#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zrd h PRO 9 N 0.00 -0.09 -1.70 0.11 0.11 -2.05 -2.82 132.00 125.57 1zrd h PRO 9 Ca 0.00 0.01 0.51 0.00 0.11 0.00 0.00 66.00 66.62 1zrd h PRO 9 Cb 0.00 0.02 -0.08 0.00 0.11 0.00 0.00 31.00 31.04 1zrd h PRO 9 CO 0.00 -0.06 1.20 0.25 -0.21 0.00 0.00 178.00 179.19 1zrd n THR 10 N -3.27 -0.05 -0.05 -1.15 -2.24 -1.26 -0.85 114.28 105.41 1zrd n THR 10 Ca -0.01 1.43 -0.22 0.00 -2.27 0.00 0.00 64.05 62.98 1zrd n THR 10 Cb 0.07 -2.37 -0.13 0.00 -2.10 0.00 0.00 70.33 65.81 1zrd n THR 10 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1zrd h LEU 11 N 0.00 0.20 -1.47 3.22 5.85 -1.93 -3.00 115.31 118.19 1zrd h LEU 11 Ca 0.85 -0.72 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1zrd h LEU 11 Cb 3.29 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 44.24 1zrd h LEU 11 CO -0.10 1.64 -0.27 -0.08 -0.34 0.00 0.00 178.44 179.30 1zrd h GLU 12 N -0.52 0.00 0.00 1.25 4.57 -0.81 0.47 114.58 119.54 1zrd h GLU 12 Ca -0.37 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 57.69 1zrd h GLU 12 Cb 1.63 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.21 1zrd h GLU 12 CO -0.07 0.27 -0.55 2.35 -1.18 0.00 0.00 179.01 179.83 1zrd h TRP 13 N 0.00 0.00 0.41 0.92 7.01 -1.15 0.24 115.95 123.38 1zrd h TRP 13 Ca -0.00 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 1zrd h TRP 13 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.54 1zrd h TRP 13 CO 0.00 0.55 -0.20 0.35 -2.79 0.00 0.00 178.44 176.36 1zrd h PHE 14 N 0.00 -0.51 -0.77 2.65 3.57 -0.55 -3.18 116.94 118.15 1zrd h PHE 14 Ca -0.01 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.58 1zrd h PHE 14 Cb 1.16 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 40.01 1zrd h PHE 14 CO 0.00 -0.23 0.50 -0.07 -2.23 0.00 0.00 178.31 176.28 1zrd h LEU 15 N -1.07 0.63 -1.98 0.59 3.38 -0.21 -0.11 115.31 116.54 1zrd h LEU 15 Ca -0.06 0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.09 1zrd h LEU 15 Cb 0.51 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1zrd h LEU 15 CO 0.09 0.38 0.48 0.77 0.09 0.00 0.00 178.44 180.26 1zrd h SER 16 N 0.70 0.00 -0.16 -0.43 4.64 -0.92 0.33 113.55 117.72 1zrd h SER 16 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1zrd h SER 16 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1zrd h SER 16 CO -0.13 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.24 1zrd n HIS 17 N -3.96 0.18 -2.74 4.77 8.25 -0.06 -4.98 115.22 116.68 1zrd n HIS 17 Ca 0.10 -0.09 -0.20 0.00 -0.26 0.00 0.00 57.72 57.27 1zrd n HIS 17 Cb 0.70 -0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.85 1zrd n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1zrd s HIS 19 N -2.68 3.48 0.20 0.00 5.65 0.43 -4.92 115.29 117.44 1zrd s HIS 19 Ca 0.57 -2.57 -0.30 0.00 0.25 0.00 0.00 55.06 53.02 1zrd s HIS 19 Cb -0.10 -2.38 -0.08 0.00 -1.18 0.00 0.00 32.58 28.84 1zrd s HIS 19 CO 0.37 -0.91 1.09 0.42 -0.65 0.00 0.00 174.74 175.07 1zrd s ILE 20 N 1.03 3.81 0.14 0.89 1.09 -1.26 -1.83 121.20 125.08 1zrd s ILE 20 Ca -0.00 1.61 0.05 0.00 -1.10 0.00 0.00 60.65 61.21 1zrd s ILE 20 Cb -0.20 -4.03 -0.04 0.00 -1.06 0.00 0.00 42.46 37.13 1zrd s ILE 20 CO -0.06 0.30 -0.11 -1.00 -0.10 0.00 0.00 174.94 173.97 1zrd s HIS 21 N -0.42 1.29 0.04 3.97 3.76 0.59 -4.97 115.29 119.55 1zrd s HIS 21 Ca 0.48 -0.72 0.07 0.00 -0.15 0.00 0.00 55.06 54.74 1zrd s HIS 21 Cb -0.30 -0.66 -0.03 0.00 1.11 0.00 0.00 32.58 32.71 1zrd s HIS 21 CO 0.36 0.10 -0.20 0.15 -0.85 0.00 0.00 174.74 174.30 1zrd s LYS 22 N -3.57 1.36 0.02 1.40 1.02 -1.26 -0.66 119.74 118.04 1zrd s LYS 22 Ca 0.16 -0.93 0.04 0.00 0.02 0.00 0.00 55.97 55.25 1zrd s LYS 22 Cb 0.01 -1.47 -0.02 0.00 -0.52 0.00 0.00 37.83 35.84 1zrd s LYS 22 CO 0.01 0.37 -0.12 0.71 -0.92 0.00 0.00 175.35 175.41 1zrd s TYR 23 N -0.81 1.01 0.61 3.18 1.51 -0.73 -4.99 117.35 117.13 1zrd s TYR 23 Ca 0.07 -0.28 -0.07 0.00 -1.01 0.00 0.00 57.07 55.78 1zrd s TYR 23 Cb -0.09 -0.62 0.01 0.00 -0.11 0.00 0.00 41.96 41.15 1zrd s TYR 23 CO 0.02 -0.00 0.93 -1.25 -1.11 0.00 0.00 175.55 174.14 1zrd s PRO 24 N -0.75 2.91 0.33 -1.71 0.04 -1.26 -2.09 135.00 132.47 1zrd s PRO 24 Ca 0.02 0.07 -0.28 0.00 0.04 0.00 0.00 61.00 60.84 1zrd s PRO 24 Cb -0.06 -2.23 -0.13 0.00 0.04 0.00 0.00 34.50 32.12 1zrd s PRO 24 CO 0.00 -0.76 1.26 0.45 0.04 0.00 0.00 177.00 178.00 1zrd n SER 25 N -2.65 2.57 0.00 6.66 2.88 -1.26 -1.82 113.62 120.00 1zrd n SER 25 Ca 0.05 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 1zrd n SER 25 Cb 0.57 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 1zrd n SER 25 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1zrd n LYS 26 N 0.65 0.00 -1.99 -1.46 5.02 -0.79 -4.97 118.16 114.62 1zrd n LYS 26 Ca 0.06 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.03 1zrd n LYS 26 Cb 0.35 -2.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.02 1zrd n LYS 26 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1zrd s SER 27 N -3.23 6.21 -0.22 4.39 1.04 -0.75 -4.68 113.70 116.46 1zrd s SER 27 Ca 0.00 1.50 -0.17 0.00 0.48 0.00 0.00 55.95 57.76 1zrd s SER 27 Cb 0.00 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 1zrd s SER 27 CO 0.00 -0.88 0.46 -0.89 0.98 0.00 0.00 173.24 172.91 1zrd s THR 28 N -2.98 5.14 -0.19 2.02 2.01 -1.26 -0.94 115.64 119.44 1zrd s THR 28 Ca 0.57 0.80 0.05 0.00 0.31 0.00 0.00 61.69 63.42 1zrd s THR 28 Cb -0.11 -3.78 -0.22 0.00 0.01 0.00 0.00 72.50 68.40 1zrd s THR 28 CO 0.47 0.19 0.08 0.18 -0.69 0.00 0.00 174.62 174.85 1zrd n LEU 29 N 4.87 1.92 -3.95 4.42 4.32 -0.16 -4.95 117.00 123.47 1zrd n LEU 29 Ca -0.06 0.04 -0.21 0.00 -0.02 0.00 0.00 56.01 55.75 1zrd n LEU 29 Cb 0.51 -0.48 -0.16 0.00 -1.62 0.00 0.00 43.42 41.67 1zrd n LEU 29 CO 0.40 0.75 -0.43 -0.63 -1.22 0.00 0.00 177.39 176.26 1zrd s ILE 30 N -2.53 0.73 -0.28 -0.08 1.01 -1.10 -4.98 121.20 113.97 1zrd s ILE 30 Ca -0.22 -0.26 -0.09 0.00 0.00 0.00 0.00 60.65 60.08 1zrd s ILE 30 Cb 0.08 -0.70 -0.02 0.00 0.01 0.00 0.00 42.46 41.83 1zrd s ILE 30 CO 0.72 0.26 0.12 -1.00 0.00 0.00 0.00 174.94 175.04 1zrd s HIS 31 N 0.69 3.14 0.45 3.97 3.76 -1.26 -2.18 115.29 123.86 1zrd s HIS 31 Ca -0.11 -0.47 -0.24 0.00 -0.15 0.00 0.00 55.06 54.09 1zrd s HIS 31 Cb -0.14 -2.31 -0.10 0.00 1.11 0.00 0.00 32.58 31.15 1zrd s HIS 31 CO 0.01 -0.40 1.03 0.94 -0.85 0.00 0.00 174.74 175.48 1zrd n GLN 32 N 4.96 1.36 0.00 1.40 7.27 -1.21 -2.27 117.38 