#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2za5 s VAL 17 N 0.00 4.71 0.00 1.39 1.01 0.18 -4.09 120.40 123.59 2za5 s VAL 17 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 59.97 2za5 s VAL 17 Cb 0.00 -4.92 0.00 0.00 0.00 0.00 0.00 36.38 31.46 2za5 s VAL 17 CO 0.00 -1.67 0.00 0.61 0.00 0.00 0.00 175.10 174.04 2za5 n GLY 18 N 5.00 2.64 7.00 4.51 0.00 0.00 -3.39 105.19 120.95 2za5 n GLY 18 Ca 0.34 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2za5 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2za5 n GLY 19 N 0.85 1.87 3.58 -0.02 0.00 -1.26 -4.77 105.19 105.43 2za5 n GLY 19 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 2za5 n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2za5 s GLN 20 N 0.00 1.46 0.29 1.61 -2.07 -0.53 -4.99 119.66 115.42 2za5 s GLN 20 Ca 0.00 -0.89 -0.30 0.00 -1.82 0.00 0.00 55.36 52.35 2za5 s GLN 20 Cb 0.00 0.54 -0.13 0.00 -1.09 0.00 0.00 33.01 32.33 2za5 s GLN 20 CO 0.00 -0.63 1.37 0.39 -1.32 0.00 0.00 175.29 175.10 2za5 n GLU 21 N -0.37 2.15 -2.42 9.60 1.02 -1.26 -0.81 120.64 128.54 2za5 n GLU 21 Ca -0.09 0.76 -0.41 0.00 -0.02 0.00 0.00 57.16 57.41 2za5 n GLU 21 Cb 0.62 -2.39 -0.04 0.00 -0.02 0.00 0.00 31.44 29.61 2za5 n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2za5 s ALA 22 N -0.56 3.42 0.44 0.62 0.00 0.29 -4.79 121.76 121.19 2za5 s ALA 22 Ca 0.61 0.93 -0.25 0.00 0.00 0.00 0.00 51.96 53.25 2za5 s ALA 22 Cb -0.59 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.07 2za5 s ALA 22 CO 0.56 -0.26 1.30 -2.30 0.00 0.00 0.00 175.76 175.05 2za5 n PRO 23 N 1.70 1.94 0.32 0.00 -0.02 -1.26 -4.89 135.00 132.80 2za5 n PRO 23 Ca 0.01 0.69 0.19 0.00 -2.02 0.00 0.00 63.50 62.37 2za5 n PRO 23 Cb 0.45 -2.43 1.01 0.00 -0.02 0.00 0.00 33.50 32.51 2za5 n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2za5 h ARG 24 N 2.03 0.00 -0.00 -0.52 3.08 -1.99 -1.36 114.38 115.62 2za5 h ARG 24 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2za5 h ARG 24 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2za5 h ARG 24 CO 0.60 0.00 -0.40 -1.13 -1.07 0.00 0.00 179.97 177.96 2za5 n SER 25 N -3.09 0.60 -4.86 7.04 3.41 -1.26 -4.94 113.62 110.52 2za5 n SER 25 Ca -0.02 -0.38 -0.33 0.00 -0.26 0.00 0.00 58.87 57.89 2za5 n SER 25 Cb 0.23 0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 2za5 n SER 25 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2za5 s LYS 26 N -2.86 3.91 -1.15 4.33 -0.14 -0.51 -4.56 119.74 118.75 2za5 s LYS 26 Ca 0.15 0.46 -0.01 0.00 -1.36 0.00 0.00 55.97 55.21 2za5 s LYS 26 Cb 0.18 -2.62 -0.01 0.00 -1.68 0.00 0.00 37.83 33.70 2za5 s LYS 26 CO 0.64 0.28 0.97 0.91 -0.76 0.00 0.00 175.35 177.39 2za5 n TRP 27 N -0.06 -2.21 0.24 3.18 5.03 -1.26 -4.87 117.44 117.48 2za5 n TRP 27 Ca 0.01 0.91 0.12 0.00 3.03 0.00 0.00 57.50 61.57 2za5 n TRP 27 Cb 0.52 -4.86 0.62 0.00 -1.03 0.00 0.00 31.31 26.56 2za5 n TRP 27 CO 0.00 0.00 0.00 -1.00 -0.03 0.00 0.00 177.69 176.66 2za5 h PRO 28 N -1.72 0.00 -0.00 -0.99 0.13 -1.80 -2.18 132.00 125.44 2za5 h PRO 28 Ca -0.58 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 2za5 h PRO 28 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2za5 h PRO 28 CO 0.48 0.00 -0.33 -2.67 -0.23 0.00 0.00 178.00 175.25 2za5 n TRP 29 N -2.35 0.00 -2.02 1.56 2.14 -1.00 -3.02 117.44 112.75 2za5 n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 2za5 n TRP 29 Cb 0.09 -0.33 -0.03 0.00 -0.81 0.00 0.00 31.31 30.23 2za5 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2za5 s GLN 30 N -2.99 4.27 0.15 -2.67 2.00 -0.82 -0.24 119.66 119.35 2za5 s GLN 30 Ca 0.12 2.28 0.07 0.00 -2.00 0.00 0.00 55.36 55.83 2za5 s GLN 30 Cb 0.18 -3.14 -0.04 0.00 0.80 0.00 0.00 33.01 30.81 2za5 s GLN 30 CO 0.64 -0.46 -0.15 0.14 -0.50 0.00 0.00 175.29 174.96 2za5 s VAL 31 N 0.42 1.52 -0.17 1.34 -7.23 -0.07 -2.69 120.40 113.52 2za5 s VAL 31 Ca 0.62 -1.88 -0.05 0.00 -1.81 0.00 0.00 61.98 58.87 2za5 s VAL 31 Cb -0.41 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.77 2za5 s VAL 31 CO 0.38 -0.44 0.00 -0.55 -0.31 0.00 0.00 175.10 174.19 2za5 s SER 32 N -2.70 5.07 -0.00 4.85 0.15 -0.29 -1.23 113.70 119.55 2za5 s SER 32 Ca 0.14 -0.08 -0.16 0.00 0.70 0.00 0.00 55.95 56.55 2za5 s SER 32 Cb -0.04 -1.85 -0.06 0.00 -1.71 0.00 0.00 66.02 62.36 2za5 s SER 32 CO 0.04 0.15 0.44 -0.76 1.20 0.00 0.00 173.24 174.32 2za5 s LEU 33 N 0.50 4.46 -0.03 3.45 1.43 0.06 -0.32 118.68 128.24 2za5 s LEU 33 Ca -0.01 1.00 0.04 0.00 -1.03 0.00 0.00 54.13 54.13 2za5 s LEU 33 Cb -0.14 -2.65 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 2za5 s LEU 33 CO 0.02 0.28 -0.14 -0.13 0.23 0.00 0.00 176.35 176.61 2za5 s ARG 34 N -0.87 1.34 -0.07 1.70 1.81 -0.39 -1.23 118.95 121.24 2za5 s ARG 34 Ca 0.25 -0.50 0.02 0.00 -1.72 0.00 0.00 55.73 53.78 2za5 s ARG 34 Cb -0.17 -1.23 -0.03 0.00 -0.45 0.00 0.00 34.95 33.07 2za5 s ARG 34 CO 0.14 0.24 -0.11 0.54 -0.68 0.00 0.00 175.30 175.43 2za5 s VAL 35 N -0.08 3.32 0.24 3.52 0.11 -0.40 -1.63 120.40 125.48 2za5 s VAL 35 Ca 0.00 -0.62 -0.30 0.00 -2.93 0.00 0.00 61.98 58.14 2za5 s VAL 35 Cb -0.08 -2.33 -0.10 0.00 -1.53 0.00 0.00 36.38 32.34 2za5 s VAL 35 CO 0.01 0.58 1.35 -2.28 -3.33 0.00 0.00 175.10 171.43 2za5 s HIS 36 N -0.62 3.13 0.00 1.54 2.46 -0.37 -2.16 115.29 119.28 2za5 s HIS 36 Ca 0.09 1.19 0.00 0.00 0.47 0.00 0.00 55.06 56.81 2za5 s HIS 36 Cb -0.11 -3.69 0.00 0.00 -0.13 0.00 0.00 32.58 28.64 2za5 s HIS 36 CO 0.01 -2.15 0.00 0.41 -2.47 0.00 0.00 174.74 170.54 2za5 n GLY 37 N 1.99 2.32 0.36 1.59 0.00 -1.26 -4.95 105.19 105.24 2za5 n GLY 37 Ca 0.05 -0.24 0.17 0.00 0.00 0.00 0.00 46.02 46.00 2za5 n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2za5 h PRO 38 N 0.00 0.08 -4.06 1.61 0.13 -2.04 -3.42 132.00 124.29 2za5 h PRO 38 Ca 0.00 -0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 2za5 h PRO 38 Cb 0.00 -0.02 -0.12 0.00 0.13 0.00 0.00 31.00 30.99 2za5 h PRO 38 CO 0.00 0.05 -0.36 1.52 -0.23 0.00 0.00 178.00 178.99 2za5 s TYR 39 N -5.10 0.67 -1.02 1.56 1.13 -1.26 -5.07 117.35 108.26 2za5 s TYR 39 Ca -0.06 -0.98 -0.23 0.00 -1.41 0.00 0.00 57.07 54.39 2za5 s TYR 39 Cb 0.19 -0.15 0.04 0.00 -1.10 0.00 0.00 41.96 40.94 2za5 s TYR 39 CO 0.73 -0.80 1.55 -1.58 -2.51 0.00 0.00 175.55 172.94 2za5 s TRP 40 N -4.06 2.43 0.00 -3.49 0.52 -1.26 -4.67 118.94 108.41 2za5 s TRP 40 Ca 0.27 -0.66 -0.24 0.00 0.02 0.00 0.00 56.10 55.49 2za5 s TRP 40 Cb 0.03 -4.60 -0.05 0.00 -1.15 0.00 0.00 33.47 27.71 2za5 s TRP 40 CO 0.08 -1.89 0.73 1.41 0.02 0.00 0.00 176.95 177.30 2za5 s MET 41 N 5.25 4.46 0.20 4.98 1.75 -0.92 -4.71 119.30 130.32 2za5 s MET 41 Ca 0.50 0.98 -0.32 0.00 -1.25 0.00 0.00 55.69 55.61 2za5 s MET 41 Cb -0.01 -3.39 -0.12 0.00 2.84 0.00 0.00 34.83 34.15 2za5 s MET 41 CO -0.07 0.21 1.70 -1.58 -0.65 0.00 0.00 175.02 174.63 2za5 s HIS 42 N 0.25 2.92 0.00 4.11 2.46 -1.26 -1.28 115.29 122.50 2za5 s HIS 42 Ca 0.38 0.39 0.00 0.00 0.47 0.00 0.00 55.06 56.30 2za5 s HIS 42 Cb -0.19 -4.11 0.00 0.00 -0.13 0.00 0.00 32.58 28.15 2za5 s HIS 42 CO 0.21 -4.18 0.00 1.97 -2.47 0.00 0.00 174.74 170.27 2za5 n PHE 43 N 3.94 0.00 -3.53 3.88 -1.74 -0.36 -4.94 117.46 114.71 2za5 n PHE 43 Ca 0.15 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.94 2za5 n PHE 43 Cb 0.36 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.34 2za5 n PHE 43 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2za5 s GLY 45 N -2.78 1.88 0.32 0.00 0.00 0.32 -0.76 107.32 106.29 2za5 s GLY 45 Ca 0.04 -1.92 -0.18 0.00 0.00 0.00 0.00 44.72 42.66 2za5 s GLY 45 CO -0.08 -1.66 0.89 -0.32 0.00 0.00 0.00 173.10 171.93 2za5 s GLY 46 N -4.51 0.31 0.02 0.20 0.00 -0.36 -3.36 107.32 99.62 2za5 s GLY 46 Ca 0.56 -0.63 0.03 0.00 0.00 0.00 0.00 44.72 44.68 2za5 s GLY 46 CO 0.35 0.82 -0.09 -1.35 0.00 0.00 0.00 173.10 172.84 2za5 s SER 47 N -3.22 1.01 -0.42 1.64 1.04 0.23 -0.89 113.70 113.09 2za5 s SER 47 Ca 0.18 -0.31 -0.28 0.00 0.48 0.00 0.00 55.95 56.02 2za5 s SER 47 Cb -0.04 -0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.04 2za5 s SER 47 CO 0.09 -0.01 1.05 -0.22 0.98 0.00 0.00 173.24 175.14 2za5 s LEU 48 N -0.77 3.83 0.00 2.42 2.96 0.67 -0.26 