0.00 0.00 55.73 55.94 3czr s ARG 28 Cb -0.34 -0.10 0.89 0.00 -0.57 0.00 0.00 34.95 34.83 3czr s ARG 28 CO 0.43 -0.08 1.79 -1.35 -1.08 0.00 0.00 175.30 175.01 3czr h PRO 29 N 6.65 0.59 0.00 3.89 0.11 -1.99 -1.79 132.00 139.47 3czr h PRO 29 Ca -0.34 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3czr h PRO 29 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3czr h PRO 29 CO 0.49 0.39 0.00 -0.85 -0.21 0.00 0.00 178.00 177.82 3czr n GLU 30 N -4.70 0.23 0.22 1.05 0.00 -1.26 -1.77 120.64 114.41 3czr n GLU 30 Ca 0.23 0.13 0.06 0.00 0.00 0.00 0.00 57.16 57.58 3czr n GLU 30 Cb 0.67 -1.50 0.51 0.00 0.00 0.00 0.00 31.44 31.12 3czr n GLU 30 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 3czr h MET 31 N 0.00 0.00 0.00 3.44 2.86 -1.70 -2.75 114.93 116.79 3czr h MET 31 Ca 0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3czr h MET 31 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 3czr h MET 31 CO 0.00 0.20 -1.06 -0.07 1.06 0.00 0.00 176.91 177.04 3czr h LEU 32 N 0.00 0.00 -9.16 1.22 -0.00 -1.58 -3.45 115.31 102.34 3czr h LEU 32 Ca -0.00 0.00 -0.67 0.00 -0.00 0.00 0.00 57.88 57.21 3czr h LEU 32 Cb 0.37 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.05 3czr h LEU 32 CO 0.03 0.17 1.05 1.67 -0.00 0.00 0.00 178.44 181.36 3czr n GLN 33 N -2.77 1.69 0.00 1.13 7.27 -1.04 -0.74 117.38 122.92 3czr n GLN 33 Ca -0.02 0.61 0.00 0.00 0.07 0.00 0.00 57.00 57.66 3czr n GLN 33 Cb 0.63 -2.43 0.00 0.00 2.41 0.00 0.00 30.24 30.86 3czr n GLN 33 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3czr n GLY 34 N 4.51 3.28 3.73 1.69 0.00 -1.18 -4.89 105.19 112.33 3czr n GLY 34 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.56 2.06 -0.70 1.61 -0.14 0.08 -4.42 119.74 117.66 3czr s LYS 35 Ca 0.00 1.57 -0.09 0.00 -1.36 0.00 0.00 55.97 56.09 3czr s LYS 35 Cb 0.00 -1.84 0.18 0.00 -1.68 0.00 0.00 37.83 34.49 3czr s LYS 35 CO 0.00 -1.86 0.59 0.15 -0.76 0.00 0.00 175.35 173.47 3czr s LYS 36 N -4.21 3.06 -0.21 1.68 1.02 -1.26 -0.18 119.74 119.64 3czr s LYS 36 Ca 0.70 -2.39 -0.08 0.00 0.02 0.00 0.00 55.97 54.22 3czr s LYS 36 Cb -0.25 -4.10 -0.04 0.00 -0.52 0.00 0.00 37.83 32.92 3czr s LYS 36 CO 0.48 -1.24 0.08 0.08 -0.92 0.00 0.00 175.35 173.84 3czr s VAL 37 N 0.26 4.81 0.04 3.17 1.01 -0.27 -0.05 120.40 129.36 3czr s VAL 37 Ca 0.16 -0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 3czr s VAL 37 Cb -0.17 -3.20 -0.06 0.00 0.00 0.00 0.00 36.38 32.95 3czr s VAL 37 CO -0.05 0.41 0.57 -0.63 0.00 0.00 0.00 175.10 175.40 3czr s ILE 38 N 0.77 4.81 -0.21 2.22 1.01 0.01 -2.51 121.20 127.30 3czr s ILE 38 Ca 0.04 1.22 0.00 0.00 0.00 0.00 0.00 60.65 61.92 3czr s ILE 38 Cb -0.13 -3.91 0.05 0.00 0.01 0.00 0.00 42.46 38.48 3czr s ILE 38 CO 0.02 0.50 -0.07 -0.69 0.00 0.00 0.00 174.94 174.71 3czr s VAL 39 N -0.75 1.47 0.53 2.92 1.01 -0.96 -0.85 120.40 123.77 3czr s VAL 39 Ca 0.30 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 3czr s VAL 39 Cb -0.19 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.52 3czr s VAL 39 CO 0.18 0.01 0.80 0.42 0.00 0.00 0.00 175.10 176.51 3czr s THR 40 N 1.44 3.66 -1.30 3.92 -4.23 -0.70 -2.71 115.64 115.73 3czr s THR 40 Ca -0.03 -0.28 -0.20 0.00 -1.18 0.00 0.00 61.69 60.00 3czr s THR 40 Cb -0.17 -3.41 0.03 0.00 1.34 0.00 0.00 72.50 70.29 3czr s THR 40 CO -0.07 -0.35 0.37 0.61 -0.54 0.00 0.00 174.62 174.64 3czr n GLY 41 N -2.36 -0.51 0.82 3.99 0.00 -0.95 -3.94 105.19 102.25 3czr n GLY 41 Ca 0.04 0.25 0.08 0.00 0.00 0.00 0.00 46.02 46.39 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 2.32 0.23 4.61 0.00 -0.76 -4.11 120.51 118.08 3czr n ALA 42 Ca -0.19 -1.03 0.09 0.00 0.00 0.00 0.00 53.44 52.31 3czr n ALA 42 Cb 0.59 -0.59 0.56 0.00 0.00 0.00 0.00 19.45 20.01 3czr n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3czr h SER 43 N 2.91 0.00 -2.55 0.00 4.64 -1.91 -3.18 113.55 113.46 3czr h SER 43 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 3czr h SER 43 Cb 0.77 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.85 3czr h SER 43 CO 0.00 0.22 0.04 2.29 -0.87 0.00 0.00 176.83 178.51 3czr n LYS 44 N -3.78 0.55 0.00 4.77 2.85 -1.26 -4.78 118.16 116.50 3czr n LYS 44 Ca -0.02 -1.46 0.00 0.00 -1.05 0.00 0.00 58.31 55.78 3czr n LYS 44 Cb 0.32 1.61 0.00 0.00 -0.65 0.00 0.00 35.03 36.30 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 -0.33 2.16 0.32 2.58 0.00 -1.26 -2.03 105.19 106.64 3czr n GLY 45 Ca -0.03 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.53 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 1.25 -0.38 -0.61 2.04 -1.90 -2.72 117.51 115.19 3czr h ILE 46 Ca 0.00 -0.87 0.08 0.00 1.00 0.00 0.00 64.86 65.07 3czr h ILE 46 Cb 0.00 0.53 -0.07 0.00 -0.74 0.00 0.00 36.82 36.54 3czr h ILE 46 CO 0.00 0.34 -0.09 1.23 0.00 0.00 0.00 178.15 179.63 3czr h GLY 47 N 1.06 0.29 0.96 5.37 0.00 -1.69 -2.30 103.07 106.76 3czr h GLY 47 Ca 0.22 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.68 3czr h GLY 47 CO -0.01 -0.14 0.38 -0.09 0.00 0.00 0.00 176.54 176.68 3czr h ARG 48 N 0.01 0.75 0.00 4.80 2.43 -1.10 -2.08 114.38 119.19 3czr h ARG 48 Ca 0.19 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3czr h ARG 48 Cb 0.28 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3czr h ARG 48 CO -0.39 0.50 0.00 0.93 -1.51 0.00 0.00 179.97 179.50 3czr h GLU 49 N 0.77 0.00 0.09 0.20 4.39 -1.24 -1.60 114.58 117.20 3czr h GLU 49 Ca 0.22 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.79 3czr h GLU 49 Cb -0.05 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.61 3czr h GLU 49 CO -0.06 0.00 -0.62 0.52 -1.16 0.00 0.00 179.01 177.68 3czr h MET 50 N 0.00 0.19 -0.49 2.33 2.86 -0.86 -1.25 114.93 117.71 3czr h MET 50 Ca 0.00 -0.33 0.10 0.00 -2.06 0.00 0.00 59.70 57.41 3czr h MET 50 Cb 0.42 0.12 -0.10 0.00 0.06 0.00 0.00 31.60 32.10 3czr h MET 50 CO 0.00 1.16 -0.24 0.00 1.06 0.00 0.00 176.91 178.89 3czr h ALA 51 N 0.02 0.09 -0.61 6.32 0.00 -1.09 -0.11 119.26 123.88 3czr h ALA 51 Ca -0.12 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3czr h ALA 51 Cb 1.44 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 3czr h ALA 51 CO 0.08 -0.58 0.39 1.88 0.00 0.00 0.00 179.25 181.02 3czr h TYR 52 N -0.13 0.78 -0.41 0.00 0.05 -1.30 -1.37 116.97 114.58 3czr h TYR 52 Ca 0.22 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.96 3czr h TYR 52 Cb 0.48 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 3czr h TYR 52 CO -0.51 0.51 0.05 0.45 -1.05 0.00 0.00 178.16 177.61 3czr h HIS 53 N 0.83 0.74 0.00 4.88 3.86 -0.76 -2.09 115.15 122.61 3czr h HIS 53 Ca 0.22 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3czr h HIS 53 Cb -0.07 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.19 3czr h HIS 53 CO -0.03 0.73 -0.17 -0.07 0.86 0.00 0.00 177.93 179.26 3czr h LEU 54 N 0.54 0.00 0.12 2.43 3.38 -0.90 -2.93 115.31 117.95 3czr h LEU 54 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3czr h LEU 54 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3czr h LEU 54 CO 0.01 0.17 -0.06 0.00 0.09 0.00 0.00 178.44 178.65 3czr h ALA 55 N 1.83 -0.16 0.00 1.53 0.00 -0.72 -1.76 119.26 119.98 3czr h ALA 55 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3czr h ALA 55 Cb 0.30 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3czr h ALA 55 CO 0.02 -0.37 0.03 1.63 0.00 0.00 0.00 179.25 180.56 3czr n LYS 56 N -4.97 0.00 0.01 0.00 5.02 -0.83 -1.52 118.16 115.87 3czr n LYS 56 Ca -0.09 0.40 0.04 0.00 -2.02 0.00 0.00 58.31 56.64 3czr n LYS 56 Cb 0.24 -1.53 -0.11 0.00 -0.02 0.00 0.00 35.03 33.61 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 -1.39 0.64 0.00 1.97 2.81 -0.90 -4.94 117.12 115.31 3czr n MET 57 Ca 0.00 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 3czr n MET 57 Cb 0.03 -1.67 0.00 0.00 -0.71 0.00 0.00 33.22 30.87 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 1.36 0.72 3.70 3.03 0.00 -0.58 -3.41 105.19 110.02 3czr n GLY 58 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 1.67 -0.35 4.61 0.00 -0.71 -2.73 121.76 122.25 3czr s ALA 59 Ca 0.00 0.57 -0.22 0.00 0.00 0.00 0.00 51.96 52.31 3czr s ALA 59 Cb 0.00 -3.42 0.01 0.00 0.00 0.00 0.00 23.12 19.70 3czr s ALA 59 CO 0.00 -2.51 0.72 -1.01 0.00 0.00 0.00 175.76 172.96 3czr s HIS 60 N -2.63 3.14 0.18 0.00 3.76 0.75 -2.06 115.29 118.43 3czr s HIS 60 Ca 0.67 0.49 0.06 0.00 -0.15 0.00 0.00 55.06 56.12 3czr s HIS 60 Cb -0.22 -3.26 -0.04 0.00 1.11 0.00 0.00 32.58 30.16 3czr s HIS 60 CO 0.56 -0.67 0.12 0.14 -0.85 0.00 0.00 174.74 174.04 3czr s VAL 61 N 2.91 4.32 -0.14 -0.90 -7.23 -1.01 -1.12 120.40 117.23 3czr s VAL 61 Ca 0.28 -1.21 -0.04 0.00 -1.81 0.00 0.00 61.98 59.20 3czr s VAL 61 Cb -0.14 -3.22 0.06 0.00 0.56 0.00 0.00 36.38 33.64 3czr s VAL 61 CO 0.15 -0.15 0.17 -0.69 -0.31 0.00 0.00 175.10 174.27 3czr s VAL 62 N -1.82 -0.25 