#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mzn s LEU 1 N 0.00 1.99 0.43 1.04 1.43 -1.26 -5.15 118.68 117.16 3mzn s LEU 1 Ca 0.00 -1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 51.32 3mzn s LEU 1 Cb 0.00 -0.10 -0.07 0.00 0.03 0.00 0.00 46.19 46.05 3mzn s LEU 1 CO 0.00 -0.92 0.81 -0.36 0.23 0.00 0.00 176.35 176.11 3mzn s PHE 2 N -3.23 3.47 0.60 0.29 0.08 -1.26 -5.05 117.98 112.88 3mzn s PHE 2 Ca 0.25 1.13 -0.17 0.00 0.12 0.00 0.00 56.93 58.26 3mzn s PHE 2 Cb 0.03 -2.51 -0.03 0.00 -0.57 0.00 0.00 43.02 39.94 3mzn s PHE 2 CO 0.15 -0.16 1.11 -1.25 -0.10 0.00 0.00 175.22 174.97 3mzn s PRO 3 N -3.89 3.10 0.35 0.24 0.04 -1.26 -4.70 135.00 128.88 3mzn s PRO 3 Ca 0.53 1.46 -0.08 0.00 0.04 0.00 0.00 61.00 62.95 3mzn s PRO 3 Cb -0.10 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 3mzn s PRO 3 CO 0.31 -1.02 0.67 0.15 0.04 0.00 0.00 177.00 177.15 3mzn s LYS 4 N -3.75 3.70 -0.04 4.56 1.02 -1.26 -1.50 119.74 122.48 3mzn s LYS 4 Ca 0.69 0.24 -0.30 0.00 0.02 0.00 0.00 55.97 56.62 3mzn s LYS 4 Cb -0.21 -2.51 -0.04 0.00 -0.52 0.00 0.00 37.83 34.54 3mzn s LYS 4 CO 0.35 0.08 1.35 0.42 -0.92 0.00 0.00 175.35 176.63 3mzn s ILE 5 N -2.25 3.90 -0.07 2.17 -1.09 0.22 -0.96 121.20 123.13 3mzn s ILE 5 Ca 0.48 1.24 0.16 0.00 -2.23 0.00 0.00 60.65 60.30 3mzn s ILE 5 Cb -0.10 -3.80 -0.25 0.00 -1.58 0.00 0.00 42.46 36.73 3mzn s ILE 5 CO 0.31 -0.02 0.38 0.35 -1.23 0.00 0.00 174.94 174.73 3mzn n THR 6 N 4.79 0.00 -3.76 2.92 -2.24 0.96 -1.06 114.28 115.89 3mzn n THR 6 Ca 0.13 -0.36 -0.13 0.00 -2.27 0.00 0.00 64.05 61.42 3mzn n THR 6 Cb 0.44 0.18 -0.10 0.00 -2.10 0.00 0.00 70.33 68.75 3mzn n THR 6 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3mzn s LYS 7 N -3.10 0.47 -0.08 -0.78 2.20 -1.06 -4.96 119.74 112.43 3mzn s LYS 7 Ca -0.05 0.23 -0.01 0.00 -0.36 0.00 0.00 55.97 55.78 3mzn s LYS 7 Cb 0.11 0.22 0.03 0.00 -1.51 0.00 0.00 37.83 36.67 3mzn s LYS 7 CO 0.68 -0.09 -0.03 1.41 -0.36 0.00 0.00 175.35 176.96 3mzn s MET 8 N -0.33 0.97 -0.16 4.03 -2.45 -1.26 -1.38 119.30 118.71 3mzn s MET 8 Ca -0.05 -0.04 0.01 0.00 -1.25 0.00 0.00 55.69 54.36 3mzn s MET 8 Cb -0.03 -1.19 0.01 0.00 1.25 0.00 0.00 34.83 34.86 3mzn s MET 8 CO 0.02 -0.27 -0.18 -0.80 1.05 0.00 0.00 175.02 174.84 3mzn s ASN 9 N 1.79 3.40 -0.29 1.11 -0.87 -0.10 -5.01 114.94 114.97 3mzn s ASN 9 Ca 0.04 -0.56 -0.14 0.00 -1.57 0.00 0.00 52.86 50.63 3mzn s ASN 9 Cb -0.13 -1.52 -0.03 0.00 -0.02 0.00 0.00 41.25 39.55 3mzn s ASN 9 CO -0.06 0.05 0.32 -0.69 -2.57 0.00 0.00 177.10 174.15 3mzn s VAL 10 N 1.02 5.21 -0.43 1.60 1.01 -1.26 -1.05 120.40 126.50 3mzn s VAL 10 Ca -0.02 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.30 3mzn s VAL 10 Cb -0.15 -3.69 0.13 0.00 0.00 0.00 0.00 36.38 32.67 3mzn s VAL 10 CO -0.05 0.11 0.21 -0.69 0.00 0.00 0.00 175.10 174.68 3mzn s VAL 11 N 1.98 1.59 0.43 2.92 1.01 0.98 -4.99 120.40 124.32 3mzn s VAL 11 Ca 0.12 -2.51 -0.25 0.00 0.00 0.00 0.00 61.98 59.34 3mzn s VAL 11 Cb -0.16 -2.13 -0.08 0.00 0.00 0.00 0.00 36.38 34.01 3mzn s VAL 11 CO 0.11 -0.83 1.27 -2.16 0.00 0.00 0.00 175.10 173.49 3mzn s PRO 12 N 0.46 3.82 0.08 2.72 0.04 -1.26 -0.47 135.00 140.39 3mzn s PRO 12 Ca 0.16 2.06 -0.04 0.00 0.04 0.00 0.00 61.00 63.22 3mzn s PRO 12 Cb -0.23 -2.61 -0.03 0.00 0.04 0.00 0.00 34.50 31.67 3mzn s PRO 12 CO -0.04 -0.58 0.07 0.14 0.04 0.00 0.00 177.00 176.63 3mzn s VAL 13 N -1.34 0.17 0.03 -0.36 -7.23 0.21 -4.26 120.40 107.61 3mzn s VAL 13 Ca 0.60 -1.62 0.01 0.00 -1.81 0.00 0.00 61.98 59.17 3mzn s VAL 13 Cb -0.36 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.99 3mzn s VAL 13 CO 0.45 -0.77 -0.06 0.00 -0.31 0.00 0.00 175.10 174.42 3mzn s ALA 14 N -3.93 0.38 0.26 1.32 0.00 -0.87 -1.28 121.76 117.65 3mzn s ALA 14 Ca 0.10 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 51.51 3mzn s ALA 14 Cb 0.07 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 3mzn s ALA 14 CO -0.08 -0.05 0.17 0.41 0.00 0.00 0.00 175.76 176.22 3mzn n GLY 15 N 1.79 3.30 3.89 0.00 0.00 -0.58 -4.67 105.19 108.91 3mzn n GLY 15 Ca -0.21 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 3mzn n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mzn s GLU 16 N -3.04 3.67 0.08 1.61 2.02 -1.26 -1.23 118.70 120.55 3mzn s GLU 16 Ca 0.24 0.02 -0.03 0.00 0.02 0.00 0.00 54.97 55.22 3mzn s GLU 16 Cb 0.01 -2.88 -0.03 0.00 0.10 0.00 0.00 34.13 31.33 3mzn s GLU 16 CO 0.17 0.49 0.05 0.34 0.02 0.00 0.00 175.26 176.32 3mzn s ASP 17 N -2.21 0.36 0.77 -0.19 2.15 -0.30 -4.76 116.67 112.49 3mzn s ASP 17 Ca 0.39 -0.95 -0.04 0.00 0.43 0.00 0.00 52.55 52.38 3mzn s ASP 17 Cb -0.13 0.26 0.09 0.00 -0.30 0.00 0.00 42.92 42.84 3mzn s ASP 17 CO 0.22 -0.66 0.56 0.61 -0.17 0.00 0.00 175.17 175.73 3mzn n GLY 18 N 0.03 -0.28 2.51 2.66 0.00 -1.26 -4.38 105.19 104.46 3mzn n GLY 18 Ca -0.13 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.65 3mzn n GLY 18 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3mzn n PHE 19 N -2.49 2.64 -2.55 1.61 -0.00 -1.26 -4.60 117.46 110.82 3mzn n PHE 19 Ca 0.08 -2.88 -0.42 0.00 -0.00 0.00 0.00 57.45 54.23 3mzn n PHE 19 Cb 0.28 -2.02 -0.03 0.00 -0.00 0.00 0.00 39.48 37.72 3mzn n PHE 19 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3mzn s LEU 20 N -1.20 4.29 0.03 -2.13 1.02 -1.26 -1.06 118.68 118.37 3mzn s LEU 20 Ca 0.55 1.73 -0.09 0.00 0.02 0.00 0.00 54.13 56.34 3mzn s LEU 20 Cb 0.17 -3.56 -0.05 0.00 0.02 0.00 0.00 46.19 42.77 3mzn s LEU 20 CO -0.07 -0.50 0.34 -0.76 0.02 0.00 0.00 176.35 175.37 3mzn s LEU 21 N 1.92 4.38 0.00 1.79 1.43 -0.70 -0.72 118.68 126.78 3mzn s LEU 21 Ca 0.53 0.72 -0.13 0.00 -1.03 0.00 0.00 54.13 54.23 3mzn s LEU 21 Cb -0.23 -2.73 0.05 0.00 0.03 0.00 0.00 46.19 43.31 3mzn s LEU 21 CO 0.22 0.25 0.73 -0.46 0.23 0.00 0.00 176.35 177.31 3mzn n ASN 22 N 1.23 -2.11 -0.25 2.29 0.23 0.01 -4.52 115.26 112.14 3mzn n ASN 22 Ca -0.11 -2.60 0.10 0.00 -0.53 0.00 0.00 54.58 51.44 3mzn n ASN 22 Cb 0.53 3.55 0.37 0.00 -2.08 0.00 0.00 39.78 42.14 3mzn n ASN 22 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3mzn h LEU 23 N 0.00 0.67 -0.01 -4.53 5.85 -1.72 -1.09 115.31 114.48 3mzn h LEU 23 Ca -0.32 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3mzn h LEU 23 Cb 1.20 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3mzn h LEU 23 CO 0.41 0.37 0.00 -1.20 -0.34 0.00 0.00 178.44 177.67 3mzn n SER 24 N -4.53 0.03 0.00 1.25 7.64 -1.26 -4.52 113.62 112.22 3mzn n SER 24 Ca 0.15 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.54 3mzn n SER 24 Cb 0.40 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 3mzn n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mzn n GLY 25 N 0.96 0.36 3.29 0.23 0.00 -0.41 -4.13 105.19 105.49 3mzn n GLY 25 Ca 0.06 -1.35 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 3mzn n GLY 25 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mzn s GLY 26 N 0.00 1.33 0.43 -0.02 0.00 -0.30 -0.81 107.32 107.94 3mzn s GLY 26 Ca 0.00 -1.04 -0.26 0.00 0.00 0.00 0.00 44.72 43.42 3mzn s GLY 26 CO 0.00 -0.66 1.44 0.30 0.00 0.00 0.00 173.10 174.18 3mzn s HIS 27 N -0.22 2.50 0.78 1.90 3.76 0.10 -4.37 115.29 119.73 3mzn s HIS 27 Ca -0.02 1.23 -0.11 0.00 -0.15 0.00 0.00 55.06 56.02 3mzn s HIS 27 Cb -0.13 -3.95 0.06 0.00 1.11 0.00 0.00 32.58 29.66 3mzn s HIS 27 CO 0.03 -2.95 1.09 -1.21 -0.85 0.00 0.00 174.74 170.85 3mzn s GLU 28 N -2.34 2.23 0.11 1.40 2.02 -1.26 -4.47 118.70 116.39 3mzn s GLU 28 Ca 0.58 1.10 0.13 0.00 0.02 0.00 0.00 54.97 56.80 3mzn s GLU 28 Cb -0.45 -1.90 0.61 0.00 0.10 0.00 0.00 34.13 32.50 3mzn s GLU 28 CO 0.58 -1.64 1.41 -0.35 0.02 0.00 0.00 175.26 175.29 3mzn n PRO 29 N -3.51 0.07 -5.23 0.39 -0.04 -1.26 -4.53 135.00 120.88 3mzn n PRO 29 Ca 0.09 0.43 -0.31 0.00 -0.04 0.00 0.00 63.50 63.67 3mzn n PRO 29 Cb 0.53 -1.66 -0.16 0.00 -0.04 0.00 0.00 33.50 32.18 3mzn n PRO 29 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3mzn s TRP 30 N -3.16 2.34 0.12 0.54 0.52 -1.26 -1.15 118.94 116.88 3mzn s TRP 30 Ca 0.03 -0.43 0.08 0.00 0.02 0.00 0.00 56.10 55.80 3mzn s TRP 30 Cb 0.06 -1.49 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 3mzn s TRP 30 CO 0.20 -0.00 -0.14 -0.59 0.02 0.00 0.00 176.95 176.44 3mzn s PHE 31 N -0.65 2.63 -0.05 -1.98 -0.12 -0.36 -4.85 117.98 112.59 3mzn s PHE 31 Ca 0.10 -0.22 0.06 0.00 -0.05 0.00 0.00 56.93 56.83 3mzn s PHE 31 Cb -0.10 -1.37 -0.01 0.00 -0.63 0.00 0.00 43.02 40.91 3mzn s PHE 31 CO -0.00 0.42 -0.25 0.42 -0.05 0.00 0.00 175.22 175.76 3mzn s ILE 32 N -1.25 2.04 0.14 -4.49 -1.09 -1.26 -1.53 121.20 113.75 3mzn s ILE 32 Ca 0.20 -1.06 -0.01 0.00 -2.23 0.00 0.00 60.65 57.55 3mzn s ILE 32 Cb -0.10 -1.72 -0.04 0.00 -1.58 0.00 0.00 42.46 39.02 3mzn s ILE 32 CO 0.12 0.57 0.07 -0.13 -1.23 0.00 0.00 174.94 174.34 3mzn s ARG 33 N -0.18 0.96 -0.12 2.79 1.81 -0.40 -3.95 118.95 119.86 3mzn s ARG 33 Ca -0.03 -1.45 0.02 0.00 -1.72 0.00 0.00 55.73 52.55 3mzn s ARG 33 Cb -0.13 0.25 -0.01 0.00 -0.45 0.00 0.00 34.95 34.61 3mzn s ARG 33 CO 0.03 -0.28 -0.19 0.00 -0.68 0.00 0.00 175.30 174.19 3mzn s VAL 35 N 0.38 4.60 -0.19 0.00 1.01 0.38 -1.55 120.40 125.02 3mzn s VAL 35 Ca -0.15 -0.10 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 3mzn s VAL 35 Cb -0.17 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3mzn s VAL 35 CO 0.07 0.47 0.04 -0.22 0.00 0.00 0.00 175.10 175.46 3mzn s LEU 36 N 0.35 3.61 -0.20 3.92 2.96 0.09 -0.01 118.68 129.40 3mzn s LEU 36 Ca 0.01 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 3mzn s LEU 36 Cb -0.13 -1.92 0.03 0.00 0.50 0.00 0.00 46.19 44.67 3mzn s LEU 36 CO 0.01 0.12 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.30 3mzn s VAL 37 N 0.67 2.17 -0.07 1.68 1.01 -0.22 -1.39 120.40 124.26 3mzn s VAL 37 Ca 0.02 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 60.92 3mzn s VAL 37 Cb -0.13 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 3mzn s VAL 37 CO 0.02 0.39 -0.06 -0.76 0.00 0.00 0.00 175.10 174.68 3mzn s LEU 38 N 1.25 3.21 -0.03 3.92 1.43 -0.27 -0.93 118.68 127.27 3mzn s LEU 38 Ca 0.02 -0.01 0.06 0.00 -1.03 0.00 0.00 54.13 53.17 3mzn s LEU 38 Cb -0.15 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 3mzn s LEU 38 CO -0.10 0.36 -0.22 -0.70 0.23 0.00 0.00 176.35 175.92 3mzn s GLU 39 N -0.81 1.91 0.47 1.70 2.12 -0.48 -1.01 118.70 122.60 3mzn s GLU 39 Ca 0.12 -0.78 0.06 0.00 0.36 0.00 0.00 54.97 54.73 3mzn s GLU 39 Cb -0.11 -1.77 -0.01 0.00 0.26 0.00 0.00 34.13 32.50 3mzn s GLU 39 CO 0.01 0.43 0.29 0.16 -0.54 0.00 0.00 175.26 175.61 3mzn s ASP 40 N -0.38 4.59 0.59 -1.70 1.47 -0.79 -0.03 116.67 120.42 3mzn s ASP 40 Ca 0.05 -1.13 0.29 0.00 1.18 0.00 0.00 52.55 52.93 3mzn s ASP 40 Cb -0.10 -0.07 1.75 0.00 -0.34 0.00 0.00 42.92 44.17 3mzn s ASP 40 CO 0.00 -0.81 2.21 -0.33 0.68 0.00 0.00 175.17 176.93 3mzn h GLU 41 N 1.09 0.00 0.00 2.11 5.08 -1.35 0.19 114.58 121.70 3mzn h GLU 41 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3mzn h GLU 41 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3mzn h GLU 41 CO 0.63 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.51 3mzn n SER 42 N -3.88 0.00 0.00 1.42 3.41 -1.26 -4.88 113.62 108.42 3mzn n SER 42 Ca -0.02 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 3mzn n SER 42 Cb 0.14 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 3mzn n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mzn n GLY 43 N 0.97 0.94 3.77 5.00 0.00 0.06 -5.06 105.19 110.86 3mzn n GLY 43 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 3mzn n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mzn s ASN 44 N -3.03 4.88 0.03 1.61 0.01 -1.26 -4.82 114.94 112.36 3mzn s ASN 44 Ca 0.00 1.92 0.05 0.00 -0.71 0.00 0.00 52.86 54.13 3mzn s ASN 44 Cb 0.00 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 39.10 3mzn s ASN 44 CO 0.00 -1.78 -0.15 -0.13 -1.51 0.00 0.00 177.10 173.53 3mzn s ARG 45 N -4.42 1.03 0.05 -0.60 0.52 -1.26 -1.88 118.95 112.39 3mzn s ARG 45 Ca 0.65 -0.74 0.08 0.00 -0.52 0.00 0.00 55.73 55.20 3mzn s ARG 45 Cb -0.19 -1.04 -0.03 0.00 0.52 0.00 0.00 34.95 34.21 3mzn s ARG 45 CO 0.47 0.26 -0.22 0.20 0.02 0.00 0.00 175.30 176.04 3mzn s GLY 46 N -1.01 1.20 0.16 -3.53 0.00 -0.18 -4.74 107.32 99.23 3mzn s GLY 46 Ca 0.03 -1.13 0.06 0.00 0.00 0.00 0.00 44.72 43.68 3mzn s GLY 46 CO 0.01 -1.06 -0.14 -1.34 0.00 0.00 0.00 173.10 170.57 3mzn s VAL 47 N -0.85 1.49 0.05 1.40 -7.23 -1.26 -1.11 120.40 112.88 3mzn s VAL 47 Ca 0.08 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 3mzn s VAL 47 Cb -0.09 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 3mzn s VAL 47 CO 0.02 -0.56 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.38 3mzn s GLY 48 N -2.97 0.44 -0.01 2.32 0.00 -0.48 -2.65 107.32 103.97 3mzn s GLY 48 Ca 0.17 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.92 3mzn s GLY 48 CO 0.04 -1.06 -0.02 1.85 0.00 0.00 0.00 173.10 173.91 3mzn s GLU 49 N -2.81 0.23 0.20 2.90 2.12 -1.26 -0.73 118.70 119.34 3mzn s GLU 49 Ca -0.02 -0.07 -0.10 0.00 0.36 0.00 0.00 54.97 55.14 3mzn s GLU 49 Cb -0.01 -0.25 -0.01 0.00 0.26 0.00 0.00 34.13 34.13 3mzn s GLU 49 CO -0.05 0.03 0.36 0.96 -0.54 0.00 0.00 175.26 176.02 3mzn s ILE 50 N 0.11 0.03 0.95 -3.70 -4.36 -0.60 -4.73 121.20 108.91 3mzn s ILE 50 Ca -0.01 -1.39 -0.12 0.00 -0.26 0.00 0.00 60.65 58.88 3mzn s ILE 50 Cb -0.03 -2.00 0.09 0.00 1.25 0.00 0.00 42.46 41.77 3mzn s ILE 50 CO -0.00 -0.15 0.68 -2.65 0.24 0.00 0.00 174.94 173.06 3mzn n PRO 51 N -0.29 -0.49 -4.18 0.37 -0.02 -1.26 -0.29 135.00 128.84 3mzn n PRO 51 Ca -0.05 -0.09 -0.15 0.00 -2.02 0.00 0.00 63.50 61.19 3mzn n PRO 51 Cb 0.63 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.95 3mzn n PRO 51 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3mzn s SER 52 N -2.25 1.48 0.12 2.55 0.15 -1.25 -4.10 113.70 110.40 3mzn s SER 52 Ca 0.61 -0.81 -0.26 0.00 0.70 0.00 0.00 55.95 56.19 3mzn s SER 52 Cb -0.22 0.00 0.07 0.00 -1.71 0.00 0.00 66.02 64.17 3mzn s SER 52 CO 0.64 -0.26 0.89 -0.94 1.20 0.00 0.00 173.24 174.77 3mzn s SER 53 N -2.45 -0.27 0.28 5.45 1.04 -1.25 -4.60 113.70 111.89 3mzn s SER 53 Ca 0.06 -0.27 -0.03 0.00 0.48 0.00 0.00 55.95 56.19 3mzn s SER 53 Cb -0.03 0.49 0.38 0.00 0.10 0.00 0.00 66.02 66.96 3mzn s SER 53 CO 0.00 -0.86 1.91 -0.33 0.98 0.00 0.00 173.24 174.94 3mzn h GLU 54 N 2.00 1.07 -0.49 4.02 5.08 -2.00 -0.83 114.58 123.42 3mzn h GLU 54 Ca -0.24 -0.11 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 3mzn h GLU 54 Cb 1.24 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 3mzn h GLU 54 CO 0.28 0.77 0.32 0.78 -1.00 0.00 0.00 179.01 180.16 3mzn h GLY 55 N 1.11 0.70 0.94 -3.84 0.00 -1.96 -0.07 103.07 99.95 3mzn h GLY 55 Ca 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 3mzn h GLY 55 CO -0.05 0.23 0.15 -2.22 0.00 0.00 0.00 176.54 174.66 3mzn h ILE 56 N 0.64 1.19 -0.80 2.60 2.04 -1.74 -0.32 117.51 121.13 3mzn h ILE 56 Ca 0.19 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3mzn h ILE 56 Cb -0.05 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 3mzn h ILE 56 CO -0.06 0.21 0.48 -0.07 0.00 0.00 0.00 178.15 178.71 3mzn h LEU 57 N 0.48 0.96 -0.85 1.44 3.38 -0.80 -0.82 115.31 119.10 3mzn h LEU 57 Ca 0.13 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 3mzn h LEU 57 Cb 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3mzn h LEU 57 CO -0.01 0.75 0.05 0.78 0.09 0.00 0.00 178.44 180.10 