118.68 127.52 2za5 s LEU 48 Ca -0.01 0.57 0.11 0.00 -0.22 0.00 0.00 54.13 54.58 2za5 s LEU 48 Cb -0.06 -3.44 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 2za5 s LEU 48 CO 0.00 -1.06 0.61 2.30 -1.32 0.00 0.00 176.35 176.88 2za5 n ILE 49 N 6.40 0.00 -3.49 6.68 -5.35 -0.97 -1.03 119.36 121.59 2za5 n ILE 49 Ca 0.10 -0.34 -0.13 0.00 -0.27 0.00 0.00 62.75 62.12 2za5 n ILE 49 Cb 0.48 1.09 -0.04 0.00 -1.74 0.00 0.00 39.64 39.44 2za5 n ILE 49 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 2za5 s HIS 50 N -1.66 -0.49 0.62 4.28 5.04 -1.16 -4.72 115.29 117.21 2za5 s HIS 50 Ca 0.08 0.40 0.37 0.00 -1.54 0.00 0.00 55.06 54.37 2za5 s HIS 50 Cb 0.09 0.45 2.11 0.00 0.04 0.00 0.00 32.58 35.27 2za5 s HIS 50 CO 0.34 -0.76 2.31 -1.35 -2.34 0.00 0.00 174.74 172.94 2za5 h PRO 51 N 2.34 0.00 -0.05 2.88 0.11 -1.94 -2.68 132.00 132.65 2za5 h PRO 51 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2za5 h PRO 51 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2za5 h PRO 51 CO 0.40 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.13 2za5 n GLN 52 N -3.47 1.20 -4.50 1.05 7.27 -1.26 -0.91 117.38 116.76 2za5 n GLN 52 Ca -0.03 -1.18 -0.21 0.00 0.07 0.00 0.00 57.00 55.65 2za5 n GLN 52 Cb 0.08 -1.07 -0.15 0.00 2.41 0.00 0.00 30.24 31.50 2za5 n GLN 52 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2za5 s TRP 53 N -0.64 1.11 -0.10 3.69 0.52 -1.01 -0.17 118.94 122.34 2za5 s TRP 53 Ca 0.05 -0.27 0.01 0.00 0.02 0.00 0.00 56.10 55.91 2za5 s TRP 53 Cb 0.03 -0.76 -0.02 0.00 -1.15 0.00 0.00 33.47 31.56 2za5 s TRP 53 CO 0.05 -0.10 -0.10 0.08 0.02 0.00 0.00 176.95 176.90 2za5 s VAL 54 N 0.07 3.36 -0.19 4.03 1.01 0.55 -2.29 120.40 126.95 2za5 s VAL 54 Ca -0.02 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 2za5 s VAL 54 Cb -0.08 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 2za5 s VAL 54 CO 0.01 0.56 0.10 -0.22 0.00 0.00 0.00 175.10 175.54 2za5 s LEU 55 N -0.23 4.05 0.00 3.92 2.96 0.64 -0.79 118.68 129.22 2za5 s LEU 55 Ca 0.02 0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 2za5 s LEU 55 Cb -0.13 -2.03 -0.00 0.00 0.50 0.00 0.00 46.19 44.53 2za5 s LEU 55 CO 0.03 0.19 0.12 1.07 -1.32 0.00 0.00 176.35 176.44 2za5 n THR 56 N 3.45 0.00 -3.42 3.68 5.66 -0.56 -0.60 114.28 122.48 2za5 n THR 56 Ca -0.16 -0.55 -0.37 0.00 -3.05 0.00 0.00 64.05 59.92 2za5 n THR 56 Cb 0.52 0.32 -0.06 0.00 -1.55 0.00 0.00 70.33 69.56 2za5 n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2za5 s ALA 57 N -2.03 3.64 0.25 1.79 0.00 -1.26 -0.88 121.76 123.28 2za5 s ALA 57 Ca 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 51.84 2za5 s ALA 57 Cb -0.00 -2.46 0.38 0.00 0.00 0.00 0.00 23.12 21.04 2za5 s ALA 57 CO 0.06 0.47 1.85 0.00 0.00 0.00 0.00 175.76 178.14 2za5 h ALA 58 N 4.12 1.26 0.00 0.00 0.00 -1.66 -2.48 119.26 120.50 2za5 h ALA 58 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2za5 h ALA 58 Cb 1.21 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2za5 h ALA 58 CO 0.64 0.28 0.00 -2.39 0.00 0.00 0.00 179.25 177.78 2za5 n HIS 59 N -4.62 0.36 0.15 0.00 1.44 -1.26 -0.45 115.22 110.84 2za5 n HIS 59 Ca 0.14 0.15 0.02 0.00 -2.01 0.00 0.00 57.72 56.01 2za5 n HIS 59 Cb 0.21 -0.74 0.19 0.00 0.12 0.00 0.00 29.99 29.78 2za5 n HIS 59 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2za5 n VAL 61 N -3.56 0.00 -3.55 0.00 0.24 -0.26 -5.03 118.33 106.17 2za5 n VAL 61 Ca -0.00 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 2za5 n VAL 61 Cb 0.62 1.20 0.00 0.00 -1.47 0.00 0.00 33.84 34.19 2za5 n VAL 61 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2za5 n GLY 62 N 0.21 4.27 0.05 7.63 0.00 0.41 -4.47 105.19 113.28 2za5 n GLY 62 Ca 0.00 -1.52 0.13 0.00 0.00 0.00 0.00 46.02 44.63 2za5 n GLY 62 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2za5 n PRO 63 N 0.00 0.10 -2.41 1.61 -0.04 -1.26 -4.51 135.00 128.49 2za5 n PRO 63 Ca 0.00 0.14 -0.41 0.00 -0.04 0.00 0.00 63.50 63.19 2za5 n PRO 63 Cb 0.00 -1.63 -0.03 0.00 -0.04 0.00 0.00 33.50 31.79 2za5 n PRO 63 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2za5 s ASP 64 N -3.60 7.12 -0.03 3.54 1.11 -1.26 -4.98 116.67 118.58 2za5 s ASP 64 Ca 0.11 2.16 -0.30 0.00 0.18 0.00 0.00 52.55 54.70 2za5 s ASP 64 Cb 0.15 -2.60 -0.05 0.00 1.07 0.00 0.00 42.92 41.48 2za5 s ASP 64 CO 0.50 -0.36 1.45 -0.69 1.18 0.00 0.00 175.17 177.26 2za5 s VAL 65 N 0.13 3.71 0.38 -1.27 1.01 -1.26 -4.97 120.40 118.13 2za5 s VAL 65 Ca 0.53 1.03 0.08 0.00 0.00 0.00 0.00 61.98 63.62 2za5 s VAL 65 Cb -0.31 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 2za5 s VAL 65 CO 0.35 -0.03 0.25 -0.54 0.00 0.00 0.00 175.10 175.13 2za5 s LYS 66 N 2.87 2.44 0.09 2.72 3.01 -1.26 -5.10 119.74 124.51 2za5 s LYS 66 Ca 0.65 -1.58 -0.30 0.00 -1.01 0.00 0.00 55.97 53.73 2za5 s LYS 66 Cb -0.31 -2.24 -0.06 0.00 -1.01 0.00 0.00 37.83 34.21 2za5 s LYS 66 CO 0.26 -0.04 1.20 0.34 0.51 0.00 0.00 175.35 177.61 2za5 s ASP 67 N -3.97 7.09 0.43 2.83 -1.08 -1.26 -4.94 116.67 115.77 2za5 s ASP 67 Ca 0.42 2.06 0.16 0.00 -0.52 0.00 0.00 52.55 54.67 2za5 s ASP 67 Cb -0.02 -2.58 1.07 0.00 -1.46 0.00 0.00 42.92 39.92 2za5 s ASP 67 CO 0.25 -0.44 1.92 -0.07 0.52 0.00 0.00 175.17 177.35 2za5 h LEU 68 N 6.46 0.38 -2.13 -1.34 4.07 -1.96 -2.34 115.31 118.45 2za5 h LEU 68 Ca -0.42 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.55 2za5 h LEU 68 Cb 1.21 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.90 2za5 h LEU 68 CO 0.80 0.19 -0.06 0.00 -1.08 0.00 0.00 178.44 178.29 2za5 h ALA 69 N 1.65 1.16 -0.14 1.53 0.00 -1.92 -2.02 119.26 119.52 2za5 h ALA 69 Ca 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2za5 h ALA 69 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2za5 h ALA 69 CO -0.12 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.21 2za5 n ALA 70 N -2.19 2.53 -2.36 0.00 0.00 -0.88 -4.86 120.51 112.75 2za5 n ALA 70 Ca -0.02 -0.43 -0.29 0.00 0.00 0.00 0.00 53.44 52.70 2za5 n ALA 70 Cb 0.20 -1.12 -0.16 0.00 0.00 0.00 0.00 19.45 18.38 2za5 n ALA 70 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2za5 s LEU 71 N -1.51 2.07 0.06 0.00 2.96 -0.76 -1.24 118.68 120.26 2za5 s LEU 71 Ca 0.30 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 2za5 s LEU 71 Cb 0.16 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 2za5 s LEU 71 CO 0.24 0.28 -0.06 -0.13 -1.32 0.00 0.00 176.35 175.36 2za5 s ARG 72 N -0.68 0.63 -0.07 1.98 3.00 -0.64 -4.40 118.95 118.76 2za5 s ARG 72 Ca 0.09 -1.01 0.03 0.00 0.00 0.00 0.00 55.73 54.84 2za5 s ARG 72 Cb -0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 34.95 34.68 2za5 s ARG 72 CO -0.00 -0.01 -0.16 0.08 0.00 0.00 0.00 175.30 175.21 2za5 s VAL 73 N -2.53 2.91 -0.12 3.52 1.01 -0.11 -1.27 120.40 123.81 2za5 s VAL 73 Ca -0.00 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2za5 s VAL 73 Cb -0.02 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 2za5 s VAL 73 CO -0.03 0.57 -0.16 -1.58 0.00 0.00 0.00 175.10 173.90 2za5 s GLN 74 N -0.39 3.25 1.01 2.72 2.00 0.56 -0.22 119.66 128.58 2za5 s GLN 74 Ca 0.04 -0.74 -0.17 0.00 -2.00 0.00 0.00 55.36 52.49 2za5 s GLN 74 Cb -0.12 -2.52 0.23 0.00 0.80 0.00 0.00 33.01 31.40 2za5 s GLN 74 CO 0.02 0.22 1.28 1.28 -0.50 0.00 0.00 175.29 177.59 2za5 n LEU 75 N 3.47 0.00 -4.68 3.68 4.77 -1.26 -1.14 117.00 121.83 2za5 n LEU 75 Ca -0.18 -1.39 -0.45 0.00 -0.03 0.00 0.00 56.01 53.96 2za5 n LEU 75 Cb 0.53 -1.00 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 2za5 n LEU 75 CO 0.30 -1.55 1.42 -1.14 -1.33 0.00 0.00 177.39 175.09 2za5 n ARG 76 N -3.94 2.49 -4.61 3.23 0.63 -1.09 -4.68 116.66 108.68 2za5 n ARG 76 Ca 0.16 0.90 -0.27 0.00 -0.92 0.00 0.00 57.85 57.73 2za5 n ARG 76 Cb 0.57 -2.76 -0.14 0.00 0.45 0.00 0.00 32.46 30.58 2za5 n ARG 76 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2za5 s GLU 77 N 2.73 1.45 0.16 -0.14 2.02 -1.26 -5.01 118.70 118.65 2za5 s GLU 77 Ca 0.84 -1.09 -0.08 0.00 0.02 0.00 0.00 54.97 54.66 2za5 s GLU 77 Cb -0.58 -1.67 0.01 0.00 0.10 0.00 0.00 34.13 32.00 2za5 s GLU 77 CO 0.41 0.42 1.48 0.37 0.02 0.00 0.00 175.26 177.96 2za5 h GLN 78 N 4.56 0.80 -4.30 1.61 5.75 -1.94 -3.43 