0.39 1.32 1.01 -1.05 -2.91 120.40 117.10 3czr s VAL 62 Ca 0.31 0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.44 3czr s VAL 62 Cb -0.09 -0.47 -0.00 0.00 0.00 0.00 0.00 36.38 35.81 3czr s VAL 62 CO 0.23 -0.05 0.56 0.68 0.00 0.00 0.00 175.10 176.52 3czr s VAL 63 N 2.27 3.91 0.14 2.92 -7.23 -0.25 -2.27 120.40 119.89 3czr s VAL 63 Ca 0.04 -0.82 -0.19 0.00 -1.81 0.00 0.00 61.98 59.20 3czr s VAL 63 Cb -0.14 -3.38 0.05 0.00 0.56 0.00 0.00 36.38 33.46 3czr s VAL 63 CO -0.08 -0.19 0.49 0.28 -0.31 0.00 0.00 175.10 175.28 3czr s THR 64 N -2.34 0.04 -3.04 5.32 -1.32 -1.10 -2.17 115.64 111.03 3czr s THR 64 Ca 0.47 -0.36 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 3czr s THR 64 Cb -0.10 -1.13 0.00 0.00 -1.51 0.00 0.00 72.50 69.76 3czr s THR 64 CO 0.34 -0.18 0.00 0.00 -2.21 0.00 0.00 174.62 172.57 3czr n ALA 65 N -0.30 0.00 0.31 11.08 0.00 -1.26 -1.84 120.51 128.51 3czr n ALA 65 Ca -0.16 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.39 3czr n ALA 65 Cb 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.01 3czr n ALA 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3czr n ARG 66 N 0.00 0.45 -3.04 0.00 1.74 -1.19 0.72 116.66 115.34 3czr n ARG 66 Ca 0.00 -0.07 -0.45 0.00 -0.77 0.00 0.00 57.85 56.57 3czr n ARG 66 Cb 0.00 -1.59 -0.02 0.00 -1.02 0.00 0.00 32.46 29.83 3czr n ARG 66 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3czr s SER 67 N -4.27 6.67 0.15 0.55 0.01 -1.26 -4.59 113.70 110.97 3czr s SER 67 Ca -0.01 -2.23 -0.29 0.00 1.31 0.00 0.00 55.95 54.73 3czr s SER 67 Cb 0.14 -2.35 -0.03 0.00 0.21 0.00 0.00 66.02 63.99 3czr s SER 67 CO 0.85 -0.93 1.57 0.11 0.41 0.00 0.00 173.24 175.25 3czr h LYS 68 N 8.53 -0.33 -0.50 12.44 1.57 -1.98 0.12 116.57 136.41 3czr h LYS 68 Ca 0.15 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.99 3czr h LYS 68 Cb 1.03 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 3czr h LYS 68 CO 1.01 -0.22 0.25 0.93 -0.57 0.00 0.00 179.45 180.85 3czr h GLU 69 N -0.34 0.47 -0.06 3.15 4.39 -2.00 -1.35 114.58 118.85 3czr h GLU 69 Ca 0.12 -0.03 -0.25 0.00 0.34 0.00 0.00 59.36 59.55 3czr h GLU 69 Cb 0.59 -0.11 0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3czr h GLU 69 CO -0.59 0.31 -0.95 1.15 -1.16 0.00 0.00 179.01 177.77 3czr h THR 70 N 0.48 1.28 -0.06 1.13 2.02 -1.86 -2.69 112.91 113.22 3czr h THR 70 Ca 0.22 -2.15 0.04 0.00 0.77 0.00 0.00 66.41 65.29 3czr h THR 70 Cb 0.14 2.23 -0.06 0.00 -1.74 0.00 0.00 68.15 68.73 3czr h THR 70 CO -0.16 0.67 -0.34 -0.07 0.37 0.00 0.00 175.52 175.99 3czr h LEU 71 N 0.44 -1.03 -0.89 2.58 3.38 -0.59 -1.05 115.31 118.15 3czr h LEU 71 Ca -0.10 0.14 0.21 0.00 0.09 0.00 0.00 57.88 58.22 3czr h LEU 71 Cb 1.59 0.42 -0.16 0.00 0.09 0.00 0.00 40.66 42.60 3czr h LEU 71 CO 0.19 -0.39 -0.06 -0.61 0.09 0.00 0.00 178.44 177.66 3czr h GLN 72 N -0.46 0.04 -0.75 1.13 5.75 -1.23 0.11 115.11 119.70 3czr h GLN 72 Ca 0.07 -0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.53 3czr h GLN 72 Cb 0.57 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 3czr h GLN 72 CO -0.31 0.02 0.31 -0.22 -2.65 0.00 0.00 178.83 175.98 3czr h LYS 73 N 0.04 1.11 0.01 1.69 3.64 -0.89 -1.62 116.57 120.54 3czr h LYS 73 Ca 0.49 -0.19 -0.06 0.00 -1.27 0.00 0.00 60.65 59.62 3czr h LYS 73 Cb 0.88 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.52 3czr h LYS 73 CO -0.85 0.89 -0.25 0.28 -2.27 0.00 0.00 179.45 177.25 3czr h VAL 74 N 1.08 1.57 -0.95 2.00 2.07 -0.31 -2.57 116.25 119.14 3czr h VAL 74 Ca 0.25 -2.02 0.21 0.00 0.82 0.00 0.00 66.70 65.97 3czr h VAL 74 Cb 0.19 2.86 -0.08 0.00 -1.52 0.00 0.00 31.29 32.74 3czr h VAL 74 CO -0.02 0.55 0.62 0.58 0.02 0.00 0.00 177.57 179.32 3czr h VAL 75 N -0.55 0.65 -0.11 2.57 2.07 -0.73 0.76 116.25 120.91 3czr h VAL 75 Ca -0.03 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.14 3czr h VAL 75 Cb 1.04 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3czr h VAL 75 CO 0.05 0.09 -0.72 0.28 0.02 0.00 0.00 177.57 177.29 3czr h SER 76 N 0.47 0.61 1.51 0.57 0.02 -1.22 -2.81 113.55 112.69 3czr h SER 76 Ca 0.52 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 3czr h SER 76 Cb 1.20 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3czr h SER 76 CO -0.23 1.14 0.00 -0.74 -1.14 0.00 0.00 176.83 175.86 3czr h HIS 77 N 0.36 0.00 0.02 3.45 6.17 -0.72 -2.63 115.15 121.79 3czr h HIS 77 Ca -0.03 0.00 -0.22 0.00 0.71 0.00 0.00 60.37 60.83 3czr h HIS 77 Cb 1.30 0.00 -0.00 0.00 2.52 0.00 0.00 27.41 31.23 3czr h HIS 77 CO 0.05 0.00 -0.96 0.00 0.71 0.00 0.00 177.93 177.74 3czr h LEU 79 N 0.18 0.82 -2.58 0.00 3.38 -1.40 -2.58 115.31 113.14 3czr h LEU 79 Ca -0.08 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.36 3czr h LEU 79 Cb 1.60 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 3czr h LEU 79 CO 0.16 1.20 -0.01 -0.33 0.09 0.00 0.00 178.44 179.55 3czr h GLU 80 N 0.47 0.00 0.00 1.13 5.08 -1.49 -3.24 114.58 116.54 3czr h GLU 80 Ca 0.02 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3czr h GLU 80 Cb 1.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 3czr h GLU 80 CO 0.10 0.01 -1.34 1.28 -1.00 0.00 0.00 179.01 178.06 3czr n LEU 81 N -3.53 0.71 0.00 1.33 4.77 -1.01 -4.95 117.00 114.33 3czr n LEU 81 Ca -0.03 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3czr n LEU 81 Cb 0.10 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3czr n LEU 81 CO 0.25 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3czr n GLY 82 N 1.29 -0.59 3.71 -0.72 0.00 -1.16 -4.11 105.19 103.61 3czr n GLY 82 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 3czr n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3czr n ALA 83 N 0.00 1.37 0.14 4.61 0.00 -0.97 -4.22 120.51 121.44 3czr n ALA 83 Ca 0.00 0.18 0.05 0.00 0.00 0.00 0.00 53.44 53.67 3czr n ALA 83 Cb 0.00 -2.30 0.04 0.00 0.00 0.00 0.00 19.45 17.19 3czr n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3czr h ALA 84 N 1.70 0.73 -2.53 0.00 0.00 -1.21 -3.46 119.26 114.48 3czr h ALA 84 Ca -0.49 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 53.95 3czr h ALA 84 Cb 1.30 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 18.91 3czr h ALA 84 CO 0.58 0.49 -0.16 0.45 0.00 0.00 0.00 179.25 180.60 3czr s SER 85 N -6.24 -0.22 -0.24 0.00 0.15 -1.25 -4.95 113.70 100.95 3czr s SER 85 Ca 0.03 -0.07 -0.04 0.00 0.70 0.00 0.00 55.95 56.58 3czr s SER 85 Cb 0.07 0.40 0.13 0.00 -1.71 0.00 0.00 66.02 64.91 3czr s SER 85 CO 0.74 -0.64 0.43 0.00 1.20 0.00 0.00 173.24 174.98 3czr s ALA 86 N -2.47 -1.33 0.05 5.45 0.00 -1.25 -2.39 121.76 119.80 3czr s ALA 86 Ca -0.05 1.26 0.03 0.00 0.00 0.00 0.00 51.96 53.20 3czr s ALA 86 Cb -0.01 -1.67 -0.02 0.00 0.00 0.00 0.00 23.12 21.41 3czr s ALA 86 CO -0.03 -1.14 -0.09 -1.01 0.00 0.00 0.00 175.76 173.49 3czr s HIS 87 N 2.63 0.81 0.18 0.00 3.76 -1.14 -5.00 115.29 116.52 3czr s HIS 87 Ca 0.10 -0.47 0.09 0.00 -0.15 0.00 0.00 55.06 54.63 3czr s HIS 87 Cb -0.14 -0.48 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 3czr s HIS 87 CO -0.16 -0.04 -0.19 1.52 -0.85 0.00 0.00 174.74 175.02 3czr s TYR 88 N -1.30 1.92 -0.40 1.40 -0.85 -1.26 -1.10 117.35 115.76 3czr s TYR 88 Ca -0.07 -0.45 0.04 0.00 -0.52 0.00 0.00 57.07 56.06 3czr s TYR 88 Cb -0.10 -0.94 0.16 0.00 0.38 0.00 0.00 41.96 41.47 3czr s TYR 88 CO 0.01 0.39 0.39 0.42 -1.52 0.00 0.00 175.55 175.24 3czr s ILE 89 N -2.13 -0.13 0.61 -3.49 1.01 -0.92 -4.94 121.20 111.21 3czr s ILE 89 Ca 0.18 -1.68 -0.19 0.00 0.00 0.00 0.00 60.65 58.96 3czr s ILE 89 Cb -0.05 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 3czr s ILE 89 CO 0.08 -0.79 1.24 0.00 0.00 0.00 0.00 174.94 175.47 3czr n ALA 90 N 3.52 1.06 0.00 9.38 0.00 -1.26 -4.42 120.51 128.79 3czr n ALA 90 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3czr n ALA 90 Cb 0.47 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.63 3czr n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3czr n GLY 91 N 0.96 -0.18 3.37 0.00 0.00 0.22 -4.93 105.19 104.63 3czr n GLY 91 Ca 0.14 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.63 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 2.99 -2.00 2.61 -1.32 -1.26 -3.18 115.64 111.48 3czr s THR 92 Ca 0.00 -0.69 0.01 0.00 -1.21 0.00 0.00 61.69 59.80 3czr s THR 92 Cb 0.00 -2.24 0.04 0.00 -1.51 0.00 0.00 72.50 68.79 3czr s THR 92 CO 0.00 0.53 0.79 0.23 -2.21 0.00 0.00 174.62 173.96 3czr n MET 93 N 3.40 0.72 0.19 7.08 0.00 -1.26 -0.82 117.12 126.44 3czr n MET 93 Ca -0.18 0.00 0.14 0.00 0.00 0.00 0.00 57.70 57.66 3czr n MET 93 Cb 0.53 -1.03 0.50 0.00 0.00 0.00 0.00 33.22 33.21 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 -4.26 0.03 5.08 -1.92 -3.41 114.58 110.10 3czr h GLU 94 Ca 0.00 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 57.62 3czr h GLU 94 Cb 0.00 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 