3mzn h ASN 58 N 1.09 0.87 -0.45 -0.43 2.35 -0.87 -2.08 115.58 116.07 3mzn h ASN 58 Ca 0.29 -0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 3mzn h ASN 58 Cb -0.04 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 3mzn h ASN 58 CO -0.05 0.90 0.15 1.23 -1.65 0.00 0.00 177.43 178.01 3mzn h GLY 59 N 1.00 0.74 0.61 2.83 0.00 -0.34 -1.01 103.07 106.91 3mzn h GLY 59 Ca 0.17 -0.43 0.07 0.00 0.00 0.00 0.00 47.33 47.14 3mzn h GLY 59 CO 0.02 0.40 0.32 1.41 0.00 0.00 0.00 176.54 178.69 3mzn h LEU 60 N 0.58 0.45 -1.11 3.11 3.38 -1.05 -2.24 115.31 118.43 3mzn h LEU 60 Ca 0.14 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3mzn h LEU 60 Cb 0.25 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3mzn h LEU 60 CO -0.01 0.29 0.37 -0.33 0.09 0.00 0.00 178.44 178.85 3mzn h GLU 61 N 0.59 0.99 0.00 1.13 4.39 -0.97 -1.73 114.58 118.98 3mzn h GLU 61 Ca 0.29 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 3mzn h GLU 61 Cb 0.23 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3mzn h GLU 61 CO -0.21 0.74 -0.05 0.87 -1.16 0.00 0.00 179.01 179.21 3mzn h LYS 62 N 0.99 0.00 -0.02 2.33 1.57 -0.61 -2.18 116.57 118.65 3mzn h LYS 62 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 3mzn h LYS 62 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3mzn h LYS 62 CO -0.04 0.05 -0.06 0.00 -0.57 0.00 0.00 179.45 178.83 3mzn h ARG 64 N 2.67 0.65 0.00 0.00 2.43 -0.98 -1.75 114.38 117.41 3mzn h ARG 64 Ca 0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 3mzn h ARG 64 Cb 0.61 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 3mzn h ARG 64 CO 0.00 0.43 -0.28 0.66 -1.51 0.00 0.00 179.97 179.27 3mzn h SER 65 N 0.67 0.00 0.81 -3.80 4.64 -1.80 -0.23 113.55 113.84 3mzn h SER 65 Ca 0.35 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.52 3mzn h SER 65 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 3mzn h SER 65 CO -0.24 0.28 -0.72 -0.07 -0.87 0.00 0.00 176.83 175.20 3mzn h LEU 66 N 0.00 0.00 0.00 5.97 3.38 -1.64 -3.38 115.31 119.64 3mzn h LEU 66 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 3mzn h LEU 66 Cb 0.74 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 3mzn h LEU 66 CO 0.04 0.72 -1.09 0.52 0.09 0.00 0.00 178.44 178.72 3mzn n VAL 67 N -3.60 1.50 -1.72 1.22 0.31 -0.78 -4.41 118.33 110.85 3mzn n VAL 67 Ca -0.01 0.03 -0.43 0.00 -0.01 0.00 0.00 64.34 63.93 3mzn n VAL 67 Cb 0.72 -2.14 -0.02 0.00 -0.91 0.00 0.00 33.84 31.49 3mzn n VAL 67 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3mzn n GLU 68 N -4.48 2.57 0.00 5.55 1.02 -0.17 -1.70 120.64 123.44 3mzn n GLU 68 Ca -0.26 0.92 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 3mzn n GLU 68 Cb 0.57 -2.70 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 3mzn n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3mzn n GLY 69 N 2.76 2.38 3.79 0.62 0.00 -0.22 -4.86 105.19 109.66 3mzn n GLY 69 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 3mzn n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mzn s ALA 70 N -2.35 2.85 0.24 4.61 0.00 -0.69 -4.57 121.76 121.86 3mzn s ALA 70 Ca 0.00 0.68 -0.21 0.00 0.00 0.00 0.00 51.96 52.42 3mzn s ALA 70 Cb 0.00 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 3mzn s ALA 70 CO 0.00 -0.42 0.78 1.03 0.00 0.00 0.00 175.76 177.15 3mzn s ARG 71 N -3.16 4.35 0.53 0.00 0.52 -1.26 -0.61 118.95 119.31 3mzn s ARG 71 Ca 0.68 0.99 0.28 0.00 -0.52 0.00 0.00 55.73 57.16 3mzn s ARG 71 Cb -0.19 -2.89 1.50 0.00 0.52 0.00 0.00 34.95 33.90 3mzn s ARG 71 CO 0.23 0.38 2.09 -0.39 0.02 0.00 0.00 175.30 177.62 3mzn h VAL 72 N 2.75 0.52 0.00 3.52 -1.51 -1.55 -0.60 116.25 119.39 3mzn h VAL 72 Ca -0.48 -0.48 0.00 0.00 -1.23 0.00 0.00 66.70 64.51 3mzn h VAL 72 Cb 1.19 1.32 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 3mzn h VAL 72 CO 0.65 0.10 0.00 -0.46 -1.23 0.00 0.00 177.57 176.63 3mzn n ASN 73 N -3.60 0.00 -0.92 4.19 6.94 -1.26 -3.42 115.26 117.18 3mzn n ASN 73 Ca -0.02 0.47 0.04 0.00 -0.02 0.00 0.00 54.58 55.05 3mzn n ASN 73 Cb 0.23 -0.49 0.18 0.00 -2.36 0.00 0.00 39.78 37.33 3mzn n ASN 73 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3mzn n GLU 74 N -1.49 2.37 -0.25 -3.83 1.02 -0.23 -4.60 120.64 113.63 3mzn n GLU 74 Ca 0.06 -1.39 0.06 0.00 -0.02 0.00 0.00 57.16 55.87 3mzn n GLU 74 Cb 0.28 -1.59 0.17 0.00 -0.02 0.00 0.00 31.44 30.28 3mzn n GLU 74 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 3mzn h VAL 75 N 1.97 0.41 -0.41 2.62 3.04 -1.73 0.06 116.25 122.20 3mzn h VAL 75 Ca 0.00 -0.06 -0.07 0.00 -1.01 0.00 0.00 66.70 65.57 3mzn h VAL 75 Cb 0.86 0.23 -0.02 0.00 -2.01 0.00 0.00 31.29 30.35 3mzn h VAL 75 CO 0.12 0.03 -0.02 0.11 -1.01 0.00 0.00 177.57 176.81 3mzn h LYS 76 N 0.17 0.67 -0.15 4.17 1.57 -1.92 -0.60 116.57 120.47 3mzn h LYS 76 Ca 0.42 -0.17 -0.15 0.00 -1.87 0.00 0.00 60.65 58.87 3mzn h LYS 76 Cb 0.74 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.97 3mzn h LYS 76 CO -0.60 0.70 -0.51 0.37 -0.57 0.00 0.00 179.45 178.84 3mzn h GLN 77 N 0.63 0.62 -0.41 3.15 4.15 -1.55 -1.28 115.11 120.43 3mzn h GLN 77 Ca 0.13 -0.46 0.07 0.00 0.77 0.00 0.00 58.65 59.16 3mzn h GLN 77 Cb 0.42 0.08 -0.06 0.00 0.21 0.00 0.00 27.48 28.13 3mzn h GLN 77 CO 0.02 1.08 0.03 0.28 -1.93 0.00 0.00 178.83 178.30 3mzn h VAL 78 N 0.28 0.72 -0.57 2.39 2.07 -0.67 -0.42 116.25 120.05 3mzn h VAL 78 Ca -0.02 -0.05 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 3mzn h VAL 78 Cb 1.13 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3mzn h VAL 78 CO 0.11 0.03 -0.02 -0.07 0.02 0.00 0.00 177.57 177.64 3mzn h LEU 79 N 0.14 0.97 -0.59 2.57 3.38 -1.09 0.41 115.31 121.09 3mzn h LEU 79 Ca 0.20 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.94 3mzn h LEU 79 Cb 0.27 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 3mzn h LEU 79 CO -0.31 1.03 0.32 0.28 0.09 0.00 0.00 178.44 179.86 3mzn h SER 80 N 0.90 0.49 -0.46 -0.43 0.02 -0.67 0.52 113.55 113.92 3mzn h SER 80 Ca 0.16 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 61.03 3mzn h SER 80 Cb 0.55 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 3mzn h SER 80 CO 0.03 0.33 -0.14 0.03 -1.14 0.00 0.00 176.83 175.94 3mzn h ARG 81 N 0.62 0.91 -0.72 3.45 2.47 -0.78 -2.71 114.38 117.62 3mzn h ARG 81 Ca 0.26 -0.36 0.01 0.00 -1.26 0.00 0.00 59.98 58.63 3mzn h ARG 81 Cb 0.13 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.37 3mzn h ARG 81 CO -0.16 1.02 0.47 0.00 0.56 0.00 0.00 179.97 181.86 3mzn h ALA 82 N 0.87 0.93 -0.60 0.04 0.00 -0.51 -0.74 119.26 119.25 3mzn h ALA 82 Ca 0.11 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3mzn h ALA 82 Cb 0.70 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3mzn h ALA 82 CO 0.05 0.31 0.35 0.00 0.00 0.00 0.00 179.25 179.96 3mzn h ARG 83 N 0.95 0.66 -0.35 0.00 3.08 -0.78 -0.85 114.38 117.10 3mzn h ARG 83 Ca 0.27 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 3mzn h ARG 83 Cb -0.07 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 3mzn h ARG 83 CO -0.07 0.44 0.19 0.78 -1.07 0.00 0.00 179.97 180.23 3mzn h GLY 84 N 0.68 0.52 0.80 0.04 0.00 -1.12 0.84 103.07 104.83 3mzn h GLY 84 Ca 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 3mzn h GLY 84 CO -0.13 0.23 -0.21 -2.00 0.00 0.00 0.00 176.54 174.43 3mzn h LEU 85 N 0.44 -0.54 -1.17 3.11 5.85 -0.87 -2.79 115.31 119.34 3mzn h LEU 85 Ca 0.12 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 3mzn h LEU 85 Cb 0.06 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3mzn h LEU 85 CO -0.02 -0.32 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.43 3mzn h LEU 86 N -0.47 0.24 -2.07 2.25 3.38 -1.08 -2.38 115.31 115.18 3mzn h LEU 86 Ca -0.01 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 57.96 3mzn h LEU 86 Cb 0.42 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3mzn h LEU 86 CO -0.02 0.51 0.22 0.00 0.09 0.00 0.00 178.44 179.24 3mzn h ALA 87 N 1.51 2.15 0.00 1.53 0.00 -0.55 -2.04 119.26 121.86 3mzn h ALA 87 Ca 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3mzn h ALA 87 Cb 0.60 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3mzn h ALA 87 CO 0.04 -0.36 -0.04 1.96 0.00 0.00 0.00 179.25 180.85 3mzn h GLN 88 N 0.00 0.00 0.00 0.00 4.20 -1.28 -0.21 115.11 117.82 3mzn h GLN 88 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3mzn h GLN 88 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3mzn h GLN 88 CO -0.00 0.04 0.00 0.41 -0.67 0.00 0.00 178.83 178.61 3mzn n GLY 89 N -1.10 -0.91 0.00 3.46 0.00 -0.77 -5.00 105.19 100.87 3mzn n GLY 89 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3mzn n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mzn n GLY 90 N 0.10 -0.30 3.76 -0.02 0.00 -0.09 -4.99 105.19 103.65 3mzn n GLY 90 Ca 0.06 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 3mzn n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3mzn n PRO 91 N -0.28 2.15 -4.45 1.61 -0.04 -1.26 -4.90 135.00 127.84 3mzn n PRO 91 Ca 0.00 0.77 -0.26 0.00 -0.04 0.00 0.00 63.50 63.97 3mzn n PRO 91 Cb 0.00 -2.61 -0.13 0.00 -0.04 0.00 0.00 33.50 30.72 3mzn n PRO 91 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3mzn s GLU 92 N -2.49 1.28 -0.03 0.54 2.02 -1.26 -5.15 118.70 113.61 3mzn s GLU 92 Ca 0.63 -1.12 0.06 0.00 0.02 0.00 0.00 54.97 54.56 3mzn s GLU 92 Cb -0.45 -1.53 -0.02 0.00 0.10 0.00 0.00 34.13 32.22 3mzn s GLU 92 CO 0.56 0.37 -0.22 -1.21 0.02 0.00 0.00 175.26 174.79 3mzn s GLU 93 N -1.67 2.24 0.18 1.61 2.02 -1.26 -5.03 118.70 116.79 3mzn s GLU 93 Ca 0.08 -0.85 -0.13 0.00 0.02 0.00 0.00 54.97 54.08 3mzn s GLU 93 Cb -0.10 -2.16 0.18 0.00 0.10 0.00 0.00 34.13 32.15 3mzn s GLU 93 CO 0.04 0.58 1.71 -0.09 0.02 0.00 0.00 175.26 177.52 3mzn h ARG 94 N 5.39 0.20 0.00 1.61 2.43 -1.98 -3.35 114.38 118.68 3mzn h ARG 94 Ca -0.44 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3mzn h ARG 94 Cb 1.13 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3mzn h ARG 94 CO 0.48 0.13 0.00 0.41 -1.51 0.00 0.00 179.97 179.48 3mzn n GLY 95 N -1.29 -2.71 0.54 2.80 0.00 -1.26 -1.35 105.19 101.92 3mzn n GLY 95 Ca 0.05 -1.89 0.08 0.00 0.00 0.00 0.00 46.02 44.26 3mzn n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mzn n ARG 96 N -0.15 1.52 -1.58 1.61 5.12 -1.26 -4.96 116.66 116.96 3mzn n ARG 96 Ca 0.00 -1.19 -0.29 0.00 -1.93 0.00 0.00 57.85 54.44 3mzn n ARG 96 Cb 0.00 -1.31 0.14 0.00 -1.16 0.00 0.00 32.46 30.14 3mzn n ARG 96 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3mzn s GLN 97 N -1.66 1.02 0.59 5.56 -1.52 -1.26 -4.86 119.66 117.51 3mzn s GLN 97 Ca 0.17 0.19 0.37 0.00 -1.95 0.00 0.00 55.36 54.13 3mzn s GLN 97 Cb 0.14 -1.83 1.70 0.00 -0.22 0.00 0.00 33.01 32.80 3mzn s GLN 97 CO 0.31 -2.26 2.11 1.79 -0.25 0.00 0.00 175.29 176.99 3mzn h THR 98 N -1.54 0.04 -1.31 -0.19 1.35 -1.94 -3.44 112.91 105.87 3mzn h THR 98 Ca -0.49 -0.36 -0.60 0.00 -0.55 0.00 0.00 66.41 64.41 3mzn h THR 98 Cb 1.32 1.35 -0.09 0.00 -1.73 0.00 0.00 68.15 69.00 3mzn h THR 98 CO 0.58 0.01 -0.49 0.72 -0.25 0.00 0.00 175.52 176.09 3mzn s PHE 99 N -3.84 2.37 -0.21 4.73 -0.12 -1.26 -5.01 117.98 114.64 3mzn s PHE 99 Ca -0.01 -0.68 -0.11 0.00 -0.05 0.00 0.00 56.93 56.07 3mzn s PHE 99 Cb 0.10 -1.88 -0.05 0.00 -0.63 0.00 0.00 43.02 40.57 3mzn s PHE 99 CO 0.50 0.16 0.19 0.34 -0.05 0.00 0.00 175.22 176.36 3mzn s ASP 100 N -3.91 6.22 0.00 1.98 -1.08 -1.26 -4.84 116.67 113.78 3mzn s ASP 100 Ca 0.34 0.24 0.21 0.00 -0.52 0.00 0.00 52.55 52.82 3mzn s ASP 100 Cb 0.04 -2.12 0.54 0.00 -1.46 0.00 0.00 42.92 39.92 3mzn s ASP 100 CO 0.19 0.10 1.45 0.18 0.52 0.00 0.00 175.17 177.60 3mzn n LEU 101 N 3.94 2.73 -4.76 -1.34 4.77 -0.46 -4.95 117.00 116.92 3mzn n LEU 101 Ca -0.14 -1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 54.30 3mzn n LEU 101 Cb 0.52 -0.22 0.06 0.00 -2.33 0.00 0.00 43.42 41.45 3mzn n LEU 101 CO 0.37 0.60 0.73 -0.13 -1.33 0.00 0.00 177.39 177.64 3mzn s ARG 102 N -1.55 2.59 -0.12 3.23 0.52 -1.26 -4.93 118.95 117.44 3mzn s ARG 102 Ca 0.36 1.37 -0.08 0.00 -0.52 0.00 0.00 55.73 56.86 3mzn s ARG 102 Cb 0.20 -1.93 -0.05 0.00 0.52 0.00 0.00 34.95 33.69 3mzn s ARG 102 CO 0.28 -1.41 -0.19 0.28 0.02 0.00 0.00 175.30 174.28 3mzn n VAL 103 N -2.73 1.00 -0.28 3.52 0.31 -1.26 -4.70 118.33 114.19 3mzn n VAL 103 Ca 0.10 -0.06 -0.03 0.00 -0.01 0.00 0.00 64.34 64.35 3mzn n VAL 103 Cb 0.52 -1.80 0.09 0.00 -0.91 0.00 0.00 33.84 31.74 3mzn n VAL 103 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mzn h ALA 104 N -0.54 1.01 -0.41 3.52 0.00 -1.95 -1.99 119.26 118.90 3mzn h ALA 104 Ca -0.26 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 3mzn h ALA 104 Cb 1.08 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3mzn h ALA 104 CO -0.16 0.30 -0.03 -0.39 0.00 0.00 0.00 179.25 178.97 3mzn h VAL 105 N 0.96 1.23 -0.27 0.00 -1.51 -1.89 -1.49 116.25 113.29 3mzn h VAL 105 Ca 0.31 -0.98 -0.04 0.00 -1.23 0.00 0.00 66.70 64.75 3mzn h VAL 105 Cb 0.00 0.96 -0.01 0.00 -2.13 0.00 0.00 31.29 30.11 3mzn h VAL 105 CO -0.11 0.34 -0.01 0.45 -1.23 0.00 0.00 177.57 177.01 3mzn h HIS 106 N 0.63 0.52 -0.25 5.19 3.86 -1.50 -1.96 115.15 121.65 3mzn h HIS 106 Ca 0.12 -0.09 0.05 0.00 -1.16 0.00 0.00 60.37 59.29 3mzn h HIS 106 Cb 0.45 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.73 3mzn h HIS 106 CO 0.02 0.64 -0.08 0.28 0.86 0.00 0.00 177.93 179.65 3mzn h VAL 107 N 0.25 0.72 -0.19 2.45 2.07 -1.02 -1.51 116.25 119.02 3mzn h VAL 107 Ca 0.07 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.63 3mzn h VAL 107 Cb 0.44 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3mzn h VAL 107 CO 0.02 0.00 0.00 0.40 0.02 0.00 0.00 177.57 178.01 3mzn h ILE 108 N -0.02 0.87 -0.78 4.57 1.08 -1.22 -2.62 117.51 119.38 3mzn h ILE 108 Ca 0.12 -0.02 0.07 0.00 -0.39 0.00 0.00 64.86 64.64 3mzn h ILE 108 Cb 0.21 0.80 -0.06 0.00 -3.07 0.00 0.00 36.82 34.69 3mzn h ILE 108 CO -0.27 0.01 0.46 0.74 -0.69 0.00 0.00 178.15 178.40 3mzn h THR 109 N 0.07 0.98 -0.45 -0.27 2.02 -0.88 0.41 112.91 114.79 3mzn h THR 109 Ca 0.09 -0.28 0.02 0.00 0.77 0.00 0.00 66.41 67.01 3mzn h THR 109 Cb 0.11 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.57 3mzn h THR 109 CO -0.15 0.15 0.26 0.00 0.37 0.00 0.00 175.52 176.15 3mzn h ALA 110 N 1.40 0.58 -0.25 6.16 0.00 -0.95 -0.31 119.26 125.89 3mzn h ALA 110 Ca 0.35 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 3mzn h ALA 110 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3mzn h ALA 110 CO -0.19 -0.05 0.09 0.82 0.00 0.00 0.00 179.25 179.91 3mzn h ILE 111 N 0.53 1.18 -0.33 0.00 2.04 -1.09 -2.50 117.51 117.34 3mzn h ILE 111 Ca 0.18 -0.56 0.06 0.00 1.00 0.00 0.00 64.86 65.54 3mzn h ILE 111 Cb 0.02 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 3mzn h ILE 111 CO -0.09 0.19 0.01 -0.08 0.00 0.00 0.00 178.15 178.18 3mzn h GLU 112 N 0.24 0.11 -0.25 2.37 4.81 -0.61 -0.16 114.58 121.09 3mzn h GLU 112 Ca 0.08 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3mzn h GLU 112 Cb 0.20 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3mzn h GLU 112 CO -0.00 0.07 0.09 1.03 -0.73 0.00 0.00 179.01 179.47 3mzn h SER 113 N 0.11 0.35 -0.68 1.04 0.87 -0.96 0.13 113.55 114.41 3mzn h SER 113 Ca 0.16 -0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 3mzn h SER 113 Cb 0.21 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 3mzn h SER 113 CO -0.26 0.44 0.20 0.00 -0.53 0.00 0.00 176.83 176.68 3mzn h ALA 114 N 0.93 0.89 -0.25 6.23 0.00 -1.11 0.10 119.26 126.05 3mzn h ALA 114 Ca 0.08 -0.22 -0.20 0.00 0.00 0.00 0.00 54.91 54.57 3mzn h ALA 114 Cb 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3mzn h ALA 114 CO -0.01 0.57 -0.62 -0.07 0.00 0.00 0.00 179.25 179.13 3mzn h LEU 115 N 0.99 0.98 -1.11 0.00 3.38 -0.89 -1.79 115.31 116.86 3mzn h LEU 115 Ca 0.22 -0.56 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 3mzn h LEU 115 Cb 0.32 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3mzn h LEU 115 CO -0.00 1.36 0.11 -0.26 0.09 0.00 0.00 178.44 179.74 3mzn h PHE 116 N 0.63 0.76 0.23 1.13 0.04 -0.52 0.33 116.94 119.53 3mzn h PHE 116 Ca -0.01 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 3mzn h PHE 116 Cb 1.24 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 39.16 3mzn h PHE 116 CO 0.08 0.65 -0.13 0.22 -0.60 0.00 0.00 178.31 178.53 3mzn h ASP 117 N 0.72 -0.31 -0.64 2.17 3.58 -0.58 0.39 116.42 121.74 3mzn h ASP 117 Ca 0.16 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 3mzn h ASP 117 Cb 0.27 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.38 3mzn h ASP 117 CO -0.00 -0.21 0.37 -0.07 -2.88 0.00 0.00 179.24 176.45 3mzn h LEU 118 N -0.33 0.79 -0.26 2.28 3.38 -1.18 -1.44 115.31 118.55 3mzn h LEU 118 Ca -0.03 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3mzn h LEU 118 Cb 0.27 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3mzn h LEU 118 CO 0.03 0.64 0.07 0.15 0.09 0.00 0.00 178.44 179.42 3mzn h PHE 119 N 0.88 0.44 -0.63 1.13 3.57 -0.77 0.44 116.94 122.00 3mzn h PHE 119 Ca 0.23 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.76 3mzn h PHE 119 Cb 0.01 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.56 3mzn h PHE 119 CO -0.01 0.50 0.29 0.78 -2.23 0.00 0.00 178.31 177.64 3mzn h GLY 120 N 0.25 0.91 1.03 2.40 0.00 -0.81 -0.58 103.07 106.27 3mzn h GLY 120 Ca 0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 3mzn h GLY 120 CO 0.00 0.06 0.41 1.46 0.00 0.00 0.00 176.54 178.47 3mzn h GLN 121 N 0.53 1.18 0.00 4.80 4.20 -0.88 0.17 115.11 125.11 3mzn h GLN 121 Ca 0.30 -0.17 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 3mzn h GLN 121 Cb 0.29 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3mzn h GLN 121 CO -0.24 0.90 -0.19 0.00 -0.67 0.00 0.00 178.83 178.63 3mzn h ALA 122 N 1.22 1.67 -0.00 3.87 0.00 -0.18 -2.86 119.26 122.98 3mzn h ALA 122 Ca 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3mzn h ALA 122 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3mzn h ALA 122 CO -0.04 0.24 -0.63 1.28 0.00 0.00 0.00 179.25 180.10 3mzn n LEU 123 N -4.29 0.81 -1.36 0.00 4.77 -0.29 -4.96 117.00 111.68 3mzn n LEU 123 Ca -0.02 -0.23 -0.12 0.00 -0.03 0.00 0.00 56.01 55.61 3mzn n LEU 123 Cb 0.25 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3mzn n LEU 123 CO 0.36 0.19 -0.14 0.61 -1.33 0.00 0.00 177.39 177.08 3mzn n GLY 124 N 1.48 -0.10 3.18 -0.72 0.00 0.14 -5.04 105.19 104.13 3mzn n GLY 124 Ca 0.06 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 3mzn n GLY 124 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3mzn s MET 125 N -4.63 1.32 0.58 1.61 1.00 0.36 -4.60 119.30 114.94 3mzn s MET 125 Ca 0.01 -0.73 -0.19 0.00 0.00 0.00 0.00 55.69 54.79 3mzn s MET 125 Cb -0.01 -1.33 -0.04 0.00 0.00 0.00 0.00 34.83 33.46 3mzn s MET 125 CO 0.02 0.35 1.17 -2.14 0.00 0.00 0.00 175.02 174.42 3mzn s PRO 126 N -0.73 3.12 0.23 2.03 0.02 -1.22 -0.28 135.00 138.16 3mzn s PRO 126 Ca 0.06 1.72 -0.07 0.00 0.02 0.00 0.00 61.00 62.73 3mzn s PRO 126 Cb -0.07 -1.96 0.29 0.00 0.02 0.00 0.00 34.50 32.78 3mzn s PRO 126 CO 0.00 -1.06 1.83 0.28 -0.33 0.00 0.00 177.00 177.72 3mzn h VAL 127 N 0.98 1.00 -0.97 3.83 2.07 -1.54 -2.15 116.25 119.47 3mzn h VAL 127 Ca -0.50 -0.28 0.22 0.00 0.82 0.00 0.00 66.70 66.96 3mzn h VAL 127 Cb 1.28 0.11 -0.12 0.00 -1.52 0.00 0.00 31.29 31.04 3mzn h VAL 127 CO 0.56 0.15 0.55 0.00 0.02 0.00 0.00 177.57 178.85 3mzn h ALA 128 N 1.38 1.67 0.00 1.67 0.00 -1.86 0.14 119.26 122.26 3mzn h ALA 128 Ca 0.34 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.37 3mzn h ALA 128 Cb 0.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3mzn h ALA 128 CO -0.18 -0.23 0.00 -0.25 0.00 0.00 0.00 179.25 178.59 3mzn n ASP 129 N -4.89 0.52 -0.00 0.00 9.92 -0.81 -2.37 116.55 118.92 3mzn n ASP 129 Ca 0.25 0.63 0.10 0.00 -0.53 0.00 0.00 54.79 55.24 3mzn n ASP 129 Cb 0.68 -0.74 -0.12 0.00 -0.64 0.00 0.00 41.12 40.30 3mzn n ASP 129 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3mzn n LEU 130 N -2.07 0.64 -4.86 0.64 4.77 0.47 -4.59 117.00 112.00 3mzn n LEU 130 Ca 0.03 -0.29 -0.34 0.00 -0.03 0.00 0.00 56.01 55.37 3mzn n LEU 130 Cb 0.22 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 3mzn n LEU 130 CO 0.19 0.15 0.15 -0.76 -1.33 0.00 0.00 177.39 175.78 3mzn s LEU 131 N -3.56 4.32 0.11 2.23 1.43 -1.00 -4.96 118.68 117.25 3mzn s LEU 131 Ca 0.03 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.03 3mzn s LEU 131 Cb 0.15 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 43.19 3mzn s LEU 131 CO 0.87 0.11 0.00 0.61 0.23 0.00 0.00 176.35 178.18 3mzn n GLY 132 N 0.71 -1.66 0.21 -3.19 0.00 -1.26 -2.30 105.19 97.70 3mzn n GLY 132 Ca -0.06 -1.42 0.08 0.00 0.00 0.00 0.00 46.02 44.63 3mzn n GLY 132 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3mzn h GLN 133 N -0.38 0.00 -0.00 1.61 4.20 -1.94 -3.34 115.11 115.26 3mzn h GLN 133 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3mzn h GLN 133 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3mzn h GLN 133 CO 0.01 0.28 -0.32 0.66 -0.67 0.00 0.00 178.83 178.78 3mzn n TYR 134 N -3.46 0.00 -4.96 2.96 4.01 -1.26 -5.08 117.16 109.37 3mzn n TYR 134 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3mzn n TYR 134 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.49 3mzn n TYR 134 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mzn n GLY 135 N 1.05 1.87 3.70 2.72 0.00 -0.97 -4.66 105.19 108.89 3mzn n GLY 135 Ca 0.03 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 3mzn n GLY 135 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mzn s ARG 136 N 0.00 4.32 0.00 1.61 3.52 -1.23 -4.27 118.95 122.90 3mzn s ARG 136 Ca 0.00 1.93 0.01 0.00 -0.13 0.00 0.00 55.73 57.54 3mzn s ARG 136 Cb 0.00 -3.46 0.01 0.00 -1.56 0.00 0.00 34.95 29.93 3mzn s ARG 136 CO 0.00 -0.48 0.51 1.04 -0.81 0.00 0.00 175.30 175.56 3mzn n GLN 137 N 4.80 -0.65 -3.53 5.12 1.13 0.62 -4.98 117.38 119.89 3mzn n GLN 137 Ca 0.12 -0.52 -0.16 0.00 -1.94 0.00 0.00 57.00 54.50 3mzn n GLN 137 Cb 0.44 -1.00 -0.06 0.00 0.11 0.00 0.00 30.24 29.74 3mzn n GLN 137 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3mzn s ARG 138 N -0.09 0.97 0.00 -1.09 1.70 -1.14 -4.94 118.95 114.36 3mzn s ARG 138 Ca 0.01 0.19 0.19 0.00 -0.47 0.00 0.00 55.73 55.65 3mzn s ARG 138 Cb 0.01 0.46 0.03 0.00 -0.57 0.00 0.00 34.95 34.88 3mzn s ARG 138 CO 0.01 -0.31 1.00 -0.25 -1.08 0.00 0.00 175.30 174.67 3mzn n ASP 139 N 0.79 2.02 -3.95 -2.89 8.00 -1.26 -4.83 116.55 114.43 3mzn n ASP 139 Ca -0.17 -1.51 -0.09 0.00 0.71 0.00 0.00 54.79 53.73 3mzn n ASP 139 Cb 0.58 0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 41.93 3mzn n ASP 139 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3mzn s GLU 140 N -2.02 0.48 -0.10 -1.24 -1.05 -1.26 -0.62 118.70 112.89 3mzn s GLU 140 Ca 0.17 -0.67 -0.01 0.00 -0.15 0.00 0.00 54.97 54.31 3mzn s GLU 140 Cb 0.16 0.19 0.03 0.00 -0.44 0.00 0.00 34.13 34.06 3mzn s GLU 140 CO 0.42 -0.11 -0.00 0.08 0.95 0.00 0.00 175.26 176.60 3mzn s VAL 141 N -2.10 0.50 0.31 1.83 1.01 0.21 -4.93 120.40 117.23 3mzn s VAL 141 Ca -0.09 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 3mzn s VAL 141 Cb -0.04 -0.70 -0.10 0.00 0.00 0.00 0.00 36.38 35.53 3mzn s VAL 141 CO -0.03 0.19 1.24 -1.61 0.00 0.00 0.00 175.10 174.90 3mzn s GLU 142 N 1.91 4.45 0.16 2.72 2.02 -1.26 -0.71 118.70 127.99 3mzn s GLU 142 Ca 0.04 2.08 0.10 0.00 0.02 0.00 0.00 54.97 57.21 3mzn s GLU 142 Cb -0.13 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 30.94 3mzn s GLU 142 CO -0.06 -0.06 -0.23 0.00 0.02 0.00 0.00 175.26 174.92 3mzn s ALA 143 N -1.08 2.27 0.27 5.21 0.00 0.05 -1.24 121.76 127.25 3mzn s ALA 143 Ca 0.48 -1.50 0.08 0.00 0.00 0.00 0.00 51.96 51.01 3mzn s ALA 143 Cb -0.37 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 3mzn s ALA 143 CO 0.48 0.41 0.18 -0.48 0.00 0.00 0.00 175.76 176.35 3mzn s LEU 144 N -2.38 3.65 -0.38 0.00 0.05 -0.53 -4.63 118.68 114.47 3mzn s LEU 144 Ca 0.16 -0.39 -0.22 0.00 0.05 0.00 0.00 54.13 53.73 3mzn s LEU 144 Cb -0.08 -2.19 0.01 0.00 -2.05 0.00 0.00 46.19 41.88 3mzn s LEU 144 CO 0.07 -0.10 0.71 -0.83 -0.55 0.00 0.00 176.35 175.65 3mzn s GLY 145 N -3.84 1.69 -0.78 -3.48 0.00 -0.01 -4.32 107.32 96.58 3mzn s GLY 145 Ca 0.34 -0.83 -0.18 0.00 0.00 0.00 0.00 44.72 44.05 3mzn s GLY 145 CO 0.24 1.63 0.89 -0.47 0.00 0.00 0.00 173.10 175.39 3mzn s TYR 146 N 2.94 3.24 0.21 1.90 6.04 -1.26 -1.40 117.35 129.02 3mzn s TYR 146 Ca 0.27 -1.39 -0.23 0.00 0.04 0.00 0.00 57.07 55.77 3mzn s TYR 146 Cb -0.14 -4.07 -0.08 0.00 -1.04 0.00 0.00 41.96 36.63 3mzn s TYR 146 CO 0.17 -1.30 0.77 -0.51 -1.54 0.00 0.00 175.55 173.14 3mzn s LEU 147 N 2.06 4.45 0.02 6.97 1.43 0.35 -4.96 118.68 129.00 3mzn s LEU 147 Ca 0.22 1.57 0.05 0.00 -1.03 0.00 0.00 54.13 54.93 3mzn s LEU 147 Cb -0.13 -3.51 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 3mzn s LEU 147 CO -0.04 0.10 -0.14 -0.36 0.23 0.00 0.00 176.35 176.14 3mzn s PHE 148 N -1.37 1.22 0.51 0.29 0.08 -1.26 -0.90 117.98 116.54 3mzn s PHE 148 Ca 0.41 -0.31 -0.23 0.00 0.12 0.00 0.00 56.93 56.92 3mzn s PHE 148 Cb -0.20 -0.74 -0.06 0.00 -0.57 0.00 0.00 43.02 41.45 3mzn s PHE 148 CO 0.24 0.02 1.32 -0.51 -0.10 0.00 0.00 175.22 176.18 3mzn s LEU 149 N -0.88 3.94 -0.05 -0.37 1.43 -1.26 -4.91 118.68 116.57 3mzn s LEU 149 Ca 0.03 2.67 0.04 0.00 -1.03 0.00 0.00 54.13 55.83 3mzn s LEU 149 Cb -0.07 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 41.95 3mzn s LEU 149 CO 0.01 -1.33 -0.15 -0.76 0.23 0.00 0.00 176.35 174.35 3mzn s LEU 150 N -3.25 1.84 0.71 1.79 1.43 0.36 -1.73 118.68 119.84 3mzn s LEU 150 Ca 0.68 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 53.34 3mzn s LEU 150 Cb -0.38 -0.90 0.02 0.00 0.03 0.00 0.00 46.19 44.96 3mzn s LEU 150 CO 0.46 0.11 1.07 -0.83 0.23 0.00 0.00 176.35 177.39 3mzn s GLY 151 N 0.22 1.67 -0.49 -3.19 0.00 -0.22 -1.18 107.32 104.13 3mzn s GLY 151 Ca -0.07 0.12 -0.28 0.00 0.00 0.00 0.00 44.72 44.48 3mzn s GLY 151 CO 0.03 0.44 1.12 -0.35 0.00 0.00 0.00 173.10 174.33 3mzn s ASP 152 N -3.71 6.59 0.59 1.64 -1.08 -1.26 -4.06 116.67 115.38 3mzn s ASP 152 Ca 0.59 0.37 0.29 0.00 -0.52 0.00 0.00 52.55 53.27 3mzn s ASP 152 Cb -0.15 -2.54 1.68 0.00 -1.46 0.00 0.00 42.92 40.46 3mzn s ASP 152 CO 0.55 -1.26 2.12 -0.65 0.52 0.00 0.00 175.17 176.45 3mzn h PRO 153 N 9.26 0.00 0.00 4.34 0.11 -1.94 -0.69 132.00 143.08 3mzn h PRO 153 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3mzn h PRO 153 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3mzn h PRO 153 CO 1.13 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.67 3mzn n ASP 154 N -3.80 0.00 -0.10 -2.05 8.00 -1.26 -1.71 116.55 115.63 3mzn n ASP 154 Ca 0.01 0.35 0.15 0.00 0.71 0.00 0.00 54.79 56.02 3mzn n ASP 154 Cb 0.30 -0.44 0.82 0.00 -0.02 0.00 0.00 41.12 41.77 3mzn n ASP 154 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3mzn n LYS 155 N -1.44 1.04 -4.49 -1.24 5.02 -0.27 -4.88 118.16 111.91 3mzn n LYS 155 Ca 0.07 -0.20 -0.23 0.00 -2.02 0.00 0.00 58.31 55.92 3mzn n LYS 155 Cb 0.23 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 3mzn n LYS 155 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mzn s THR 156 N -2.10 1.17 -0.22 -0.18 -4.23 -0.69 -4.77 115.64 104.61 3mzn s THR 156 Ca 0.43 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.08 3mzn s THR 156 Cb 0.21 -2.71 0.54 0.00 1.34 0.00 0.00 72.50 71.88 3mzn s THR 156 CO 0.38 0.00 1.46 -0.90 -0.54 0.00 0.00 174.62 175.02 3mzn n ASP 157 N -0.84 3.53 -4.83 3.99 5.68 -1.26 -5.02 116.55 117.80 3mzn n ASP 157 Ca -0.04 -3.25 -0.34 0.00 -0.50 0.00 0.00 54.79 50.66 3mzn n ASP 157 Cb 0.66 -0.59 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 3mzn n ASP 157 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3mzn s LEU 158 N -2.97 4.17 -0.23 -2.12 1.43 -1.26 -4.96 118.68 112.74 3mzn s LEU 158 Ca 0.44 1.35 -0.06 0.00 -1.03 0.00 0.00 54.13 54.83 3mzn s LEU 158 Cb 0.37 -3.91 -0.22 0.00 0.03 0.00 0.00 46.19 42.46 3mzn s LEU 158 CO 0.07 -0.12 3.25 -0.81 0.23 0.00 0.00 176.35 178.97 3mzn n PRO 159 N 0.05 2.06 -1.80 1.29 -0.04 -1.26 -4.93 135.00 130.37 3mzn n PRO 159 Ca 0.01 -1.08 -0.39 0.00 -0.04 0.00 0.00 63.50 62.00 3mzn n PRO 159 Cb 0.52 -2.07 0.03 0.00 -0.04 0.00 0.00 33.50 31.94 3mzn n PRO 159 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3mzn s TYR 160 N 1.38 2.33 0.54 0.54 2.02 -1.26 -4.89 117.35 118.01 3mzn s TYR 160 Ca 0.61 1.35 -0.21 0.00 -0.37 0.00 0.00 57.07 58.45 3mzn s TYR 160 Cb 0.27 -3.82 -0.05 0.00 -0.40 0.00 0.00 41.96 37.96 3mzn s TYR 160 CO -0.01 -2.89 1.26 -1.25 -1.57 0.00 0.00 175.55 171.10 3mzn s PRO 161 N -2.80 3.25 0.26 -1.71 0.04 -1.26 -5.03 135.00 127.75 3mzn s PRO 161 Ca 0.69 2.00 0.08 0.00 0.04 0.00 0.00 61.00 63.81 3mzn s PRO 161 Cb -0.41 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 3mzn s PRO 161 CO 0.49 -1.03 -0.11 1.03 0.04 0.00 0.00 177.00 177.42 3mzn s ARG 162 N -2.97 1.52 0.23 4.56 1.81 -1.26 -4.83 118.95 118.01 3mzn s ARG 162 Ca 0.71 -1.73 -0.32 0.00 -1.72 0.00 0.00 55.73 52.67 3mzn s ARG 162 Cb -0.34 -1.30 -0.13 0.00 -0.45 0.00 0.00 34.95 32.73 3mzn s ARG 162 CO 0.40 0.15 1.48 0.28 -0.68 0.00 0.00 175.30 176.93 3mzn n VAL 163 N -0.54 0.74 -3.37 3.52 0.31 -1.26 -4.99 118.33 112.74 3mzn n VAL 163 Ca -0.06 -0.19 0.02 0.00 -0.01 0.00 0.00 64.34 64.10 3mzn n VAL 163 Cb 0.62 -1.58 -0.03 0.00 -0.91 0.00 0.00 33.84 31.94 3mzn n VAL 163 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mzn s ALA 164 N 0.18 -2.52 -1.17 3.52 0.00 -1.26 -4.99 121.76 115.51 3mzn s ALA 164 Ca 0.70 1.99 -0.12 0.00 0.00 0.00 0.00 51.96 54.53 3mzn s ALA 164 Cb -0.63 -2.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 3mzn s ALA 164 CO 0.47 -1.12 0.78 -3.47 0.00 0.00 0.00 175.76 172.42 3mzn n ASP 165 N 5.30 -4.38 -4.77 0.00 2.03 -1.26 -4.91 116.55 108.56 3mzn n ASP 165 Ca -0.08 -0.91 -0.39 0.00 0.52 0.00 0.00 54.79 53.93 3mzn n ASP 165 Cb 0.51 -3.86 -0.01 0.00 -0.72 0.00 0.00 41.12 37.04 3mzn n ASP 165 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3mzn s PRO 166 N -5.70 3.96 0.07 -0.67 0.04 -1.26 -4.91 135.00 126.52 3mzn s PRO 166 Ca 0.34 2.10 0.14 0.00 0.04 0.00 0.00 61.00 63.62 3mzn s PRO 166 Cb -0.10 -2.73 -0.15 0.00 0.04 0.00 0.00 34.50 31.56 3mzn s PRO 166 CO 0.83 -0.48 0.94 0.28 0.04 0.00 0.00 177.00 178.60 3mzn h VAL 167 N 2.41 0.86 -3.24 -0.36 2.07 -1.90 -3.49 116.25 112.60 3mzn h VAL 167 Ca -0.49 -2.49 -0.12 0.00 0.82 0.00 0.00 66.70 64.42 3mzn h VAL 167 Cb 1.25 2.34 -0.02 0.00 -1.52 0.00 0.00 31.29 33.34 3mzn h VAL 167 CO 0.62 0.49 0.08 -0.90 0.02 0.00 0.00 177.57 177.88 3mzn n ASP 168 N -3.06 -1.62 0.03 0.57 5.68 -1.26 -5.04 116.55 111.85 3mzn n ASP 168 Ca -0.09 -2.48 0.04 0.00 -0.50 0.00 0.00 54.79 51.76 3mzn n ASP 168 Cb 0.91 2.81 0.44 0.00 -1.14 0.00 0.00 41.12 44.14 3mzn n ASP 168 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mzn h ALA 169 N 1.98 1.72 -0.66 2.12 0.00 -1.93 -1.91 119.26 120.58 3mzn h ALA 169 Ca -0.26 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3mzn h ALA 169 Cb 1.