128.89 1zrd n GLN 32 Ca -0.15 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.41 1zrd n GLN 32 Cb 0.50 -2.10 0.00 0.00 2.41 0.00 0.00 30.24 31.05 1zrd n GLN 32 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1zrd n GLY 33 N 1.15 3.26 3.87 1.69 0.00 -0.51 -4.89 105.19 109.76 1zrd n GLY 33 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1zrd n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zrd s GLU 34 N -0.58 3.18 -0.15 1.61 2.02 -0.96 -4.62 118.70 119.20 1zrd s GLU 34 Ca 0.00 0.65 -0.29 0.00 0.02 0.00 0.00 54.97 55.35 1zrd s GLU 34 Cb 0.00 -2.04 -0.01 0.00 0.10 0.00 0.00 34.13 32.18 1zrd s GLU 34 CO 0.00 -0.85 1.07 0.15 0.02 0.00 0.00 175.26 175.65 1zrd s LYS 35 N -5.23 4.34 0.24 1.61 -0.14 -1.26 -0.18 119.74 119.11 1zrd s LYS 35 Ca 0.57 1.44 -0.30 0.00 -1.36 0.00 0.00 55.97 56.32 1zrd s LYS 35 Cb -0.11 -3.60 -0.09 0.00 -1.68 0.00 0.00 37.83 32.35 1zrd s LYS 35 CO 0.53 -0.48 1.10 0.00 -0.76 0.00 0.00 175.35 175.74 1zrd s ALA 36 N 2.61 3.39 0.00 5.17 0.00 -0.45 -4.83 121.76 127.66 1zrd s ALA 36 Ca 0.48 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1zrd s ALA 36 Cb -0.18 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1zrd s ALA 36 CO 0.14 -0.16 0.00 0.39 0.00 0.00 0.00 175.76 176.12 1zrd n GLU 37 N 1.64 0.00 -4.16 0.00 1.02 -1.26 -4.78 120.64 113.10 1zrd n GLU 37 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.01 1zrd n GLU 37 Cb 0.45 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.76 1zrd n GLU 37 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1zrd s THR 38 N 0.00 0.85 0.12 2.62 2.01 -1.26 -1.19 115.64 118.79 1zrd s THR 38 Ca 0.00 -1.59 0.11 0.00 0.31 0.00 0.00 61.69 60.51 1zrd s THR 38 Cb 0.00 -1.29 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 1zrd s THR 38 CO 0.00 -0.57 -0.26 -0.22 -0.69 0.00 0.00 174.62 172.88 1zrd s LEU 39 N -2.39 2.31 0.01 4.42 2.96 0.22 -4.70 118.68 121.51 1zrd s LEU 39 Ca 0.04 -0.73 0.05 0.00 -0.22 0.00 0.00 54.13 53.26 1zrd s LEU 39 Cb -0.03 -1.18 -0.02 0.00 0.50 0.00 0.00 46.19 45.46 1zrd s LEU 39 CO -0.01 0.17 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.74 1zrd s TYR 40 N -1.05 1.25 -0.10 5.38 1.51 0.30 -1.25 117.35 123.38 1zrd s TYR 40 Ca 0.13 -0.28 -0.01 0.00 -1.01 0.00 0.00 57.07 55.90 1zrd s TYR 40 Cb -0.10 -0.78 0.03 0.00 -0.11 0.00 0.00 41.96 41.00 1zrd s TYR 40 CO 0.06 0.00 -0.04 -0.47 -1.11 0.00 0.00 175.55 173.99 1zrd s TYR 41 N -0.53 1.13 -0.62 2.71 6.14 0.45 0.16 117.35 126.78 1zrd s TYR 41 Ca 0.04 -0.51 -0.27 0.00 0.64 0.00 0.00 57.07 56.96 1zrd s TYR 41 Cb -0.06 -1.05 0.01 0.00 0.42 0.00 0.00 41.96 41.28 1zrd s TYR 41 CO 0.00 -0.44 1.46 0.42 0.64 0.00 0.00 175.55 177.63 1zrd s ILE 42 N 1.82 3.69 0.09 3.14 1.01 -0.76 -0.84 121.20 129.34 1zrd s ILE 42 Ca 0.05 0.50 -0.12 0.00 0.00 0.00 0.00 60.65 61.08 1zrd s ILE 42 Cb -0.13 -4.49 -0.21 0.00 0.01 0.00 0.00 42.46 37.64 1zrd s ILE 42 CO -0.07 -1.33 1.23 0.58 0.00 0.00 0.00 174.94 175.35 1zrd h VAL 43 N 6.37 1.30 -2.54 2.92 2.07 -1.72 0.42 116.25 125.07 1zrd h VAL 43 Ca -0.27 -2.24 -0.10 0.00 0.82 0.00 0.00 66.70 64.92 1zrd h VAL 43 Cb 1.09 2.32 -0.24 0.00 -1.52 0.00 0.00 31.29 32.95 1zrd h VAL 43 CO 1.22 