28.99 3czr h GLU 94 CO 0.00 0.00 -0.34 0.34 -1.00 0.00 0.00 179.01 178.01 3czr s ASP 95 N -5.09 5.92 0.33 1.42 2.15 0.00 -4.96 116.67 116.45 3czr s ASP 95 Ca 0.05 -1.72 0.02 0.00 0.43 0.00 0.00 52.55 51.32 3czr s ASP 95 Cb 0.09 -2.10 0.58 0.00 -0.30 0.00 0.00 42.92 41.19 3czr s ASP 95 CO 0.52 -0.72 1.96 0.24 -0.17 0.00 0.00 175.17 177.01 3czr h MET 96 N 8.63 0.81 -0.05 4.34 2.86 -1.84 -1.38 114.93 128.30 3czr h MET 96 Ca -0.25 -0.08 0.01 0.00 -2.06 0.00 0.00 59.70 57.31 3czr h MET 96 Cb 1.09 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 3czr h MET 96 CO 0.90 0.59 0.00 1.15 1.06 0.00 0.00 176.91 180.62 3czr h THR 97 N 0.82 0.97 -0.06 2.22 2.02 -1.95 -0.65 112.91 116.28 3czr h THR 97 Ca 0.21 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.34 3czr h THR 97 Cb 0.01 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3czr h THR 97 CO -0.04 0.00 -0.16 0.15 0.37 0.00 0.00 175.52 175.85 3czr h PHE 98 N 0.02 0.10 -0.12 3.16 3.57 -1.80 0.93 116.94 122.80 3czr h PHE 98 Ca 0.02 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 3czr h PHE 98 Cb 0.02 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 3czr h PHE 98 CO -0.10 0.26 0.00 0.00 -2.23 0.00 0.00 178.31 176.24 3czr h ALA 99 N 1.75 0.15 0.36 2.41 0.00 -0.91 0.32 119.26 123.33 3czr h ALA 99 Ca 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3czr h ALA 99 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3czr h ALA 99 CO 0.02 -0.16 -0.17 1.49 0.00 0.00 0.00 179.25 180.43 3czr h GLU 100 N -0.06 -0.46 -0.58 0.00 4.81 -0.74 -2.77 114.58 114.78 3czr h GLU 100 Ca 0.03 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.41 3czr h GLU 100 Cb 0.35 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.74 3czr h GLU 100 CO 0.01 -0.25 0.08 1.96 -0.73 0.00 0.00 179.01 180.07 3czr h GLN 101 N -0.57 0.19 -0.82 1.92 1.08 -0.84 -2.98 115.11 113.09 3czr h GLN 101 Ca -0.05 -0.01 0.14 0.00 -1.45 0.00 0.00 58.65 57.28 3czr h GLN 101 Cb 0.43 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.75 3czr h GLN 101 CO 0.08 0.13 0.54 0.35 -0.95 0.00 0.00 178.83 178.97 3czr h PHE 102 N 0.20 0.65 -0.03 2.96 3.57 -0.06 0.13 116.94 124.37 3czr h PHE 102 Ca 0.30 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.69 3czr h PHE 102 Cb 0.46 -0.21 0.01 0.00 2.79 0.00 0.00 35.95 39.01 3czr h PHE 102 CO -0.28 0.25 -0.51 0.28 -2.23 0.00 0.00 178.31 175.81 3czr h VAL 103 N 0.56 1.43 0.24 1.41 2.07 -1.46 -0.00 116.25 120.50 3czr h VAL 103 Ca 0.40 -1.98 0.00 0.00 0.82 0.00 0.00 66.70 65.94 3czr h VAL 103 Cb 0.76 2.52 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 3czr h VAL 103 CO -0.16 0.58 -0.43 0.00 0.02 0.00 0.00 177.57 177.58 3czr h ALA 104 N 0.35 -0.99 -0.72 1.67 0.00 -1.42 0.41 119.26 118.55 3czr h ALA 104 Ca -0.06 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.88 3czr h ALA 104 Cb 1.21 0.75 -0.13 0.00 0.00 0.00 0.00 17.79 19.62 3czr h ALA 104 CO 0.10 -1.07 -0.14 1.96 0.00 0.00 0.00 179.25 180.11 3czr h GLN 105 N -0.71 0.02 0.00 0.00 4.20 -0.78 0.08 115.11 117.91 3czr h GLN 105 Ca -0.03 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 3czr h GLN 105 Cb 0.67 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 3czr h GLN 105 CO -0.16 0.01 -0.44 0.00 -0.67 0.00 0.00 178.83 177.57 3czr h ALA 106 N 1.71 1.14 -0.15 3.87 0.00 -0.74 -2.27 119.26 122.82 3czr h ALA 106 Ca 0.36 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3czr h ALA 106 Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3czr h ALA 106 CO -0.72 0.55 0.03 0.78 0.00 0.00 0.00 179.25 179.89 3czr h GLY 107 N 1.58 0.27 0.66 0.00 0.00 0.17 -2.79 103.07 102.96 3czr h GLY 107 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 3czr h GLY 107 CO 0.06 0.16 -0.39 0.50 0.00 0.00 0.00 176.54 176.87 3czr h LYS 108 N 0.04 -0.81 0.00 4.80 1.57 -1.21 0.48 116.57 121.43 3czr h LYS 108 Ca 0.05 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3czr h LYS 108 Cb 0.29 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3czr h LYS 108 CO 0.00 -0.54 0.28 1.28 -0.57 0.00 0.00 179.45 179.90 3czr n LEU 109 N -5.50 0.10 0.00 2.94 4.32 -0.86 -1.95 117.00 116.05 3czr n LEU 109 Ca -0.11 0.35 0.00 0.00 -0.02 0.00 0.00 56.01 56.23 3czr n LEU 109 Cb 0.40 -0.32 0.00 0.00 -1.62 0.00 0.00 43.42 41.88 3czr n LEU 109 CO 0.29 -0.38 -0.32 0.23 -1.22 0.00 0.00 177.39 175.99 3czr n MET 110 N -1.52 2.18 -2.52 3.23 2.81 -0.90 -5.06 117.12 115.33 3czr n MET 110 Ca -0.00 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.81 3czr n MET 110 Cb 0.29 -0.82 0.03 0.00 -0.71 0.00 0.00 33.22 32.01 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 1.62 -0.42 0.00 3.03 0.00 0.16 -4.92 105.19 104.66 3czr n GLY 111 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.36 1.54 3.39 -0.02 0.00 -1.07 -5.06 105.19 102.61 3czr n GLY 112 Ca -0.03 -2.21 -0.07 0.00 0.00 0.00 0.00 46.02 43.71 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 -0.71 -0.24 0.99 2.96 -1.26 -4.68 118.68 115.73 3czr s LEU 113 Ca 0.00 1.17 -0.17 0.00 -0.22 0.00 0.00 54.13 54.91 3czr s LEU 113 Cb 0.00 1.67 -0.16 0.00 0.50 0.00 0.00 46.19 48.20 3czr s LEU 113 CO 0.00 -0.22 -0.04 0.47 -1.32 0.00 0.00 176.35 175.24 3czr n ASP 114 N 5.15 1.92 -4.12 3.68 10.43 0.92 -4.32 116.55 130.21 3czr n ASP 114 Ca -0.12 0.36 -0.28 0.00 2.57 0.00 0.00 54.79 57.31 3czr n ASP 114 Cb 0.51 -0.88 -0.17 0.00 1.84 0.00 0.00 41.12 42.42 3czr n ASP 114 CO 0.00 0.00 0.00 -0.32 -1.07 0.00 0.00 177.20 175.81 3czr s MET 115 N -2.44 2.22 -0.45 -1.24 1.75 -0.87 -1.14 119.30 117.13 3czr s MET 115 Ca -0.33 -0.63 -0.09 0.00 -1.25 0.00 0.00 55.69 53.39 3czr s MET 115 Cb 0.10 -1.78 0.11 0.00 2.84 0.00 0.00 34.83 36.10 3czr s MET 115 CO 0.56 0.14 0.31 -1.17 -0.65 0.00 0.00 175.02 174.21 3czr s LEU 116 N 0.40 5.54 -0.46 4.11 2.96 0.59 -0.81 118.68 131.02 3czr s LEU 116 Ca -0.14 -1.84 -0.19 0.00 -0.22 0.00 0.00 54.13 51.74 3czr s LEU 116 Cb -0.16 -1.99 0.03 0.00 0.50 0.00 0.00 46.19 44.58 3czr s LEU 116 CO 0.05 -0.65 0.59 -0.63 -1.32 0.00 0.00 176.35 174.39 3czr s ILE 117 N 1.35 4.91 -0.43 6.68 1.01 -0.03 -0.36 121.20 134.34 3czr s ILE 117 Ca 0.05 -0.21 -0.14 0.00 0.00 0.00 0.00 60.65 60.35 3czr s ILE 117 Cb -0.25 -4.20 0.04 0.00 0.01 0.00 0.00 42.46 38.06 3czr s ILE 117 CO -0.01 -0.63 0.32 -0.76 0.00 0.00 0.00 174.94 173.87 3czr s LEU 118 N 2.59 5.26 0.00 2.97 1.43 0.83 -1.72 118.68 130.04 3czr s LEU 118 Ca 0.17 -1.10 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 3czr s LEU 118 Cb -0.17 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.91 3czr s LEU 118 CO 0.15 -0.52 0.00 -3.20 0.23 0.00 0.00 176.35 173.01 3czr n ASN 119 N 5.15 1.84 -4.71 2.29 2.85 -1.26 -1.35 115.26 120.06 3czr n ASN 119 Ca -0.12 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 54.01 3czr n ASN 119 Cb 0.45 0.27 0.11 0.00 1.24 0.00 0.00 39.78 41.85 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 -1.08 1.92 0.00 1.20 -3.43 -1.25 -4.87 115.29 107.77 3czr s HIS 120 Ca 0.00 1.61 -0.03 0.00 -0.80 0.00 0.00 55.06 55.84 3czr s HIS 120 Cb 0.00 -3.54 -0.01 0.00 -1.43 0.00 0.00 32.58 27.61 3czr s HIS 120 CO 0.00 -2.83 0.05 0.96 -2.00 0.00 0.00 174.74 170.92 3czr s ILE 121 N -1.92 0.07 1.19 -5.38 -4.36 -1.26 -4.81 121.20 104.73 3czr s ILE 121 Ca 0.76 -0.60 -0.13 0.00 -0.26 0.00 0.00 60.65 60.42 3czr s ILE 121 Cb -0.31 -0.28 0.29 0.00 1.25 0.00 0.00 42.46 43.41 3czr s ILE 121 CO 0.47 -0.33 1.02 0.28 0.24 0.00 0.00 174.94 176.62 3czr s THR 122 N -1.04 1.97 -0.06 8.37 -1.32 -1.26 -4.92 115.64 117.37 3czr s THR 122 Ca -0.11 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.07 3czr s THR 122 Cb -0.07 -2.08 -0.05 0.00 -1.51 0.00 0.00 72.50 68.79 3czr s THR 122 CO 0.00 0.00 1.60 0.20 -2.21 0.00 0.00 174.62 174.21 3czr s ASN 123 N -2.58 6.71 0.08 8.08 0.01 -1.26 -4.96 114.94 121.00 3czr s ASN 123 Ca 0.68 2.17 -0.24 0.00 -0.71 0.00 0.00 52.86 54.77 3czr s ASN 123 Cb -0.24 -2.53 -0.06 0.00 0.41 0.00 0.00 41.25 38.82 3czr s ASN 123 CO 0.64 -0.90 0.72 0.28 -1.51 0.00 0.00 177.10 176.33 3czr s THR 124 N 3.92 4.66 -0.56 1.60 -1.32 -1.26 -5.00 115.64 117.68 3czr s THR 124 Ca 0.71 1.54 -0.19 0.00 -1.21 0.00 0.00 61.69 62.53 3czr s THR 124 Cb -0.32 -4.06 0.08 0.00 -1.51 0.00 0.00 72.50 66.69 3czr s THR 124 CO 0.28 0.44 0.67 -0.55 -2.21 0.00 0.00 174.62 173.25 3czr s SER 125 N -0.53 6.20 -1.25 8.08 0.15 -1.26 -5.00 113.70 120.09 3czr s SER 125 Ca 0.35 -1.20 -0.20 0.00 0.70 0.00 0.00 55.95 55.61 3czr s SER 125 Cb -0.21 -2.30 0.02 0.00 -1.71 0.00 0.00 66.02 61.82 3czr s SER 125 CO 0.22 -1.02 1.79 -0.76 1.20 0.00 0.00 173.24 174.67 3czr s LEU 126 N 2.69 3.58 0.09 3.45 1.43 -1.26 -4.64 118.68 124.02 3czr s LEU 126 Ca 0.13 -2.16 -0.26 0.00 -1.03 0.00 0.00 54.13 50.81 3czr s LEU 126 Cb -0.22 -2.58 0.08 0.00 0.03 0.00 0.00 46.19 43.50 3czr s