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3mzn h ALA 169 CO 0.34 0.25 0.40 2.35 0.00 0.00 0.00 179.25 182.59 3mzn h TRP 170 N 0.49 0.85 0.00 0.00 2.91 -1.96 0.46 115.95 118.70 3mzn h TRP 170 Ca 0.13 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.15 3mzn h TRP 170 Cb -0.03 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.33 3mzn h TRP 170 CO 0.00 0.57 0.00 -0.25 -1.03 0.00 0.00 178.44 177.73 3mzn n ASP 171 N -4.41 0.00 -0.11 2.65 8.00 -0.72 -2.42 116.55 119.54 3mzn n ASP 171 Ca 0.07 0.04 -0.17 0.00 0.71 0.00 0.00 54.79 55.43 3mzn n ASP 171 Cb 0.07 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 40.83 3mzn n ASP 171 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3mzn n GLU 172 N -1.28 0.54 0.19 -1.24 1.02 0.04 -4.62 120.64 115.30 3mzn n GLU 172 Ca 0.08 0.22 0.06 0.00 -0.02 0.00 0.00 57.16 57.50 3mzn n GLU 172 Cb 0.13 -1.42 0.35 0.00 -0.02 0.00 0.00 31.44 30.48 3mzn n GLU 172 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 3mzn h VAL 173 N -0.97 0.86 0.00 2.62 -1.51 -1.25 -2.26 116.25 113.74 3mzn h VAL 173 Ca -0.29 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 63.72 3mzn h VAL 173 Cb 1.23 1.90 0.00 0.00 -2.13 0.00 0.00 31.29 32.29 3mzn h VAL 173 CO -0.17 0.35 0.00 -2.11 -1.23 0.00 0.00 177.57 174.41 3mzn n ARG 174 N -3.54 0.14 -0.24 5.19 1.85 -1.02 -2.75 116.66 116.30 3mzn n ARG 174 Ca -0.00 0.39 0.06 0.00 -1.00 0.00 0.00 57.85 57.30 3mzn n ARG 174 Cb 0.49 -1.77 0.17 0.00 -1.05 0.00 0.00 32.46 30.31 3mzn n ARG 174 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3mzn n TYR 175 N -2.02 0.54 -4.35 2.89 4.01 -0.85 -4.79 117.16 112.58 3mzn n TYR 175 Ca 0.02 -0.63 -0.18 0.00 -0.16 0.00 0.00 57.90 56.95 3mzn n TYR 175 Cb 0.20 -0.12 -0.10 0.00 -0.31 0.00 0.00 39.34 39.01 3mzn n TYR 175 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3mzn s ARG 176 N -1.62 1.38 0.47 -0.72 0.52 -1.11 -4.63 118.95 113.24 3mzn s ARG 176 Ca 0.27 -1.69 -0.23 0.00 -0.52 0.00 0.00 55.73 53.56 3mzn s ARG 176 Cb 0.18 -0.76 -0.09 0.00 0.52 0.00 0.00 34.95 34.79 3mzn s ARG 176 CO 0.12 -0.05 0.97 -1.91 0.02 0.00 0.00 175.30 174.45 3mzn n GLU 177 N -0.45 1.22 -3.38 3.54 2.13 -1.26 -4.80 120.64 117.64 3mzn n GLU 177 Ca -0.05 0.44 -0.16 0.00 0.66 0.00 0.00 57.16 58.05 3mzn n GLU 177 Cb 0.64 -2.05 -0.09 0.00 0.27 0.00 0.00 31.44 30.21 3mzn n GLU 177 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3mzn s ALA 178 N -1.35 -0.57 -0.00 4.31 0.00 -0.33 -4.89 121.76 118.92 3mzn s ALA 178 Ca 0.66 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.23 3mzn s ALA 178 Cb -0.52 -1.91 0.01 0.00 0.00 0.00 0.00 23.12 20.70 3mzn s ALA 178 CO 0.55 -1.82 0.67 -1.33 0.00 0.00 0.00 175.76 173.83 3mzn n MET 179 N 5.06 0.84 -4.20 0.00 2.00 -1.26 -0.49 117.12 119.07 3mzn n MET 179 Ca 0.02 -0.83 -0.12 0.00 0.00 0.00 0.00 57.70 56.76 3mzn n MET 179 Cb 0.46 -0.66 -0.10 0.00 0.00 0.00 0.00 33.22 32.93 3mzn n MET 179 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3mzn s THR 180 N -0.33 0.71 0.26 2.03 -4.23 -1.26 -5.03 115.64 107.78 3mzn s THR 180 Ca 0.01 -1.96 -0.04 0.00 -1.18 0.00 0.00 61.69 58.52 3mzn s THR 180 Cb 0.01 -1.88 0.25 0.00 1.34 0.00 0.00 72.50 72.22 3mzn s THR 180 CO 0.00 -0.70 1.88 -0.65 -0.54 0.00 0.00 174.62 174.61 3mzn h PRO 181 N 2.84 1.10 -0.53 3.99 0.11 -1.88 -1.10 132.00 136.53 3mzn h PRO 181 Ca -0.36 -0.07 0.03 0.00 0.11 0.00 0.00 66.00 65.71 3mzn h PRO 181 Cb 1.18 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.01 3mzn h PRO 181 CO 0.64 0.73 0.31 1.49 -0.21 0.00 0.00 178.00 180.95 3mzn h GLU 182 N 1.13 0.60 -0.74 1.05 4.81 -1.95 -0.30 114.58 119.19 3mzn h GLU 182 Ca 0.41 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 3mzn h GLU 182 Cb 0.14 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 3mzn h GLU 182 CO -0.17 0.40 0.25 0.00 -0.73 0.00 0.00 179.01 178.76 3mzn h ALA 183 N 1.24 0.96 -0.35 2.92 0.00 -1.77 -0.90 119.26 121.36 3mzn h ALA 183 Ca 0.22 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3mzn h ALA 183 Cb 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3mzn h ALA 183 CO -0.10 0.63 0.03 0.28 0.00 0.00 0.00 179.25 180.09 3mzn h VAL 184 N 1.09 1.25 -0.49 0.00 2.07 -0.91 -1.19 116.25 118.07 3mzn h VAL 184 Ca 0.24 -0.90 0.02 0.00 0.82 0.00 0.00 66.70 66.88 3mzn h VAL 184 Cb 0.29 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 3mzn h VAL 184 CO -0.01 0.30 0.33 0.00 0.02 0.00 0.00 177.57 178.20 3mzn h ALA 185 N 0.88 1.71 -0.14 1.67 0.00 -0.84 -1.97 119.26 120.57 3mzn h ALA 185 Ca 0.10 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 3mzn h ALA 185 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3mzn h ALA 185 CO 0.01 0.26 -0.41 -0.91 0.00 0.00 0.00 179.25 178.20 3mzn h ASN 186 N 0.61 0.32 -0.43 0.00 2.35 -0.53 -0.36 115.58 117.54 3mzn h ASN 186 Ca 0.19 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 3mzn h ASN 186 Cb 0.01 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 3mzn h ASN 186 CO -0.04 0.70 0.18 -0.07 -1.65 0.00 0.00 177.43 176.55 3mzn h LEU 187 N 0.26 0.59 -0.07 1.61 3.38 -0.61 -1.79 115.31 118.66 3mzn h LEU 187 Ca 0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 3mzn h LEU 187 Cb 0.83 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 3mzn h LEU 187 CO 0.07 0.58 0.03 0.00 0.09 0.00 0.00 178.44 179.21 3mzn h ALA 188 N 1.03 0.09 -0.47 1.53 0.00 -1.03 0.20 119.26 120.61 3mzn h ALA 188 Ca 0.14 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3mzn h ALA 188 Cb 0.17 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 3mzn h ALA 188 CO -0.01 -0.34 0.17 0.00 0.00 0.00 0.00 179.25 179.07 3mzn h ARG 189 N -0.02 0.34 -0.53 0.00 3.08 -1.00 0.14 114.38 116.39 3mzn h ARG 189 Ca 0.02 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 3mzn h ARG 189 Cb 0.14 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3mzn h ARG 189 CO -0.00 0.22 0.07 0.00 -1.07 0.00 0.00 179.97 179.19 3mzn h ALA 190 N 1.31 0.71 -0.34 0.04 0.00 -1.17 -1.50 119.26 118.32 3mzn h ALA 190 Ca 0.22 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3mzn h ALA 190 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3mzn h ALA 190 CO -0.22 0.46 -0.21 0.00 0.00 0.00 0.00 179.25 179.29 3mzn h ALA 191 N 0.98 1.01 -0.38 0.00 0.00 -0.70 -2.55 119.26 117.62 3mzn h ALA 191 Ca 0.16 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3mzn h ALA 191 Cb 0.43 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3mzn h ALA 191 CO 0.01 0.59 0.14 -0.92 0.00 0.00 0.00 179.25 179.08 3mzn h TYR 192 N 0.57 0.58 -0.56 0.00 3.20 -0.44 0.09 116.97 120.42 3mzn h TYR 192 Ca 0.09 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 3mzn h TYR 192 Cb 0.67 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 3mzn h TYR 192 CO 0.03 0.53 0.31 -0.44 -1.64 0.00 0.00 178.16 176.95 3mzn h ASP 193 N 0.47 0.67 0.13 -2.11 3.32 -1.09 0.12 116.42 117.92 3mzn h ASP 193 Ca 0.13 -0.04 -0.19 0.00 0.02 0.00 0.00 57.03 56.94 3mzn h ASP 193 Cb 0.20 -0.17 0.02 0.00 0.22 0.00 0.00 39.33 39.60 3mzn h ASP 193 CO -0.01 0.54 -0.87 -0.09 -1.72 0.00 0.00 179.24 177.08 3mzn h ARG 194 N 0.77 0.27 0.00 3.56 2.43 -1.13 -3.42 114.38 116.85 3mzn h ARG 194 Ca 0.20 -0.46 -0.06 0.00 -0.81 0.00 0.00 59.98 58.85 3mzn h ARG 194 Cb 0.00 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 3mzn h ARG 194 CO -0.03 1.22 -1.50 0.66 -1.51 0.00 0.00 179.97 178.81 3mzn n TYR 195 N -4.12 0.00 -1.03 2.20 4.01 -0.01 -4.95 117.16 113.26 3mzn n TYR 195 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 3mzn n TYR 195 Cb 0.82 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 3mzn n TYR 195 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mzn n GLY 196 N 2.12 0.46 3.68 2.72 0.00 0.42 -0.70 105.19 113.89 3mzn n GLY 196 Ca -0.06 -0.96 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 3mzn n GLY 196 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mzn n PHE 197 N -3.02 2.14 -0.17 1.61 3.72 -1.26 -2.67 117.46 117.81 3mzn n PHE 197 Ca 0.00 0.55 0.07 0.00 -0.05 0.00 0.00 57.45 58.02 3mzn n PHE 197 Cb 0.07 -2.40 0.18 0.00 -0.94 0.00 0.00 39.48 36.39 3mzn n PHE 197 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3mzn n LYS 198 N 0.86 2.74 -3.78 -1.08 5.02 -1.26 -4.91 118.16 115.74 3mzn n LYS 198 Ca 0.07 -2.13 -0.14 0.00 -2.02 0.00 0.00 58.31 54.08 3mzn n LYS 198 Cb 0.35 -1.33 -0.15 0.00 -0.02 0.00 0.00 35.03 33.88 3mzn n LYS 198 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mzn s ASP 199 N -1.01 -0.01 -0.02 4.39 1.01 -1.26 -1.31 116.67 118.46 3mzn s ASP 199 Ca 0.28 0.12 0.01 0.00 0.71 0.00 0.00 52.55 53.68 3mzn s ASP 199 Cb 0.15 0.04 0.01 0.00 1.01 0.00 0.00 42.92 44.12 3mzn s ASP 199 CO 0.19 -0.11 -0.05 -0.36 0.21 0.00 0.00 175.17 175.06 3mzn s PHE 200 N 0.86 0.55 -0.08 4.23 0.08 -0.38 -0.83 117.98 122.40 3mzn s PHE 200 Ca -0.07 -0.11 0.05 0.00 0.12 0.00 0.00 56.93 56.92 3mzn s PHE 200 Cb -0.10 -0.43 -0.00 0.00 -0.57 0.00 0.00 43.02 41.92 3mzn s PHE 200 CO -0.03 -0.07 -0.23 0.21 -0.10 0.00 0.00 175.22 175.00 3mzn s LYS 201 N 0.27 2.74 -0.21 0.44 2.20 -0.49 -1.87 119.74 122.81 3mzn s LYS 201 Ca -0.03 -0.85 -0.10 0.00 -0.36 0.00 0.00 55.97 54.63 3mzn s LYS 201 Cb -0.07 -2.16 -0.05 0.00 -1.51 0.00 0.00 37.83 34.04 3mzn s LYS 201 CO -0.00 0.25 0.13 -1.17 -0.36 0.00 0.00 175.35 174.19 3mzn s LEU 202 N 0.17 4.12 -0.20 5.43 2.96 -0.09 -0.50 118.68 130.58 3mzn s LEU 202 Ca -0.13 0.17 -0.29 0.00 -0.22 0.00 0.00 54.13 53.66 3mzn s LEU 202 Cb -0.16 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.44 3mzn s LEU 202 CO 0.07 0.15 1.31 -0.75 -1.32 0.00 0.00 176.35 175.80 3mzn s LYS 203 N 0.57 4.13 0.00 1.98 2.47 -0.08 -1.21 119.74 127.60 3mzn s LYS 203 Ca 0.07 1.59 0.00 0.00 -1.56 0.00 0.00 55.97 56.07 3mzn s LYS 203 Cb -0.12 -3.82 0.00 0.00 -1.46 0.00 0.00 37.83 32.43 3mzn s LYS 203 CO 0.00 -0.84 0.00 0.41 0.16 0.00 0.00 175.35 175.08 3mzn n GLY 204 N 3.86 2.97 2.24 5.54 0.00 0.19 -4.36 105.19 115.62 3mzn n GLY 204 Ca 0.14 -1.84 -0.09 0.00 0.00 0.00 0.00 46.02 44.23 3mzn n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mzn n GLY 205 N 5.00 0.72 1.09 -0.02 0.00 -1.26 -4.17 105.19 106.55 3mzn n GLY 205 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3mzn n GLY 205 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mzn n VAL 206 N -3.16 0.85 -2.84 1.61 0.31 -1.26 -0.94 118.33 112.90 3mzn n VAL 206 Ca -0.10 0.28 -0.13 0.00 -0.01 0.00 0.00 64.34 64.38 3mzn n VAL 206 Cb 0.40 -1.51 0.05 0.00 -0.91 0.00 0.00 33.84 31.87 3mzn n VAL 206 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3mzn n LEU 207 N -3.36 0.00 -4.71 7.52 4.77 -1.26 -0.72 117.00 119.24 3mzn n LEU 207 Ca 0.00 -1.52 -0.40 0.00 -0.03 0.00 0.00 56.01 54.06 3mzn n LEU 207 Cb 0.13 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 40.93 3mzn n LEU 207 CO 0.00 -0.69 0.90 0.54 -1.33 0.00 0.00 177.39 176.81 3mzn n ARG 208 N -1.93 1.78 -0.19 3.23 1.74 -1.26 -4.80 116.66 115.23 3mzn n ARG 208 Ca 0.11 0.64 -0.01 0.00 -0.77 0.00 0.00 57.85 57.82 3mzn n ARG 208 Cb 0.38 -2.45 0.07 0.00 -1.02 0.00 0.00 32.46 29.44 3mzn n ARG 208 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3mzn h GLY 209 N 1.72 0.53 1.61 -0.13 0.00 -1.99 -0.96 103.07 103.84 3mzn h GLY 209 Ca -0.49 0.13 0.01 0.00 0.00 0.00 0.00 47.33 46.97 3mzn h GLY 209 CO 0.58 -0.20 0.26 0.83 0.00 0.00 0.00 176.54 178.01 3mzn h GLU 210 N 0.06 0.49 -0.27 4.80 3.07 -1.92 -0.49 114.58 120.32 3mzn h GLU 210 Ca 0.29 -0.03 -0.14 0.00 -0.50 0.00 0.00 59.36 58.98 3mzn h GLU 210 Cb 0.46 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 3mzn h GLU 210 CO -0.54 0.33 -0.42 0.93 -1.40 0.00 0.00 179.01 177.90 3mzn h GLU 211 N 0.51 0.66 -0.20 2.33 5.08 -1.55 -1.41 114.58 120.00 3mzn h GLU 211 Ca 0.14 -0.35 -0.13 0.00 -1.00 0.00 0.00 59.36 58.02 3mzn h GLU 211 Cb -0.04 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3mzn h GLU 211 CO -0.03 0.96 -0.44 0.93 -1.00 0.00 0.00 179.01 179.43 3mzn h GLU 212 N 0.54 0.50 -0.29 2.33 5.08 -0.74 -1.85 114.58 120.14 3mzn h GLU 212 Ca 0.04 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 3mzn h GLU 212 Cb 0.96 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 3mzn h GLU 212 CO 0.09 0.84 0.05 0.00 -1.00 0.00 0.00 179.01 178.99 3mzn h ALA 213 N 1.12 1.55 0.00 3.43 0.00 -0.93 -1.30 119.26 123.14 3mzn h ALA 213 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3mzn h ALA 213 Cb 0.93 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3mzn h ALA 213 CO 0.08 0.34 -0.45 -0.44 0.00 0.00 0.00 179.25 178.78 3mzn h ASP 214 N 0.42 0.00 -0.57 0.00 3.32 -0.72 -1.45 116.42 117.41 3mzn h ASP 214 Ca 0.10 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 3mzn h ASP 214 Cb 0.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 3mzn h ASP 214 CO -0.00 0.45 0.06 0.00 -1.72 0.00 0.00 179.24 178.02 3mzn h ILE 216 N 0.86 1.20 -0.50 0.00 1.08 -0.90 -0.83 117.51 118.42 3mzn h ILE 216 Ca 0.17 -0.52 0.06 0.00 -0.39 0.00 0.00 64.86 64.18 3mzn h ILE 216 Cb 0.47 0.44 -0.05 0.00 -3.07 0.00 0.00 36.82 34.61 3mzn h ILE 216 CO 0.02 0.22 0.20 0.03 -0.69 0.00 0.00 178.15 177.93 3mzn h ARG 217 N 0.82 0.39 -0.74 2.37 3.08 -1.13 -0.42 114.38 118.74 3mzn h ARG 217 Ca 0.21 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 3mzn h ARG 217 Cb 0.07 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 3mzn h ARG 217 CO -0.03 0.26 0.31 0.00 -1.07 0.00 0.00 179.97 179.44 3mzn h ALA 218 N 1.32 0.96 -0.66 0.04 0.00 -0.92 -0.87 119.26 119.13 3mzn h ALA 218 Ca 0.24 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3mzn h ALA 218 Cb 0.22 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3mzn h ALA 218 CO -0.22 0.57 0.26 -0.07 0.00 0.00 0.00 179.25 179.79 3mzn h LEU 219 N 1.06 0.93 -1.02 0.00 3.38 -0.71 -0.64 115.31 118.32 3mzn h LEU 219 Ca 0.25 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3mzn h LEU 219 Cb 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3mzn h LEU 219 CO -0.02 0.85 0.07 -0.74 0.09 0.00 0.00 178.44 178.68 3mzn h HIS 220 N 0.94 0.81 -0.40 1.13 2.76 -0.78 0.12 115.15 119.73 3mzn h HIS 220 Ca 0.22 -0.09 -0.09 0.00 -2.20 0.00 0.00 60.37 58.21 3mzn h HIS 220 Cb 0.22 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.94 3mzn h HIS 220 CO 0.02 0.72 -0.14 0.93 -1.30 0.00 0.00 177.93 178.15 3mzn h GLU 221 N 0.74 0.73 -0.17 5.26 4.39 -0.60 -2.46 114.58 122.47 3mzn h GLU 221 Ca 0.16 -0.25 -0.21 0.00 0.34 0.00 0.00 59.36 59.40 3mzn h GLU 221 Cb 0.36 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 28.95 3mzn h GLU 221 CO 0.01 0.84 -0.71 0.00 -1.16 0.00 0.00 179.01 177.98 3mzn h ALA 222 N 1.19 0.41 -2.49 3.43 0.00 -0.49 -3.39 119.26 117.91 3mzn h ALA 222 Ca 0.11 -0.58 -0.59 0.00 0.00 0.00 0.00 54.91 53.84 3mzn h ALA 222 Cb 0.61 -0.04 -0.39 0.00 0.00 0.00 0.00 17.79 17.97 3mzn h ALA 222 CO 0.04 0.70 -0.88 1.19 0.00 0.00 0.00 179.25 180.29 3mzn n PHE 223 N -3.94 0.24 0.31 0.00 3.72 0.36 -4.99 117.46 113.17 3mzn n PHE 223 Ca -0.06 -3.59 0.19 0.00 -0.05 0.00 0.00 57.45 53.94 3mzn n PHE 223 Cb 0.71 -0.02 1.04 0.00 -0.94 0.00 0.00 39.48 40.27 3mzn n PHE 223 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3mzn h PRO 224 N 