0.69 -0.16 -0.75 0.02 0.00 0.00 177.57 178.58 1zrd s LYS 44 N -3.38 0.54 0.00 1.57 2.20 -0.98 -4.66 119.74 115.04 1zrd s LYS 44 Ca -0.09 0.73 0.00 0.00 -0.36 0.00 0.00 55.97 56.25 1zrd s LYS 44 Cb 0.08 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.60 1zrd s LYS 44 CO 0.91 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 176.22 1zrd n GLY 45 N 3.20 -0.97 3.17 5.54 0.00 -1.26 -0.99 105.19 113.88 1zrd n GLY 45 Ca -0.16 -2.15 -0.12 0.00 0.00 0.00 0.00 46.02 43.59 1zrd n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zrd s SER 46 N -4.00 -0.16 0.44 1.61 1.04 -1.26 -2.63 113.70 108.74 1zrd s SER 46 Ca 0.00 0.16 0.04 0.00 0.48 0.00 0.00 55.95 56.63 1zrd s SER 46 Cb 0.00 0.36 -0.05 0.00 0.10 0.00 0.00 66.02 66.43 1zrd s SER 46 CO 0.00 -0.30 0.02 0.68 0.98 0.00 0.00 173.24 174.62 1zrd s VAL 47 N -0.83 1.53 -0.13 5.02 -7.23 0.20 -0.17 120.40 118.79 1zrd s VAL 47 Ca -0.09 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.08 1zrd s VAL 47 Cb -0.05 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.30 1zrd s VAL 47 CO 0.02 0.00 -0.13 0.00 -0.31 0.00 0.00 175.10 174.68 1zrd s ALA 48 N -2.85 1.68 -0.19 1.32 0.00 0.16 -1.53 121.76 120.36 1zrd s ALA 48 Ca 0.23 -0.76 -0.21 0.00 0.00 0.00 0.00 51.96 51.21 1zrd s ALA 48 Cb 0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 1zrd s ALA 48 CO 0.12 -0.29 0.65 0.08 0.00 0.00 0.00 175.76 176.31 1zrd s VAL 49 N 1.38 5.01 0.05 0.00 1.01 0.10 -1.84 120.40 126.11 1zrd s VAL 49 Ca 0.01 1.24 -0.11 0.00 0.00 0.00 0.00 61.98 63.12 1zrd s VAL 49 Cb -0.13 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.29 1zrd s VAL 49 CO -0.07 0.11 0.24 -1.48 0.00 0.00 0.00 175.10 173.90 1zrd s LEU 50 N 1.87 1.17 0.22 3.92 0.05 -0.21 -0.95 118.68 124.74 1zrd s LEU 50 Ca 0.30 -0.34 0.11 0.00 0.05 0.00 0.00 54.13 54.25 1zrd s LEU 50 Cb -0.16 1.14 -0.05 0.00 -2.05 0.00 0.00 46.19 45.07 1zrd s LEU 50 CO 0.11 -0.61 -0.19 0.27 -0.55 0.00 0.00 176.35 175.38 1zrd s ILE 51 N -2.76 2.61 0.26 1.48 -4.36 -0.18 -0.82 121.20 117.42 1zrd s ILE 51 Ca -0.04 -2.05 0.10 0.00 -0.26 0.00 0.00 60.65 58.40 1zrd s ILE 51 Cb -0.00 -2.30 -0.05 0.00 1.25 0.00 0.00 42.46 41.36 1zrd s ILE 51 CO -0.05 -0.20 -0.15 -0.54 0.24 0.00 0.00 174.94 174.24 1zrd s LYS 52 N -2.97 1.55 0.44 0.37 1.02 -1.26 -0.72 119.74 118.16 1zrd s LYS 52 Ca 0.24 -1.72 0.07 0.00 0.02 0.00 0.00 55.97 54.58 1zrd s LYS 52 Cb -0.07 -1.46 -0.03 0.00 -0.52 0.00 0.00 37.83 35.75 1zrd s LYS 52 CO 0.13 0.23 0.26 0.16 -0.92 0.00 0.00 175.35 175.20 1zrd s ASP 53 N -3.44 4.59 0.29 2.83 3.84 -0.56 -4.94 116.67 119.28 1zrd s ASP 53 Ca 0.27 -1.05 0.03 0.00 -0.00 0.00 0.00 52.55 51.80 1zrd s ASP 53 Cb -0.02 -0.32 0.63 0.00 -1.38 0.00 0.00 42.92 41.84 1zrd s ASP 53 CO 0.12 -0.67 1.80 1.05 -0.00 0.00 0.00 175.17 177.47 1zrd h GLU 54 N 1.22 0.85 0.00 2.11 9.09 -2.02 0.17 114.58 126.00 1zrd h GLU 54 Ca -0.42 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 58.94 1zrd h GLU 54 Cb 1.27 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 28.18 1zrd h GLU 54 CO 0.65 0.56 0.00 0.39 0.05 0.00 0.00 179.01 180.66 1zrd n GLU 55 N -4.70 0.61 -0.15 1.06 1.02 -1.26 -4.84 120.64 112.38 1zrd n GLU 55 Ca 