115.11 118.17 2za5 h GLN 78 Ca -0.45 -0.46 -0.54 0.00 -0.15 0.00 0.00 58.65 57.05 2za5 h GLN 78 Cb 1.16 0.03 -0.37 0.00 1.07 0.00 0.00 27.48 29.38 2za5 h GLN 78 CO 0.42 1.09 -0.81 -1.01 -2.65 0.00 0.00 178.83 175.87 2za5 s HIS 79 N -4.23 1.59 0.35 3.99 3.76 -1.26 -1.04 115.29 118.44 2za5 s HIS 79 Ca -0.10 -0.82 -0.27 0.00 -0.15 0.00 0.00 55.06 53.73 2za5 s HIS 79 Cb 0.11 -1.29 -0.12 0.00 1.11 0.00 0.00 32.58 32.39 2za5 s HIS 79 CO 0.87 -0.54 1.11 1.28 -0.85 0.00 0.00 174.74 176.61 2za5 n LEU 80 N 4.92 2.68 0.00 0.89 4.77 -0.75 -2.94 117.00 126.57 2za5 n LEU 80 Ca -0.13 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.99 2za5 n LEU 80 Cb 0.50 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 2za5 n LEU 80 CO 0.17 -1.11 0.00 -1.22 -1.33 0.00 0.00 177.39 173.91 2za5 n TYR 81 N 0.02 0.00 -0.05 -1.77 4.01 -1.26 -4.84 117.16 113.27 2za5 n TYR 81 Ca 0.08 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.67 2za5 n TYR 81 Cb 0.36 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.32 2za5 n TYR 81 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 2za5 h TYR 82 N 0.00 0.73 -0.97 -0.72 0.05 -1.91 -3.33 116.97 110.81 2za5 h TYR 82 Ca 0.00 -0.28 -0.57 0.00 0.05 0.00 0.00 58.73 57.93 2za5 h TYR 82 Cb 0.00 -0.13 -0.41 0.00 1.01 0.00 0.00 36.73 37.20 2za5 h TYR 82 CO 0.00 1.03 -0.63 1.04 -1.05 0.00 0.00 178.16 178.56 2za5 n GLN 83 N -4.27 3.49 -1.69 4.88 1.13 -1.26 -5.08 117.38 114.58 2za5 n GLN 83 Ca -0.07 -4.17 -0.44 0.00 -1.94 0.00 0.00 57.00 50.39 2za5 n GLN 83 Cb 0.54 -2.27 -0.02 0.00 0.11 0.00 0.00 30.24 28.59 2za5 n GLN 83 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2za5 n ASP 84 N -0.67 3.02 -3.56 1.08 9.92 -1.25 -4.97 116.55 120.11 2za5 n ASP 84 Ca 0.44 1.14 -0.28 0.00 -0.53 0.00 0.00 54.79 55.56 2za5 n ASP 84 Cb 0.86 -1.47 -0.12 0.00 -0.64 0.00 0.00 41.12 39.76 2za5 n ASP 84 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2za5 s GLN 85 N -0.42 1.11 0.31 -1.24 -0.21 -1.26 -5.13 119.66 112.82 2za5 s GLN 85 Ca 0.67 -2.03 -0.29 0.00 0.02 0.00 0.00 55.36 53.73 2za5 s GLN 85 Cb -0.61 -1.88 -0.10 0.00 1.00 0.00 0.00 33.01 31.42 2za5 s GLN 85 CO 0.49 -1.27 1.19 -0.51 -2.12 0.00 0.00 175.29 173.07 2za5 s LEU 86 N 0.21 4.47 -0.15 2.90 1.02 -1.26 -4.62 118.68 121.25 2za5 s LEU 86 Ca 0.24 2.45 0.01 0.00 0.02 0.00 0.00 54.13 56.84 2za5 s LEU 86 Cb -0.12 -3.67 0.00 0.00 0.02 0.00 0.00 46.19 42.43 2za5 s LEU 86 CO -0.09 -0.34 -0.17 -0.76 0.02 0.00 0.00 176.35 175.01 2za5 s LEU 87 N -1.68 2.38 0.62 1.79 1.43 0.69 -4.93 118.68 118.99 2za5 s LEU 87 Ca 0.47 -0.51 -0.16 0.00 -1.03 0.00 0.00 54.13 52.90 2za5 s LEU 87 Cb -0.35 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 2za5 s LEU 87 CO 0.46 0.08 1.11 -2.16 0.23 0.00 0.00 176.35 176.07 2za5 s PRO 88 N 0.84 2.99 -0.08 1.29 0.04 -1.26 -0.94 135.00 137.89 2za5 s PRO 88 Ca -0.05 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.44 2za5 s PRO 88 Cb -0.15 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 2za5 s PRO 88 CO -0.01 -1.10 -0.08 0.08 0.04 0.00 0.00 177.00 175.92 2za5 s VAL 89 N -2.18 3.58 -0.05 -0.36 1.01 -1.26 -2.15 120.40 118.99 2za5 s VAL 89 Ca 0.68 -0.52 0.17 0.00 0.00 0.00 0.00 61.98 62.31 2za5 s VAL 89 Cb -0.21 -2.46 -0.26 0.00 0.00 0.00 0.00 36.38 33.45 2za5 s VAL 89 CO 0.37 0.59 0.32 -1.54 0.00 0.00 0.00 175.10 174.84 2za5 n SER 90 N 2.41 1.07 -3.84 3.32 3.41 0.06 -4.74 113.62 115.32 2za5 n SER 90 Ca -0.18 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.31 2za5 n SER 90 Cb 0.53 1.63 -0.14 0.00 -0.26 0.00 0.00 64.21 65.98 2za5 n SER 90 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2za5 s ARG 91 N -3.06 0.07 -0.19 4.33 0.52 -1.17 -4.99 118.95 114.47 2za5 s ARG 91 Ca -0.07 0.11 -0.01 0.00 -0.52 0.00 0.00 55.73 55.25 2za5 s ARG 91 Cb 0.10 0.01 0.01 0.00 0.52 0.00 0.00 34.95 35.58 2za5 s ARG 91 CO 0.70 -0.03 -0.14 0.42 0.02 0.00 0.00 175.30 176.28 2za5 s ILE 92 N 0.16 2.61 -0.20 1.52 1.01 -1.26 -0.76 121.20 124.29 2za5 s ILE 92 Ca -0.01 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.88 2za5 s ILE 92 Cb -0.02 -2.13 0.02 0.00 0.01 0.00 0.00 42.46 40.34 2za5 s ILE 92 CO -0.00 0.50 -0.16 -0.63 0.00 0.00 0.00 174.94 174.64 2za5 s ILE 93 N 1.24 2.29 -0.09 2.92 1.01 0.11 -4.98 121.20 123.70 2za5 s ILE 93 Ca 0.03 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 59.73 2za5 s ILE 93 Cb -0.14 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 2za5 s ILE 93 CO -0.07 0.44 -0.14 -0.69 0.00 0.00 0.00 174.94 174.48 2za5 s VAL 94 N 1.30 2.99 0.22 2.92 1.01 -1.26 -0.04 120.40 127.53 2za5 s VAL 94 Ca 0.03 -0.72 -0.32 0.00 0.00 0.00 0.00 61.98 60.98 2za5 s VAL 94 Cb -0.14 -2.21 -0.13 0.00 0.00 0.00 0.00 36.38 33.90 2za5 s VAL 94 CO -0.10 0.56 1.50 1.57 0.00 0.00 0.00 175.10 178.62 2za5 n HIS 95 N 2.93 2.30 0.25 5.22 -0.00 -1.08 -4.85 115.22 119.98 2za5 n HIS 95 Ca -0.18 0.35 0.13 0.00 0.46 0.00 0.00 57.72 58.48 2za5 n HIS 95 Cb 0.52 -2.51 0.62 0.00 -0.12 0.00 0.00 29.99 28.51 2za5 n HIS 95 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2za5 h PRO 96 N 4.93 0.00 0.00 1.57 0.13 -1.93 -2.47 132.00 134.23 2za5 h PRO 96 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2za5 h PRO 96 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2za5 h PRO 96 CO 0.81 0.12 0.00 1.04 -0.23 0.00 0.00 178.00 179.75 2za5 n GLN 97 N -3.33 0.12 -2.70 0.86 1.13 -1.26 -4.87 117.38 107.33 2za5 n GLN 97 Ca -0.00 0.24 -0.41 0.00 -1.94 0.00 0.00 57.00 54.88 2za5 n GLN 97 Cb 0.33 -1.69 -0.04 0.00 0.11 0.00 0.00 30.24 28.96 2za5 n GLN 97 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2za5 s PHE 98 N -3.12 3.72 0.00 1.08 5.36 -0.93 -4.85 117.98 119.25 2za5 s PHE 98 Ca 0.09 1.73 0.00 0.00 -0.96 0.00 0.00 56.93 57.78 2za5 s PHE 98 Cb 0.12 -3.11 0.00 0.00 -0.34 0.00 0.00 43.02 39.69 2za5 s PHE 98 CO 0.44 0.02 0.00 2.48 -1.46 0.00 0.00 175.22 176.70 2za5 n TYR 99 N 3.28 0.00 -4.03 10.12 0.18 -1.26 -4.90 117.16 120.55 2za5 n TYR 99 Ca 0.04 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.68 2za5 n TYR 99 Cb 0.50 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.31 2za5 n TYR 99 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 2za5 s THR 100 N -0.21 0.23 0.36 -3.48 -1.32 -1.26 -4.59 115.64 105.38 2za5 s THR 100 Ca 0.00 -0.12 0.09 0.00 -1.21 0.00 0.00 61.69 60.45 2za5 s THR 100 Cb 0.00 -0.20 0.32 0.00 -1.51 0.00 0.00 72.50 71.11 2za5 s THR 100 CO 0.00 0.07 1.88 0.00 -2.21 0.00 0.00 174.62 174.36 2za5 h ALA 101 N 6.10 1.85 0.00 11.08 0.00 -1.95 -2.07 119.26 134.27 2za5 h ALA 101 Ca -0.27 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2za5 h ALA 101 Cb 1.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2za5 h ALA 101 CO 0.50 -0.08 -0.32 1.96 0.00 0.00 0.00 179.25 181.32 2za5 h GLN 102 N 0.67 0.00 0.19 0.00 7.50 -1.96 -2.97 115.11 118.54 2za5 h GLN 102 Ca 0.43 0.00 -0.32 0.00 0.50 0.00 0.00 58.65 59.26 2za5 h GLN 102 Cb 0.71 0.00 0.02 0.00 0.05 0.00 0.00 27.48 28.25 2za5 h GLN 102 CO -0.19 0.32 -1.51 0.82 -1.50 0.00 0.00 178.83 176.77 2za5 h ILE 103 N 0.00 1.22 0.00 2.54 2.04 -1.78 -3.49 117.51 118.05 2za5 h ILE 103 Ca -0.00 -2.75 0.00 0.00 1.00 0.00 0.00 64.86 63.11 2za5 h ILE 103 Cb 0.87 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.86 2za5 h ILE 103 CO 0.04 0.84 0.00 0.61 0.00 0.00 0.00 178.15 179.64 2za5 n GLY 104 N 1.70 0.59 2.42 5.37 0.00 -0.85 -4.98 105.19 109.44 2za5 n GLY 104 Ca -0.17 -2.23 -0.16 0.00 0.00 0.00 0.00 46.02 43.45 2za5 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2za5 n ALA 105 N -1.00 -0.69 -1.96 4.61 0.00 -1.26 -4.55 120.51 115.66 2za5 n ALA 105 Ca 0.00 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 2za5 n ALA 105 Cb 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 17.63 2za5 n ALA 105 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2za5 n ASP 106 N -1.87 4.19 -3.79 0.00 2.03 -1.26 -4.36 116.55 111.49 2za5 n ASP 106 Ca -0.19 -2.88 -0.13 0.00 0.52 0.00 0.00 54.79 52.11 2za5 n ASP 106 Cb 0.64 -1.66 -0.11 0.00 -0.72 0.00 0.00 41.12 39.27 2za5 n ASP 106 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2za5 s ILE 107 N 3.18 