LEU 126 CO 0.09 -1.78 0.82 0.20 0.23 0.00 0.00 176.35 175.91 3czr s ASN 127 N 4.97 -0.37 0.39 2.29 0.02 -0.99 -5.03 114.94 116.22 3czr s ASN 127 Ca 0.58 -0.12 -0.26 0.00 -1.02 0.00 0.00 52.86 52.04 3czr s ASN 127 Cb 0.02 0.48 -0.11 0.00 0.02 0.00 0.00 41.25 41.66 3czr s ASN 127 CO 0.09 -0.82 1.13 0.18 0.02 0.00 0.00 177.10 177.71 3czr n LEU 128 N -0.34 3.06 -4.75 0.60 4.77 -1.26 -4.32 117.00 114.76 3czr n LEU 128 Ca -0.10 1.11 -0.40 0.00 -0.03 0.00 0.00 56.01 56.59 3czr n LEU 128 Cb 0.62 -1.41 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 3czr n LEU 128 CO 0.12 -1.05 0.52 0.12 -1.33 0.00 0.00 177.39 175.77 3czr s PHE 129 N -1.19 3.80 0.04 -1.77 5.36 -1.26 -4.98 117.98 117.98 3czr s PHE 129 Ca 0.60 1.60 0.00 0.00 -0.96 0.00 0.00 56.93 58.17 3czr s PHE 129 Cb -0.57 -2.87 0.00 0.00 -0.34 0.00 0.00 43.02 39.24 3czr s PHE 129 CO 0.59 0.31 0.00 1.58 -1.46 0.00 0.00 175.22 176.24 3czr n HIS 130 N 2.53 -0.19 -1.99 10.12 -0.00 -1.26 -5.02 115.22 119.41 3czr n HIS 130 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 3czr n HIS 130 Cb 0.50 0.14 0.00 0.00 -0.00 0.00 0.00 29.99 30.63 3czr n HIS 130 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3czr n ASP 131 N -2.76 0.00 -4.25 0.26 5.68 -1.26 -5.02 116.55 109.20 3czr n ASP 131 Ca 0.00 -1.51 -0.43 0.00 -0.50 0.00 0.00 54.79 52.35 3czr n ASP 131 Cb 0.00 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 3czr n ASP 131 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3czr n ASP 132 N 0.00 4.83 -0.32 -1.12 -0.08 -1.26 -4.75 116.55 113.86 3czr n ASP 132 Ca 0.00 -2.95 -0.02 0.00 -1.51 0.00 0.00 54.79 50.30 3czr n ASP 132 Cb 0.60 -1.63 0.13 0.00 2.34 0.00 0.00 41.12 42.56 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 4.66 1.25 -0.15 5.18 2.04 -2.00 -2.17 117.51 126.32 3czr h ILE 133 Ca 0.43 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 3czr h ILE 133 Cb 0.78 -0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3czr h ILE 133 CO 1.52 0.26 -0.00 0.45 0.00 0.00 0.00 178.15 180.37 3czr h HIS 134 N 1.23 0.21 -0.06 1.37 3.86 -1.99 0.94 115.15 120.72 3czr h HIS 134 Ca 0.32 -0.01 -0.22 0.00 -1.16 0.00 0.00 60.37 59.30 3czr h HIS 134 Cb -0.04 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 28.37 3czr h HIS 134 CO 0.01 0.23 -0.87 1.25 0.86 0.00 0.00 177.93 179.41 3czr h HIS 135 N 0.21 0.80 0.18 2.45 -0.00 -1.80 -2.24 115.15 114.74 3czr h HIS 135 Ca 0.05 -0.39 -0.00 0.00 -0.00 0.00 0.00 60.37 60.03 3czr h HIS 135 Cb 0.16 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 3czr h HIS 135 CO 0.00 1.20 -0.14 0.28 -0.00 0.00 0.00 177.93 179.28 3czr h VAL 136 N 0.35 0.69 -0.81 5.26 2.07 -1.10 -0.30 116.25 122.43 3czr h VAL 136 Ca -0.07 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.59 3czr h VAL 136 Cb 1.49 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.90 3czr h VAL 136 CO 0.16 0.00 0.53 -0.09 0.02 0.00 0.00 177.57 178.19 3czr h ARG 137 N -0.33 0.54 0.14 1.57 2.43 -0.84 -0.80 114.38 117.09 3czr h ARG 137 Ca -0.01 -0.03 -0.30 0.00 -0.81 0.00 0.00 59.98 58.83 3czr h ARG 137 Cb 0.29 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3czr h ARG 137 CO -0.01 0.36 -1.43 -0.22 -1.51 0.00 0.00 179.97 177.15 3czr h LYS 138 N 0.55 0.30 -0.24 0.20 3.64 -1.11 -0.19 116.57 119.73 3czr h LYS 138 Ca 0.40 -0.52 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 3czr h LYS 138 Cb 0.75 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.73 3czr h LYS 138 CO -0.15 1.20 0.05 0.77 -2.27 0.00 0.00 179.45 179.05 3czr h SER 139 N 0.08 0.02 -0.22 4.20 0.02 -0.54 0.11 113.55 117.23 3czr h SER 139 Ca -0.21 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 3czr h SER 139 Cb 2.02 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 64.58 3czr h SER 139 CO 0.19 0.04 0.04 0.24 -1.14 0.00 0.00 176.83 176.20 3czr h MET 140 N 0.14 0.12 0.04 3.45 2.86 -1.02 0.34 114.93 120.86 3czr h MET 140 Ca 0.11 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3czr h MET 140 Cb 0.10 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.74 3czr h MET 140 CO -0.14 0.08 -0.02 0.93 1.06 0.00 0.00 176.91 178.82 3czr h GLU 141 N 0.12 -0.05 0.08 1.72 4.39 -0.90 0.12 114.58 120.06 3czr h GLU 141 Ca 0.10 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.63 3czr h GLU 141 Cb 0.10 0.01 0.02 0.00 -0.10 0.00 0.00 28.75 28.78 3czr h GLU 141 CO -0.14 0.01 -0.72 0.28 -1.16 0.00 0.00 179.01 177.29 3czr h VAL 142 N -0.11 1.48 0.02 3.13 2.07 -0.71 -0.34 116.25 121.79 3czr h VAL 142 Ca -0.01 -2.35 -0.23 0.00 0.82 0.00 0.00 66.70 64.94 3czr h VAL 142 Cb 0.09 2.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.80 3czr h VAL 142 CO 0.01 0.67 -1.12 0.78 0.02 0.00 0.00 177.57 177.93 3czr h ASN 143 N -0.27 0.06 0.00 0.57 4.21 -0.41 -3.39 115.58 116.35 3czr h ASN 143 Ca -0.11 -0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.33 3czr h ASN 143 Cb 1.50 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.68 3czr h ASN 143 CO 0.14 1.05 -0.15 0.33 -1.29 0.00 0.00 177.43 177.51 3czr n PHE 144 N -3.34 0.00 -0.29 1.19 7.35 -0.31 -4.63 117.46 117.43 3czr n PHE 144 Ca -0.03 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.68 3czr n PHE 144 Cb 0.96 -0.07 0.15 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 -0.15 0.69 -1.44 -2.13 3.38 -0.76 -0.22 115.31 114.68 3czr h LEU 145 Ca 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3czr h LEU 145 Cb 0.15 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3czr h LEU 145 CO 0.00 0.41 -0.03 0.77 0.09 0.00 0.00 178.44 179.68 3czr h SER 146 N 0.81 0.30 -0.61 -0.43 4.64 -1.25 0.23 113.55 117.23 3czr h SER 146 Ca 0.38 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 3czr h SER 146 Cb 0.30 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.28 3czr h SER 146 CO -0.22 0.38 0.36 1.88 -0.87 0.00 0.00 176.83 178.36 3czr h TYR 147 N 0.31 0.84 0.34 4.77 -1.99 -1.28 -0.62 116.97 119.35 3czr h TYR 147 Ca 0.07 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.78 3czr h TYR 147 Cb 0.27 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 38.73 3czr h TYR 147 CO 0.01 0.58 -0.17 0.28 -0.00 0.00 0.00 178.16 178.86 3czr h VAL 148 N 0.87 0.55 -0.43 -2.88 2.07 -0.63 -2.25 116.25 113.56 3czr h VAL 148 Ca 0.23 -0.66 0.09 0.00 0.82 0.00 0.00 66.70 67.17 3czr h VAL 148 Cb 0.00 0.84 -0.09 0.00 -1.52 0.00 0.00 31.29 30.51 3czr h VAL 148 CO -0.04 0.11 -0.30 0.58 0.02 0.00 0.00 177.57 177.94 3czr h VAL 149 N -0.89 0.26 -0.83 2.57 2.07 -1.29 0.25 116.25 118.40 3czr h VAL 149 Ca -0.05 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.63 3czr h VAL 149 Cb 0.53 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 3czr h VAL 149 CO 0.08 0.00 0.54 -0.07 0.02 0.00 0.00 177.57 178.14 3czr h LEU 150 N -0.21 0.47 0.15 2.57 3.38 -1.15 -1.18 115.31 119.34 3czr h LEU 150 Ca 0.19 0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.98 3czr h LEU 150 Cb 0.52 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 41.23 3czr h LEU 150 CO -0.55 0.23 -0.93 0.74 0.09 0.00 0.00 178.44 178.02 3czr h THR 151 N 0.50 1.45 -0.71 0.22 2.02 -0.14 -1.61 112.91 114.63 3czr h THR 151 Ca 0.41 -2.54 0.16 0.00 0.77 0.00 0.00 66.41 65.21 3czr h THR 151 Cb 0.87 3.15 -0.11 0.00 -1.74 0.00 0.00 68.15 70.32 3czr h THR 151 CO -0.16 0.72 0.11 0.58 0.37 0.00 0.00 175.52 177.14 3czr h VAL 152 N -0.32 0.47 0.00 3.16 2.07 -0.39 -1.44 116.25 119.79 3czr h VAL 152 Ca -0.17 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 3czr h VAL 152 Cb 1.70 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3czr h VAL 152 CO 0.15 0.04 -0.21 0.00 0.02 0.00 0.00 177.57 177.57 3czr h ALA 153 N 1.62 0.90 -0.54 1.67 0.00 -1.22 -3.15 119.26 118.54 3czr h ALA 153 Ca 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3czr h ALA 153 Cb 0.68 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3czr h ALA 153 CO -0.54 0.27 0.00 0.00 0.00 0.00 0.00 179.25 178.97 3czr n ALA 154 N -2.17 2.39 0.29 0.00 0.00 -0.61 -4.61 120.51 115.79 3czr n ALA 154 Ca 0.02 -1.14 -0.12 0.00 0.00 0.00 0.00 53.44 52.20 3czr n ALA 154 Cb 0.54 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.07 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 4.25 -0.66 -0.93 0.00 5.85 -1.28 -2.28 115.31 120.27 3czr h LEU 155 Ca 0.00 0.02 0.25 0.00 0.84 0.00 0.00 57.88 58.99 3czr h LEU 155 Cb 0.97 0.17 -0.17 0.00 0.37 0.00 0.00 40.66 42.00 3czr h LEU 155 CO 0.00 -0.26 0.04 -0.65 -0.34 0.00 0.00 178.44 177.23 3czr h PRO 156 N -1.20 0.05 -0.08 5.25 0.11 -1.81 0.66 132.00 134.98 3czr h PRO 156 Ca -0.08 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.86 3czr h PRO 156 Cb 0.60 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 3czr h PRO 156 CO 0.13 0.03 -0.67 0.52 -0.21 0.00 0.00 178.00 177.80 3czr h MET 157 N 0.05 0.32 -0.46 1.05 2.86 -1.87 -2.93 114.93 113.95 3czr h MET 157 Ca 0.56 -0.24 -0.11 0.00 -2.06 0.00 0.00 59.70 57.84 3czr h MET 157 Cb 1.11 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 3czr h MET 157 CO -0.84 0.87 -0.15 -0.07 1.06 0.00 0.00 176.91 177.78 3czr h LEU 158 N 0.23 0.93 -0.56 1.22 3.38 0.76 -2.64 115.31 118.62 3czr h LEU 158 Ca -0.02 -0.38 0.09 0.00 0.09 0.00 0.00 57.88 57.67 3czr h LEU 158 Cb 1.21 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.64 3czr h LEU 158 CO 0.11 1.09 0.16 0.11 0.09 0.00 0.00 178.44 180.00 3czr h LYS 159 N 0.75 0.30 -0.81 1.13 1.57 -0.54 0.75 116.57 119.73 3czr h LYS 159 Ca 0.11 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3czr h LYS 159 Cb 0.71 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.91 3czr h LYS 159 CO 0.05 0.20 0.36 1.96 -0.57 0.00 0.00 179.45 181.45 3czr h GLN 160 N 0.31 1.19 -0.01 3.15 4.20 -1.29 -1.81 115.11 120.86 3czr h GLN 160 Ca 0.29 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.80 3czr h GLN 160 Cb 0.38 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3czr h GLN 160 CO -0.33 0.94 -0.01 -1.13 -0.67 0.00 0.00 178.83 177.63 3czr n SER 161 N -4.30 1.28 -3.77 1.46 3.41 -1.03 -4.93 113.62 105.74 3czr n SER 161 Ca 0.08 -1.41 -0.23 0.00 -0.26 0.00 0.00 58.87 57.05 3czr n SER 161 Cb 0.16 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.13 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 -0.01 -1.33 -2.96 4.04 3.02 -0.00 -4.97 115.26 113.05 3czr n ASN 162 Ca 0.19 -0.89 -0.14 0.00 -0.03 0.00 0.00 54.58 53.71 3czr n ASN 162 Cb 0.32 -3.71 0.09 0.00 -0.61 0.00 0.00 39.78 35.87 3czr n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3czr n GLY 163 N -1.70 -1.04 3.32 7.41 0.00 0.24 -4.73 105.19 108.69 3czr n GLY 163 Ca -0.28 -1.73 -0.28 0.00 0.00 0.00 0.00 46.02 43.73 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 -3.29 2.93 -0.19 1.61 0.01 -0.29 -1.85 113.70 112.62 3czr s SER 164 Ca 0.36 -0.62 -0.02 0.00 1.31 0.00 0.00 55.95 56.97 3czr s SER 164 Cb -0.01 -0.23 -0.00 0.00 0.21 0.00 0.00 66.02 65.99 3czr s SER 164 CO 0.25 0.19 -0.10 -0.63 0.41 0.00 0.00 173.24 173.36 3czr s ILE 165 N -0.91 3.00 -0.18 1.44 1.01 -0.31 -0.30 121.20 124.95 3czr s ILE 165 Ca 0.10 -0.63 -0.05 0.00 0.00 0.00 0.00 60.65 60.07 3czr s ILE 165 Cb -0.10 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 3czr s ILE 165 CO 0.03 0.47 0.00 -0.69 0.00 0.00 0.00 174.94 174.76 3czr s VAL 166 N 1.22 4.16 -0.20 2.92 1.01 0.52 -0.92 120.40 129.11 3czr s VAL 166 Ca 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 3czr s VAL 166 Cb -0.14 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.38 3czr s VAL 166 CO -0.04 0.46 -0.10 -0.69 0.00 0.00 0.00 175.10 174.73 3czr s VAL 167 N 0.61 2.94 -0.07 2.92 1.01 0.10 -0.12 120.40 127.80 3czr s VAL 167 Ca -0.00 -0.64 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 3czr s VAL 167 Cb -0.14 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 3czr s VAL 167 CO 0.02 0.47 0.57 -0.69 0.00 0.00 0.00 175.10 175.47 3czr s VAL 168 N 1.35 5.07 0.00 2.92 1.01 -0.46 -0.71 120.40 129.57 3czr s VAL 168 Ca 0.04 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.20 3czr s VAL 168 Cb -0.14 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.33 3czr s VAL 168 CO -0.06 0.34 0.00 -0.24 0.00 0.00 0.00 175.10 175.14 3czr n SER 169 N 3.38 0.00 -3.84 3.32 2.88 0.27 -4.88 113.62 114.76 3czr n SER 169 Ca -0.06 -0.52 -0.10 0.00 -1.33 0.00 0.00 58.87 56.86 3czr n SER 169 Cb 0.51 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.89 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 0.04 0.04 0.32 -3.46 0.01 -1.24 -1.92 113.70 107.49 3czr s SER 170 Ca 0.00 -0.43 0.09 0.00 1.31 0.00 0.00 55.95 56.92 3czr s SER 170 Cb 0.00 0.31 0.94 0.00 0.21 0.00 0.00 66.02 67.49 3czr s SER 170 CO 0.00 -0.62 1.61 -0.07 0.41 0.00 0.00 173.24 174.57 3czr h LEU 171 N 3.21 0.04 0.00 2.44 3.38 -1.62 0.41 115.31 123.17 3czr h LEU 171 Ca -0.33 0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3czr h LEU 171 Cb 1.20 0.31 0.00 0.00 0.09 0.00 0.00 40.66 42.25 3czr h LEU 171 CO 0.50 -0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.76 3czr n ALA 172 N -2.64 2.60 -0.47 1.53 0.00 -1.26 -1.53 120.51 118.74 3czr n ALA 172 Ca 0.28 -0.14 0.10 0.00 0.00 0.00 0.00 53.44 53.67 3czr n ALA 172 Cb 0.90 -1.37 0.31 0.00 0.00 0.00 0.00 19.45 19.30 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 0.81 2.70 0.00 0.00 0.00 0.14 -4.43 105.19 104.42 3czr n GLY 173 Ca 0.17 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 1.20 1.31 -4.30 1.61 4.76 -0.75 -4.23 118.16 117.77 3czr n LYS 174 Ca 0.23 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.51 3czr n LYS 174 Cb 0.71 -0.72 -0.10 0.00 -1.84 0.00 0.00 35.03 33.08 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 -1.43 0.57 -0.02 -0.18 -7.23 -0.58 -5.14 120.40 106.39 3czr s VAL 175 Ca 0.00 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.14 3czr s VAL 175 Cb 0.00 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.37 3czr s VAL 175 CO 0.00 -0.10 0.17 0.00 -0.31 0.00 0.00 175.10 174.86 3czr s ALA 176 N -3.75 3.93 0.02 1.32 0.00 -1.26 -4.32 121.76 117.70 3czr s ALA 176 Ca 0.35 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.57 3czr s ALA 176 Cb 0.07 -1.87 -0.01 0.00 0.00 0.00 0.00 23.12 21.31 3czr s ALA 176 CO 0.12 0.73 -0.06 0.71 0.00 0.00 0.00 175.76 177.26 3czr s TYR 177 N -1.29 0.54 0.63 0.00 1.51 -1.26 -5.07 117.35 112.41 3czr s TYR 177 Ca 0.26 -0.30 -0.14 0.00 -1.01 0.00 0.00 57.07 55.87 3czr s TYR 177 Cb -0.13 -0.34 -0.02 0.00 -0.11 0.00 0.00 41.96 41.37 3czr s TYR 177 CO 0.17 -0.05 1.07 -1.25 -1.11 0.00 0.00 175.55 174.38 3czr s PRO 178 N -0.88 3.12 0.00 -1.71 0.04 -1.26 -3.97 135.00 130.34 3czr s PRO 178 Ca -0.05 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.18 3czr s PRO 178 Cb -0.06 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3czr s PRO 178 CO 0.00 -0.97 0.00 -1.33 0.04 0.00 0.00 177.00 174.74 3czr n MET 179 N -2.36 0.00 -2.74 4.56 2.81 -1.26 -4.86 117.12 113.27 3czr n MET 179 Ca 0.09 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.93 3czr n MET 179 Cb 0.53 -1.38 0.05 0.00 -0.71 0.00 0.00 33.22 31.71 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 1.03 0.18 2.03 0.24 -1.25 -2.34 118.33 116.21 3czr n VAL 180 Ca 0.00 -2.86 -0.14 0.00 -2.04 0.00 0.00 64.34 59.30 3czr n VAL 180 Cb 0.00 0.96 -0.08 0.00 -1.47 0.00 0.00 33.84 33.25 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 2.73 -0.44 -0.83 2.33 0.00 -1.88 0.12 119.26 121.29 3czr h ALA 181 Ca -0.14 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.65 3czr h ALA 181 Cb 1.23 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 19.13 3czr h ALA 181 CO 0.32 -0.62 0.51 0.00 0.00 0.00 0.00 179.25 179.46 3czr h ALA 182 N -0.14 1.11 -0.43 0.00 0.00 -1.94 0.12 119.26 117.98 3czr h ALA 182 Ca -0.05 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 3czr h ALA 182 Cb 0.49 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3czr h ALA 182 CO 0.07 0.28 -0.18 -0.92 0.00 0.00 0.00 179.25 178.51 3czr h TYR 183 N 0.96 0.94 -0.46 0.00 3.20 -1.89 -2.73 116.97 117.00 3czr h TYR 183 Ca 0.35 -0.20 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 3czr h TYR 183 Cb 0.11 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 3czr h TYR 183 CO -0.03 0.95 -0.17 1.03 -1.64 0.00 0.00 178.16 178.30 3czr h SER 184 N 0.74 0.94 -0.61 -2.11 0.87 -0.05 -1.27 113.55 112.06 3czr h SER 184 Ca 0.11 -0.38 0.08 0.00 -1.23 0.00 0.00 61.79 60.37 3czr h SER 184 Cb 0.70 -0.26 -0.07 0.00 -0.44 0.00 0.00 62.40 62.34 3czr h SER 184 CO 0.05 1.11 0.26 0.00 -0.53 0.00 0.00 176.83 177.72 3czr h ALA 185 N 0.86 0.79 -0.18 6.23 0.00 -0.77 0.27 119.26 126.46 3czr h ALA 185 Ca 0.11 0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 3czr h ALA 185 Cb 0.73 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 3czr h ALA 185 CO 0.06 -0.14 -0.64 0.66 0.00 0.00 0.00 179.25 179.18 3czr h SER 186 N 0.46 0.75 0.11 0.00 4.64 -1.14 -0.89 113.55 117.49 3czr h SER 186 Ca 0.30 -0.44 -0.25 0.00 -0.47 0.00 0.00 61.79 60.92 3czr h SER 186 Cb 0.32 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.21 3czr h SER 186 CO -0.27 1.20 -0.99 0.11 -0.87 0.00 0.00 176.83 176.01 3czr h LYS 187 N 0.48 0.60 -0.57 4.77 1.79 -0.98 -2.24 116.57 120.42 3czr h LYS 187 Ca -0.01 -0.64 0.05 0.00 -2.18 0.00 0.00 60.65 57.87 3czr h LYS 187 Cb 1.23 0.18 -0.05 0.00 -1.58 0.00 0.00 32.23 32.01 3czr h LYS 187 CO 0.13 1.25 0.30 0.74 -1.08 0.00 0.00 179.45 180.78 3czr h PHE 188 N 0.35 0.55 -0.83 -1.35 0.04 -0.44 -2.41 116.94 112.84 3czr h PHE 188 Ca -0.11 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.72 3czr h PHE 188 Cb 1.64 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 39.58 3czr h PHE 188 CO 0.09 0.26 0.55 0.00 -0.60 0.00 0.00 178.31 178.61 3czr h ALA 189 N 1.31 1.48 -0.93 2.45 0.00 -1.08 -0.39 119.26 122.09 3czr h ALA 189 Ca 0.26 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.24 3czr h ALA 189 Cb 0.16 -0.30 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 3czr h ALA 189 CO -0.17 0.44 0.57 -0.07 0.00 0.00 0.00 179.25 180.02 3czr h LEU 190 N 1.04 0.82 0.42 0.00 3.38 -0.91 -1.47 115.31 118.60 3czr h LEU 190 Ca 0.33 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.33 3czr h LEU 190 Cb 0.