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1zrd n GLU 55 Cb 0.45 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1zrd n GLU 55 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zrd n GLY 56 N 0.21 1.20 3.68 0.62 0.00 0.59 -5.02 105.19 106.46 1zrd n GLY 56 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1zrd n GLY 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1zrd n LYS 57 N -2.00 2.12 -4.59 1.61 5.02 -1.26 -4.62 118.16 114.45 1zrd n LYS 57 Ca 0.00 0.75 -0.34 0.00 -2.02 0.00 0.00 58.31 56.70 1zrd n LYS 57 Cb 0.00 -2.41 -0.11 0.00 -0.02 0.00 0.00 35.03 32.49 1zrd n LYS 57 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1zrd s GLU 58 N -0.63 2.81 -0.04 1.97 2.02 -1.26 -1.49 118.70 122.07 1zrd s GLU 58 Ca 0.66 -0.53 0.04 0.00 0.02 0.00 0.00 54.97 55.16 1zrd s GLU 58 Cb -0.62 -2.62 -0.00 0.00 0.10 0.00 0.00 34.13 30.98 1zrd s GLU 58 CO 0.51 0.65 -0.18 1.41 0.02 0.00 0.00 175.26 177.68 1zrd s MET 59 N -0.77 1.86 -0.43 1.61 1.75 0.10 -4.71 119.30 118.71 1zrd s MET 59 Ca 0.12 -0.64 -0.17 0.00 -1.25 0.00 0.00 55.69 53.75 1zrd s MET 59 Cb -0.11 -1.61 0.03 0.00 2.84 0.00 0.00 34.83 35.98 1zrd s MET 59 CO 0.02 0.26 0.44 0.42 -0.65 0.00 0.00 175.02 175.50 1zrd s ILE 60 N 0.02 5.09 0.03 10.11 1.01 0.32 -1.02 121.20 136.77 1zrd s ILE 60 Ca -0.04 -0.45 -0.17 0.00 0.00 0.00 0.00 60.65 60.00 1zrd s ILE 60 Cb -0.12 -4.06 -0.28 0.00 0.01 0.00 0.00 42.46 38.01 1zrd s ILE 60 CO 0.02 -0.46 1.08 -0.07 0.00 0.00 0.00 174.94 175.51 1zrd h LEU 61 N 9.05 0.76 -7.51 2.97 3.38 -1.33 -3.42 115.31 119.21 1zrd h LEU 61 Ca -0.27 -0.82 0.15 0.00 0.09 0.00 0.00 57.88 57.04 1zrd h LEU 61 Cb 1.11 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.53 1zrd h LEU 61 CO 0.81 1.50 0.47 -0.55 0.09 0.00 0.00 178.44 180.76 1zrd s SER 62 N -7.22 -0.23 -0.09 -0.43 0.15 -1.11 -4.98 113.70 99.79 1zrd s SER 62 Ca -0.11 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.25 1zrd s SER 62 Cb 0.05 0.48 -0.02 0.00 -1.71 0.00 0.00 66.02 64.82 1zrd s SER 62 CO 0.90 -0.86 -0.17 -0.31 1.20 0.00 0.00 173.24 174.00 1zrd s TYR 63 N -3.29 2.69 0.10 3.44 2.02 -1.26 0.03 117.35 121.09 1zrd s TYR 63 Ca 0.10 -0.58 0.08 0.00 -0.37 0.00 0.00 57.07 56.30 1zrd s TYR 63 Cb -0.01 -1.74 -0.04 0.00 -0.40 0.00 0.00 41.96 39.77 1zrd s TYR 63 CO -0.01 -0.14 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.17 1zrd s LEU 64 N -0.00 2.79 0.00 -1.29 1.43 -0.58 -4.96 118.68 116.07 1zrd s LEU 64 Ca -0.05 -0.49 0.05 0.00 -1.03 0.00 0.00 54.13 52.60 1zrd s LEU 64 Cb -0.14 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1zrd s LEU 64 CO 0.04 0.19 0.18 0.59 0.23 0.00 0.00 176.35 177.58 1zrd n ASN 65 N 0.86 0.24 -3.64 2.29 3.02 -1.26 -0.62 115.26 116.15 1zrd n ASN 65 Ca -0.15 -2.79 -0.48 0.00 -0.03 0.00 0.00 54.58 51.12 1zrd n ASN 65 Cb 0.52 1.13 -0.07 0.00 -0.61 0.00 0.00 39.78 40.76 1zrd n ASN 65 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1zrd n GLN 66 N -0.63 0.00 0.00 3.52 7.27 -1.08 0.14 117.38 126.60 1zrd n GLN 66 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.08 1zrd n GLN 66 Cb 0.50 -1.21 0.00 0.00 2.41 0.00 0.00 30.24 31.94 1zrd n GLN 66 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1zrd