0.02 0.18 5.18 2.07 -1.26 -3.72 121.20 126.85 2za5 s ILE 107 Ca 0.48 -0.14 -0.10 0.00 -1.41 0.00 0.00 60.65 59.48 2za5 s ILE 107 Cb 0.11 -0.40 -0.01 0.00 0.13 0.00 0.00 42.46 42.30 2za5 s ILE 107 CO -0.05 -0.08 0.33 0.00 -1.91 0.00 0.00 174.94 173.23 2za5 s ALA 108 N -0.22 -0.06 -0.04 1.50 0.00 -0.06 -2.64 121.76 120.25 2za5 s ALA 108 Ca -0.03 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.08 2za5 s ALA 108 Cb -0.03 0.92 0.01 0.00 0.00 0.00 0.00 23.12 24.02 2za5 s ALA 108 CO 0.01 -0.69 -0.11 -0.51 0.00 0.00 0.00 175.76 174.45 2za5 s LEU 109 N -2.98 1.74 -0.17 0.00 1.43 0.94 -1.50 118.68 118.14 2za5 s LEU 109 Ca 0.18 -0.25 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2za5 s LEU 109 Cb 0.02 -0.71 -0.02 0.00 0.03 0.00 0.00 46.19 45.52 2za5 s LEU 109 CO 0.02 0.07 -0.06 -0.76 0.23 0.00 0.00 176.35 175.85 2za5 s LEU 110 N 0.34 3.00 -0.21 1.79 1.43 0.03 0.09 118.68 125.16 2za5 s LEU 110 Ca -0.07 -0.27 -0.18 0.00 -1.03 0.00 0.00 54.13 52.58 2za5 s LEU 110 Cb -0.12 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2za5 s LEU 110 CO 0.02 0.10 0.50 -0.70 0.23 0.00 0.00 176.35 176.50 2za5 s GLU 111 N 0.76 4.17 0.40 1.70 2.12 0.06 -0.33 118.70 127.59 2za5 s GLU 111 Ca -0.03 0.38 -0.24 0.00 0.36 0.00 0.00 54.97 55.44 2za5 s GLU 111 Cb -0.15 -3.57 -0.09 0.00 0.26 0.00 0.00 34.13 30.59 2za5 s GLU 111 CO 0.02 -0.16 1.08 -0.51 -0.54 0.00 0.00 175.26 175.16 2za5 s LEU 112 N 1.66 4.15 0.23 2.70 1.43 0.76 -0.76 118.68 128.85 2za5 s LEU 112 Ca 0.23 2.13 -0.07 0.00 -1.03 0.00 0.00 54.13 55.39 2za5 s LEU 112 Cb -0.15 -4.15 0.32 0.00 0.03 0.00 0.00 46.19 42.24 2za5 s LEU 112 CO 0.09 -0.56 1.81 -0.08 0.23 0.00 0.00 176.35 177.84 2za5 h GLU 113 N 2.51 0.74 -5.92 1.70 4.81 -1.72 -3.42 114.58 113.27 2za5 h GLU 113 Ca -0.48 -0.04 -0.52 0.00 -0.13 0.00 0.00 59.36 58.18 2za5 h GLU 113 Cb 1.22 -0.17 -0.22 0.00 0.63 0.00 0.00 28.75 30.21 2za5 h GLU 113 CO 0.62 0.49 -0.82 -2.00 -0.73 0.00 0.00 179.01 176.58 2za5 s GLU 114 N -6.06 1.07 0.72 1.92 2.56 -1.26 -4.95 118.70 112.69 2za5 s GLU 114 Ca -0.13 -1.07 -0.15 0.00 0.00 0.00 0.00 54.97 53.63 2za5 s GLU 114 Cb 0.18 -1.25 0.03 0.00 2.00 0.00 0.00 34.13 35.09 2za5 s GLU 114 CO 0.77 0.29 1.17 -1.25 -0.56 0.00 0.00 175.26 175.69 2za5 s PRO 115 N -1.76 2.29 -0.01 4.30 0.04 -1.26 -4.82 135.00 133.79 2za5 s PRO 115 Ca 0.04 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.56 2za5 s PRO 115 Cb -0.10 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2za5 s PRO 115 CO 0.03 -1.69 0.45 0.08 0.04 0.00 0.00 177.00 175.91 2za5 s VAL 116 N -2.12 5.00 -0.70 -0.36 1.01 -0.09 -4.98 120.40 118.16 2za5 s VAL 116 Ca 0.72 0.93 -0.25 0.00 0.00 0.00 0.00 61.98 63.38 2za5 s VAL 116 Cb -0.26 -3.77 0.05 0.00 0.00 0.00 0.00 36.38 32.40 2za5 s VAL 116 CO 0.45 0.53 1.11 -0.54 0.00 0.00 0.00 175.10 176.65 2za5 s LYS 117 N -0.78 3.15 0.23 2.72 1.02 -1.26 -4.86 119.74 119.96 2za5 s LYS 117 Ca 0.25 -0.55 -0.31 0.00 0.02 0.00 0.00 55.97 55.38 2za5 s LYS 117 Cb -0.17 -4.20 -0.14 0.00 -0.52 0.00 0.00 37.83 32.80 2za5 s LYS 117 CO 0.14 -1.97 1.31 0.28 -0.92 0.00 0.00 175.35 174.19 2za5 n VAL 118 N 6.14 1.05 -3.10 3.17 0.31 -1.26 -5.00 118.33 119.63 2za5 n VAL 118 Ca -0.01 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2za5 n VAL 118 Cb 0.47 -1.28 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 2za5 n VAL 118 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2za5 n SER 119 N 2.00 1.98 0.07 4.52 7.64 0.57 -4.99 113.62 125.41 2za5 n SER 119 Ca 0.12 -0.10 -0.21 0.00 1.01 0.00 0.00 58.87 59.69 2za5 n SER 119 Cb 0.30 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.35 2za5 n SER 119 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2za5 h SER 120 N 0.00 0.54 0.41 6.43 0.87 -2.02 -3.35 113.55 116.43 2za5 h SER 120 Ca 0.00 -0.94 0.00 0.00 -1.23 0.00 0.00 61.79 59.62 2za5 h SER 120 Cb 0.00 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.79 2za5 h SER 120 CO 0.00 1.49 -0.12 1.41 -0.53 0.00 0.00 176.83 179.07 2za5 n HIS 121 N -4.02 0.00 -3.61 2.24 8.25 -1.26 -4.66 115.22 112.16 2za5 n HIS 121 Ca -0.16 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.04 2za5 n HIS 121 Cb 0.89 -0.21 -0.17 0.00 1.12 0.00 0.00 29.99 31.62 2za5 n HIS 121 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2za5 s VAL 122 N -2.54 -0.08 0.28 1.59 1.01 -1.26 -4.56 120.40 114.84 2za5 s VAL 122 Ca 0.27 -0.17 -0.16 0.00 0.00 0.00 0.00 61.98 61.91 2za5 s VAL 122 Cb 0.20 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 36.01 2za5 s VAL 122 CO 0.49 -0.28 0.62 -1.38 0.00 0.00 0.00 175.10 174.55 2za5 s HIS 123 N 2.13 0.11 0.57 5.22 -3.43 -1.17 -0.31 115.29 118.42 2za5 s HIS 123 Ca 0.02 -0.55 -0.16 0.00 -0.80 0.00 0.00 55.06 53.58 2za5 s HIS 123 Cb -0.16 0.48 -0.05 0.00 -1.43 0.00 0.00 32.58 31.42 2za5 s HIS 123 CO -0.09 -1.17 1.03 0.95 -2.00 0.00 0.00 174.74 173.46 2za5 s THR 124 N -3.77 4.06 0.11 -5.38 -4.23 -1.26 -2.38 115.64 102.80 2za5 s THR 124 Ca 0.17 0.97 -0.01 0.00 -1.18 0.00 0.00 61.69 61.64 2za5 s THR 124 Cb -0.04 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 70.26 2za5 s THR 124 CO 0.09 -0.58 0.29 0.54 -0.54 0.00 0.00 174.62 174.42 2za5 s VAL 125 N -2.53 5.30 0.04 2.29 0.11 -0.20 -4.84 120.40 120.58 2za5 s VAL 125 Ca 0.62 -0.30 -0.21 0.00 -2.93 0.00 0.00 61.98 59.16 2za5 s VAL 125 Cb -0.14 -3.65 -0.06 0.00 -1.53 0.00 0.00 36.38 31.00 2za5 s VAL 125 CO 0.35 0.05 0.62 -0.89 -3.33 0.00 0.00 175.10 171.90 2za5 s THR 126 N -1.62 4.79 0.54 5.04 2.01 -1.24 -4.66 115.64 120.51 2za5 s THR 126 Ca 0.37 1.31 -0.16 0.00 0.31 0.00 0.00 61.69 63.52 2za5 s THR 126 Cb -0.12 -3.95 -0.06 0.00 0.01 0.00 0.00 72.50 68.37 2za5 s THR 126 CO 0.27 0.47 1.01 -0.76 -0.69 0.00 0.00 174.62 174.92 2za5 s LEU 127 N -0.56 3.57 0.44 4.42 1.43 -1.26 -1.27 118.68 125.44 2za5 s LEU 127 Ca 0.31 1.66 -0.21 0.00 -1.03 0.00 0.00 54.13 54.86 2za5 s LEU 127 Cb -0.19 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.41 2za5 s LEU 127 CO 0.19 -0.80 0.97 -2.16 0.23 0.00 0.00 176.35 174.78 2za5 s PRO 128 N -4.09 4.16 0.49 1.29 0.04 -1.26 -4.79 135.00 130.84 2za5 s PRO 128 Ca 0.60 1.19 -0.23 0.00 0.04 0.00 0.00 61.00 62.60 2za5 s PRO 128 Cb -0.12 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 2za5 s PRO 128 CO 0.34 -0.10 1.35 -1.25 0.04 0.00 0.00 177.00 177.38 2za5 s PRO 129 N -3.12 3.46 0.58 0.56 0.04 -1.26 -4.86 135.00 130.41 2za5 s PRO 129 Ca 0.62 2.24 0.32 0.00 0.04 0.00 0.00 61.00 64.22 2za5 s PRO 129 Cb -0.11 -2.45 1.34 0.00 0.04 0.00 0.00 34.50 33.32 2za5 s PRO 129 CO 0.15 -0.93 1.66 0.00 0.04 0.00 0.00 177.00 177.92 2za5 h ALA 130 N 1.92 2.76 0.00 8.56 0.00 -1.96 -1.75 119.26 128.80 2za5 h ALA 130 Ca -0.51 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2za5 h ALA 130 Cb 1.28 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2za5 h ALA 130 CO 0.59 -1.34 0.00 0.66 0.00 0.00 0.00 179.25 179.16 2za5 h SER 131 N 0.00 0.00 -3.19 0.00 4.64 -1.97 -3.45 113.55 109.58 2za5 h SER 131 Ca 0.43 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 61.18 2za5 h SER 131 Cb 2.17 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 64.20 2za5 h SER 131 CO -0.00 0.00 0.62 -0.70 -0.87 0.00 0.00 176.83 175.88 2za5 s GLU 132 N -3.33 4.30 -0.00 4.77 2.56 -0.66 -4.89 118.70 121.45 2za5 s GLU 132 Ca 0.06 1.25 0.22 0.00 0.00 0.00 0.00 54.97 56.50 2za5 s GLU 132 Cb 0.09 -3.60 -0.23 0.00 2.00 0.00 0.00 34.13 32.39 2za5 s GLU 132 CO 0.55 -0.48 0.74 0.25 -0.56 0.00 0.00 175.26 175.76 2za5 n THR 133 N 5.01 0.04 -3.21 -1.70 -2.24 -1.26 -4.94 114.28 105.97 2za5 n THR 133 Ca 0.09 -0.27 -0.05 0.00 -2.27 0.00 0.00 64.05 61.54 2za5 n THR 133 Cb 0.47 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 2za5 n THR 133 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2za5 n PHE 134 N -1.93 -2.78 -1.05 4.78 3.72 -1.26 -4.98 117.46 113.95 2za5 n PHE 134 Ca 0.00 1.06 -0.31 0.00 -0.05 0.00 0.00 57.45 58.16 2za5 n PHE 134 Cb 0.46 -3.87 0.12 0.00 -0.94 0.00 0.00 39.48 35.25 2za5 n PHE 134 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2za5 s PRO 135 N -3.45 1.71 0.49 -1.08 0.02 -1.26 -4.91 135.00 126.52 