5.39 0.00 -0.02 -1.08 0.11 -1.65 -1.68 132.00 133.07 3mzn h PRO 224 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3mzn h PRO 224 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3mzn h PRO 224 CO 0.48 0.01 -0.42 0.39 -0.21 0.00 0.00 178.00 178.25 3mzn n GLU 225 N -3.36 1.37 -2.36 1.05 -0.58 -1.26 -4.98 120.64 110.51 3mzn n GLU 225 Ca -0.03 -1.05 -0.37 0.00 -0.42 0.00 0.00 57.16 55.29 3mzn n GLU 225 Cb 0.11 -1.45 -0.02 0.00 -0.57 0.00 0.00 31.44 29.52 3mzn n GLU 225 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3mzn s ALA 226 N -2.35 3.00 -0.05 0.62 0.00 -0.63 -5.02 121.76 117.33 3mzn s ALA 226 Ca 0.18 0.84 -0.24 0.00 0.00 0.00 0.00 51.96 52.74 3mzn s ALA 226 Cb 0.17 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 3mzn s ALA 226 CO 0.52 -0.50 0.74 1.03 0.00 0.00 0.00 175.76 177.55 3mzn s ARG 227 N -2.66 4.46 0.08 0.00 0.52 -0.43 -4.97 118.95 115.94 3mzn s ARG 227 Ca 0.62 0.96 0.10 0.00 -0.52 0.00 0.00 55.73 56.89 3mzn s ARG 227 Cb -0.26 -3.45 -0.03 0.00 0.52 0.00 0.00 34.95 31.73 3mzn s ARG 227 CO 0.32 0.06 -0.26 -0.51 0.02 0.00 0.00 175.30 174.92 3mzn s LEU 228 N 0.80 2.24 0.04 2.53 1.43 -1.26 -1.25 118.68 123.20 3mzn s LEU 228 Ca 0.39 -0.65 -0.02 0.00 -1.03 0.00 0.00 54.13 52.83 3mzn s LEU 228 Cb -0.18 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.74 3mzn s LEU 228 CO 0.20 0.23 -0.00 0.00 0.23 0.00 0.00 176.35 177.00 3mzn s ALA 229 N -0.91 0.24 -0.02 4.21 0.00 -0.78 -0.05 121.76 124.44 3mzn s ALA 229 Ca 0.13 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.29 3mzn s ALA 229 Cb -0.10 0.22 -0.00 0.00 0.00 0.00 0.00 23.12 23.24 3mzn s ALA 229 CO 0.04 -0.28 -0.13 -1.17 0.00 0.00 0.00 175.76 174.22 3mzn s LEU 230 N -2.19 1.91 -0.40 0.00 2.96 -1.23 -0.91 118.68 118.81 3mzn s LEU 230 Ca -0.04 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 3mzn s LEU 230 Cb -0.01 -0.72 0.13 0.00 0.50 0.00 0.00 46.19 46.09 3mzn s LEU 230 CO -0.05 0.13 0.21 -0.62 -1.32 0.00 0.00 176.35 174.69 3mzn s ASP 231 N -0.04 3.57 -0.09 3.68 2.15 -0.35 -1.30 116.67 124.28 3mzn s ASP 231 Ca -0.00 -2.38 0.07 0.00 0.43 0.00 0.00 52.55 50.67 3mzn s ASP 231 Cb -0.08 -0.88 0.37 0.00 -0.30 0.00 0.00 42.92 42.03 3mzn s ASP 231 CO 0.01 -0.30 1.12 -0.81 -0.17 0.00 0.00 175.17 175.01 3mzn n PRO 232 N 3.85 2.65 -4.22 4.34 -0.04 -1.22 -0.64 135.00 139.72 3mzn n PRO 232 Ca 0.08 -1.44 -0.36 0.00 -0.04 0.00 0.00 63.50 61.73 3mzn n PRO 232 Cb 0.36 -1.76 -0.02 0.00 -0.04 0.00 0.00 33.50 32.04 3mzn n PRO 232 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3mzn n ASN 233 N 0.33 -3.40 0.00 3.54 4.13 -1.24 -1.88 115.26 116.74 3mzn n ASN 233 Ca 0.13 -1.00 0.00 0.00 1.68 0.00 0.00 54.58 55.38 3mzn n ASN 233 Cb 0.62 -2.79 0.00 0.00 -1.54 0.00 0.00 39.78 36.07 3mzn n ASN 233 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3mzn n GLY 234 N -1.39 0.43 0.23 7.41 0.00 0.16 -4.91 105.19 107.11 3mzn n GLY 234 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.20 3mzn n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mzn h ALA 235 N 0.00 1.11 -2.64 4.61 0.00 -1.51 -3.28 119.26 117.56 3mzn h ALA 235 Ca 0.00 -0.21 -0.57 0.00 0.00 0.00 0.00 54.91 54.13 3mzn h ALA 235 Cb 0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3mzn h ALA 235 CO 0.00 0.29 -0.23 -1.58 0.00 0.00 0.00 179.25 177.73 3mzn s TRP 236 N -3.83 3.47 0.60 0.00 0.51 -1.25 -3.97 118.94 114.48 3mzn s TRP 236 Ca -0.01 0.71 -0.18 0.00 -2.12 0.00 0.00 56.10 54.51 3mzn s TRP 236 Cb 0.11 -2.13 -0.03 0.00 -0.81 0.00 0.00 33.47 30.62 3mzn s TRP 236 CO 0.63 0.39 1.16 0.15 -0.51 0.00 0.00 176.95 178.77 3mzn s LYS 237 N -2.59 2.99 0.16 4.98 -0.14 -1.26 -4.09 119.74 119.78 3mzn s LYS 237 Ca 0.42 1.64 -0.17 0.00 -1.36 0.00 0.00 55.97 56.50 3mzn s LYS 237 Cb -0.12 -1.95 0.07 0.00 -1.68 0.00 0.00 37.83 34.15 3mzn s LYS 237 CO 0.22 -1.15 1.69 1.25 -0.76 0.00 0.00 175.35 176.61 3mzn h LEU 238 N 0.69 -0.21 -1.23 3.17 5.85 -1.90 0.13 115.31 121.79 3mzn h LEU 238 Ca -0.49 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 3mzn h LEU 238 Cb 1.27 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.44 3mzn h LEU 238 CO 0.55 -0.07 0.37 0.44 -0.34 0.00 0.00 178.44 179.39 3mzn h ASP 239 N 0.06 0.80 -0.35 1.25 3.32 -1.99 -1.09 116.42 118.42 3mzn h ASP 239 Ca 0.17 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.03 3mzn h ASP 239 Cb 0.25 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3mzn h ASP 239 CO -0.32 0.63 -0.32 -0.08 -1.72 0.00 0.00 179.24 177.44 3mzn h GLU 240 N 0.91 0.88 -0.52 3.56 4.57 -1.62 -2.15 114.58 120.20 3mzn h GLU 240 Ca 0.23 -0.42 -0.02 0.00 -1.18 0.00 0.00 59.36 57.97 3mzn h GLU 240 Cb 0.01 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 3mzn h GLU 240 CO -0.04 1.06 0.23 0.00 -1.18 0.00 0.00 179.01 179.08 3mzn h ALA 241 N 0.90 0.67 -0.44 2.92 0.00 -0.00 0.79 119.26 124.09 3mzn h ALA 241 Ca 0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3mzn h ALA 241 Cb 0.88 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3mzn h ALA 241 CO 0.08 0.26 0.23 0.28 0.00 0.00 0.00 179.25 180.10 3mzn h VAL 242 N 0.69 1.17 -0.42 0.00 2.07 -1.18 -0.71 116.25 117.87 3mzn h VAL 242 Ca 0.18 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3mzn h VAL 242 Cb 0.16 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3mzn h VAL 242 CO -0.02 0.18 0.26 -0.09 0.02 0.00 0.00 177.57 177.92 3mzn h ARG 243 N 0.58 0.57 -0.04 1.57 2.43 -1.00 -0.04 114.38 118.44 3mzn h ARG 243 Ca 0.15 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 59.06 3mzn h ARG 243 Cb 0.07 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3mzn h ARG 243 CO -0.02 0.42 -0.86 0.28 -1.51 0.00 0.00 179.97 178.28 3mzn h VAL 244 N 0.56 1.38 0.00 0.20 2.07 -0.75 -3.36 116.25 116.35 3mzn h VAL 244 Ca 0.15 -2.30 -0.23 0.00 0.82 0.00 0.00 66.70 65.14 3mzn h VAL 244 Cb -0.01 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3mzn h VAL 244 CO -0.03 0.69 -1.76 0.18 0.02 0.00 0.00 177.57 176.67 3mzn n LEU 245 N -3.79 0.59 -0.24 2.57 4.77 -0.28 -4.32 117.00 116.30 3mzn n LEU 245 Ca -0.06 0.27 0.05 0.00 -0.03 0.00 0.00 56.01 56.23 3mzn n LEU 245 Cb 0.78 0.19 0.17 0.00 -2.33 0.00 0.00 43.42 42.23 3mzn n LEU 245 CO 0.50 0.27 0.94 -0.33 -1.33 0.00 0.00 177.39 177.44 3mzn h GLU 246 N 0.00 0.27 0.00 3.23 4.39 -1.14 -0.55 114.58 120.78 3mzn h GLU 246 Ca -0.27 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3mzn h GLU 246 Cb 1.78 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.37 3mzn h GLU 246 CO 0.05 0.18 0.00 -2.30 -1.16 0.00 0.00 179.01 175.78 3mzn n PRO 247 N -5.14 0.20 -0.02 2.33 -0.02 -1.26 -2.97 135.00 128.12 3mzn n PRO 247 Ca 0.13 0.43 0.02 0.00 -2.02 0.00 0.00 63.50 62.06 3mzn n PRO 247 Cb 0.43 -1.89 0.03 0.00 -0.02 0.00 0.00 33.50 32.05 3mzn n PRO 247 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3mzn n ILE 248 N -2.27 1.16 0.26 4.25 -5.35 -0.39 -4.78 119.36 112.24 3mzn n ILE 248 Ca 0.02 -1.23 0.09 0.00 -0.27 0.00 0.00 62.75 61.36 3mzn n ILE 248 Cb 0.23 0.37 0.67 0.00 -1.74 0.00 0.00 39.64 39.17 3mzn n ILE 248 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3mzn h LYS 249 N 0.06 0.00 0.00 6.28 2.10 -1.05 0.74 116.57 124.70 3mzn h LYS 249 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3mzn h LYS 249 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 3mzn h LYS 249 CO 0.00 0.06 0.00 0.72 -2.00 0.00 0.00 179.45 178.23 3mzn n HIS 250 N -4.26 0.06 0.30 0.07 8.25 -1.26 -2.43 115.22 115.94 3mzn n HIS 250 Ca -0.03 0.02 0.12 0.00 -0.26 0.00 0.00 57.72 57.57 3mzn n HIS 250 Cb 0.14 -0.53 0.12 0.00 1.12 0.00 0.00 29.99 30.85 3mzn n HIS 250 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3mzn h LEU 251 N 0.00 0.00 -9.25 2.41 3.38 -1.21 -3.47 115.31 107.17 3mzn h LEU 251 Ca 0.00 -0.05 -0.67 0.00 0.09 0.00 0.00 57.88 57.24 3mzn h LEU 251 Cb 0.46 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.06 3mzn h LEU 251 CO 0.00 0.03 -0.62 -0.76 0.09 0.00 0.00 178.44 177.18 3mzn s LEU 252 N -5.22 3.60 0.10 1.67 1.43 -1.02 -4.31 118.68 114.93 3mzn s LEU 252 Ca 0.04 0.13 -0.13 0.00 -1.03 0.00 0.00 54.13 53.14 3mzn s LEU 252 Cb 0.10 -1.83 -0.17 0.00 0.03 0.00 0.00 46.19 44.31 3mzn s LEU 252 CO 0.72 0.35 1.28 0.28 0.23 0.00 0.00 176.35 179.21 3mzn h SER 253 N 5.37 0.95 -5.00 2.29 0.02 -0.76 -3.48 113.55 112.94 3mzn h SER 253 Ca -0.49 -0.65 -0.00 0.00 -0.84 0.00 0.00 61.79 59.81 3mzn h SER 253 Cb 1.19 -0.28 -0.11 0.00 0.14 0.00 0.00 62.40 63.34 3mzn h SER 253 CO 0.56 1.46 0.21 -0.72 -1.14 0.00 0.00 176.83 177.20 3mzn s TYR 254 N -3.64 -0.47 -0.17 3.45 -0.85 -1.24 -4.44 117.35 109.99 3mzn s TYR 254 Ca -0.10 0.21 -0.04 0.00 -0.52 0.00 0.00 57.07 56.62 3mzn s TYR 254 Cb 0.08 0.59 -0.02 0.00 0.38 0.00 0.00 41.96 42.99 3mzn s TYR 254 CO 0.91 -0.93 -0.04 0.00 -1.52 0.00 0.00 175.55 173.97 3mzn s ALA 255 N -3.78 2.93 -0.29 9.51 0.00 -0.57 -3.57 121.76 125.99 3mzn s ALA 255 Ca 0.03 -0.91 -0.13 0.00 0.00 0.00 0.00 51.96 50.95 3mzn s ALA 255 Cb -0.02 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 3mzn s ALA 255 CO -0.09 0.05 0.28 -2.00 0.00 0.00 0.00 175.76 174.01 3mzn s GLU 256 N 0.65 3.91 -1.35 0.00 2.12 -0.42 -1.70 118.70 121.90 3mzn s GLU 256 Ca -0.03 -0.21 -0.12 0.00 0.36 0.00 0.00 54.97 54.97 3mzn s GLU 256 Cb -0.15 -3.68 0.01 0.00 0.26 0.00 0.00 34.13 30.57 3mzn s GLU 256 CO 0.02 -0.27 0.43 -0.25 -0.54 0.00 0.00 175.26 174.66 3mzn n ASP 257 N 5.21 -1.78 0.12 -1.70 8.00 -0.36 -3.42 116.55 122.62 3mzn n ASP 257 Ca -0.11 -1.16 0.07 0.00 0.71 0.00 0.00 54.79 54.30 3mzn n ASP 257 Cb 0.51 -2.37 0.55 0.00 -0.02 0.00 0.00 41.12 39.78 3mzn n ASP 257 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 3mzn h PRO 258 N -2.04 0.25 0.00 -0.24 0.13 -1.87 0.45 132.00 128.68 3mzn h PRO 258 Ca -0.67 -0.01 -0.30 0.00 -0.87 0.00 0.00 66.00 64.15 3mzn h PRO 258 Cb 1.39 -0.06 -0.08 0.00 0.13 0.00 0.00 31.00 32.39 3mzn h PRO 258 CO 0.60 0.16 -0.24 0.00 -0.23 0.00 0.00 178.00 178.29 3mzn n GLY 260 N -0.47 3.31 3.77 0.00 0.00 -1.24 -4.42 105.19 106.14 3mzn n GLY 260 Ca 0.03 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 3mzn n GLY 260 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3mzn s GLN 261 N 2.52 3.90 -0.27 1.61 -2.07 -1.26 -4.20 119.66 119.89 3mzn s GLN 261 Ca 0.00 2.32 -0.27 0.00 -1.82 0.00 0.00 55.36 55.59 3mzn s GLN 261 Cb 0.00 -2.77 0.17 0.00 -1.09 0.00 0.00 33.01 29.32 3mzn s GLN 261 CO 0.00 -0.61 1.26 -1.83 -1.32 0.00 0.00 175.29 172.79 3mzn s GLU 262 N -2.27 0.25 -1.38 9.60 -1.05 -0.83 -4.92 118.70 118.10 3mzn s GLU 262 Ca 0.57 0.18 -0.02 0.00 -0.15 0.00 0.00 54.97 55.56 3mzn s GLU 262 Cb -0.42 0.12 0.01 0.00 -0.44 0.00 0.00 34.13 33.41 3mzn s GLU 262 CO 0.54 -0.05 0.18 0.41 0.95 0.00 0.00 175.26 177.29 3mzn n GLY 263 N 1.31 -0.50 1.69 -3.83 0.00 -1.26 -0.56 105.19 102.04 3mzn n GLY 263 Ca -0.08 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3mzn n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mzn n GLY 264 N -1.05 1.71 3.81 -0.02 0.00 -1.26 -5.04 105.19 103.35 3mzn n GLY 264 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 3mzn n GLY 264 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mzn s PHE 265 N -2.55 3.75 0.77 1.61 0.08 0.27 -5.08 117.98 116.84 3mzn s PHE 265 Ca 0.00 1.35 -0.12 0.00 0.12 0.00 0.00 56.93 58.28 3mzn s PHE 265 Cb 0.00 -2.57 0.05 0.00 -0.57 0.00 0.00 43.02 39.93 3mzn s PHE 265 CO 0.00 0.47 1.10 -1.54 -0.10 0.00 0.00 175.22 175.16 3mzn s SER 266 N -1.38 4.77 0.51 1.36 1.04 -1.26 -1.96 113.70 116.79 3mzn s SER 266 Ca 0.36 1.19 0.20 0.00 0.48 0.00 0.00 55.95 58.18 3mzn s SER 266 Cb -0.19 -1.93 1.33 0.00 0.10 0.00 0.00 66.02 65.33 3mzn s SER 266 CO 0.21 -1.78 2.11 1.23 0.98 0.00 0.00 173.24 175.99 3mzn h GLY 267 N -0.96 0.00 1.12 7.32 0.00 -1.92 -1.75 103.07 106.88 3mzn h GLY 267 Ca -0.46 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.73 3mzn h GLY 267 CO 0.61 0.00 -0.21 3.21 0.00 0.00 0.00 176.54 180.16 3mzn h ARG 268 N 0.00 1.01 -0.38 4.80 3.08 -1.90 -1.39 114.38 119.60 3mzn h ARG 268 Ca -0.00 -0.43 -0.09 0.00 0.07 0.00 0.00 59.98 59.54 3mzn h ARG 268 Cb 0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3mzn h ARG 268 CO 0.01 1.11 -0.10 0.93 -1.07 0.00 0.00 179.97 180.85 3mzn h GLU 269 N 0.87 0.73 -0.03 0.04 5.08 -1.76 -2.02 114.58 117.48 3mzn h GLU 269 Ca 0.11 -0.28 -0.17 0.00 -1.00 0.00 0.00 59.36 58.02 3mzn h GLU 269 Cb 0.79 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 3mzn h GLU 269 CO 0.07 0.88 -0.72 1.79 -1.00 0.00 0.00 179.01 180.03 3mzn h THR 270 N 0.53 1.44 0.00 1.13 1.35 -1.34 -2.74 112.91 113.29 3mzn h THR 270 Ca 0.09 -2.27 -0.13 0.00 -0.55 0.00 0.00 66.41 63.56 3mzn h THR 270 Cb 0.62 2.21 -0.02 0.00 -1.73 0.00 0.00 68.15 69.22 3mzn h THR 270 CO 0.04 0.66 -0.63 0.24 -0.25 0.00 0.00 175.52 175.58 3mzn h MET 271 N 0.13 0.00 -0.85 4.72 2.86 -1.25 0.08 114.93 120.62 3mzn h MET 271 Ca -0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 3mzn h MET 271 Cb 1.27 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.89 3mzn h MET 271 CO 0.11 0.63 0.46 0.00 1.06 0.00 0.00 176.91 179.17 3mzn h ALA 272 N 1.37 1.21 -0.23 6.32 0.00 -1.25 -1.12 119.26 125.56 3mzn h ALA 272 Ca -0.01 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 3mzn h ALA 272 Cb 1.26 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 3mzn h ALA 272 CO 0.08 0.63 -0.56 1.49 0.00 0.00 0.00 179.25 180.89 3mzn h GLU 273 N 1.19 0.71 -0.66 0.00 4.57 -1.14 -1.99 114.58 117.27 3mzn h GLU 273 Ca 0.30 -0.46 -0.00 0.00 -1.18 0.00 0.00 59.36 58.02 3mzn h GLU 273 Cb 0.03 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 3mzn h GLU 273 CO -0.05 1.08 0.39 0.35 -1.18 0.00 0.00 179.01 179.61 3mzn h PHE 274 N 0.54 0.87 -0.31 0.92 3.57 -0.66 -0.35 116.94 121.53 3mzn h PHE 274 Ca 0.01 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 3mzn h PHE 274 Cb 1.14 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 3mzn h PHE 274 CO 0.06 0.59 0.18 0.87 -2.23 0.00 0.00 178.31 177.79 3mzn h LYS 275 N 0.89 0.42 -0.55 1.11 1.57 -1.08 -1.03 116.57 117.90 3mzn h LYS 275 Ca 0.24 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 3mzn h LYS 275 Cb -0.02 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3mzn h LYS 275 CO -0.04 0.33 0.26 0.87 -0.57 0.00 0.00 179.45 180.30 3mzn h LYS 276 N 0.39 0.77 0.00 3.15 1.57 -1.01 0.66 116.57 122.10 3mzn h LYS 276 Ca 0.11 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 3mzn h LYS 276 Cb 0.02 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 3mzn h LYS 276 CO -0.02 0.60 -0.56 0.00 -0.57 0.00 0.00 179.45 178.90 3mzn h ARG 277 N 0.77 0.00 0.00 3.15 3.08 -0.81 -3.40 114.38 117.18 3mzn h ARG 277 Ca 0.19 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 3mzn h ARG 277 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3mzn h ARG 277 CO -0.03 0.32 -1.29 0.25 -1.07 0.00 0.00 179.97 178.16 3mzn n THR 278 N -3.11 0.29 -0.98 2.04 -2.24 -0.41 -5.00 114.28 104.87 3mzn n THR 278 Ca 0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3mzn n THR 278 Cb 0.69 -0.87 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 3mzn n THR 278 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mzn n GLY 279 N 2.80 0.48 3.75 3.38 0.00 0.21 -5.01 105.19 110.80 3mzn n GLY 279 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3mzn n GLY 279 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3mzn