n GLY 67 N 1.34 2.30 3.75 1.69 0.00 0.15 -5.01 105.19 109.41 1zrd n GLY 67 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1zrd n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zrd s ASP 68 N -2.72 7.25 0.53 1.61 1.01 0.12 -4.82 116.67 119.65 1zrd s ASP 68 Ca 0.00 1.49 -0.17 0.00 0.71 0.00 0.00 52.55 54.58 1zrd s ASP 68 Cb 0.00 -2.47 -0.07 0.00 1.01 0.00 0.00 42.92 41.39 1zrd s ASP 68 CO 0.00 0.07 1.01 -0.36 0.21 0.00 0.00 175.17 176.09 1zrd s PHE 69 N -0.33 3.29 -0.04 4.23 0.40 -1.26 -1.83 117.98 122.43 1zrd s PHE 69 Ca 0.38 1.50 -0.05 0.00 -0.60 0.00 0.00 56.93 58.15 1zrd s PHE 69 Cb -0.21 -2.87 0.01 0.00 0.51 0.00 0.00 43.02 40.46 1zrd s PHE 69 CO 0.24 -0.58 0.13 0.42 0.70 0.00 0.00 175.22 176.13 1zrd s ILE 70 N -2.51 0.01 0.00 0.64 1.01 0.41 -4.88 121.20 115.88 1zrd s ILE 70 Ca 0.61 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 61.17 1zrd s ILE 70 Cb -0.12 -0.22 0.00 0.00 0.01 0.00 0.00 42.46 42.13 1zrd s ILE 70 CO 0.31 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.81 1zrd n GLY 71 N 2.82 0.43 0.07 6.18 0.00 -1.26 0.11 105.19 113.54 1zrd n GLY 71 Ca -0.14 -0.97 -0.07 0.00 0.00 0.00 0.00 46.02 44.84 1zrd n GLY 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1zrd h GLU 72 N 0.04 0.00 -0.52 1.61 -0.00 -1.90 -3.36 114.58 110.45 1zrd h GLU 72 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 59.36 59.51 1zrd h GLU 72 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.73 1zrd h GLU 72 CO 0.00 0.92 0.64 -0.07 -0.00 0.00 0.00 179.01 180.50 1zrd h LEU 73 N 0.00 0.00 0.00 3.06 3.38 -1.96 0.15 115.31 119.94 1zrd h LEU 73 Ca -0.04 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1zrd h LEU 73 Cb 1.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.52 1zrd h LEU 73 CO 0.12 0.00 -0.71 1.23 0.09 0.00 0.00 178.44 179.17 1zrd h GLY 74 N 0.00 0.00 1.58 0.83 0.00 -1.88 -3.37 103.07 100.22 1zrd h GLY 74 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1zrd h GLY 74 CO -0.00 0.00 0.04 -0.10 0.00 0.00 0.00 176.54 176.47 1zrd n LEU 75 N -2.97 0.00 -0.04 3.11 7.94 0.53 -3.18 117.00 122.40 1zrd n LEU 75 Ca -0.01 0.34 0.02 0.00 -1.11 0.00 0.00 56.01 55.26 1zrd n LEU 75 Cb 0.66 -0.34 -0.14 0.00 0.53 0.00 0.00 43.42 44.13 1zrd n LEU 75 CO 0.39 -0.34 -0.84 0.49 -1.11 0.00 0.00 177.39 175.98 1zrd n PHE 76 N -1.33 0.00 -4.28 1.96 3.01 -1.26 -4.99 117.46 110.58 1zrd n PHE 76 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.25 1zrd n PHE 76 Cb 0.04 -0.58 -0.13 0.00 -0.01 0.00 0.00 39.48 38.81 1zrd n PHE 76 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1zrd s GLU 77 N -2.93 0.96 0.75 -1.08 2.12 -1.19 -5.14 118.70 112.19 1zrd s GLU 77 Ca -0.07 -0.96 -0.11 0.00 0.36 0.00 0.00 54.97 54.19 1zrd s GLU 77 Cb 0.09 -1.04 0.04 0.00 0.26 0.00 0.00 34.13 33.49 1zrd s GLU 77 CO 0.73 0.24 1.09 -1.21 -0.54 0.00 0.00 175.26 175.57 1zrd s GLU 78 N -1.60 2.40 -0.91 4.30 0.41 -1.26 -4.15 118.70 117.88 1zrd s GLU 78 Ca 0.02 1.19 -0.08 0.00 -0.41 0.00 0.00 54.97 55.69 1zrd s GLU 78 Cb -0.09 -1.91 -0.00 0.00 -1.78 0.00 0.00 34.13 30.34 1zrd s GLU 78 CO 0.02 -1.54 0.70 0.41 -0.49 0.00 0.00 175.26 174.36 1zrd n GLY 79 N -1.14 -1.18 