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3czr h LEU 190 CO -0.09 0.44 -0.20 -0.78 0.09 0.00 0.00 178.44 177.89 3czr h ASP 191 N 0.90 -0.48 -0.01 -0.43 1.82 -0.81 -1.86 116.42 115.56 3czr h ASP 191 Ca 0.46 -0.11 0.03 0.00 -0.39 0.00 0.00 57.03 57.02 3czr h ASP 191 Cb 0.45 0.12 -0.06 0.00 0.68 0.00 0.00 39.33 40.53 3czr h ASP 191 CO -0.26 -0.12 -0.48 1.23 -1.61 0.00 0.00 179.24 178.00 3czr h GLY 192 N -0.90 -0.95 0.85 -0.78 0.00 -1.31 0.73 103.07 100.71 3czr h GLY 192 Ca -0.06 0.59 -0.02 0.00 0.00 0.00 0.00 47.33 47.84 3czr h GLY 192 CO 0.10 -0.24 -0.35 -2.75 0.00 0.00 0.00 176.54 173.30 3czr h PHE 193 N -0.62 -0.92 0.00 5.60 3.04 -1.33 -0.42 116.94 122.29 3czr h PHE 193 Ca 0.03 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.91 3czr h PHE 193 Cb 0.69 0.33 -0.01 0.00 2.56 0.00 0.00 35.95 39.52 3czr h PHE 193 CO -0.48 -0.53 -0.28 0.74 -2.02 0.00 0.00 178.31 175.75 3czr h PHE 194 N -0.86 0.00 -0.09 0.41 -1.00 -1.31 -1.82 116.94 112.27 3czr h PHE 194 Ca -0.07 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.51 3czr h PHE 194 Cb 0.70 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.26 3czr h PHE 194 CO -0.10 0.28 -0.77 0.77 -1.61 0.00 0.00 178.31 176.88 3czr h SER 195 N 0.00 0.64 -0.46 2.17 0.02 -0.73 -2.17 113.55 113.02 3czr h SER 195 Ca -0.00 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.47 3czr h SER 195 Cb 0.89 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 3czr h SER 195 CO 0.04 1.20 0.12 0.28 -1.14 0.00 0.00 176.83 177.32 3czr h SER 196 N 0.36 0.69 1.62 3.07 0.02 -0.67 -2.96 113.55 115.68 3czr h SER 196 Ca -0.04 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 3czr h SER 196 Cb 1.37 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.72 3czr h SER 196 CO 0.14 0.73 -0.18 0.16 -1.14 0.00 0.00 176.83 176.55 3czr h ILE 197 N 0.61 0.32 -0.69 3.27 3.07 -1.39 -2.32 117.51 120.38 3czr h ILE 197 Ca 0.14 -1.33 -0.01 0.00 1.55 0.00 0.00 64.86 65.22 3czr h ILE 197 Cb 0.31 2.05 -0.03 0.00 -0.27 0.00 0.00 36.82 38.87 3czr h ILE 197 CO -0.00 0.17 0.39 -0.09 -1.05 0.00 0.00 178.15 177.58 3czr h ARG 198 N 0.00 0.96 -0.00 0.16 2.43 -1.24 0.98 114.38 117.67 3czr h ARG 198 Ca -0.00 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 58.97 3czr h ARG 198 Cb 1.04 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 3czr h ARG 198 CO 0.02 0.71 -0.47 0.87 -1.51 0.00 0.00 179.97 179.59 3czr h LYS 199 N 0.95 0.00 -0.22 0.20 1.57 -1.32 -2.62 116.57 115.13 3czr h LYS 199 Ca 0.25 -0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.84 3czr h LYS 199 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3czr h LYS 199 CO -0.04 0.47 -0.60 0.93 -0.57 0.00 0.00 179.45 179.64 3czr h GLU 200 N 0.00 0.73 0.00 3.15 5.08 -0.90 -3.02 114.58 119.62 3czr h GLU 200 Ca -0.00 -0.49 -0.09 0.00 -1.00 0.00 0.00 59.36 57.77 3czr h GLU 200 Cb 0.84 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3czr h GLU 200 CO 0.06 1.12 -0.43 1.88 -1.00 0.00 0.00 179.01 180.64 3czr h TYR 201 N 0.55 0.00 0.02 4.33 -1.99 -0.65 -2.21 116.97 117.01 3czr h TYR 201 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 3czr h TYR 201 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.92 3czr h TYR 201 CO 0.06 0.43 -0.01 0.66 -0.00 0.00 0.00 178.16 179.31 3czr h SER 202 N 0.00 -0.02 0.67 3.88 4.64 -1.45 0.96 113.55 122.23 3czr h SER 202 Ca -0.00 -0.48 -0.08 0.00 -0.47 0.00 0.00 61.79 60.76 3czr h SER 202 Cb 0.83 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 3czr h SER 202 CO 0.06 0.47 -0.38 -0.37 -0.87 0.00 0.00 176.83 175.74 3czr h VAL 203 N -0.51 1.00 -0.66 0.95 -1.51 -1.49 -1.48 116.25 112.55 3czr h VAL 203 Ca -0.00 -1.44 0.00 0.00 -1.23 0.00 0.00 66.70 64.02 3czr h VAL 203 Cb 0.49 1.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.50 3czr h VAL 203 CO 0.00 0.37 0.00 -1.54 -1.23 0.00 0.00 177.57 175.18 3czr n SER 204 N -3.69 4.68 -1.94 4.19 3.41 -0.84 -4.94 113.62 114.49 3czr n SER 204 Ca -0.01 -2.39 -0.19 0.00 -0.26 0.00 0.00 58.87 56.01 3czr n SER 204 Cb 0.47 -0.57 -0.05 0.00 -0.26 0.00 0.00 64.21 63.80 3czr n SER 204 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3czr n ARG 205 N 1.19 -1.59 -1.99 4.33 1.74 -0.56 -4.94 116.66 114.85 3czr n ARG 205 Ca 0.26 1.04 -0.42 0.00 -0.77 0.00 0.00 57.85 57.96 3czr n ARG 205 Cb 0.86 -5.53 -0.03 0.00 -1.02 0.00 0.00 32.46 26.74 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 -2.78 3.55 -0.72 1.55 1.01 0.32 -4.91 120.40 118.42 3czr s VAL 206 Ca 0.00 0.65 -0.04 0.00 0.00 0.00 0.00 61.98 62.59 3czr s VAL 206 Cb 0.00 -3.46 0.13 0.00 0.00 0.00 0.00 36.38 33.04 3czr s VAL 206 CO 0.00 -0.11 2.54 -3.20 0.00 0.00 0.00 175.10 174.33 3czr n ASN 207 N 7.64 7.00 -4.13 3.32 5.15 -1.26 -4.49 115.26 128.48 3czr n ASN 207 Ca 0.18 -3.31 -0.34 0.00 -0.60 0.00 0.00 54.58 50.52 3czr n ASN 207 Cb 0.43 -1.23 -0.14 0.00 -0.53 0.00 0.00 39.78 38.30 3czr n ASN 207 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3czr s VAL 208 N -2.52 2.58 0.60 3.44 1.01 -1.26 -4.14 120.40 120.10 3czr s VAL 208 Ca 0.56 -1.39 -0.16 0.00 0.00 0.00 0.00 61.98 60.99 3czr s VAL 208 Cb 0.34 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 3czr s VAL 208 CO -0.22 0.02 1.06 -0.94 0.00 0.00 0.00 175.10 175.03 3czr s SER 209 N 1.21 5.74 -0.09 3.32 1.04 -0.77 -4.88 113.70 119.26 3czr s SER 209 Ca -0.05 1.83 0.00 0.00 0.48 0.00 0.00 55.95 58.21 3czr s SER 209 Cb -0.19 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.42 3czr s SER 209 CO -0.04 -1.20 -0.07 -0.63 0.98 0.00 0.00 173.24 172.28 3czr s ILE 210 N -2.45 0.89 -0.17 -1.02 1.01 -1.26 -1.17 121.20 117.03 3czr s ILE 210 Ca 0.64 -0.24 -0.00 0.00 0.00 0.00 0.00 60.65 61.05 3czr s ILE 210 Cb -0.16 -0.91 0.00 0.00 0.01 0.00 0.00 42.46 41.40 3czr s ILE 210 CO 0.37 0.33 -0.15 -0.89 0.00 0.00 0.00 174.94 174.61 3czr s THR 211 N 1.46 2.62 -0.21 2.92 2.01 -0.10 -4.40 115.64 119.96 3czr s THR 211 Ca -0.01 -0.77 -0.09 0.00 0.31 0.00 0.00 61.69 61.13 3czr s THR 211 Cb -0.13 -2.12 -0.05 0.00 0.01 0.00 0.00 72.50 70.21 3czr s THR 211 CO -0.05 0.51 0.12 -0.22 -0.69 0.00 0.00 174.62 174.29 3czr s LEU 212 N 1.00 4.07 -0.09 4.42 2.96 -0.39 0.02 118.68 130.66 3czr s LEU 212 Ca -0.02 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.02 3czr s LEU 212 Cb -0.15 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 3czr s LEU 212 CO -0.03 0.15 0.03 0.00 -1.32 0.00 0.00 176.35 175.17 3czr s VAL 214 N -0.88 1.86 -0.12 0.00 1.01 0.14 -0.57 120.40 121.84 3czr s VAL 214 Ca 0.13 -1.44 -0.02 0.00 0.00 0.00 0.00 61.98 60.65 3czr s VAL 214 Cb -0.11 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 3czr s VAL 214 CO 0.03 -0.07 -0.02 -0.76 0.00 0.00 0.00 175.10 174.27 3czr s LEU 215 N 1.24 3.39 0.00 3.92 1.43 -0.81 -1.11 118.68 126.75 3czr s LEU 215 Ca -0.07 0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 3czr s LEU 215 Cb -0.19 -1.79 0.00 0.00 0.03 0.00 0.00 46.19 44.23 3czr s LEU 215 CO -0.06 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.41 3czr n GLY 216 N 2.80 -0.80 3.64 -3.19 0.00 0.14 -1.64 105.19 106.14 3czr n GLY 216 Ca -0.18 -1.65 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 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 3.85 -4.58 0.99 7.94 -1.26 -4.92 117.00 119.02 3czr n LEU 217 Ca 0.00 0.67 -0.34 0.00 -1.11 0.00 0.00 56.01 55.23 3czr n LEU 217 Cb 0.00 -1.53 -0.11 0.00 0.53 0.00 0.00 43.42 42.31 3czr n LEU 217 CO 0.00 -0.10 -0.38 -0.63 -1.11 0.00 0.00 177.39 175.17 3czr s ILE 218 N 5.74 3.67 -1.07 1.96 -1.09 -1.26 -1.74 121.20 127.41 3czr s ILE 218 Ca 0.93 -0.51 -0.08 0.00 -2.23 0.00 0.00 60.65 58.76 3czr s ILE 218 Cb -0.41 -2.50 -0.13 0.00 -1.58 0.00 0.00 42.46 37.83 3czr s ILE 218 CO 0.40 0.59 3.02 -0.90 -1.23 0.00 0.00 174.94 176.82 3czr n ASP 219 N 2.19 7.23 -4.89 3.58 3.85 -0.09 -4.64 116.55 123.78 3czr n ASP 219 Ca -0.18 -2.50 -0.29 0.00 -0.71 0.00 0.00 54.79 51.12 3czr n ASP 219 Cb 0.53 -1.44 0.00 0.00 -1.35 0.00 0.00 41.12 38.86 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 1.99 4.84 0.19 2.12 -4.23 -1.26 -4.73 115.64 114.55 3czr s THR 220 Ca 0.65 0.43 -0.13 0.00 -1.18 0.00 0.00 61.69 61.46 3czr s THR 220 Cb 0.21 -3.86 0.09 0.00 1.34 0.00 0.00 72.50 70.28 3czr s THR 220 CO -0.04 -0.94 1.85 -0.33 -0.54 0.00 