s LEU 280 N 0.00 4.41 0.64 0.99 2.96 -1.26 -5.04 118.68 121.37 3mzn s LEU 280 Ca 0.00 1.29 -0.17 0.00 -0.22 0.00 0.00 54.13 55.03 3mzn s LEU 280 Cb 0.00 -3.09 -0.01 0.00 0.50 0.00 0.00 46.19 43.59 3mzn s LEU 280 CO 0.00 0.02 1.18 -2.84 -1.32 0.00 0.00 176.35 173.39 3mzn s PRO 281 N 0.07 2.75 0.15 0.98 0.02 -1.26 -4.67 135.00 133.05 3mzn s PRO 281 Ca 0.36 1.69 0.11 0.00 0.02 0.00 0.00 61.00 63.17 3mzn s PRO 281 Cb -0.19 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 3mzn s PRO 281 CO 0.20 -1.34 -0.25 0.95 -0.33 0.00 0.00 177.00 176.22 3mzn s THR 282 N -1.89 2.26 0.24 0.99 -4.23 -1.26 -1.51 115.64 110.24 3mzn s THR 282 Ca 0.74 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 59.43 3mzn s THR 282 Cb -0.27 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.49 3mzn s THR 282 CO 0.37 -0.01 -0.04 0.00 -0.54 0.00 0.00 174.62 174.40 3mzn s ALA 283 N -1.33 1.98 -0.11 3.99 0.00 -0.69 -0.94 121.76 124.66 3mzn s ALA 283 Ca 0.16 -1.78 -0.21 0.00 0.00 0.00 0.00 51.96 50.13 3mzn s ALA 283 Cb -0.09 0.30 0.05 0.00 0.00 0.00 0.00 23.12 23.38 3mzn s ALA 283 CO 0.07 -0.15 0.53 -0.08 0.00 0.00 0.00 175.76 176.13 3mzn s THR 284 N -3.23 0.01 -0.16 0.00 -1.32 -0.67 -1.22 115.64 109.05 3mzn s THR 284 Ca 0.27 -0.12 0.15 0.00 -1.21 0.00 0.00 61.69 60.79 3mzn s THR 284 Cb 0.04 -0.79 0.34 0.00 -1.51 0.00 0.00 72.50 70.58 3mzn s THR 284 CO 0.09 -0.06 1.18 -0.46 -2.21 0.00 0.00 174.62 173.15 3mzn n ASN 285 N 1.89 2.04 0.00 8.08 6.94 -1.26 -1.36 115.26 131.59 3mzn n ASN 285 Ca -0.17 -3.42 0.00 0.00 -0.02 0.00 0.00 54.58 50.97 3mzn n ASN 285 Cb 0.56 -0.47 0.00 0.00 -2.36 0.00 0.00 39.78 37.51 3mzn n ASN 285 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 3mzn n MET 286 N -1.27 0.93 0.00 -3.83 2.81 -1.26 -4.89 117.12 109.60 3mzn n MET 286 Ca 0.17 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 3mzn n MET 286 Cb 0.67 -0.73 0.00 0.00 -0.71 0.00 0.00 33.22 32.44 3mzn n MET 286 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 3mzn n ILE 287 N -1.58 0.69 -3.19 2.02 -6.64 -1.26 -4.67 119.36 104.73 3mzn n ILE 287 Ca 0.00 -0.82 -0.22 0.00 -1.77 0.00 0.00 62.75 59.94 3mzn n ILE 287 Cb 0.23 0.67 -0.06 0.00 -1.44 0.00 0.00 39.64 39.04 3mzn n ILE 287 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3mzn n ALA 288 N -0.34 1.80 -0.13 -1.28 0.00 -1.26 -4.61 120.51 114.68 3mzn n ALA 288 Ca 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 53.44 50.62 3mzn n ALA 288 Cb 0.19 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.74 3mzn n ALA 288 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3mzn n THR 289 N 2.25 0.17 -4.00 0.00 -2.24 -1.26 -4.79 114.28 104.41 3mzn n THR 289 Ca 0.24 -0.52 -0.11 0.00 -2.27 0.00 0.00 64.05 61.39 3mzn n THR 289 Cb 0.52 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.73 3mzn n THR 289 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mzn s ASP 290 N -0.17 0.26 0.38 3.42 1.47 -1.26 -4.79 116.67 115.98 3mzn s ASP 290 Ca 0.00 -1.15 0.13 0.00 1.18 0.00 0.00 52.55 52.72 3mzn s ASP 290 Cb 0.00 0.65 0.76 0.00 -0.34 0.00 0.00 42.92 43.99 3mzn s ASP 290 CO 0.00 -1.27 1.85 1.88 0.68 0.00 0.00 175.17 178.31 3mzn h TYR 291 N 2.17 0.00 -0.12 2.11 0.05 -1.98 -0.77 116.97 118.43 3mzn h TYR 291 Ca -0.28 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.37 3mzn h TYR 291 Cb 1.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.99 3mzn h TYR 291 CO 0.90 0.35 -0.45 -0.22 -1.05 0.00 0.00 178.16 177.69 3mzn h LYS 292 N 0.00 0.52 -0.81 4.88 1.63 -2.00 -0.13 116.57 120.66 3mzn h LYS 292 Ca -0.00 -0.40 0.02 0.00 -0.85 0.00 0.00 60.65 59.42 3mzn h LYS 292 Cb 0.62 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 32.28 3mzn h LYS 292 CO 0.05 1.02 0.53 1.96 -3.45 0.00 0.00 179.45 179.55 3mzn h GLN 293 N 0.13 1.02 -0.72 1.90 4.20 -1.85 -2.84 115.11 116.96 3mzn h GLN 293 Ca -0.02 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 3mzn h GLN 293 Cb 1.08 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.59 3mzn h GLN 293 CO 0.09 0.68 0.28 1.25 -0.67 0.00 0.00 178.83 180.47 3mzn h LEU 294 N 1.06 1.00 -0.36 1.46 5.85 -0.86 0.23 115.31 123.68 3mzn h LEU 294 Ca 0.31 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.93 3mzn h LEU 294 Cb -0.06 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 40.63 3mzn h LEU 294 CO -0.09 0.90 -0.28 -0.61 -0.34 0.00 0.00 178.44 178.03 3mzn h GLN 295 N 1.04 -0.22 -0.07 1.25 4.15 -0.79 0.61 115.11 121.08 3mzn h GLN 295 Ca 0.24 0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.54 3mzn h GLN 295 Cb 0.22 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 3mzn h GLN 295 CO -0.02 -0.14 -0.56 1.88 -1.93 0.00 0.00 178.83 178.06 3mzn h TYR 296 N -0.23 0.26 -0.58 3.99 0.05 -1.26 -1.16 116.97 118.04 3mzn h TYR 296 Ca 0.17 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 3mzn h TYR 296 Cb 0.50 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.17 3mzn h TYR 296 CO -0.48 0.72 0.29 0.00 -1.05 0.00 0.00 178.16 177.63 3mzn h ALA 297 N 1.26 0.75 -0.19 3.88 0.00 -0.58 -1.48 119.26 122.89 3mzn h ALA 297 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3mzn h ALA 297 Cb 1.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3mzn h ALA 297 CO 0.08 0.30 -0.01 0.28 0.00 0.00 0.00 179.25 179.91 3mzn h VAL 298 N 0.79 1.26 -0.99 0.00 2.07 -0.69 0.09 116.25 118.78 3mzn h VAL 298 Ca 0.20 -0.89 0.11 0.00 0.82 0.00 0.00 66.70 66.94 3mzn h VAL 298 Cb 0.10 1.47 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3mzn h VAL 298 CO -0.03 0.27 0.63 -0.61 0.02 0.00 0.00 177.57 177.85 3mzn h GLN 299 N 0.10 0.98 -0.01 1.57 5.75 -1.14 -1.58 115.11 120.78 3mzn h GLN 299 Ca 0.05 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3mzn h GLN 299 Cb 0.41 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.74 3mzn h GLN 299 CO 0.01 0.65 -0.18 1.28 -2.65 0.00 0.00 178.83 177.94 3mzn n LEU 300 N -4.58 0.98 -3.66 -2.39 4.77 -0.57 -4.96 117.00 106.60 3mzn n LEU 300 Ca 0.18 -0.25 -0.29 0.00 -0.03 0.00 0.00 56.01 55.62 3mzn n LEU 300 Cb 0.32 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 3mzn n LEU 300 CO 0.29 0.18 -0.07 -3.20 -1.33 0.00 0.00 177.39 173.25 3mzn n ASN 301 N -0.56 -4.84 -0.03 -1.43 5.15 -0.52 -4.72 115.26 108.32 3mzn n ASN 301 Ca 0.14 -0.97 -0.02 0.00 -0.60 0.00 0.00 54.58 53.12 3mzn n ASN 301 Cb 0.33 -3.58 -0.13 0.00 -0.53 0.00 0.00 39.78 35.87 3mzn n ASN 301 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3mzn n SER 302 N -2.77 0.42 -3.67 1.20 7.64 -0.10 -4.49 113.62 111.85 3mzn n SER 302 Ca -0.12 0.19 -0.20 0.00 1.01 0.00 0.00 58.87 59.75 3mzn n SER 302 Cb 0.61 0.75 -0.18 0.00 -1.01 0.00 0.00 64.21 64.38 3mzn n SER 302 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3mzn s VAL 303 N -2.86 -0.10 0.05 0.44 1.01 -1.26 -4.38 120.40 113.31 3mzn s VAL 303 Ca -0.06 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.38 3mzn s VAL 303 Cb 0.09 -0.16 -0.24 0.00 0.00 0.00 0.00 36.38 36.07 3mzn s VAL 303 CO 0.84 0.18 1.03 0.44 0.00 0.00 0.00 175.10 177.59 3mzn h ASP 304 N 8.44 0.15 -3.07 3.32 3.32 -1.55 -3.44 116.42 123.59 3mzn h ASP 304 Ca -0.12 -0.20 -0.58 0.00 0.02 0.00 0.00 57.03 56.15 3mzn h ASP 304 Cb 1.12 -0.05 -0.40 0.00 0.22 0.00 0.00 39.33 40.22 3mzn h ASP 304 CO 0.15 1.16 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.43 3mzn s ILE 305 N -2.66 0.70 -0.04 0.35 1.01 -0.12 -0.84 121.20 119.61 3mzn s ILE 305 Ca -0.03 -1.55 -0.30 0.00 0.00 0.00 0.00 60.65 58.77 3mzn s ILE 305 Cb 0.08 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 3mzn s ILE 305 CO 0.84 -0.77 1.25 -2.16 0.00 0.00 0.00 174.94 174.10 3mzn s PRO 306 N 1.39 4.33 -1.01 2.79 0.04 -1.25 -1.67 135.00 139.61 3mzn s PRO 306 Ca 0.12 1.75 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 3mzn s PRO 306 Cb -0.19 -3.56 0.15 0.00 0.04 0.00 0.00 34.50 30.94 3mzn s PRO 306 CO -0.19 -0.48 1.20 -0.51 0.04 0.00 0.00 177.00 177.06 3mzn s LEU 307 N 2.28 5.18 -1.30 -3.56 1.43 -0.47 -2.53 118.68 119.71 3mzn s LEU 307 Ca 0.58 -2.41 -0.15 0.00 -1.03 0.00 0.00 54.13 51.12 3mzn s LEU 307 Cb -0.26 -2.38 0.11 0.00 0.03 0.00 0.00 46.19 43.68 3mzn s LEU 307 CO 0.23 -0.92 1.75 0.00 0.23 0.00 0.00 176.35 177.64 3mzn n ALA 308 N 6.04 4.29 -1.65 4.21 0.00 -0.01 -3.72 120.51 129.67 3mzn n ALA 308 Ca 0.27 -4.05 -0.44 0.00 0.00 0.00 0.00 53.44 49.22 3mzn n ALA 308 Cb 0.47 -3.33 -0.03 0.00 0.00 0.00 0.00 19.45 16.56 3mzn n ALA 308 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3mzn n ASP 309 N 6.42 3.85 0.30 0.00 -0.08 -1.26 -4.62 116.55 121.16 3mzn n ASP 309 Ca 0.44 0.78 0.17 0.00 -1.51 0.00 0.00 54.79 54.68 3mzn n ASP 309 Cb 0.42 -1.50 0.97 0.00 2.34 0.00 0.00 41.12 43.35 3mzn n ASP 309 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3mzn h HIS 311 N 0.00 0.35 -0.00 0.00 3.86 -1.89 0.14 115.15 117.61 3mzn h HIS 311 Ca -0.00 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 3mzn h HIS 311 Cb 0.08 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3mzn h HIS 311 CO 0.00 0.45 -0.48 1.97 0.86 0.00 0.00 177.93 180.73 3mzn n PHE 312 N -4.25 0.00 0.95 2.45 1.16 -0.88 -3.88 117.46 113.01 3mzn n PHE 312 Ca -0.00 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.68 3mzn n PHE 312 Cb 0.28 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.13 3mzn n PHE 312 CO 0.00 0.00 0.00 0.91 -1.87 0.00 0.00 176.76 175.80 3mzn n TRP 313 N -0.98 0.01 -0.85 2.97 7.02 -0.48 -4.84 117.44 120.30 3mzn n TRP 313 Ca 0.03 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.62 3mzn n TRP 313 Cb 0.21 -0.10 -0.06 0.00 -2.42 0.00 0.00 31.31 28.94 3mzn n TRP 313 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3mzn n THR 314 N -1.55 -0.53 -0.06 -0.99 -2.24 0.48 -3.68 114.28 105.72 3mzn n THR 314 Ca 0.04 0.55 -0.13 0.00 -2.27 0.00 0.00 64.05 62.24 3mzn n THR 314 Cb 0.34 -0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 67.67 3mzn n THR 314 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3mzn h MET 315 N -0.83 0.42 -0.25 -0.78 0.00 -1.91 -0.00 114.93 111.57 3mzn h MET 315 Ca -0.12 -0.22 -0.09 0.00 0.00 0.00 0.00 59.70 59.27 3mzn h MET 315 Cb 0.81 0.01 -0.01 0.00 0.00 0.00 0.00 31.60 32.41 3mzn h MET 315 CO 0.04 0.78 -0.24 1.96 0.00 0.00 0.00 176.91 179.46 3mzn h GLN 316 N 0.07 0.48 -0.35 1.72 4.20 -1.93 -2.21 115.11 117.09 3mzn h GLN 316 Ca 0.03 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.48 3mzn h GLN 316 Cb 0.71 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 3mzn h GLN 316 CO 0.04 0.69 -0.09 0.78 -0.67 0.00 0.00 178.83 179.58 3mzn h GLY 317 N 1.01 0.73 1.10 3.46 0.00 -1.59 -0.37 103.07 107.40 3mzn h GLY 317 Ca 0.06 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3mzn h GLY 317 CO 0.05 0.55 0.48 0.00 0.00 0.00 0.00 176.54 177.62 3mzn h ALA 318 N 0.81 1.24 -0.38 3.60 0.00 -0.83 -0.22 119.26 123.48 3mzn h ALA 318 Ca 0.09 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 3mzn h ALA 318 Cb 0.59 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mzn h ALA 318 CO 0.03 0.62 -0.37 0.28 0.00 0.00 0.00 179.25 179.82 3mzn h VAL 319 N 1.19 1.27 -1.00 0.00 2.07 -1.15 -1.50 116.25 117.13 3mzn h VAL 319 Ca 0.30 -1.55 0.01 0.00 0.82 0.00 0.00 66.70 66.29 3mzn h VAL 319 Cb 0.00 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 3mzn h VAL 319 CO -0.05 0.52 0.66 0.00 0.02 0.00 0.00 177.57 178.72 3mzn h ALA 320 N 0.77 1.27 -0.68 1.67 0.00 -0.60 0.58 119.26 122.27 3mzn h ALA 320 Ca 0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3mzn h ALA 320 Cb 0.97 -0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3mzn h ALA 320 CO 0.09 0.65 0.36 0.28 0.00 0.00 0.00 179.25 180.64 3mzn h VAL 321 N 1.35 1.22 -0.96 0.00 2.07 -0.84 -1.23 116.25 117.86 3mzn h VAL 321 Ca 0.37 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.33 3mzn h VAL 321 Cb -0.15 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 29.92 3mzn h VAL 321 CO -0.08 0.24 0.60 1.23 0.02 0.00 0.00 177.57 179.58 3mzn h GLY 322 N 0.93 1.37 1.00 2.17 0.00 -0.41 0.11 103.07 108.24 3mzn h GLY 322 Ca 0.24 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 3mzn h GLY 322 CO -0.04 0.53 0.30 0.83 0.00 0.00 0.00 176.54 178.16 3mzn h GLU 323 N 1.31 0.91 -0.56 4.80 5.08 -0.60 -2.25 114.58 123.26 3mzn h GLU 323 Ca 0.35 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.52 3mzn h GLU 323 Cb -0.09 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 3mzn h GLU 323 CO -0.07 0.73 0.16 1.25 -1.00 0.00 0.00 179.01 180.09 3mzn h LEU 324 N 0.87 0.83 -0.70 1.33 5.85 -0.49 -2.54 115.31 120.46 3mzn h LEU 324 Ca 0.22 -0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.80 3mzn h LEU 324 Cb 0.13 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 3mzn h LEU 324 CO -0.03 0.83 0.37 0.00 -0.34 0.00 0.00 178.44 179.28 3mzn h ASN 326 N 0.66 0.00 0.82 0.00 -1.24 -1.10 -1.39 115.58 113.32 3mzn h ASN 326 Ca 0.33 0.00 -0.24 0.00 0.71 0.00 0.00 56.30 57.10 3mzn h ASN 326 Cb 0.29 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.31 3mzn h ASN 326 CO -0.23 0.36 -1.20 -0.33 -1.29 0.00 0.00 177.43 174.74 3mzn h GLU 327 N 0.00 0.06 -0.36 6.67 4.39 -0.98 -3.39 114.58 120.96 3mzn h GLU 327 Ca -0.00 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.60 3mzn h GLU 327 Cb 0.67 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 3mzn h GLU 327 CO 0.05 0.95 0.00 0.91 -1.16 0.00 0.00 179.01 179.76 3mzn n TRP 328 N -3.33 0.50 -1.00 4.33 7.02 -0.37 -4.97 117.44 119.61 3mzn n TRP 328 Ca -0.05 -0.51 -0.00 0.00 -1.02 0.00 0.00 57.50 55.91 3mzn n TRP 328 Cb 0.98 -0.03 -0.00 0.00 -2.42 0.00 0.00 31.31 29.83 3mzn n TRP 328 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3mzn n GLY 329 N 0.54 0.41 4.00 6.99 0.00 -0.71 -5.02 105.19 111.39 3mzn n GLY 329 Ca 0.13 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 3mzn n GLY 329 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3mzn s MET 330 N -1.66 1.99 -0.12 1.61 -1.94 -0.61 -5.04 119.30 113.53 3mzn s MET 330 Ca 0.00 -1.19 -0.00 0.00 -1.71 0.00 0.00 55.69 52.79 3mzn s MET 330 Cb 0.00 -2.44 0.02 0.00 2.01 0.00 0.00 34.83 34.42 3mzn s MET 330 CO 0.00 -1.17 -0.09 0.99 -0.01 0.00 0.00 175.02 174.74 3mzn s THR 331 N -2.95 1.13 0.28 2.05 2.01 -0.02 -4.39 115.64 113.76 3mzn s THR 331 Ca 0.64 -0.36 -0.29 0.00 0.31 0.00 0.00 61.69 61.98 3mzn s THR 331 Cb -0.06 -1.12 -0.09 0.00 0.01 0.00 0.00 72.50 71.23 3mzn s THR 331 CO 0.42 0.38 1.03 0.86 -0.69 0.00 0.00 174.62 176.62 3mzn s TRP 332 N 1.58 3.71 0.16 4.92 -0.00 -1.26 -3.97 118.94 124.08 3mzn s TRP 332 Ca 0.03 1.78 0.02 0.00 -0.00 0.00 0.00 56.10 57.94 3mzn s TRP 332 Cb -0.13 -3.13 -0.01 0.00 -0.00 0.00 0.00 33.47 30.20 3mzn s TRP 332 CO -0.08 -0.13 0.16 0.41 -0.00 0.00 0.00 176.95 177.31 3mzn n GLY 333 N 1.17 3.27 2.86 5.86 0.00 -1.05 -1.20 105.19 116.09 3mzn n GLY 333 Ca -0.01 -1.69 -0.13 0.00 0.00 0.00 0.00 46.02 44.19 3mzn n GLY 333 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3mzn s SER 334 N -2.09 0.00 0.20 1.61 0.15 -1.26 -0.83 113.70 111.49 3mzn s SER 334 Ca 0.18 0.05 -0.05 0.00 0.70 0.00 0.00 55.95 56.83 3mzn s SER 334 Cb 0.01 0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.27 3mzn s SER 334 CO 0.12 -0.05 0.44 -2.28 1.20 0.00 0.00 173.24 172.68 3mzn s HIS 335 N 0.35 3.47 0.16 3.44 5.65 -1.24 -1.43 115.29 125.69 3mzn s HIS 335 Ca -0.03 0.58 0.05 0.00 0.25 0.00 0.00 55.06 55.91 3mzn s HIS 335 Cb -0.04 -2.03 -0.04 0.00 -1.18 0.00 0.00 32.58 29.28 3mzn s HIS 335 CO -0.01 0.34 -0.11 -1.54 -0.65 0.00 0.00 174.74 172.77 3mzn s SER 336 N -2.72 1.94 0.31 9.88 1.04 -1.26 -4.33 113.70 118.55 3mzn s SER 336 Ca 0.42 -1.01 0.07 0.00 0.48 0.00 0.00 55.95 55.91 3mzn s SER 336 Cb -0.11 -0.03 -0.06 0.00 0.10 0.00 0.00 66.02 65.91 3mzn s SER 336 CO 0.26 -0.30 -0.06 0.20 0.98 0.00 0.00 173.24 174.32 3mzn s ASN 337 N -3.18 3.06 0.12 7.02 -0.87 -1.26 -4.91 114.94 114.93 3mzn s ASN 337 Ca 0.18 -1.21 -0.35 0.00 -1.57 0.00 0.00 52.86 49.90 3mzn s ASN 337 Cb 0.02 -0.22 -0.16 0.00 -0.02 0.00 0.00 41.25 40.87 3mzn s ASN 337 CO 0.02 -0.32 1.40 0.59 -2.57 0.00 0.00 177.10 176.22 3mzn n ASN 338 N -0.66 2.12 -3.84 -1.22 4.13 -1.26 -4.59 115.26 109.93 3mzn n ASN 338 Ca -0.05 1.11 -0.09 0.00 1.68 0.00 0.00 54.58 57.23 3mzn n ASN 338 Cb 0.64 -1.28 -0.06 0.00 -1.54 0.00 0.00 39.78 37.54 3mzn n ASN 338 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 3mzn s HIS 339 N 0.53 0.15 0.04 3.10 -3.43 -1.26 -4.91 115.29 109.50 3mzn s HIS 339 Ca 0.81 -0.53 -0.00 0.00 -0.80 0.00 0.00 55.06 54.54 3mzn s HIS 339 Cb -0.85 0.04 0.01 0.00 -1.43 0.00 0.00 32.58 30.35 3mzn s HIS 339 CO 0.45 -0.66 0.05 1.19 -2.00 0.00 0.00 174.74 173.76 3mzn n PHE 340 N -0.17 -3.56 0.97 0.38 3.72 -1.26 -4.85 117.46 112.69 3mzn n PHE 340 Ca -0.12 -0.07 0.14 0.00 -0.05 0.00 0.00 57.45 57.35 3mzn n PHE 340 Cb 0.63 -0.04 0.57 0.00 -0.94 0.00 0.00 39.48 39.70 3mzn n PHE 340 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3mzn n ASP 341 N -3.01 0.11 -0.02 4.37 5.75 -1.26 -2.83 116.55 119.65 3mzn n ASP 341 Ca 0.01 0.43 -0.13 0.00 -0.01 0.00 0.00 54.79 55.09 3mzn n ASP 341 Cb 0.03 -0.45 -0.10 0.00 -1.03 0.00 0.00 41.12 39.57 3mzn n ASP 341 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 3mzn h ILE 342 N 0.00 1.44 -0.76 2.12 2.04 -1.96 -2.74 117.51 117.65 3mzn h ILE 342 Ca 0.00 -1.31 0.08 0.00 1.00 0.00 0.00 64.86 64.63 3mzn h ILE 342 Cb 0.52 2.