2za5 s PRO 135 Ca 0.02 1.27 -0.22 0.00 0.02 0.00 0.00 61.00 62.10 2za5 s PRO 135 Cb -0.01 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.61 2za5 s PRO 135 CO 0.78 -2.06 1.04 -2.30 -0.33 0.00 0.00 177.00 174.13 2za5 n PRO 136 N -3.82 1.30 0.00 5.54 -0.02 -1.26 -3.27 135.00 133.47 2za5 n PRO 136 Ca 0.10 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2za5 n PRO 136 Cb 0.53 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2za5 n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2za5 n GLY 137 N 1.15 0.12 3.78 -1.23 0.00 -1.26 -5.03 105.19 102.71 2za5 n GLY 137 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2za5 n GLY 137 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2za5 s MET 138 N -0.95 4.49 -0.39 1.61 -1.94 -1.20 -4.99 119.30 115.92 2za5 s MET 138 Ca 0.00 1.45 -0.29 0.00 -1.71 0.00 0.00 55.69 55.14 2za5 s MET 138 Cb 0.00 -2.80 0.01 0.00 2.01 0.00 0.00 34.83 34.05 2za5 s MET 138 CO 0.00 0.17 1.34 -1.25 -0.01 0.00 0.00 175.02 175.27 2za5 s PRO 139 N -2.05 3.69 -0.01 2.03 0.04 -1.26 -4.77 135.00 132.67 2za5 s PRO 139 Ca 0.51 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.54 2za5 s PRO 139 Cb -0.22 -3.97 -0.01 0.00 0.04 0.00 0.00 34.50 30.35 2za5 s PRO 139 CO 0.27 -1.42 -0.10 0.00 0.04 0.00 0.00 177.00 175.79 2za5 s TRP 141 N -0.23 1.98 0.04 0.00 0.51 0.13 -1.04 118.94 120.33 2za5 s TRP 141 Ca 0.04 -0.37 0.03 0.00 -2.12 0.00 0.00 56.10 53.67 2za5 s TRP 141 Cb -0.04 -1.27 -0.04 0.00 -0.81 0.00 0.00 33.47 31.31 2za5 s TRP 141 CO -0.00 -0.03 -0.01 0.54 -0.51 0.00 0.00 176.95 176.93 2za5 s VAL 142 N -0.52 4.02 0.08 4.03 0.11 -0.55 -0.70 120.40 126.87 2za5 s VAL 142 Ca 0.09 -0.80 0.02 0.00 -2.93 0.00 0.00 61.98 58.36 2za5 s VAL 142 Cb -0.09 -2.84 -0.03 0.00 -1.53 0.00 0.00 36.38 31.89 2za5 s VAL 142 CO -0.01 0.27 -0.07 0.42 -3.33 0.00 0.00 175.10 172.37 2za5 s THR 143 N -1.17 0.67 0.00 5.04 -4.23 -1.20 -1.31 115.64 113.44 2za5 s THR 143 Ca 0.22 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 2za5 s THR 143 Cb -0.12 -1.25 0.00 0.00 1.34 0.00 0.00 72.50 72.47 2za5 s THR 143 CO 0.13 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 2za5 n GLY 144 N 0.58 0.48 1.36 3.99 0.00 -0.75 -4.47 105.19 106.39 2za5 n GLY 144 Ca -0.16 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.70 2za5 n GLY 144 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2za5 n TRP 145 N -0.71 1.52 -1.56 1.61 8.01 -1.26 -1.95 117.44 123.11 2za5 n TRP 145 Ca 0.00 -1.44 -0.24 0.00 -1.31 0.00 0.00 57.50 54.51 2za5 n TRP 145 Cb 0.00 -0.55 0.18 0.00 -2.01 0.00 0.00 31.31 28.93 2za5 n TRP 145 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2za5 n GLY 146 N -0.89 -1.75 3.63 6.99 0.00 -1.25 -4.70 105.19 107.22 2za5 n GLY 146 Ca 0.36 -1.65 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 2za5 n GLY 146 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2za5 n ASP 147 N -3.91 1.08 -0.34 1.61 8.00 0.61 -3.02 116.55 120.59 2za5 n ASP 147 Ca 0.13 0.86 0.12 0.00 0.71 0.00 0.00 54.79 56.61 2za5 n ASP 147 Cb 0.48 -1.41 0.15 0.00 -0.02 0.00 0.00 41.12 40.32 2za5 n ASP 147 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2za5 n VAL 148 N -1.48 0.00 -3.71 2.53 0.24 -0.58 -0.04 118.33 115.29 2za5 n VAL 148 Ca 0.13 -0.18 -0.04 0.00 -2.04 0.00 0.00 64.34 62.22 2za5 n VAL 148 Cb 0.46 0.85 -0.01 0.00 -1.47 0.00 0.00 33.84 33.66 2za5 n VAL 148 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2za5 s ASP 149 N -2.55 -0.19 -0.37 -1.34 -1.08 -1.22 -4.31 116.67 105.62 2za5 s ASP 149 Ca 0.20 -0.33 -0.42 0.00 -0.52 0.00 0.00 52.55 51.48 2za5 s ASP 149 Cb 0.18 0.44 -0.17 0.00 -1.46 0.00 0.00 42.92 41.92 2za5 s ASP 149 CO 0.58 -0.81 1.77 0.59 0.52 0.00 0.00 175.17 177.82 2za5 n ASN 150 N -0.44 1.92 -2.40 -0.34 4.13 -1.26 -1.25 115.26 115.62 2za5 n ASN 150 Ca -0.07 1.03 -0.20 0.00 1.68 0.00 0.00 54.58 57.03 2za5 n ASN 150 Cb 0.61 -1.06 0.01 0.00 -1.54 0.00 0.00 39.78 37.80 2za5 n ASN 150 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2za5 n ASP 151 N 5.48 -5.62 -3.78 6.41 9.92 -1.26 -4.97 116.55 122.74 2za5 n ASP 151 Ca 0.31 -0.10 -0.26 0.00 -0.53 0.00 0.00 54.79 54.20 2za5 n ASP 151 Cb 0.07 -4.58 -0.17 0.00 -0.64 0.00 0.00 41.12 35.80 2za5 n ASP 151 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2za5 s GLU 152 N -5.18 0.80 0.60 -1.24 2.12 -0.38 -5.10 118.70 110.30 2za5 s GLU 152 Ca 0.10 -0.27 -0.14 0.00 0.36 0.00 0.00 54.97 55.02 2za5 s GLU 152 Cb -0.04 -1.73 -0.04 0.00 0.26 0.00 0.00 34.13 32.58 2za5 s GLU 152 CO 0.12 -0.49 1.03 1.03 -0.54 0.00 0.00 175.26 176.41 2za5 s ARG 153 N 1.85 3.48 0.09 4.30 1.81 -1.26 -1.52 118.95 127.70 2za5 s ARG 153 Ca 0.01 0.99 -0.31 0.00 -1.72 0.00 0.00 55.73 54.70 2za5 s ARG 153 Cb -0.15 -2.06 -0.08 0.00 -0.45 0.00 0.00 34.95 32.21 2za5 s ARG 153 CO -0.07 -0.67 1.42 -1.17 -0.68 0.00 0.00 175.30 174.14 2za5 s LEU 154 N -4.73 4.36 0.49 2.53 2.96 -1.26 -4.47 118.68 118.56 2za5 s LEU 154 Ca 0.59 2.32 -0.18 0.00 -0.22 0.00 0.00 54.13 56.64 2za5 s LEU 154 Cb -0.13 -3.58 -0.09 0.00 0.50 0.00 0.00 46.19 42.90 2za5 s LEU 154 CO 0.43 -0.70 0.98 -2.84 -1.32 0.00 0.00 176.35 172.90 2za5 s PRO 155 N 1.48 4.00 0.59 0.98 0.02 -1.26 -4.81 135.00 136.00 2za5 s PRO 155 Ca 0.66 1.02 -0.18 0.00 0.02 0.00 0.00 61.00 62.51 2za5 s PRO 155 Cb -0.36 -2.14 -0.06 0.00 0.02 0.00 0.00 34.50 31.95 2za5 s PRO 155 CO 0.30 -0.23 0.86 -2.30 -0.33 0.00 0.00 177.00 175.30 2za5 n PRO 156 N -1.31 0.80 -0.43 5.54 -0.02 -1.26 -0.93 135.00 137.40 2za5 n PRO 156 Ca 0.07 0.31 -0.08 0.00 -2.02 0.00 0.00 63.50 61.78 2za5 n PRO 156 Cb 0.54 -2.05 0.06 0.00 -0.02 0.00 0.00 33.50 32.03 2za5 n PRO 156 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2za5 n PRO 157 N -0.77 1.42 -3.32 0.52 -0.04 -1.26 -4.94 135.00 126.61 2za5 n PRO 157 Ca 0.13 -0.99 -0.17 0.00 -0.04 0.00 0.00 63.50 62.44 2za5 n PRO 157 Cb 0.47 -1.39 0.07 0.00 -0.04 0.00 0.00 33.50 32.61 2za5 n PRO 157 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2za5 n PHE 158 N 0.01 -2.37 -2.27 0.54 3.72 -0.10 -3.86 117.46 113.13 2za5 n PHE 158 Ca 0.20 0.85 -0.41 0.00 -0.05 0.00 0.00 57.45 58.04 2za5 n PHE 158 Cb 0.86 -4.25 -0.03 0.00 -0.94 0.00 0.00 39.48 35.12 2za5 n PHE 158 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2za5 s PRO 159 N -4.70 4.46 0.16 -1.08 0.04 -1.26 -1.82 135.00 130.80 2za5 s PRO 159 Ca 0.37 2.03 -0.33 0.00 0.04 0.00 0.00 61.00 63.11 2za5 s PRO 159 Cb -0.06 -3.14 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 2za5 s PRO 159 CO 0.75 -0.06 1.70 -0.11 0.04 0.00 0.00 177.00 179.32 2za5 n LEU 160 N 1.39 3.67 -4.81 -3.56 7.94 -0.21 -4.83 117.00 116.59 2za5 n LEU 160 Ca 0.01 1.05 -0.24 0.00 -1.11 0.00 0.00 56.01 55.72 2za5 n LEU 160 Cb 0.43 -1.51 -0.05 0.00 0.53 0.00 0.00 43.42 42.82 2za5 n LEU 160 CO 0.57 0.01 -0.19 -0.54 -1.11 0.00 0.00 177.39 176.12 2za5 s LYS 161 N 1.53 2.90 0.01 1.96 1.02 -0.82 -0.55 119.74 125.79 2za5 s LYS 161 Ca 0.79 -0.98 0.00 0.00 0.02 0.00 0.00 55.97 55.80 2za5 s LYS 161 Cb -0.57 -2.59 -0.01 0.00 -0.52 0.00 0.00 37.83 34.14 2za5 s LYS 161 CO 0.36 0.44 -0.02 1.14 -0.92 0.00 0.00 175.35 176.35 2za5 s GLN 162 N -3.50 0.19 -0.02 1.68 -2.07 0.01 -1.80 119.66 114.15 2za5 s GLN 162 Ca 0.32 -0.34 -0.02 0.00 -1.82 0.00 0.00 55.36 53.50 2za5 s GLN 162 Cb -0.09 0.02 0.00 0.00 -1.09 0.00 0.00 33.01 31.86 2za5 s GLN 162 CO 0.24 -0.02 0.04 0.54 -1.32 0.00 0.00 175.29 174.78 2za5 s VAL 163 N -0.79 0.00 -0.17 3.63 0.11 -0.42 -1.46 120.40 121.30 2za5 s VAL 163 Ca -0.08 -0.03 -0.26 0.00 -2.93 0.00 0.00 61.98 58.68 2za5 s VAL 163 Cb -0.05 -0.08 -0.01 0.00 -1.53 0.00 0.00 36.38 34.70 2za5 s VAL 163 CO -0.00 -0.02 0.85 -0.75 -3.33 0.00 0.00 175.10 171.84 2za5 s LYS 164 N -0.03 4.30 0.00 1.54 2.20 -1.26 -1.49 119.74 125.00 2za5 s LYS 164 Ca -0.01 1.04 0.07 0.00 -0.36 0.00 0.00 55.97 56.71 2za5 s LYS 164 Cb -0.01 -3.58 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 2za5 s LYS 164 CO 0.00 -0.34 -0.21 0.14 -0.36 0.00 0.00 175.35 174.58 2za5 s VAL 165 N 2.21 2.52 -0.13 4.02 -7.23 -0.21 -4.93 120.40 116.65 2za5 s VAL 165 Ca 0.39 -1.09 -0.28 0.00 -1.81 0.00 0.00 61.98 59.19 2za5 