0.00 174.62 174.62 3czr h GLU 221 N 0.07 0.79 -0.47 3.99 5.08 -1.98 -0.12 114.58 121.93 3czr h GLU 221 Ca -0.46 -0.05 0.09 0.00 -1.00 0.00 0.00 59.36 57.95 3czr h GLU 221 Cb 1.20 -0.18 -0.08 0.00 0.50 0.00 0.00 28.75 30.19 3czr h GLU 221 CO 0.62 0.52 -0.06 1.15 -1.00 0.00 0.00 179.01 180.23 3czr h THR 222 N 0.81 0.57 0.09 1.13 2.02 -1.95 0.12 112.91 115.71 3czr h THR 222 Ca 0.22 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 3czr h THR 222 Cb -0.09 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 3czr h THR 222 CO -0.05 0.01 -0.05 0.00 0.37 0.00 0.00 175.52 175.80 3czr h ALA 223 N 1.45 -0.13 -0.72 6.16 0.00 -1.55 -1.83 119.26 122.64 3czr h ALA 223 Ca 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3czr h ALA 223 Cb 0.35 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3czr h ALA 223 CO -0.44 -0.46 0.41 0.52 0.00 0.00 0.00 179.25 179.27 3czr h MET 224 N -0.35 0.99 -0.73 0.00 2.86 -0.66 0.36 114.93 117.41 3czr h MET 224 Ca -0.01 -0.10 0.08 0.00 -2.06 0.00 0.00 59.70 57.61 3czr h MET 224 Cb 0.29 -0.20 -0.07 0.00 0.06 0.00 0.00 31.60 31.68 3czr h MET 224 CO 0.02 0.72 0.39 0.87 1.06 0.00 0.00 176.91 179.98 3czr h LYS 225 N 1.01 0.67 -0.29 1.72 1.57 -0.67 -1.70 116.57 118.88 3czr h LYS 225 Ca 0.26 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.81 3czr h LYS 225 Cb 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3czr h LYS 225 CO -0.04 0.44 -0.55 0.00 -0.57 0.00 0.00 179.45 178.73 3czr h ALA 226 N 1.41 0.48 -0.68 3.86 0.00 0.47 -3.23 119.26 121.57 3czr h ALA 226 Ca 0.35 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3czr h ALA 226 Cb 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3czr h ALA 226 CO -0.23 0.68 0.00 1.33 0.00 0.00 0.00 179.25 181.03 3czr n VAL 227 N -4.01 1.30 -0.04 0.00 0.24 0.17 -4.67 118.33 111.32 3czr n VAL 227 Ca -0.04 -1.03 -0.08 0.00 -2.04 0.00 0.00 64.34 61.15 3czr n VAL 227 Cb 0.63 0.32 -0.02 0.00 -1.47 0.00 0.00 33.84 33.29 3czr n VAL 227 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 3czr h SER 228 N 4.07 -0.75 0.00 -1.34 0.87 -1.32 -3.26 113.55 111.82 3czr h SER 228 Ca 0.00 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 3czr h SER 228 Cb 1.15 0.35 0.00 0.00 -0.44 0.00 0.00 62.40 63.46 3czr h SER 228 CO 0.10 -0.27 0.00 0.61 -0.53 0.00 0.00 176.83 176.73 3czr n GLY 229 N -1.37 -3.03 3.75 5.77 0.00 -1.26 -4.78 105.19 104.27 3czr n GLY 229 Ca -0.01 0.32 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 3czr n GLY 229 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3czr s ILE 230 N -2.04 2.91 -0.28 -0.61 -4.36 -1.23 -5.03 121.20 110.55 3czr s ILE 230 Ca 0.00 0.40 -0.09 0.00 -0.26 0.00 0.00 60.65 60.70 3czr s ILE 230 Cb 0.00 -2.90 -0.03 0.00 1.25 0.00 0.00 42.46 40.79 3czr s ILE 230 CO 0.00 -0.28 0.14 -0.69 0.24 0.00 0.00 174.94 174.35 3czr s VAL 231 N -2.32 4.74 0.00 8.37 1.01 -1.26 -4.95 120.40 125.99 3czr s VAL 231 Ca 0.68 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.50 3czr s VAL 231 Cb -0.23 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.84 3czr s VAL 231 CO 0.45 0.20 0.00 1.41 0.00 0.00 0.00 175.10 177.16 3czr n HIS 232 N 4.99 -0.85 -1.84 5.22 -0.00 -1.26 -5.11 115.22 116.37 3czr n HIS 232 Ca -0.15 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.25 3czr n HIS 232 Cb 0.51 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.53 3czr n HIS 232 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 3czr s MET 233 N -0.31 3.06 0.10 -0.41 1.75 -1.26 -4.95 119.30 117.28 3czr s MET 233 Ca 0.00 1.20 -0.35 0.00 -1.25 0.00 0.00 55.69 55.29 3czr s MET 233 Cb 0.00 -2.00 -0.18 0.00 2.84 0.00 0.00 34.83 35.49 3czr s MET 233 CO 0.00 -1.02 0.98 0.94 -0.65 0.00 0.00 175.02 175.27 3czr n GLN 234 N -2.41 0.39 -2.30 4.11 7.27 -1.26 -4.95 117.38 118.24 3czr n GLN 234 Ca 0.09 0.14 -0.32 0.00 0.07 0.00 0.00 57.00 56.98 3czr n GLN 234 Cb 0.53 -1.53 -0.02 0.00 2.41 0.00 0.00 30.24 31.63 3czr n GLN 234 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3czr s ALA 235 N -0.26 2.99 0.08 1.69 0.00 -1.26 -4.70 121.76 120.29 3czr s ALA 235 Ca 0.79 0.23 0.02 0.00 0.00 0.00 0.00 51.96 53.00 3czr s ALA 235 Cb -1.05 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 18.88 3czr s ALA 235 CO 0.55 -0.39 0.13 0.00 0.00 0.00 0.00 175.76 176.05 3czr s ALA 236 N -2.60 3.74 -0.02 0.00 0.00 -0.71 -4.77 121.76 117.40 3czr s ALA 236 Ca 0.60 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 51.31 3czr s ALA 236 Cb -0.11 -1.58 -0.08 0.00 0.00 0.00 0.00 23.12 21.34 3czr s ALA 236 CO 0.33 0.77 2.03 -0.35 0.00 0.00 0.00 175.76 178.54 3czr n PRO 237 N 0.35 2.67 0.29 0.00 -0.04 -1.26 -0.91 135.00 136.10 3czr n PRO 237 Ca -0.07 0.94 0.18 0.00 -0.04 0.00 0.00 63.50 64.51 3czr n PRO 237 Cb 0.51 -3.05 0.93 0.00 -0.04 0.00 0.00 33.50 31.85 3czr n PRO 237 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 3czr h LYS 238 N 11.53 0.00 0.08 0.54 2.10 -1.93 -1.38 116.57 127.51 3czr h LYS 238 Ca -0.48 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 57.97 3czr h LYS 238 Cb 1.24 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.59 3czr h LYS 238 CO 0.94 0.00 -0.82 0.93 -2.00 0.00 0.00 179.45 178.51 3czr h GLU 239 N 0.00 0.41 0.00 0.07 3.07 -1.95 -2.17 114.58 114.02 3czr h GLU 239 Ca 0.03 -0.55 -0.00 0.00 -0.50 0.00 0.00 59.36 58.34 3czr h GLU 239 Cb 0.46 0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 3czr h GLU 239 CO -0.00 1.22 -0.00 1.49 -1.40 0.00 0.00 179.01 180.31 3czr h GLU 240 N -0.13 -0.01 -0.87 2.33 4.81 -1.82 -2.66 114.58 116.23 3czr h GLU 240 Ca -0.13 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 59.26 3czr h GLU 240 Cb 1.57 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.85 3czr h GLU 240 CO 0.16 0.16 0.46 0.00 -0.73 0.00 0.00 179.01 179.06 3czr h ALA 242 N 1.57 0.87 -0.28 0.00 0.00 -1.34 -2.58 119.26 117.51 3czr h ALA 242 Ca 0.48 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3czr h ALA 242 Cb 0.69 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3czr h ALA 242 CO -0.37 0.63 -0.19 1.25 0.00 0.00 0.00 179.25 180.57 3czr h LEU 243 N 0.65 0.65 -1.29 0.00 5.85 -0.83 -2.61 115.31 117.73 3czr h LEU 243 Ca 0.09 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.39 3czr h LEU 243 Cb 0.75 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 3czr h LEU 243 CO 0.06 0.95 0.49 -0.33 -0.34 0.00 0.00 178.44 179.27 3czr h GLU 244 N 0.36 0.93 -0.42 1.25 4.39 -1.24 0.22 114.58 120.07 3czr h GLU 244 Ca 0.05 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3czr h GLU 244 Cb 0.73 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3czr h GLU 244 CO 0.05 0.61 0.27 0.82 -1.16 0.00 0.00 179.01 179.61 3czr h ILE 245 N 0.96 1.12 -0.27 3.13 2.04 -1.35 -1.61 117.51 121.53 3czr h ILE 245 Ca 0.28 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 3czr h ILE 245 Cb -0.05 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3czr h ILE 245 CO -0.07 0.12 -0.02 0.40 0.00 0.00 0.00 178.15 178.58 3czr h ILE 246 N 0.56 1.26 0.17 -0.67 2.04 -0.84 -1.91 117.51 118.13 3czr h ILE 246 Ca 0.15 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 65.05 3czr h ILE 246 Cb -0.04 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3czr h ILE 246 CO -0.03 0.31 -0.38 0.11 0.00 0.00 0.00 178.15 178.15 3czr h LYS 247 N 0.27 -0.58 -0.97 2.37 1.57 -0.55 0.25 116.57 118.92 3czr h LYS 247 Ca 0.08 0.04 0.18 0.00 -1.87 0.00 0.00 60.65 59.07 3czr h LYS 247 Cb 0.46 0.13 -0.10 0.00 0.08 0.00 0.00 32.23 32.79 3czr h LYS 247 CO 0.02 -0.39 0.58 0.78 -0.57 0.00 0.00 179.45 179.86 3czr h GLY 248 N -0.61 1.70 1.00 3.86 0.00 -1.31 0.58 103.07 108.29 3czr h GLY 248 Ca -0.02 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 3czr h GLY 248 CO -0.17 -0.05 0.21 -1.33 0.00 0.00 0.00 176.54 175.21 3czr h GLY 249 N 0.75 0.95 0.82 4.60 0.00 -0.79 -0.66 103.07 108.74 3czr h GLY 249 Ca 0.55 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 3czr h GLY 249 CO -0.37 0.51 0.03 0.00 0.00 0.00 0.00 176.54 176.70 3czr h ALA 250 N 1.07 0.21 0.00 3.60 0.00 0.15 -1.85 119.26 122.44 3czr h ALA 250 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3czr h ALA 250 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3czr h ALA 250 CO -0.01 -0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.39 3czr n LEU 251 N -4.79 0.00 -2.32 0.00 4.77 -0.04 -4.83 117.00 109.78 3czr n LEU 251 Ca -0.05 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.72 3czr n LEU 251 Cb 0.18 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.25 3czr n LEU 251 CO 0.36 0.00 -0.26 0.54 -1.33 0.00 0.00 177.39 176.69 3czr n ARG 252 N -0.92 -1.65 -1.26 3.23 1.74 -0.70 -0.12 116.66 116.99 3czr n ARG 252 Ca 0.13 1.03 -0.33 0.00 -0.77 0.00 0.00 57.85 57.91 3czr n ARG 252 Cb 0.06 -5.67 0.11 0.00 -1.02 0.00 0.00 32.46 