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.87 3mzn h ILE 342 CO 0.00 0.34 0.50 0.28 0.00 0.00 0.00 178.15 179.27 3mzn h SER 343 N -0.57 0.67 -0.69 1.72 0.02 -1.84 -1.22 113.55 111.65 3mzn h SER 343 Ca -0.00 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.05 3mzn h SER 343 Cb 0.56 -0.13 -0.07 0.00 0.14 0.00 0.00 62.40 62.90 3mzn h SER 343 CO 0.00 0.41 0.34 0.25 -1.14 0.00 0.00 176.83 176.69 3mzn h LEU 344 N 0.75 0.44 -0.16 5.07 5.85 -1.47 0.12 115.31 125.92 3mzn h LEU 344 Ca 0.34 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 59.01 3mzn h LEU 344 Cb 0.35 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.37 3mzn h LEU 344 CO -0.12 0.26 -0.34 0.00 -0.34 0.00 0.00 178.44 177.89 3mzn h ALA 345 N 1.41 0.26 -0.35 1.25 0.00 -1.01 -2.78 119.26 118.04 3mzn h ALA 345 Ca 0.33 -0.43 0.08 0.00 0.00 0.00 0.00 54.91 54.89 3mzn h ALA 345 Cb 0.34 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 3mzn h ALA 345 CO -0.26 0.31 -0.27 0.52 0.00 0.00 0.00 179.25 179.55 3mzn h MET 346 N 0.15 -0.22 -0.08 0.00 2.86 -0.67 -1.60 114.93 115.37 3mzn h MET 346 Ca 0.00 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 3mzn h MET 346 Cb 0.94 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.64 3mzn h MET 346 CO 0.08 -0.15 -0.12 0.00 1.06 0.00 0.00 176.91 177.77 3mzn h MET 347 N -0.23 0.13 -0.09 1.72 -0.00 -0.78 -1.24 114.93 114.43 3mzn h MET 347 Ca 0.17 -0.02 -0.03 0.00 -0.00 0.00 0.00 59.70 59.82 3mzn h MET 347 Cb 0.50 -0.02 -0.00 0.00 -0.00 0.00 0.00 31.60 32.07 3mzn h MET 347 CO -0.48 0.26 -0.05 1.15 -0.00 0.00 0.00 176.91 177.79 3mzn h THR 348 N 0.12 1.33 -0.49 -0.10 2.02 -1.13 -1.65 112.91 113.01 3mzn h THR 348 Ca 0.03 -1.08 -0.04 0.00 0.77 0.00 0.00 66.41 66.09 3mzn h THR 348 Cb 0.30 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 3mzn h THR 348 CO 0.02 0.30 0.13 0.45 0.37 0.00 0.00 175.52 176.79 3mzn h HIS 349 N -0.18 0.75 0.24 3.16 3.86 -0.95 -1.26 115.15 120.77 3mzn h HIS 349 Ca 0.02 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 3mzn h HIS 349 Cb 0.50 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.75 3mzn h HIS 349 CO 0.07 0.63 -0.11 0.28 0.86 0.00 0.00 177.93 179.66 3mzn h VAL 350 N 0.71 0.83 -0.53 2.45 2.07 -1.16 -2.84 116.25 117.78 3mzn h VAL 350 Ca 0.16 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.27 3mzn h VAL 350 Cb 0.25 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3mzn h VAL 350 CO -0.00 0.10 0.35 0.00 0.02 0.00 0.00 177.57 178.03 3mzn h ALA 351 N 0.15 1.80 0.00 1.67 0.00 -1.25 -2.11 119.26 119.52 3mzn h ALA 351 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3mzn h ALA 351 Cb 0.41 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3mzn h ALA 351 CO 0.05 0.13 -0.14 0.00 0.00 0.00 0.00 179.25 179.29 3mzn h ALA 352 N 1.70 1.39 -0.02 0.00 0.00 -0.99 -2.28 119.26 119.06 3mzn h ALA 352 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mzn h ALA 352 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3mzn h ALA 352 CO -0.06 0.18 -0.03 0.00 0.00 0.00 0.00 179.25 179.33 3mzn n ALA 353 N -2.34 2.59 -2.70 0.00 0.00 -0.80 -0.28 120.51 116.97 3mzn n ALA 353 Ca -0.02 -0.57 -0.41 0.00 0.00 0.00 0.00 53.44 52.44 3mzn n ALA 353 Cb 0.24 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 3mzn n ALA 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mzn s PRO 355 N 1.19 3.47 3.17 0.00 0.04 -1.26 -4.77 135.00 136.83 3mzn s PRO 355 Ca 0.45 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.90 3mzn s PRO 355 Cb -0.19 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.12 3mzn s PRO 355 CO 0.22 -0.44 0.00 0.41 0.04 0.00 0.00 177.00 177.23 3mzn n GLY 356 N -2.52 -0.22 3.62 0.56 0.00 -1.26 -4.74 105.19 100.62 3mzn n GLY 356 Ca 0.03 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 3mzn n GLY 356 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mzn s GLU 357 N 0.00 4.03 0.33 1.61 0.41 -1.26 -5.06 118.70 118.75 3mzn s GLU 357 Ca 0.00 -0.08 0.09 0.00 -0.41 0.00 0.00 54.97 54.57 3mzn s GLU 357 Cb 0.00 -3.63 -0.05 0.00 -1.78 0.00 0.00 34.13 28.67 3mzn s GLU 357 CO 0.00 -0.17 0.01 0.96 -0.49 0.00 0.00 175.26 175.57 3mzn s ILE 358 N 1.75 2.75 0.30 -1.63 -4.36 -1.26 -4.38 121.20 114.37 3mzn s ILE 358 Ca 0.12 -1.97 0.01 0.00 -0.26 0.00 0.00 60.65 58.56 3mzn s ILE 358 Cb -0.15 -2.79 -0.03 0.00 1.25 0.00 0.00 42.46 40.73 3mzn s ILE 358 CO 0.09 -0.23 0.49 0.28 0.24 0.00 0.00 174.94 175.81 3mzn s THR 359 N -2.49 5.15 0.31 8.37 -1.32 -0.34 -4.97 115.64 120.35 3mzn s THR 359 Ca 0.34 -0.56 -0.29 0.00 -1.21 0.00 0.00 61.69 59.97 3mzn s THR 359 Cb -0.01 -3.84 -0.13 0.00 -1.51 0.00 0.00 72.50 67.01 3mzn s THR 359 CO 0.19 -0.46 1.33 0.00 -2.21 0.00 0.00 174.62 173.48 3mzn n ALA 360 N -1.55 1.25 -1.85 11.08 0.00 -1.26 -4.72 120.51 123.47 3mzn n ALA 360 Ca -0.06 0.38 -0.35 0.00 0.00 0.00 0.00 53.44 53.41 3mzn n ALA 360 Cb 0.56 -2.26 -0.07 0.00 0.00 0.00 0.00 19.45 17.68 3mzn n ALA 360 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3mzn s ILE 361 N -0.73 4.36 0.43 0.00 -4.36 -0.37 -4.66 121.20 115.86 3mzn s ILE 361 Ca 0.60 1.56 -0.25 0.00 -0.26 0.00 0.00 60.65 62.30 3mzn s ILE 361 Cb -0.59 -3.77 -0.08 0.00 1.25 0.00 0.00 42.46 39.27 3mzn s ILE 361 CO 0.58 -0.11 1.25 -1.81 0.24 0.00 0.00 174.94 175.09 3mzn s ASP 362 N -1.95 6.20 0.01 4.36 1.11 -0.51 -1.45 116.67 124.45 3mzn s ASP 362 Ca 0.56 2.53 -0.12 0.00 0.18 0.00 0.00 52.55 55.70 3mzn s ASP 362 Cb -0.13 -2.63 0.01 0.00 1.07 0.00 0.00 42.92 41.25 3mzn s ASP 362 CO 0.18 -0.91 0.25 0.28 1.18 0.00 0.00 175.17 176.14 3mzn s THR 363 N -1.35 0.08 -2.03 -1.27 -1.32 -1.26 -4.48 115.64 104.00 3mzn s THR 363 Ca 0.60 -0.64 0.21 0.00 -1.21 0.00 0.00 61.69 60.64 3mzn s THR 363 Cb -0.35 -0.69 0.58 0.00 -1.51 0.00 0.00 72.50 70.52 3mzn s THR 363 CO 0.44 -0.35 1.48 1.41 -2.21 0.00 0.00 174.62 175.39 3mzn n HIS 364 N 1.07 0.86 0.08 9.09 8.25 -1.26 -4.33 115.22 128.98 3mzn n HIS 364 Ca -0.21 -0.43 0.13 0.00 -0.26 0.00 0.00 57.72 56.95 3mzn n HIS 364 Cb 0.57 0.00 0.61 0.00 1.12 0.00 0.00 29.99 32.29 3mzn n HIS 364 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 3mzn h TRP 365 N 3.89 0.13 0.00 4.41 2.91 -1.93 -0.40 115.95 124.96 3mzn h TRP 365 Ca 0.00 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.01 3mzn h TRP 365 Cb 0.89 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 29.49 3mzn h TRP 365 CO 0.43 0.07 -0.05 -0.84 -1.03 0.00 0.00 178.44 177.01 3mzn h ILE 366 N 0.13 0.47 0.00 2.65 3.07 -1.96 0.16 117.51 122.03 3mzn h ILE 366 Ca 0.15 -0.26 -0.16 0.00 1.55 0.00 0.00 64.86 66.14 3mzn h ILE 366 Cb 0.45 1.17 -0.03 0.00 -0.27 0.00 0.00 36.82 38.14 3mzn h ILE 366 CO -0.02 0.05 -0.95 -0.50 -1.05 0.00 0.00 178.15 175.69 3mzn h TRP 367 N 0.00 0.00 -0.00 0.16 4.06 -1.44 -3.34 115.95 115.38 3mzn h TRP 367 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3mzn h TRP 367 Cb 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.33 3mzn h TRP 367 CO 0.00 0.70 -0.73 1.04 -3.56 0.00 0.00 178.44 175.89 3mzn n GLN 368 N -3.17 1.30 -1.62 0.49 3.00 -0.19 -4.74 117.38 112.45 3mzn n GLN 368 Ca -0.03 -0.18 -0.49 0.00 -0.01 0.00 0.00 57.00 56.28 3mzn n GLN 368 Cb 0.84 -1.33 -0.05 0.00 0.00 0.00 0.00 30.24 29.70 3mzn n GLN 368 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 3mzn n ASP 369 N -1.13 2.11 0.00 1.08 -0.08 0.39 -1.43 116.55 117.49 3mzn n ASP 369 Ca 0.04 1.11 0.00 0.00 -1.51 0.00 0.00 54.79 54.43 3mzn n ASP 369 Cb 0.30 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.48 3mzn n ASP 369 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3mzn n GLY 370 N 2.70 2.49 3.72 0.27 0.00 -1.26 -5.06 105.19 108.06 3mzn n GLY 370 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 3mzn n GLY 370 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mzn s GLN 371 N -0.28 2.58 -0.18 1.61 -0.21 -0.52 -5.13 119.66 117.53 3mzn s GLN 371 Ca 0.00 -1.22 -0.30 0.00 0.02 0.00 0.00 55.36 53.86 3mzn s GLN 371 Cb 0.00 -2.36 0.14 0.00 1.00 0.00 0.00 33.01 31.79 3mzn s GLN 371 CO 0.00 0.39 1.05 -0.98 -2.12 0.00 0.00 175.29 173.63 3mzn s ARG 372 N -3.63 0.52 0.00 2.91 1.70 -1.26 -4.88 118.95 114.30 3mzn s ARG 372 Ca 0.31 0.14 0.00 0.00 -0.47 0.00 0.00 55.73 55.72 3mzn s ARG 372 Cb -0.07 0.24 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 3mzn s ARG 372 CO 0.22 -0.16 0.57 0.44 -1.08 0.00 0.00 175.30 175.29 3mzn n ILE 373 N 0.75 0.27 -3.84 4.99 -5.35 -1.26 -4.74 119.36 110.18 3mzn n ILE 373 Ca -0.09 -0.54 -0.22 0.00 -0.27 0.00 0.00 62.75 61.63 3mzn n ILE 373 Cb 0.58 0.99 -0.05 0.00 -1.74 0.00 0.00 39.64 39.42 3mzn n ILE 373 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3mzn s THR 374 N -0.27 2.86 0.16 7.28 -4.23 -1.26 -1.03 115.64 119.15 3mzn s THR 374 Ca 0.00 -1.49 -0.08 0.00 -1.18 0.00 0.00 61.69 58.94 3mzn s THR 374 Cb 0.00 -3.03 -0.04 0.00 1.34 0.00 0.00 72.50 70.77 3mzn s THR 374 CO 0.00 -0.08 1.50 0.03 -0.54 0.00 0.00 174.62 175.53 3mzn h ARG 375 N 1.27 0.82 -2.49 3.99 3.08 -1.18 -3.42 114.38 116.46 3mzn h ARG 375 Ca -0.43 -0.44 -0.56 0.00 0.07 0.00 0.00 59.98 58.62 3mzn h ARG 375 Cb 1.26 0.02 -0.38 0.00 0.08 0.00 0.00 29.97 30.95 3mzn h ARG 375 CO 0.61 1.08 -0.85 -1.21 -1.07 0.00 0.00 179.97 178.53 3mzn s GLU 376 N -4.32 0.60 0.56 0.04 2.02 -1.26 -5.08 118.70 111.26 3mzn s GLU 376 Ca -0.10 -1.39 -0.20 0.00 0.02 0.00 0.00 54.97 53.30 3mzn s GLU 376 Cb 0.11 -1.25 -0.06 0.00 0.10 0.00 0.00 34.13 33.03 3mzn s GLU 376 CO 0.87 -1.23 1.02 -2.30 0.02 0.00 0.00 175.26 173.63 3mzn n PRO 377 N 3.89 1.08 -1.83 0.39 -0.02 -1.26 -4.90 135.00 132.35 3mzn n PRO 377 Ca 0.14 0.41 -0.37 0.00 -2.02 0.00 0.00 63.50 61.66 3mzn n PRO 377 Cb 0.39 -2.19 0.05 0.00 -0.02 0.00 0.00 33.50 31.73 3mzn n PRO 377 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3mzn s PHE 378 N -1.45 2.24 -0.04 6.00 0.40 -1.26 -4.99 117.98 118.88 3mzn s PHE 378 Ca 0.73 1.45 0.00 0.00 -0.60 0.00 0.00 56.93 58.51 3mzn s PHE 378 Cb -0.44 -3.68 -0.03 0.00 0.51 0.00 0.00 43.02 39.37 3mzn s PHE 378 CO 0.49 -2.73 -0.01 -0.65 0.70 0.00 0.00 175.22 173.01 3mzn s GLN 379 N -3.17 2.83 -0.27 0.44 -0.21 -1.26 -5.09 119.66 112.92 3mzn s GLN 379 Ca 0.77 -0.54 -0.14 0.00 0.02 0.00 0.00 55.36 55.47 3mzn s GLN 379 Cb -0.37 -2.69 -0.04 0.00 1.00 0.00 0.00 33.01 30.91 3mzn s GLN 379 CO 0.41 0.65 0.32 0.42 -2.12 0.00 0.00 175.29 174.98 3mzn s ILE 380 N -0.97 5.21 -0.02 1.08 1.01 -1.26 -4.48 121.20 121.77 3mzn s ILE 380 Ca 0.16 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.27 3mzn s ILE 380 Cb -0.11 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.73 3mzn s ILE 380 CO 0.06 0.19 0.01 -0.60 0.00 0.00 0.00 174.94 174.59 3mzn s ARG 381 N 1.97 0.13 -1.37 2.79 3.52 -0.50 -4.66 118.95 120.82 3mzn s ARG 381 Ca 0.13 0.07 -0.01 0.00 -0.13 0.00 0.00 55.73 55.79 3mzn s ARG 381 Cb -0.16 -0.28 0.01 0.00 -1.56 0.00 0.00 34.95 32.95 3mzn s ARG 381 CO 0.10 -0.09 0.09 -3.47 -0.81 0.00 0.00 175.30 171.12 3mzn n ASP 382 N 3.80 -4.80 -0.00 -2.12 2.03 -0.99 -1.51 116.55 112.96 3mzn n ASP 382 Ca -0.23 0.04 -0.00 0.00 0.52 0.00 0.00 54.79 55.12 3mzn n ASP 382 Cb 0.53 -4.02 -0.00 0.00 -0.72 0.00 0.00 41.12 36.92 3mzn n ASP 382 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mzn n GLY 383 N -0.97 0.50 3.11 0.27 0.00 0.12 -4.75 105.19 103.47 3mzn n GLY 383 Ca -0.17 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 3mzn n GLY 383 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mzn s LYS 384 N -0.07 0.66 -0.04 1.61 1.02 -0.57 -0.77 119.74 121.59 3mzn s LYS 384 Ca 0.00 -1.05 0.00 0.00 0.02 0.00 0.00 55.97 54.94 3mzn s LYS 384 Cb 0.00 -0.19 -0.03 0.00 -0.52 0.00 0.00 37.83 37.08 3mzn s LYS 384 CO 0.00 0.00 -0.00 -0.51 -0.92 0.00 0.00 175.35 173.92 3mzn s LEU 385 N -2.35 3.52 0.11 3.17 1.43 0.11 -1.40 118.68 123.26 3mzn s LEU 385 Ca 0.01 0.05 -0.13 0.00 -1.03 0.00 0.00 54.13 53.04 3mzn s LEU 385 Cb -0.02 -1.92 -0.06 0.00 0.03 0.00 0.00 46.19 44.22 3mzn s LEU 385 CO -0.03 0.33 0.48 -0.89 0.23 0.00 0.00 176.35 176.47 3mzn s THR 386 N -0.99 4.96 -0.48 5.49 2.01 -1.26 -0.61 115.64 124.76 3mzn s THR 386 Ca 0.17 0.69 -0.18 0.00 0.31 0.00 0.00 61.69 62.68 3mzn s THR 386 Cb -0.11 -3.70 0.05 0.00 0.01 0.00 0.00 72.50 68.75 3mzn s THR 386 CO 0.06 0.29 0.53 -0.69 -0.69 0.00 0.00 174.62 174.13 3mzn s VAL 387 N -1.40 5.01 0.69 3.82 1.01 0.21 -4.94 120.40 124.80 3mzn s VAL 387 Ca 0.35 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.57 3mzn s VAL 387 Cb -0.15 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 32.05 3mzn s VAL 387 CO 0.18 -0.66 1.28 -2.84 0.00 0.00 0.00 175.10 173.06 3mzn s PRO 388 N 2.28 2.30 0.00 2.72 0.02 -1.26 -4.90 135.00 136.16 3mzn s PRO 388 Ca 0.12 2.00 0.19 0.00 0.02 0.00 0.00 61.00 63.33 3mzn s PRO 388 Cb -0.20 -1.82 0.49 0.00 0.02 0.00 0.00 34.50 32.98 3mzn s PRO 388 CO 0.11 -1.77 1.40 1.63 -0.33 0.00 0.00 177.00 178.04 3mzn n LYS 389 N -2.27 2.62 -1.78 5.54 5.02 -1.26 -4.86 118.16 121.15 3mzn n LYS 389 Ca 0.15 -2.36 -0.30 0.00 -2.02 0.00 0.00 58.31 53.78 3mzn n LYS 389 Cb 0.49 -1.46 0.05 0.00 -0.02 0.00 0.00 35.03 34.09 3mzn n LYS 389 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mzn s THR 390 N -1.10 3.54 0.60 -0.18 -4.23 -1.26 -4.56 115.64 108.45 3mzn s THR 390 Ca 0.39 0.50 -0.18 0.00 -1.18 0.00 0.00 61.69 61.22 3mzn s THR 390 Cb 0.21 -3.42 -0.03 0.00 1.34 0.00 0.00 72.50 70.59 3mzn s THR 390 CO 0.28 -0.66 