s VAL 165 Cb -0.17 -1.98 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 2za5 s VAL 165 CO 0.12 0.48 0.93 -2.16 -0.31 0.00 0.00 175.10 174.16 2za5 s PRO 166 N -0.99 4.37 0.26 4.82 0.04 -1.26 -4.36 135.00 137.89 2za5 s PRO 166 Ca 0.12 1.23 -0.29 0.00 0.04 0.00 0.00 61.00 62.10 2za5 s PRO 166 Cb -0.10 -3.55 -0.09 0.00 0.04 0.00 0.00 34.50 30.79 2za5 s PRO 166 CO 0.02 -0.31 1.25 0.42 0.04 0.00 0.00 177.00 178.42 2za5 s ILE 167 N 2.05 3.13 -0.05 0.56 -1.09 -1.26 -1.62 121.20 122.92 2za5 s ILE 167 Ca 0.44 1.04 0.06 0.00 -2.23 0.00 0.00 60.65 59.96 2za5 s ILE 167 Cb -0.17 -3.66 -0.01 0.00 -1.58 0.00 0.00 42.46 37.03 2za5 s ILE 167 CO 0.15 0.21 -0.23 -0.32 -1.23 0.00 0.00 174.94 173.52 2za5 s MET 168 N -0.98 2.35 0.52 2.79 -2.45 -0.31 -4.32 119.30 116.90 2za5 s MET 168 Ca 0.51 -0.84 -0.23 0.00 -1.25 0.00 0.00 55.69 53.89 2za5 s MET 168 Cb -0.36 -2.01 -0.06 0.00 1.25 0.00 0.00 34.83 33.65 2za5 s MET 168 CO 0.44 0.36 1.38 0.39 1.05 0.00 0.00 175.02 178.63 2za5 n GLU 169 N 2.97 1.86 -0.14 4.11 1.02 -1.26 -3.98 120.64 125.22 2za5 n GLU 169 Ca -0.17 0.68 -0.03 0.00 -0.02 0.00 0.00 57.16 57.61 2za5 n GLU 169 Cb 0.52 -2.59 0.05 0.00 -0.02 0.00 0.00 31.44 29.39 2za5 n GLU 169 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2za5 h ASN 170 N 1.68 -0.11 -0.22 1.62 4.21 -1.94 0.29 115.58 121.12 2za5 h ASN 170 Ca -0.51 0.10 -0.07 0.00 1.21 0.00 0.00 56.30 57.03 2za5 h ASN 170 Cb 1.29 0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 38.63 2za5 h ASN 170 CO 0.58 -0.02 -0.06 1.12 -1.29 0.00 0.00 177.43 177.75 2za5 h HIS 171 N 0.15 0.60 -0.27 1.19 2.07 -1.93 0.48 115.15 117.44 2za5 h HIS 171 Ca 0.22 -0.08 -0.06 0.00 -2.85 0.00 0.00 60.37 57.60 2za5 h HIS 171 Cb 0.31 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.12 2za5 h HIS 171 CO -0.26 0.62 -0.07 0.82 -3.07 0.00 0.00 177.93 175.97 2za5 h ILE 172 N 0.53 1.28 -0.54 6.12 1.08 -1.74 -2.44 117.51 121.80 2za5 h ILE 172 Ca 0.10 -1.10 -0.10 0.00 -0.39 0.00 0.00 64.86 63.38 2za5 h ILE 172 Cb 0.44 1.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.61 2za5 h ILE 172 CO 0.02 0.35 -0.05 0.00 -0.69 0.00 0.00 178.15 177.78 2za5 h ASP 174 N 0.87 0.54 -0.57 0.00 3.58 -0.07 -2.11 116.42 118.66 2za5 h ASP 174 Ca 0.15 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.59 2za5 h ASP 174 Cb 0.60 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.53 2za5 h ASP 174 CO 0.04 0.37 0.28 0.00 -2.88 0.00 0.00 179.24 177.05 2za5 h ALA 175 N 1.28 0.74 -0.45 -0.78 0.00 -1.20 -2.55 119.26 116.31 2za5 h ALA 175 Ca 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2za5 h ALA 175 Cb 0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2za5 h ALA 175 CO -0.13 0.29 0.25 0.87 0.00 0.00 0.00 179.25 180.53 2za5 h LYS 176 N 0.77 0.61 0.00 0.00 1.57 -0.70 -1.72 116.57 117.10 2za5 h LYS 176 Ca 0.20 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2za5 h LYS 176 Cb 0.11 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2za5 h LYS 176 CO -0.03 0.44 0.00 1.88 -0.57 0.00 0.00 179.45 181.18 2za5 h TYR 177 N 0.62 0.00 0.00 -1.35 -1.99 -0.96 -1.80 116.97 111.49 2za5 h TYR 177 Ca 0.16 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.82 2za5 h TYR 177 Cb 0.01 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.73 2za5 h TYR 177 CO 0.00 0.00 -0.74 0.45 -0.00 0.00 0.00 178.16 177.87 2za5 h HIS 178 N 0.00 0.00 -2.17 4.88 3.86 -1.30 -3.44 115.15 116.99 2za5 h HIS 178 Ca 0.00 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 58.63 2za5 h HIS 178 Cb 0.32 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.81 2za5 h HIS 178 CO 0.00 0.28 1.14 1.28 0.86 0.00 0.00 177.93 181.49 2za5 n LEU 179 N -2.98 3.72 -0.62 2.43 4.32 -0.68 -1.52 117.00 121.68 2za5 n LEU 179 Ca -0.01 0.95 -0.08 0.00 -0.02 0.00 0.00 56.01 56.85 2za5 n LEU 179 Cb 0.67 -1.43 -0.03 0.00 -1.62 0.00 0.00 43.42 41.00 2za5 n LEU 179 CO 0.40 0.04 -0.08 0.61 -1.22 0.00 0.00 177.39 177.14 2za5 n GLY 180 N 4.42 0.97 3.45 -0.72 0.00 -1.26 -5.02 105.19 107.03 2za5 n GLY 180 Ca 0.21 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 2za5 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2za5 s ALA 181 N -2.30 2.44 -0.87 4.61 0.00 -0.57 -5.05 121.76 120.02 2za5 s ALA 181 Ca 0.00 -1.95 0.26 0.00 0.00 0.00 0.00 51.96 50.27 2za5 s ALA 181 Cb 0.00 0.20 0.63 0.00 0.00 0.00 0.00 23.12 23.95 2za5 s ALA 181 CO 0.00 -0.07 1.52 0.66 0.00 0.00 0.00 175.76 177.87 2za5 n TYR 182 N -0.63 0.24 -1.85 0.00 4.01 -1.26 -4.94 117.16 112.73 2za5 n TYR 182 Ca -0.05 0.07 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 2za5 n TYR 182 Cb 0.64 -0.48 -0.02 0.00 -0.31 0.00 0.00 39.34 39.16 2za5 n TYR 182 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2za5 s THR 183 N -3.06 2.30 0.41 -0.72 2.01 -1.26 -4.92 115.64 110.40 2za5 s THR 183 Ca 0.10 0.23 -0.26 0.00 0.31 0.00 0.00 61.69 62.07 2za5 s THR 183 Cb 0.16 -3.15 -0.10 0.00 0.01 0.00 0.00 72.50 69.42 2za5 s THR 183 CO 0.66 0.03 1.42 0.61 -0.69 0.00 0.00 174.62 176.65 2za5 n GLY 184 N 2.85 0.98 0.34 4.40 0.00 -1.26 -4.90 105.19 107.60 2za5 n GLY 184 Ca 0.10 0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.46 2za5 n GLY 184 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2za5 h ASP 185 N 2.50 0.44 -0.15 1.61 3.32 -1.98 -0.59 116.42 121.57 2za5 h ASP 185 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2za5 h ASP 185 Cb 1.26 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2za5 h ASP 185 CO 0.62 0.28 0.00 -0.90 -1.72 0.00 0.00 179.24 177.52 2za5 n ASP 186 N -4.47 0.96 -4.63 6.45 5.75 -1.26 -4.71 116.55 114.64 2za5 n ASP 186 Ca 0.08 -1.85 -0.38 0.00 -0.01 0.00 0.00 54.79 52.63 2za5 n ASP 186 Cb 0.28 -0.10 -0.10 0.00 -1.03 0.00 0.00 41.12 40.17 2za5 n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2za5 s VAL 187 N -1.80 5.28 -0.29 2.12 1.01 -0.23 -5.05 120.40 121.45 2za5 s VAL 187 Ca 0.19 0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.29 2za5 s VAL 187 Cb 0.09 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 2za5 s VAL 187 CO 0.14 0.26 0.64 -0.60 0.00 0.00 0.00 175.10 175.54 2za5 s ARG 188 N 1.53 3.98 -0.21 2.72 3.52 -1.26 -4.88 118.95 124.35 2za5 s ARG 188 Ca 0.10 0.40 -0.16 0.00 -0.13 0.00 0.00 55.73 55.95 2za5 s ARG 188 Cb -0.15 -3.70 -0.19 0.00 -1.56 0.00 0.00 34.95 29.35 2za5 s ARG 188 CO 0.08 -0.52 0.11 -0.89 -0.81 0.00 0.00 175.30 173.27 2za5 n ILE 189 N 5.33 1.58 -3.22 4.11 5.41 -1.26 -4.79 119.36 126.52 2za5 n ILE 189 Ca -0.01 -0.26 -0.41 0.00 1.00 0.00 0.00 62.75 63.08 2za5 n ILE 189 Cb 0.49 -1.91 -0.08 0.00 -0.71 0.00 0.00 39.64 37.43 2za5 n ILE 189 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2za5 s VAL 190 N -2.44 5.01 0.51 1.39 1.01 -1.26 -4.99 120.40 119.63 2za5 s VAL 190 Ca -0.30 0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.28 2za5 s VAL 190 Cb 0.08 -3.94 0.04 0.00 0.00 0.00 0.00 36.38 32.56 2za5 s VAL 190 CO 0.61 -0.14 0.71 -0.13 0.00 0.00 0.00 175.10 176.14 2za5 s ARG 191 N 2.43 2.57 0.54 2.72 0.52 -1.26 -4.85 118.95 121.61 2za5 s ARG 191 Ca 0.20 -1.12 0.26 0.00 -0.52 0.00 0.00 55.73 54.56 2za5 s ARG 191 Cb -0.15 -2.62 1.56 0.00 0.52 0.00 0.00 34.95 34.26 2za5 s ARG 191 CO 0.12 -0.60 2.15 -0.44 0.02 0.00 0.00 175.30 176.55 2za5 h ASP 192 N 0.28 0.00 -0.28 0.23 3.32 -1.99 -0.44 116.42 117.54 2za5 h ASP 192 Ca -0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.66 2za5 h ASP 192 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2za5 h ASP 192 CO 0.47 0.07 0.00 -0.90 -1.72 0.00 0.00 179.24 177.15 2za5 n ASP 193 N -3.85 1.59 -4.69 6.45 5.75 -1.26 -4.86 116.55 115.68 2za5 n ASP 193 Ca -0.02 -2.02 -0.25 0.00 -0.01 0.00 0.00 54.79 52.49 2za5 n ASP 193 Cb 0.16 -0.21 -0.08 0.00 -1.03 0.00 0.00 41.12 39.96 2za5 n ASP 193 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2za5 s MET 194 N -1.62 2.16 0.02 0.11 -1.94 -0.18 -0.45 119.30 117.40 2za5 s MET 194 Ca 0.19 -1.80 -0.04 0.00 -1.71 0.00 0.00 55.69 52.33 2za5 s MET 194 Cb 0.10 -1.95 -0.01 0.00 2.01 0.00 0.00 34.83 34.98 2za5 s MET 194 CO 0.13 0.01 0.06 -1.17 -0.01 0.00 0.00 175.02 174.04 2za5 s LEU 195 N -3.81 1.88 -0.03 -0.03 