25.93 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 -4.94 1.94 0.09 5.56 -0.21 -0.32 -4.05 119.66 117.73 3czr s GLN 253 Ca 0.00 1.58 0.02 0.00 0.02 0.00 0.00 55.36 56.98 3czr s GLN 253 Cb 0.00 -1.83 -0.24 0.00 1.00 0.00 0.00 33.01 31.94 3czr s GLN 253 CO 0.00 -1.95 1.18 0.93 -2.12 0.00 0.00 175.29 173.33 3czr h GLU 254 N -0.78 0.13 -3.10 2.91 5.08 -1.88 -3.36 114.58 113.57 3czr h GLU 254 Ca -0.46 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 57.53 3czr h GLU 254 Cb 1.27 0.08 -0.25 0.00 0.50 0.00 0.00 28.75 30.35 3czr h GLU 254 CO 0.48 1.08 -0.41 -1.21 -1.00 0.00 0.00 179.01 177.96 3czr s GLU 255 N -2.68 0.32 -0.10 2.33 2.02 -1.26 -1.26 118.70 118.07 3czr s GLU 255 Ca -0.02 0.35 0.04 0.00 0.02 0.00 0.00 54.97 55.36 3czr s GLU 255 Cb 0.09 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.47 3czr s GLU 255 CO 0.85 -0.04 -0.23 0.08 0.02 0.00 0.00 175.26 175.93 3czr s VAL 256 N 0.10 2.02 -0.18 2.63 1.01 -0.13 -4.93 120.40 120.92 3czr s VAL 256 Ca -0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 3czr s VAL 256 Cb -0.02 -1.74 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 3czr s VAL 256 CO 0.00 0.55 -0.11 -0.31 0.00 0.00 0.00 175.10 175.23 3czr s TYR 257 N 0.33 2.86 -0.06 5.22 1.51 -1.26 0.23 117.35 126.18 3czr s TYR 257 Ca -0.18 -1.01 -0.01 0.00 -1.01 0.00 0.00 57.07 54.86 3czr s TYR 257 Cb -0.18 -1.97 0.03 0.00 -0.11 0.00 0.00 41.96 39.73 3czr s TYR 257 CO 0.09 -0.50 -0.00 -0.47 -1.11 0.00 0.00 175.55 173.56 3czr s TYR 258 N 1.05 0.59 0.10 2.71 6.14 -0.27 -4.96 117.35 122.72 3czr s TYR 258 Ca -0.00 -0.12 -0.14 0.00 0.64 0.00 0.00 57.07 57.45 3czr s TYR 258 Cb -0.15 -0.71 0.02 0.00 0.42 0.00 0.00 41.96 41.54 3czr s TYR 258 CO -0.02 -0.27 0.32 0.34 0.64 0.00 0.00 175.55 176.56 3czr s ASP 259 N 1.72 -0.11 0.28 4.32 -1.08 -1.26 -0.68 116.67 119.85 3czr s ASP 259 Ca 0.01 -0.41 0.24 0.00 -0.52 0.00 0.00 52.55 51.87 3czr s ASP 259 Cb -0.13 0.42 1.01 0.00 -1.46 0.00 0.00 42.92 42.77 3czr s ASP 259 CO -0.04 -0.79 1.72 -1.54 0.52 0.00 0.00 175.17 175.04 3czr n SER 260 N -0.08 0.69 -4.41 -0.34 3.41 -1.26 -4.57 113.62 107.06 3czr n SER 260 Ca -0.16 0.68 -0.33 0.00 -0.26 0.00 0.00 58.87 58.80 3czr n SER 260 Cb 0.63 -0.82 -0.14 0.00 -0.26 0.00 0.00 64.21 63.62 3czr n SER 260 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3czr s SER 261 N -4.29 4.15 0.45 4.04 0.15 -1.26 -4.99 113.70 111.95 3czr s SER 261 Ca 0.04 -0.27 0.21 0.00 0.70 0.00 0.00 55.95 56.62 3czr s SER 261 Cb 0.09 -1.54 1.09 0.00 -1.71 0.00 0.00 66.02 63.95 3czr s SER 261 CO 0.38 0.19 1.94 -0.07 1.20 0.00 0.00 173.24 176.89 3czr h LEU 262 N 6.51 0.00 -1.85 3.45 3.38 -2.01 -2.78 115.31 122.02 3czr h LEU 262 Ca -0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3czr h LEU 262 Cb 1.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 3czr h LEU 262 CO 0.56 0.23 -0.01 -0.50 0.09 0.00 0.00 178.44 178.81 3czr h TRP 263 N 0.00 0.08 -0.12 1.13 4.06 -1.97 -1.10 115.95 118.03 3czr h TRP 263 Ca -0.00 -0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.78 3czr h TRP 263 Cb 0.52 -0.03 0.01 0.00 -1.00 0.00 0.00 29.16 28.66 3czr h TRP 263 CO 0.00 0.09 -0.57 1.15 -3.56 0.00 0.00 178.44 175.55 3czr h THR 264 N 0.08 1.34 0.00 1.49 2.02 -1.90 -1.34 112.91 114.60 3czr h THR 264 Ca 0.02 -1.86 -0.04 0.00 0.77 0.00 0.00 66.41 65.31 3czr h THR 264 Cb 0.07 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 3czr h THR 264 CO 0.00 0.57 -0.17 0.71 0.37 0.00 0.00 175.52 177.00 3czr h THR 265 N 0.24 0.36 -0.04 3.16 1.35 -1.50 -1.70 112.91 114.77 3czr h THR 265 Ca -0.04 -1.12 -0.15 0.00 -0.55 0.00 0.00 66.41 64.56 3czr h THR 265 Cb 1.21 1.85 0.01 0.00 -1.73 0.00 0.00 68.15 69.49 3czr h THR 265 CO 0.12 0.17 -0.55 0.25 -0.25 0.00 0.00 175.52 175.25 3czr h LEU 266 N 0.00 0.56 -1.02 3.87 6.46 -1.14 -3.25 115.31 120.80 3czr h LEU 266 Ca -0.00 -0.71 -0.02 0.00 -0.12 0.00 0.00 57.88 57.03 3czr h LEU 266 Cb 0.84 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.59 3czr h LEU 266 CO 0.02 1.19 -0.12 -0.07 -0.62 0.00 0.00 178.44 178.84 3czr h LEU 267 N -0.01 0.00 0.00 2.25 4.07 -0.99 -3.26 115.31 117.37 3czr h LEU 267 Ca -0.06 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 3czr h LEU 267 Cb 1.23 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.97 3czr h LEU 267 CO 0.11 0.12 -0.87 -0.29 -1.08 0.00 0.00 178.44 176.43 3czr h ILE 268 N 0.00 0.17 -2.71 1.22 6.09 -1.37 -3.46 117.51 117.45 3czr h ILE 268 Ca -0.00 -1.30 -0.59 0.00 -1.37 0.00 0.00 64.86 61.60 3czr h ILE 268 Cb 0.73 1.77 0.09 0.00 0.47 0.00 0.00 36.82 39.88 3czr h ILE 268 CO 0.02 0.10 0.48 0.54 -3.07 0.00 0.00 178.15 176.21 3czr n ARG 269 N -2.84 1.86 -3.92 2.19 5.12 -1.23 -4.99 116.66 112.85 3czr n ARG 269 Ca -0.01 0.66 -0.30 0.00 -1.93 0.00 0.00 57.85 56.27 3czr n ARG 269 Cb 0.62 -2.24 -0.13 0.00 -1.16 0.00 0.00 32.46 29.55 3czr n ARG 269 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3czr s ASN 270 N 0.00 4.48 0.39 0.55 3.04 -1.26 -4.97 114.94 117.17 3czr s ASN 270 Ca 0.64 -3.18 0.06 0.00 0.04 0.00 0.00 52.86 50.42 3czr s ASN 270 Cb -0.66 -1.66 0.77 0.00 -1.54 0.00 0.00 41.25 38.17 3czr s ASN 270 CO 0.54 -0.21 2.02 -0.65 -3.04 0.00 0.00 177.10 175.77 3czr h PRO 271 N 6.31 0.60 -0.31 0.43 0.11 -2.00 -2.84 132.00 134.29 3czr h PRO 271 Ca -0.03 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.10 3czr h PRO 271 Cb 0.87 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 31.77 3czr h PRO 271 CO 0.70 0.43 -0.18 0.77 -0.21 0.00 0.00 178.00 179.50 3czr h SER 272 N 0.61 -0.61 -0.63 -2.05 0.02 -1.99 -1.12 113.55 107.78 3czr h SER 272 Ca 0.16 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 3czr h SER 272 Cb -0.01 0.32 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 3czr h SER 272 CO -0.03 -0.22 0.39 -0.09 -1.14 0.00 0.00 176.83 175.74 3czr h ARG 273 N -0.14 0.84 -0.41 3.45 2.43 -1.94 0.29 114.38 118.90 3czr h ARG 273 Ca 0.16 -0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.30 3czr h ARG 273 Cb 0.39 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.73 3czr h ARG 273 CO -0.40 0.58 0.20 0.87 -1.51 0.00 0.00 179.97 179.71 3czr h LYS 274 N 0.85 0.39 -0.62 0.20 1.57 -1.38 -1.98 116.57 115.59 3czr h LYS 274 Ca 0.23 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.94 3czr h LYS 274 Cb -0.05 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 3czr h LYS 274 CO -0.04 0.26 0.23 0.82 -0.57 0.00 0.00 179.45 180.14 3czr h ILE 275 N 0.40 1.24 -0.23 1.86 2.04 -0.78 -2.24 117.51 119.80 3czr h ILE 275 Ca 0.18 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 3czr h ILE 275 Cb 0.09 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3czr h ILE 275 CO -0.13 0.30 -0.10 0.25 0.00 0.00 0.00 178.15 178.47 3czr h LEU 276 N 0.88 0.35 0.00 1.44 5.85 -0.74 -0.89 115.31 122.21 3czr h LEU 276 Ca 0.21 -0.08 -0.19 0.00 0.84 0.00 0.00 57.88 58.66 3czr h LEU 276 Cb 0.24 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 3czr h LEU 276 CO -0.01 0.49 -0.93 -0.33 -0.34 0.00 0.00 178.44 177.31 3czr h GLU 277 N 0.35 0.00 -0.14 1.25 5.08 -1.25 -1.82 114.58 118.05 3czr h GLU 277 Ca 0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 3czr h GLU 277 Cb 0.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3czr h GLU 277 CO 0.02 0.85 0.02 0.35 -1.00 0.00 0.00 179.01 179.25 3czr h PHE 278 N 0.00 0.25 -0.19 4.33 3.57 -1.03 -2.62 116.94 121.26 3czr h PHE 278 Ca -0.03 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.47 3czr h PHE 278 Cb 1.69 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 40.33 3czr h PHE 278 CO 0.00 0.43 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.39 3czr h LEU 279 N 0.00 -0.19 -1.94 0.59 3.38 -1.13 -2.16 115.31 113.87 3czr h LEU 279 Ca 0.04 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3czr h LEU 279 Cb 0.32 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3czr h LEU 279 CO 0.00 -0.07 -0.08 1.88 0.09 0.00 0.00 178.44 180.26 3czr h TYR 280 N -0.01 0.00 -0.01 1.13 0.05 -1.28 -2.81 116.97 114.05 3czr h TYR 280 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.87 3czr h TYR 280 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 3czr h TYR 280 CO -0.21 0.08 -0.45 -1.13 -1.05 0.00 0.00 178.16 175.40 3czr n SER 281 N -4.23 1.47 -3.85 3.88 3.41 -0.96 -4.18 113.62 109.15 3czr n SER 281 Ca -0.03 -1.16 -0.42 0.00 -0.26 0.00 0.00 58.87 57.00 3czr n SER 281 Cb 0.16 0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 3czr n SER 281 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3czr n THR 282 N -0.48 4.31 0.00 6.66 -1.04 -0.85 -5.10 114.28 117.77 3czr n THR 282 Ca 0.10 -4.33 0.00 0.00 -2.04 0.00 0.00 64.05 57.78 3czr n THR 282 Cb 0.40 -2.37 0.00 0.00 -1.82 0.00 0.00 70.33 66.54 3czr n THR 282 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19