1.15 -2.84 -0.54 0.00 0.00 174.62 172.01 3mzn s PRO 391 N -5.27 3.05 4.38 3.99 0.02 -1.26 -3.42 135.00 136.49 3mzn s PRO 391 Ca 0.58 1.61 0.00 0.00 0.02 0.00 0.00 61.00 63.21 3mzn s PRO 391 Cb -0.12 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.44 3mzn s PRO 391 CO 0.53 -1.09 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 3mzn n GLY 392 N 0.07 1.25 0.13 0.52 0.00 0.61 -2.72 105.19 105.06 3mzn n GLY 392 Ca 0.12 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.60 3mzn n GLY 392 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3mzn h LEU 393 N 0.00 0.00 0.34 0.99 3.38 -1.87 -1.45 115.31 116.70 3mzn h LEU 393 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3mzn h LEU 393 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3mzn h LEU 393 CO 0.00 0.00 -0.08 0.61 0.09 0.00 0.00 178.44 179.06 3mzn n GLY 394 N 0.33 0.46 3.47 0.83 0.00 -1.10 -4.93 105.19 104.24 3mzn n GLY 394 Ca 0.03 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.99 3mzn n GLY 394 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mzn s ILE 395 N -2.16 1.92 -0.11 -0.61 -4.36 -1.26 -5.03 121.20 109.59 3mzn s ILE 395 Ca 0.00 -2.18 -0.01 0.00 -0.26 0.00 0.00 60.65 58.21 3mzn s ILE 395 Cb 0.00 -2.49 0.03 0.00 1.25 0.00 0.00 42.46 41.25 3mzn s ILE 395 CO 0.00 -0.29 -0.06 -1.61 0.24 0.00 0.00 174.94 173.23 3mzn s GLU 396 N -3.67 1.33 0.29 0.37 2.02 -1.26 -5.06 118.70 112.72 3mzn s GLU 396 Ca 0.30 -0.19 -0.30 0.00 0.02 0.00 0.00 54.97 54.80 3mzn s GLU 396 Cb 0.02 -1.49 -0.11 0.00 0.10 0.00 0.00 34.13 32.65 3mzn s GLU 396 CO 0.14 -0.29 1.58 -1.17 0.02 0.00 0.00 175.26 175.54 3mzn s LEU 397 N 1.76 4.35 -0.51 1.80 2.96 -1.26 -0.69 118.68 127.09 3mzn s LEU 397 Ca 0.05 2.92 -0.15 0.00 -0.22 0.00 0.00 54.13 56.73 3mzn s LEU 397 Cb -0.13 -3.63 0.11 0.00 0.50 0.00 0.00 46.19 43.04 3mzn s LEU 397 CO -0.08 -0.90 0.45 -0.62 -1.32 0.00 0.00 176.35 173.89 3mzn s ASP 398 N 0.50 6.11 0.25 3.68 -1.08 -0.20 -4.66 116.67 121.27 3mzn s ASP 398 Ca 0.63 -1.68 -0.05 0.00 -0.52 0.00 0.00 52.55 50.94 3mzn s ASP 398 Cb -0.47 -2.18 0.36 0.00 -1.46 0.00 0.00 42.92 39.17 3mzn s ASP 398 CO 0.47 -0.78 1.85 0.44 0.52 0.00 0.00 175.17 177.67 3mzn h ASP 399 N 8.80 0.84 -0.53 -0.34 3.32 -1.93 -0.85 116.42 125.72 3mzn h ASP 399 Ca -0.29 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.72 3mzn h ASP 399 Cb 1.10 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 3mzn h ASP 399 CO 0.97 0.52 0.06 0.44 -1.72 0.00 0.00 179.24 179.52 3mzn h ASP 400 N 0.96 0.87 -0.34 6.45 3.32 -1.95 -1.03 116.42 124.70 3mzn h ASP 400 Ca 0.39 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 3mzn h ASP 400 Cb 0.22 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3mzn h ASP 400 CO -0.19 0.92 -0.09 0.11 -1.72 0.00 0.00 179.24 178.27 3mzn h LYS 401 N 0.78 0.76 -0.37 3.56 1.79 -1.75 -0.88 116.57 120.47 3mzn h LYS 401 Ca 0.16 -0.24 -0.07 0.00 -2.18 0.00 0.00 60.65 58.31 3mzn h LYS 401 Cb 0.44 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 3mzn h LYS 401 CO 0.02 0.83 -0.05 1.25 -1.08 0.00 0.00 179.45 180.42 3mzn h LEU 402 N 0.69 0.68 -0.88 2.94 5.85 -0.97 -1.30 115.31 122.33 3mzn h LEU 402 Ca 0.12 -0.34 -0.10 0.00 0.84 0.00 0.00 57.88 58.41 3mzn h LEU 402 Cb 0.56 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3mzn h LEU 402 CO 0.03 0.86 -0.20 0.24 -0.34 0.00 0.00 178.44 179.03 3mzn h MET 403 N 0.49 0.60 -0.33 1.25 2.86 -1.00 0.34 114.93 119.14 3mzn h MET 403 Ca 0.10 -0.22 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 3mzn h MET 403 Cb 0.54 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 3mzn h MET 403 CO 0.03 0.77 0.21 0.93 1.06 0.00 0.00 176.91 179.90 3mzn h GLU 404 N 0.54 0.42 -0.33 1.72 5.08 -1.00 0.80 114.58 121.81 3mzn h GLU 404 Ca 0.08 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 3mzn h GLU 404 Cb 0.64 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3mzn h GLU 404 CO 0.05 0.28 -0.10 0.00 -1.00 0.00 0.00 179.01 178.23 3mzn h ALA 405 N 1.13 1.22 -0.38 3.43 0.00 -0.76 -1.63 119.26 122.27 3mzn h ALA 405 Ca 0.12 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3mzn h ALA 405 Cb -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3mzn h ALA 405 CO -0.04 0.51 -0.31 1.25 0.00 0.00 0.00 179.25 180.66 3mzn h HIS 406 N 0.51 0.98 -0.68 0.00 -0.00 -0.54 -1.83 115.15 113.60 3mzn h HIS 406 Ca 0.10 -0.26 -0.07 0.00 -0.00 0.00 0.00 60.37 60.14 3mzn h HIS 406 Cb 0.48 -0.22 -0.03 0.00 -0.00 0.00 0.00 27.41 27.64 3mzn h HIS 406 CO 0.02 1.04 0.16 1.49 -0.00 0.00 0.00 177.93 180.64 3mzn h GLU 407 N 0.71 1.07 -0.35 5.26 4.57 -0.63 -0.59 114.58 124.61 3mzn h GLU 407 Ca 0.08 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 3mzn h GLU 407 Cb 0.86 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 3mzn h GLU 407 CO 0.08 0.95 0.21 1.15 -1.18 0.00 0.00 179.01 180.21 3mzn h THR 408 N 1.02 1.12 -0.67 0.32 2.02 -1.06 -0.73 112.91 114.94 3mzn h THR 408 Ca 0.21 -0.29 0.08 0.00 0.77 0.00 0.00 66.41 67.18 3mzn h THR 408 Cb 0.36 0.68 -0.07 0.00 -1.74 0.00 0.00 68.15 67.38 3mzn h THR 408 CO 0.00 0.12 0.33 0.22 0.37 0.00 0.00 175.52 176.57 3mzn h TYR 409 N 0.46 0.60 -0.24 3.16 3.20 -0.94 -1.95 116.97 121.25 3mzn h TYR 409 Ca 0.13 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 3mzn h TYR 409 Cb 0.02 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 3mzn h TYR 409 CO -0.04 0.23 -0.08 0.87 -1.64 0.00 0.00 178.16 177.51 3mzn h LYS 410 N 0.59 0.38 0.00 1.82 1.57 -0.46 -2.52 116.57 117.96 3mzn h LYS 410 Ca 0.32 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3mzn h LYS 410 Cb 0.31 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3mzn h LYS 410 CO -0.25 0.48 0.00 0.00 -0.57 0.00 0.00 179.45 179.11 3mzn h ARG 411 N 0.37 0.00 -7.13 3.15 3.08 -0.43 -3.45 114.38 109.96 3mzn h ARG 411 Ca 0.08 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.67 3mzn h ARG 411 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 3mzn h ARG 411 CO 0.02 0.00 0.36 -0.51 -1.07 0.00 0.00 179.97 178.77 3mzn s LEU 412 N -5.82 3.77 -0.20 3.04 1.43 -0.83 -4.97 118.68 115.10 3mzn s LEU 412 Ca 0.05 1.63 0.14 0.00 -1.03 0.00 0.00 54.13 54.92 3mzn s LEU 412 Cb 0.08 -4.52 0.76 0.00 0.03 0.00 0.00 46.19 42.53 3mzn s LEU 412 CO 0.59 -0.48 1.66 0.47 0.23 0.00 0.00 176.35 178.82 3mzn n ASP 413 N -1.14 5.27 -4.28 2.29 8.00 -1.26 -4.93 116.55 120.49 3mzn n ASP 413 Ca 0.07 -2.77 -0.15 0.00 0.71 0.00 0.00 54.79 52.64 3mzn n ASP 413 Cb 0.54 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.89 3mzn n ASP 413 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3mzn s VAL 414 N -2.47 1.23 0.00 2.53 -7.23 -1.26 -5.06 120.40 108.15 3mzn s VAL 414 Ca 0.51 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 3mzn s VAL 414 Cb 0.37 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 35.33 3mzn s VAL 414 CO 0.17 -0.64 0.16 0.35 -0.31 0.00 0.00 175.10 174.84 3mzn n THR 415 N -0.27 0.02 -3.72 5.32 -2.24 -1.26 -5.03 114.28 107.09 3mzn n THR 415 Ca -0.09 -0.06 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 3mzn n THR 415 Cb 0.61 1.68 -0.05 0.00 -2.10 0.00 0.00 70.33 70.48 3mzn n THR 415 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mzn s GLN 416 N -0.02 1.22 0.23 -0.78 -2.07 -1.26 -3.85 119.66 113.13 3mzn s GLN 416 Ca 0.00 -0.84 -0.31 0.00 -1.82 0.00 0.00 55.36 52.39 3mzn s GLN 416 Cb 0.00 0.48 -0.11 0.00 -1.09 0.00 0.00 33.01 32.29 3mzn s GLN 416 CO 0.00 -0.49 1.60 0.50 -1.32 0.00 0.00 175.29 175.57 3mzn s ARG 417 N -3.86 4.17 -0.25 9.60 3.52 -1.26 -5.00 118.95 125.87 3mzn s ARG 417 Ca 0.08 2.49 -0.04 0.00 -0.13 0.00 0.00 55.73 58.13 3mzn s ARG 417 Cb 0.01 -3.08 0.09 0.00 -1.56 0.00 0.00 34.95 30.41 3mzn s ARG 417 CO -0.06 -0.62 0.15 1.21 -0.81 0.00 0.00 175.30 175.17 3mzn s ASN 418 N 0.80 2.78 0.00 -2.12 2.47 -1.26 -5.01 114.94 112.61 3mzn s ASN 418 Ca 0.67 -0.95 0.28 0.00 0.42 0.00 0.00 52.86 53.28 3mzn s ASN 418 Cb -0.46 -0.13 1.09 0.00 -1.45 0.00 0.00 41.25 40.29 3mzn s ASN 418 CO 0.39 -0.40 1.79 0.47 -3.72 0.00 0.00 177.10 175.63 3mzn n ASP 419 N 5.27 0.40 0.16 -4.21 9.92 -1.26 -3.81 116.55 123.02 3mzn n ASP 419 Ca -0.06 -0.32 0.06 0.00 -0.53 0.00 0.00 54.79 53.95 3mzn n ASP 419 Cb 0.45 -0.09 0.07 0.00 -0.64 0.00 0.00 41.12 40.91 3mzn n ASP 419 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3mzn h ALA 420 N 3.39 0.78 -0.06 2.24 0.00 -1.81 -0.78 119.26 123.02 3mzn h ALA 420 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3mzn h ALA 420 Cb 0.41 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3mzn h ALA 420 CO 0.00 0.39 0.03 1.98 0.00 0.00 0.00 179.25 181.66 3mzn h MET 421 N 0.00 0.07 0.00 0.00 -1.53 -1.88 -2.69 114.93 108.90 3mzn h MET 421 Ca -0.01 -0.00 -0.09 0.00 -3.44 0.00 0.00 59.70 56.16 3mzn h MET 421 Cb 1.24 -0.02 -0.01 0.00 -0.55 0.00 0.00 31.60 32.27 3mzn h MET 421 CO 0.04 0.04 -0.41 0.00 0.14 0.00 0.00 176.91 176.72 3mzn h ALA 422 N 1.03 1.23 0.00 0.39 0.00 -1.78 -2.55 119.26 117.57 3mzn h ALA 422 Ca 0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3mzn h ALA 422 Cb -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3mzn h ALA 422 CO -0.01 0.51 -0.02 0.52 0.00 0.00 0.00 179.25 180.25 3mzn h MET 423 N 0.00 0.00 0.00 0.00 2.86 -1.58 -2.60 114.93 113.61 3mzn h MET 423 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3mzn h MET 423 Cb 0.77 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.43 3mzn h MET 423 CO 0.05 0.02 -0.03 1.96 1.06 0.00 0.00 176.91 179.98 3mzn h GLN 424 N 0.00 0.00 0.00 1.72 1.08 -1.38 0.83 115.11 117.36 3mzn h GLN 424 Ca -0.00 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 3mzn h GLN 424 Cb 0.05 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3mzn h GLN 424 CO 0.00 0.03 -0.69 1.88 -0.95 0.00 0.00 178.83 179.10 3mzn h TYR 425 N 0.00 0.00 0.16 2.96 0.05 -1.64 -3.04 116.97 115.46 3mzn h TYR 425 Ca -0.00 0.00 -0.36 0.00 0.05 0.00 0.00 58.73 58.42 3mzn h TYR 425 Cb 0.06 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.80 3mzn h TYR 425 CO 0.00 0.69 -1.86 -0.07 -1.05 0.00 0.00 178.16 175.87 3mzn h LEU 426 N 0.00 0.53 -6.72 3.88 3.38 -1.34 -3.45 115.31 111.59 3mzn h LEU 426 Ca -0.01 -0.95 -0.54 0.00 0.09 0.00 0.00 57.88 56.48 3mzn h LEU 426 Cb 1.30 -0.17 -0.39 0.00 0.09 0.00 0.00 40.66 41.48 3mzn h LEU 426 CO 0.09 1.83 -0.79 -0.63 0.09 0.00 0.00 178.44 179.02 3mzn s ILE 427 N -2.57 -0.03 0.27 1.22 1.01 0.16 -5.12 121.20 116.15 3mzn s ILE 427 Ca -0.19 -1.00 -0.30 0.00 0.00 0.00 0.00 60.65 59.15 3mzn s ILE 427 Cb 0.06 -1.01 -0.12 0.00 0.01 0.00 0.00 42.46 41.40 3mzn s ILE 427 CO 0.82 -0.79 1.64 -2.65 0.00 0.00 0.00 174.94 173.95 3mzn n PRO 428 N 4.92 2.75 -0.63 2.79 -0.02 -1.15 -1.28 135.00 142.39 3mzn n PRO 428 Ca -0.01 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 3mzn n PRO 428 Cb 0.41 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 3mzn n PRO 428 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mzn n GLY 429 N 2.60 0.77 3.57 -1.23 0.00 -1.26 -5.01 105.19 104.63 3mzn n GLY 429 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 3mzn n GLY 429 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3mzn n TRP 430 N -2.20 1.08 -4.17 1.61 -0.00 -0.40 -5.00 117.44 108.36 3mzn n TRP 430 Ca 0.00 0.70 -0.16 0.00 -0.00 0.00 0.00 57.50 58.04 3mzn n TRP 430 Cb 0.00 -2.22 -0.12 0.00 -0.00 0.00 0.00 31.31 28.97 3mzn n TRP 430 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 3mzn s GLU 431 N -1.57 0.67 0.33 5.87 2.02 -1.26 -4.92 118.70 119.84 3mzn s GLU 431 Ca 0.59 -0.73 -0.29 0.00 0.02 0.00 0.00 54.97 54.57 3mzn s GLU 431 Cb -0.69 -0.58 -0.10 0.00 0.10 0.00 0.00 34.13 32.85 3mzn s GLU 431 CO 0.59 0.13 1.31 0.12 0.02 0.00 0.00 175.26 177.43 3mzn s PHE 432 N -1.07 3.04 -0.15 1.61 5.36 -1.26 -5.03 117.98 120.48 3mzn s PHE 432 Ca -0.04 1.41 -0.04 0.00 -0.96 0.00 0.00 56.93 57.30 3mzn s PHE 432 Cb -0.08 -3.68 0.06 0.00 -0.34 0.00 0.00 43.02 38.97 3mzn s PHE 432 CO 0.01 -1.88 0.14 0.34 -1.46 0.00 0.00 175.22 172.37 3mzn s ASP 433 N -0.47 1.59 0.12 6.13 3.68 -1.26 -5.03 116.67 121.43 3mzn s ASP 433 Ca 0.49 -0.22 0.14 0.00 2.13 0.00 0.00 52.55 55.09 3mzn s ASP 433 Cb -0.40 0.06 0.65 0.00 -1.45 0.00 0.00 42.92 41.78 3mzn s ASP 433 CO 0.53 -0.31 1.44 -0.81 0.13 0.00 0.00 175.17 176.15 3mzn n PRO 434 N 5.30 0.07 -0.67 4.34 -0.04 -1.26 -1.83 135.00 140.91 3mzn n PRO 434 Ca -0.06 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 3mzn n PRO 434 Cb 0.49 -1.67 0.23 0.00 -0.04 0.00 0.00 33.50 32.51 3mzn n PRO 434 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3mzn n LYS 435 N -1.82 2.42 -3.63 0.54 4.76 -1.26 -4.01 118.16 115.16 3mzn n LYS 435 Ca 0.01 -3.01 -0.13 0.00 -2.87 0.00 0.00 58.31 52.31 3mzn n LYS 435 Cb 0.11 -1.86 -0.12 0.00 -1.84 0.00 0.00 35.03 31.32 3mzn n LYS 435 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3mzn s ARG 436 N -3.05 0.19 0.33 1.97 3.52 -0.76 -4.77 118.95 116.37 3mzn s ARG 436 Ca 0.45 0.73 -0.26 0.00 -0.13 0.00 0.00 55.73 56.51 3mzn s ARG 436 Cb 0.38 -0.11 -0.13 0.00 -1.56 0.00 0.00 34.95 33.53 3mzn s ARG 436 CO 0.05 -0.33 0.88 -2.30 -0.81 0.00 0.00 175.30 172.79 3mzn n PRO 437 N 5.35 1.08 -0.30 5.12 -0.02 -1.26 -4.64 135.00 140.34 3mzn n PRO 437 Ca -0.06 0.38 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 3mzn n PRO 437 Cb 0.50 -1.74 0.38 0.00 -0.02 0.00 0.00 33.50 32.62 3mzn n PRO 437 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mzn h ALA 438 N 1.59 1.85 -0.16 3.55 0.00 -1.01 -1.91 119.26 123.17 3mzn h ALA 438 Ca -0.39 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3mzn h ALA 438 Cb 1.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3mzn h ALA 438 CO 0.58 -0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.97 3mzn n LEU 439 N -4.61 3.01 -4.72 0.00 4.77 0.10 -4.94 117.00 110.62 3mzn n LEU 439 Ca 0.20 -1.20 -0.41 0.00 -0.03 0.00 0.00 56.01 54.57 3mzn n LEU 439 Cb 0.54 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 3mzn n LEU 439 CO 0.27 0.57 0.59 -0.69 -1.33 0.00 0.00 177.39 176.80 3mzn s VAL 440 N -1.65 4.87 0.29 4.08 1.01 -0.72 -4.99 120.40 123.29 3mzn s VAL 440 Ca 0.29 1.87 -0.28 0.00 0.00 0.00 0.00 61.98 63.86 3mzn s VAL 440 Cb 0.19 -4.23 -0.09 0.00 0.00 0.00 0.00 36.38 32.25 3mzn s VAL 440 CO 0.28 0.21 0.97 -0.70 0.00 0.00 0.00 175.10 175.86 3mzn s GLU 441 N 0.78 4.66 2.75 2.72 2.12 -1.26 -4.86 118.70 125.62 3mzn s GLU 441 Ca 0.47 1.46 0.00 0.00 0.36 0.00 0.00 54.97 57.26 3mzn s GLU 441 Cb -0.20 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.17 3mzn s GLU 441 CO 0.25 0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.71 3mzn n GLY 442 N 0.98 0.23 3.58 -1.50 0.00 -1.26 -4.98 105.19 102.25 3mzn n GLY 442 Ca 0.00 -1.17 -0.26 0.00 0.00 0.00 0.00 46.02 44.59 3mzn n GLY 442 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mzn n HIS 443 N 5.93 -2.26 -2.36 1.61 8.25 -1.26 -4.97 115.22 120.16 3mzn n HIS 443 Ca 0.00 0.77 -0.35 0.00 -0.26 0.00 0.00 57.72 57.89 3mzn n HIS 443 Cb 0.00 -4.10 -0.01 0.00 1.12 0.00 0.00 29.99 27.00 3mzn n HIS 443 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3mzn s HIS 444 N -3.21 2.80 -0.71 4.41 3.76 -1.26 -4.82 115.29 116.26 3mzn s HIS 444 Ca 0.54 1.56 0.06 0.00 -0.15 0.00 0.00 55.06 57.06 3mzn s HIS 444 Cb -0.26 -3.20 0.04 0.00 1.11 0.00 0.00 32.58 30.28 3mzn s HIS 444 CO 0.66 -1.28 0.68 0.72 -0.85 0.00 0.00 174.74 174.67