0.20 0.23 -4.64 118.68 112.48 2za5 s LEU 195 Ca 0.38 -0.41 0.07 0.00 0.69 0.00 0.00 54.13 54.85 2za5 s LEU 195 Cb 0.02 0.44 -0.01 0.00 -0.43 0.00 0.00 46.19 46.21 2za5 s LEU 195 CO 0.21 -0.39 -0.24 0.00 -0.29 0.00 0.00 176.35 175.64 2za5 s ALA 197 N -0.38 -1.31 0.00 0.00 0.00 -0.27 -1.16 121.76 118.64 2za5 s ALA 197 Ca 0.04 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.74 2za5 s ALA 197 Cb -0.11 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2za5 s ALA 197 CO 0.01 -0.39 0.00 0.41 0.00 0.00 0.00 175.76 175.79 2za5 n GLY 198 N 0.82 2.40 0.00 0.00 0.00 -0.64 -0.73 105.19 107.03 2za5 n GLY 198 Ca -0.19 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.80 2za5 n GLY 198 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2za5 n ASN 199 N 0.00 0.00 0.00 1.61 0.23 0.23 -4.67 115.26 112.66 2za5 n ASN 199 Ca 0.00 0.00 0.14 0.00 -0.53 0.00 0.00 54.58 54.19 2za5 n ASN 199 Cb 0.00 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 38.49 2za5 n ASN 199 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2za5 n THR 200 N 0.00 0.02 -0.06 5.53 -2.24 -1.26 -2.97 114.28 113.30 2za5 n THR 200 Ca 0.00 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2za5 n THR 200 Cb 0.00 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 2za5 n THR 200 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2za5 n ARG 201 N -1.03 0.36 -3.57 -0.78 1.74 -1.26 -4.84 116.66 107.28 2za5 n ARG 201 Ca 0.19 -0.38 -0.10 0.00 -0.77 0.00 0.00 57.85 56.80 2za5 n ARG 201 Cb 0.11 -0.87 -0.10 0.00 -1.02 0.00 0.00 32.46 30.57 2za5 n ARG 201 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2za5 s ARG 202 N -0.16 0.29 -0.04 5.56 0.52 -1.16 -4.53 118.95 119.44 2za5 s ARG 202 Ca 0.00 0.82 -0.30 0.00 -0.52 0.00 0.00 55.73 55.73 2za5 s ARG 202 Cb 0.00 -0.01 0.11 0.00 0.52 0.00 0.00 34.95 35.57 2za5 s ARG 202 CO 0.00 -0.38 0.98 0.34 0.02 0.00 0.00 175.30 176.26 2za5 s ASP 203 N 2.55 -0.29 0.73 0.23 -1.08 -1.22 -0.60 116.67 116.99 2za5 s ASP 203 Ca 0.03 -0.03 -0.08 0.00 -0.52 0.00 0.00 52.55 51.95 2za5 s ASP 203 Cb -0.13 0.33 0.06 0.00 -1.46 0.00 0.00 42.92 41.72 2za5 s ASP 203 CO -0.13 -0.53 1.06 -0.94 0.52 0.00 0.00 175.17 175.15 2za5 s SER 204 N -2.45 4.78 0.36 -0.34 1.04 -1.26 -0.65 113.70 115.18 2za5 s SER 204 Ca 0.07 0.59 -0.05 0.00 0.48 0.00 0.00 55.95 57.04 2za5 s SER 204 Cb -0.01 -1.22 0.02 0.00 0.10 0.00 0.00 66.02 64.91 2za5 s SER 204 CO -0.07 -1.65 0.55 0.00 0.98 0.00 0.00 173.24 173.05 2za5 n GLN 206 N -0.57 0.67 0.00 0.00 7.27 -1.26 0.06 117.38 123.55 2za5 n GLN 206 Ca -0.01 0.24 0.00 0.00 0.07 0.00 0.00 57.00 57.30 2za5 n GLN 206 Cb 0.61 -1.81 0.00 0.00 2.41 0.00 0.00 30.24 31.45 2za5 n GLN 206 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2za5 n GLY 207 N 2.08 2.58 0.12 1.69 0.00 -1.26 -0.28 105.19 110.11 2za5 n GLY 207 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.24 2za5 n GLY 207 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2za5 h ASP 208 N 0.00 0.00 -0.72 1.61 3.32 -0.70 -3.32 116.42 116.61 2za5 h ASP 208 Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 2za5 h ASP 208 Cb 0.00 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.60 2za5 h ASP 208 CO 0.00 0.46 -0.08 -1.20 -1.72 0.00 0.00 179.24 176.70 2za5 n SER 209 N -2.99 -0.27 0.00 6.45 7.64 -1.25 -0.58 113.62 122.62 2za5 n SER 209 Ca -0.04 0.83 0.00 0.00 1.01 0.00 0.00 58.87 60.67 2za5 n SER 209 Cb 0.75 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2za5 n SER 209 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2za5 n GLY 210 N 1.18 2.80 3.91 0.23 0.00 -0.27 -0.53 105.19 112.51 2za5 n GLY 210 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2za5 n GLY 210 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2za5 s GLY 211 N -1.89 1.64 0.14 -0.02 0.00 0.25 -3.46 107.32 103.98 2za5 s GLY 211 Ca 0.00 -0.80 -0.27 0.00 0.00 0.00 0.00 44.72 43.65 2za5 s GLY 211 CO 0.00 -0.25 0.83 2.56 0.00 0.00 0.00 173.10 176.24 2za5 s PRO 212 N -5.64 4.62 -0.25 2.90 0.05 -1.26 -0.98 135.00 134.45 2za5 s PRO 212 Ca 0.65 1.24 -0.07 0.00 0.05 0.00 0.00 61.00 62.87 2za5 s PRO 212 Cb -0.09 -3.31 -0.03 0.00 0.05 0.00 0.00 34.50 31.12 2za5 s PRO 212 CO 0.50 0.43 0.07 -1.17 0.05 0.00 0.00 177.00 176.87 2za5 s LEU 213 N -0.68 3.45 0.12 -3.56 2.96 0.01 -3.21 118.68 117.78 2za5 s LEU 213 Ca 0.39 -0.23 0.10 0.00 -0.22 0.00 0.00 54.13 54.17 2za5 s LEU 213 Cb -0.23 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 2za5 s LEU 213 CO 0.27 -0.04 -0.26 0.68 -1.32 0.00 0.00 176.35 175.68 2za5 s VAL 214 N 1.61 2.14 0.00 1.68 -7.23 0.13 -1.14 120.40 117.59 2za5 s VAL 214 Ca 0.06 -1.70 0.03 0.00 -1.81 0.00 0.00 61.98 58.57 2za5 s VAL 214 Cb -0.15 -1.90 -0.01 0.00 0.56 0.00 0.00 36.38 34.88 2za5 s VAL 214 CO 0.03 0.07 -0.10 0.00 -0.31 0.00 0.00 175.10 174.79 2za5 s LYS 216 N -0.45 3.72 -0.16 0.00 2.47 -0.98 -0.88 119.74 123.45 2za5 s LYS 216 Ca 0.03 0.33 -0.00 0.00 -1.56 0.00 0.00 55.97 54.77 2za5 s LYS 216 Cb -0.05 -3.84 0.04 0.00 -1.46 0.00 0.00 37.83 32.52 2za5 s LYS 216 CO -0.00 -0.96 -0.06 0.08 0.16 0.00 0.00 175.35 174.56 2za5 s VAL 217 N 3.33 1.16 -1.49 4.02 1.01 -0.10 -4.65 120.40 123.68 2za5 s VAL 217 Ca 0.34 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 2za5 s VAL 217 Cb -0.12 -1.29 0.07 0.00 0.00 0.00 0.00 36.38 35.03 2za5 s VAL 217 CO 0.19 0.19 0.99 -3.20 0.00 0.00 0.00 175.10 173.27 2za5 n ASN 218 N 4.87 -4.68 0.00 3.32 5.15 -1.26 -1.16 115.26 121.49 2za5 n ASN 218 Ca -0.12 -0.75 0.00 0.00 -0.60 0.00 0.00 54.58 53.11 2za5 n ASN 218 Cb 0.48 -4.07 0.00 0.00 -0.53 0.00 0.00 39.78 35.66 2za5 n ASN 218 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2za5 n GLY 219 N -1.73 0.91 3.14 8.20 0.00 -1.26 -5.03 105.19 109.42 2za5 n GLY 219 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2za5 n GLY 219 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2za5 s THR 220 N -3.63 1.25 -0.09 2.61 -4.23 -0.31 -5.10 115.64 106.15 2za5 s THR 220 Ca 0.00 -0.72 -0.30 0.00 -1.18 0.00 0.00 61.69 59.50 2za5 s THR 220 Cb 0.00 -1.05 -0.03 0.00 1.34 0.00 0.00 72.50 72.76 2za5 s THR 220 CO 0.00 0.32 1.21 0.26 -0.54 0.00 0.00 174.62 175.87 2za5 s TRP 221 N -0.42 3.12 -0.06 3.99 0.52 -1.26 -0.92 118.94 123.90 2za5 s TRP 221 Ca 0.06 1.18 0.04 0.00 0.02 0.00 0.00 56.10 57.39 2za5 s TRP 221 Cb -0.06 -3.43 -0.02 0.00 -1.15 0.00 0.00 33.47 28.80 2za5 s TRP 221 CO -0.00 -1.37 -0.15 -0.51 0.02 0.00 0.00 176.95 174.93 2za5 s LEU 222 N 2.54 2.65 -0.65 2.99 1.43 -0.06 -3.65 118.68 123.94 2za5 s LEU 222 Ca 0.55 -0.25 -0.25 0.00 -1.03 0.00 0.00 54.13 53.16 2za5 s LEU 222 Cb -0.24 -1.54 0.05 0.00 0.03 0.00 0.00 46.19 44.49 2za5 s LEU 222 CO 0.20 0.31 1.07 -1.58 0.23 0.00 0.00 176.35 176.59 2za5 s GLN 223 N -0.55 3.22 0.17 1.70 0.74 -0.40 -1.04 119.66 123.49 2za5 s GLN 223 Ca 0.08 -0.44 -0.05 0.00 0.05 0.00 0.00 55.36 54.99 2za5 s GLN 223 Cb -0.11 -4.16 0.05 0.00 1.10 0.00 0.00 33.01 29.89 2za5 s GLN 223 CO 0.01 -1.83 1.47 0.00 -0.55 0.00 0.00 175.29 174.38 2za5 h ALA 224 N 9.65 0.62 -2.68 1.58 0.00 -1.48 -3.38 119.26 123.57 2za5 h ALA 224 Ca -0.28 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.04 2za5 h ALA 224 Cb 1.06 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.65 2za5 h ALA 224 CO 1.19 0.69 -0.20 0.20 0.00 0.00 0.00 179.25 181.14 2za5 s GLY 225 N -4.11 0.05 -0.13 0.00 0.00 -0.96 -1.96 107.32 100.20 2za5 s GLY 225 Ca -0.08 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.22 2za5 s GLY 225 CO 0.85 -0.57 -0.21 0.14 0.00 0.00 0.00 173.10 173.31 2za5 s VAL 226 N -3.87 2.15 0.03 1.40 1.01 -0.49 -0.81 120.40 119.82 2za5 s VAL 226 Ca 0.08 -0.96 -0.33 0.00 0.00 0.00 0.00 61.98 60.77 2za5 s VAL 226 Cb 0.03 -1.86 -0.12 0.00 0.00 0.00 0.00 36.38 34.43 2za5 s VAL 226 CO -0.07 0.55 1.78 0.52 0.00 0.00 0.00 175.10 177.88 2za5 n VAL 227 N 3.93 0.37 0.00 2.92 0.31 -0.15 -0.61 118.33 125.11 2za5 n VAL 227 Ca -0.20 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2za5 n VAL 227 Cb 0.52 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 2za5 n VAL 227 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2za5 n SER 228 N 5.51 0.06 -1.62 4.52 2.88 -0.78 -1.12 113.62 123.07 2za5 n SER 228 Ca 0.20 0.01 -0.03 0.00 -1.33 0.00 0.00 58.87 57.72 2za5 n SER 228 Cb 0.31 -0.02 0.01 0.00 -0.75 0.00 0.00 64.21 63.76 2za5 n SER 228 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2za5 n TRP 229 N -2.56 -1.44 0.00 0.66 4.27 -0.83 -4.93 117.44 112.61 2za5 n TRP 229 Ca 0.00 -0.66 0.00 0.00 -3.89 0.00 0.00 57.50 52.95 2za5 n TRP 229 Cb 0.00 0.32 0.00 0.00 -1.36 0.00 0.00 31.31 30.27 2za5 n TRP 229 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2za5 n GLY 230 N -0.19 1.95 3.57 -1.67 0.00 -1.26 -0.43 105.19 107.16 2za5 n GLY 230 Ca -0.03 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 2za5 n GLY 230 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2za5 s GLU 231 N -2.00 3.39 2.71 1.61 2.12 -1.26 -4.86 118.70 120.41 2za5 s GLU 231 Ca 0.00 0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.38 2za5 s GLU 231 Cb 0.00 -4.08 0.00 0.00 0.26 0.00 0.00 34.13 30.31 2za5 s GLU 231 CO 0.00 -1.85 0.00 0.41 -0.54 0.00 0.00 175.26 173.28 2za5 n GLY 232 N 5.18 0.40 2.99 -1.50 0.00 -1.26 -4.58 105.19 106.42 2za5 n GLY 232 Ca 0.06 -0.90 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 2za5 n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2za5 n ALA 234 N 3.98 -0.82 -2.24 0.00 0.00 -1.26 -4.65 120.51 115.51 2za5 n ALA 234 Ca -0.22 0.18 -0.32 0.00 0.00 0.00 0.00 53.44 53.08 2za5 n ALA 234 Cb 0.51 -2.68 -0.06 0.00 0.00 0.00 0.00 19.45 17.23 2za5 n ALA 234 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2za5 s GLN 235 N -5.38 3.91 0.26 0.00 -1.52 -1.26 -4.35 119.66 111.32 2za5 s GLN 235 Ca 0.15 0.51 -0.31 0.00 -1.95 0.00 0.00 55.36 53.76 2za5 s GLN 235 Cb -0.07 -2.50 -0.13 0.00 -0.22 0.00 0.00 33.01 30.09 2za5 s GLN 235 CO 0.18 0.19 1.48 -2.30 -0.25 0.00 0.00 175.29 174.59 2za5 n PRO 236 N -0.39 2.30 -1.50 2.91 -0.02 -1.26 -2.17 135.00 134.86 2za5 n PRO 236 Ca 0.02 0.82 -0.17 0.00 -2.02 0.00 0.00 63.50 62.15 2za5 n PRO 236 Cb 0.53 -2.52 -0.07 0.00 -0.02 0.00 0.00 33.50 31.42 2za5 n PRO 236 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2za5 n ASN 237 N 2.11 -5.28 -3.24 2.55 5.03 -1.26 -4.91 115.26 110.26 2za5 n ASN 237 Ca 0.10 0.42 -0.25 0.00 0.87 0.00 0.00 54.58 55.73 2za5 n ASN 237 Cb 0.34 -4.28 -0.08 0.00 -1.02 0.00 0.00 39.78 34.74 2za5 n ASN 237 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2za5 n ARG 238 N -2.21 0.66 -1.63 3.52 5.12 -0.92 -4.04 116.66 117.16 2za5 n ARG 238 Ca -0.17 -3.26 -0.33 0.00 -1.93 0.00 0.00 57.85 52.16 2za5 n ARG 238 Cb 0.60 -1.34 0.06 0.00 -1.16 0.00 0.00 32.46 30.61 2za5 n ARG 238 CO 0.00 0.00 0.00 -2.14 -1.93 0.00 0.00 177.63 173.56 2za5 s PRO 239 N -0.97 2.61 0.30 5.56 0.02 -1.26 -4.31 135.00 136.95 2za5 s PRO 239 Ca 0.35 1.40 -0.29 0.00 0.02 0.00 0.00 61.00 62.48 2za5 s PRO 239 Cb 0.14 -1.93 -0.10 0.00 0.02 0.00 0.00 34.50 32.63 2za5 s PRO 239 CO -0.13 -1.40 1.42 0.20 -0.33 0.00 0.00 177.00 176.77 2za5 s GLY 240 N -2.63 2.61 -0.15 0.52 0.00 0.09 -4.78 107.32 102.98 2za5 s GLY 240 Ca 0.67 1.37 -0.07 0.00 0.00 0.00 0.00 44.72 46.69 2za5 s GLY 240 CO 0.44 2.19 0.09 -0.42 0.00 0.00 0.00 173.10 175.40 2za5 s ILE 241 N -0.53 5.03 0.14 0.90 -1.09 0.43 -1.12 121.20 124.96 2za5 s ILE 241 Ca 0.55 0.04 0.09 0.00 -2.23 0.00 0.00 60.65 59.10 2za5 s ILE 241 Cb -0.42 -3.22 -0.04 0.00 -1.58 0.00 0.00 42.46 37.20 2za5 s ILE 241 CO 0.50 0.53 -0.20 -0.31 -1.23 0.00 0.00 174.94 174.24 2za5 s TYR 242 N -0.31 1.84 -0.01 3.97 1.51 0.80 -1.86 117.35 123.29 2za5 s TYR 242 Ca 0.09 -0.44 -0.30 0.00 -1.01 0.00 0.00 57.07 55.41 2za5 s TYR 242 Cb -0.12 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.75 2za5 s TYR 242 CO 0.01 0.29 1.01 0.99 -1.11 0.00 0.00 175.55 176.74 2za5 s THR 243 N -1.68 4.78 -0.52 -0.71 2.01 0.22 -0.60 115.64 119.14 2za5 s THR 243 Ca 0.12 2.00 -0.29 0.00 0.31 0.00 0.00 61.69 63.84 2za5 s THR 243 Cb -0.07 -4.28 0.02 0.00 0.01 0.00 0.00 72.50 68.18 2za5 s THR 243 CO 0.06 0.13 1.24 -0.60 -0.69 0.00 0.00 174.62 174.76 2za5 s ARG 244 N 1.21 3.56 0.24 4.92 3.52 0.40 -1.40 118.95 131.40 2za5 s ARG 244 Ca 0.52 0.48 -0.05 0.00 -0.13 0.00 0.00 55.73 56.55 2za5 s ARG 244 Cb -0.21 -4.00 0.35 0.00 -1.56 0.00 0.00 34.95 29.53 2za5 s ARG 244 CO 0.26 -1.61 1.84 0.28 -0.81 0.00 0.00 175.30 175.26 2za5 h VAL 245 N 6.26 1.00 -0.15 7.11 2.07 -1.67 -2.06 116.25 128.81 2za5 h VAL 245 Ca -0.25 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.00 2za5 h VAL 245 Cb 1.07 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2za5 h VAL 245 CO 1.15 0.17 0.14 0.71 0.02 0.00 0.00 177.57 179.76 2za5 h THR 246 N 0.91 0.63 0.00 2.57 1.35 -1.88 -0.45 112.91 116.05 2za5 h THR 246 Ca 0.38 0.00 -0.08 0.00 -0.55 0.00 0.00 66.41 66.16 2za5 h THR 246 Cb 0.23 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.53 2za5 h THR 246 CO -0.19 0.00 -0.37 0.22 -0.25 0.00 0.00 175.52 174.93 2za5 h TYR 247 N 0.00 0.00 -0.16 4.73 5.03 -1.74 -3.18 116.97 121.66 2za5 h TYR 247 Ca 0.07 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 2za5 h TYR 247 Cb 0.36 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.62 2za5 h TYR 247 CO 0.00 0.37 -0.06 0.66 -1.32 0.00 0.00 178.16 177.81 2za5 n TYR 248 N -3.78 0.54 -0.20 -3.82 4.01 -0.19 -4.72 117.16 109.01 2za5 n TYR 248 Ca -0.01 -1.10 -0.01 0.00 -0.16 0.00 0.00 57.90 56.62 2za5 n TYR 248 Cb 0.45 -0.28 0.10 0.00 -0.31 0.00 0.00 39.34 39.29 2za5 n TYR 248 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2za5 h LEU 249 N 0.94 0.27 -0.30 7.72 3.38 -1.51 -1.41 115.31 124.40 2za5 h LEU 249 Ca 0.04 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2za5 h LEU 249 Cb 1.28 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 2za5 h LEU 249 CO 0.15 0.17 0.05 0.44 0.09 0.00 0.00 178.44 179.34 2za5 h ASP 250 N 0.44 0.00 -0.49 -0.43 3.32 -1.87 0.66 116.42 118.05 2za5 h ASP 250 Ca 0.29 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.35 2za5 h ASP 250 Cb 0.33 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 2za5 h ASP 250 CO -0.27 0.04 0.16 -0.25 -1.72 0.00 0.00 179.24 177.19 2za5 h TRP 251 N 0.16 0.79 -0.58 4.55 7.01 -1.80 -2.07 115.95 124.01 2za5 h TRP 251 Ca 0.14 -0.08 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 2za5 h TRP 251 Cb 0.15 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 26.96 2za5 h TRP 251 CO -0.18 0.69 0.30 0.82 -2.79 0.00 0.00 178.44 177.28 2za5 h ILE 252 N 0.66 1.20 0.00 2.65 2.04 -0.98 -2.33 117.51 120.75 2za5 h ILE 252 Ca 0.16 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2za5 h ILE 252 Cb 0.27 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2za5 h ILE 252 CO -0.01 0.22 0.00 1.41 0.00 0.00 0.00 178.15 179.78 2za5 n HIS 253 N -4.57 0.37 0.23 1.37 8.25 0.20 -0.81 115.22 120.26 2za5 n HIS 253 Ca 0.03 0.14 0.10 0.00 -0.26 0.00 0.00 57.72 57.74 2za5 n HIS 253 Cb 0.10 -0.73 0.52 0.00 1.12 0.00 0.00 29.99 31.01 2za5 n HIS 253 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2za5 h HIS 254 N 0.00 0.00 0.00 4.41 -0.00 -0.79 -3.35 115.15 115.42 2za5 h HIS 254 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.21 2za5 h HIS 254 Cb 0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.72 2za5 h HIS 254 CO 0.00 0.22 -1.61 0.66 -0.00 0.00 0.00 177.93 177.20 2za5 n TYR 255 N -3.50 0.00 -3.60 5.26 4.01 -0.61 -5.00 117.16 113.72 2za5 n TYR 255 Ca -0.01 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.35 2za5 n TYR 255 Cb 0.38 -0.42 -0.11 0.00 -0.31 0.00 0.00 39.34 38.88 2za5 n TYR 255 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2za5 s VAL 256 N -2.21 5.08 0.21 -0.72 1.01 0.01 -5.05 120.40 118.73 2za5 s VAL 256 Ca -0.12 -0.05 -0.32 0.00 0.00 0.00 0.00 61.98 61.49 2za5 s VAL 256 Cb 0.03 -3.49 -0.12 0.00 0.00 0.00 0.00 36.38 32.81 2za5 s VAL 256 CO 0.28 0.17 1.71 -2.84 0.00 0.00 0.00 175.10 174.42 2za5 s PRO 257 N 1.71 4.13 0.00 2.72 0.02 -1.26 -4.56 135.00 137.76 2za5 s PRO 257 Ca 0.06 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.69 2za5 s PRO 257 Cb -0.16 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.28 2za5 s PRO 257 CO 0.09 -0.74 0.00 0.36 -0.33 0.00 0.00 177.00 176.38