3.28 -1.39 0.00 -1.26 -5.00 105.19 98.50 1zrd n GLY 79 Ca 0.09 0.51 -0.24 0.00 0.00 0.00 0.00 46.02 46.38 1zrd n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1zrd s GLN 80 N -4.81 1.17 0.14 1.61 2.00 -1.26 -5.08 119.66 113.44 1zrd s GLN 80 Ca 0.17 -1.12 0.05 0.00 -2.00 0.00 0.00 55.36 52.47 1zrd s GLN 80 Cb -0.06 -1.41 -0.04 0.00 0.80 0.00 0.00 33.01 32.30 1zrd s GLN 80 CO 0.85 0.33 0.06 -1.21 -0.50 0.00 0.00 175.29 174.82 1zrd s GLU 81 N -1.76 2.69 0.09 1.67 2.02 -1.26 -1.34 118.70 120.81 1zrd s GLU 81 Ca 0.07 -0.90 -0.31 0.00 0.02 0.00 0.00 54.97 53.85 1zrd s GLU 81 Cb -0.10 -2.56 -0.09 0.00 0.10 0.00 0.00 34.13 31.49 1zrd s GLU 81 CO 0.04 0.50 1.62 1.03 0.02 0.00 0.00 175.26 178.47 1zrd s ARG 82 N -2.78 4.21 0.36 1.61 1.81 0.75 -4.81 118.95 120.10 1zrd s ARG 82 Ca 0.29 2.32 0.06 0.00 -1.72 0.00 0.00 55.73 56.68 1zrd s ARG 82 Cb -0.11 -3.49 0.69 0.00 -0.45 0.00 0.00 34.95 31.59 1zrd s ARG 82 CO 0.21 -0.69 1.91 0.66 -0.68 0.00 0.00 175.30 176.70 1zrd h SER 83 N 7.94 0.41 -5.41 0.23 4.64 -1.92 -1.34 113.55 118.10 1zrd h SER 83 Ca -0.42 -0.07 -0.19 0.00 -0.47 0.00 0.00 61.79 60.64 1zrd h SER 83 Cb 1.20 -0.11 -0.08 0.00 -0.31 0.00 0.00 62.40 63.10 1zrd h SER 83 CO 0.92 0.48 -0.17 0.00 -0.87 0.00 0.00 176.83 177.19 1zrd s ALA 84 N -4.97 0.38 0.34 5.18 0.00 -1.26 -4.86 121.76 116.57 1zrd s ALA 84 Ca -0.07 -1.28 -0.12 0.00 0.00 0.00 0.00 51.96 50.49 1zrd s ALA 84 Cb 0.16 1.12 -0.07 0.00 0.00 0.00 0.00 23.12 24.32 1zrd s ALA 84 CO 0.75 -0.81 0.70 -1.58 0.00 0.00 0.00 175.76 174.83 1zrd s TRP 85 N -3.39 3.42 -0.07 0.00 0.52 -0.00 -3.32 118.94 116.09 1zrd s TRP 85 Ca 0.28 1.05 -0.01 0.00 0.02 0.00 0.00 56.10 57.43 1zrd s TRP 85 Cb -0.00 -2.42 0.03 0.00 -1.15 0.00 0.00 33.47 29.92 1zrd s TRP 85 CO 0.16 0.05 0.01 0.08 0.02 0.00 0.00 176.95 177.27 1zrd s VAL 86 N -2.11 0.33 -0.06 4.03 1.01 -0.93 -1.05 120.40 121.62 1zrd s VAL 86 Ca 0.51 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.66 1zrd s VAL 86 Cb -0.10 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.77 1zrd s VAL 86 CO 0.24 0.23 -0.18 -0.60 0.00 0.00 0.00 175.10 174.79 1zrd s ARG 87 N 1.99 2.16 0.36 2.72 3.52 -0.77 -0.99 118.95 127.94 1zrd s ARG 87 Ca 0.05 -0.65 -0.28 0.00 -0.13 0.00 0.00 55.73 54.71 1zrd s ARG 87 Cb -0.12 -1.76 -0.11 0.00 -1.56 0.00 0.00 34.95 31.39 1zrd s ARG 87 CO -0.05 0.18 1.46 0.00 -0.81 0.00 0.00 175.30 176.08 1zrd n ALA 88 N 3.40 2.17 -0.10 6.12 0.00 -0.12 -0.66 120.51 131.33 1zrd n ALA 88 Ca -0.20 0.35 -0.16 0.00 0.00 0.00 0.00 53.44 53.44 1zrd n ALA 88 Cb 0.53 -2.39 -0.07 0.00 0.00 0.00 0.00 19.45 17.52 1zrd n ALA 88 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1zrd n LYS 89 N 0.66 0.53 -4.16 0.00 5.02 0.76 -1.89 118.16 119.07 1zrd n LYS 89 Ca 0.03 0.46 -0.27 0.00 -2.02 0.00 0.00 58.31 56.51 1zrd n LYS 89 Cb 0.38 -1.65 -0.04 0.00 -0.02 0.00 0.00 35.03 33.70 1zrd n LYS 89 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1zrd s THR 90 N -2.42 1.71 0.18 -0.18 -4.23 -1.12 -4.25 115.64 105.32 1zrd s THR 90 Ca -0.26 -1.66 -0.30 0.00 -1.18 0.00 0.00 61.69 58.28 1zrd s THR 90 Cb 0.06 -2.38 -0.09 0.00 1.34 0.00 0.00 72.50 71.44 1zrd s THR 90 CO 0.43 0.00 1.36 0.00 -0.54 0.00 0.00 174.62 175.87 1zrd s ALA 91 N -2.75 3.57 0.27 3.99 0.00 -1.26 -4.19 121.76 121.38 1zrd s ALA 91 Ca 0.29 1.14 0.10 0.00 0.00 0.00 0.00 51.96 53.49 1zrd s ALA 91 Cb 0.00 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 1zrd s ALA 91 CO 0.17 -0.59 -0.15 0.00 0.00 0.00 0.00 175.76 175.19 1zrd s GLU 93 N -3.59 1.67 0.05 0.00 2.12 -0.17 -1.78 118.70 117.01 1zrd s GLU 93 Ca 0.28 -1.05 0.05 0.00 0.36 0.00 0.00 54.97 54.62 1zrd s GLU 93 Cb -0.02 -2.62 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 1zrd s GLU 93 CO 0.13 -0.61 -0.07 0.08 -0.54 0.00 0.00 175.26 174.25 1zrd s VAL 94 N 1.36 3.59 -0.17 3.70 1.01 0.16 -1.87 120.40 128.19 1zrd s VAL 94 Ca -0.06 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 60.88 1zrd s VAL 94 Cb -0.19 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1zrd s VAL 94 CO -0.06 0.26 0.09 0.00 0.00 0.00 0.00 175.10 175.39 1zrd s ALA 95 N -1.11 3.56 0.04 5.51 0.00 -0.02 -0.30 121.76 129.44 1zrd s ALA 95 Ca 0.20 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.51 1zrd s ALA 95 Cb -0.11 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 21.03 1zrd s ALA 95 CO 0.11 0.29 -0.19 -1.21 0.00 0.00 0.00 175.76 174.77 1zrd s GLU 96 N -0.01 1.24 0.05 0.00 2.02 -0.76 -0.41 118.70 120.82 1zrd s GLU 96 Ca 0.08 -0.88 -0.12 0.00 0.02 0.00 0.00 54.97 54.07 1zrd s GLU 96 Cb -0.12 -1.32 0.01 0.00 0.10 0.00 0.00 34.13 32.80 1zrd s GLU 96 CO 0.00 0.33 0.26 -1.50 0.02 0.00 0.00 175.26 174.37 1zrd s ILE 97 N -0.81 0.10 0.75 -1.63 2.07 -0.38 -0.43 121.20 120.87 1zrd s ILE 97 Ca 0.06 -0.79 -0.12 0.00 -1.41 0.00 0.00 60.65 58.39 1zrd s ILE 97 Cb -0.08 -0.96 0.04 0.00 0.13 0.00 0.00 42.46 41.59 1zrd s ILE 97 CO 0.02 -0.44 1.13 -0.94 -1.91 0.00 0.00 174.94 172.79 1zrd s SER 98 N -2.14 5.05 0.02 4.50 1.04 -1.26 0.73 113.70 121.63 1zrd s SER 98 Ca -0.04 1.02 -0.20 0.00 0.48 0.00 0.00 55.95 57.20 1zrd s SER 98 Cb -0.00 -1.71 -0.17 0.00 0.10 0.00 0.00 66.02 64.24 1zrd s SER 98 CO -0.04 -1.58 1.25 1.88 0.98 0.00 0.00 173.24 175.72 1zrd h TYR 99 N -0.83 0.47 -0.46 5.02 -1.99 -1.48 -1.47 116.97 116.25 1zrd h TYR 99 Ca -0.45 -0.18 -0.07 0.00 2.00 0.00 0.00 58.73 60.02 1zrd h TYR 99 Cb 1.28 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 39.91 1zrd h TYR 99 CO 0.43 0.88 -0.02 -0.22 -0.00 0.00 0.00 178.16 179.23 1zrd h LYS 100 N -0.07 0.76 0.00 4.88 1.63 -1.94 0.21 116.57 122.04 1zrd h LYS 100 Ca -0.00 -0.21 -0.06 0.00 -0.85 0.00 0.00 60.65 59.53 1zrd h LYS 100 Cb 0.87 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.41 1zrd h LYS 100 CO 0.06 0.78 -0.30 -0.22 -3.45 0.00 0.00 179.45 176.33 1zrd h LYS 101 N 0.71 0.00 0.07 1.90 1.63 -1.94 -2.90 116.57 116.03 1zrd h LYS 101 Ca 0.14 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.66 1zrd h LYS 101 Cb 0.46 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.07 1zrd h LYS 101 CO 0.02 0.30 -1.39 0.35 -3.45 0.00 0.00 179.45 175.28 1zrd h PHE 102 N 0.00 0.25 0.00 1.91 3.57 -0.40 -3.17 116.94 119.10 1zrd h PHE 102 Ca -0.00 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.30 1zrd h PHE 102 Cb 0.81 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.53 1zrd h PHE 102 CO 0.00 1.20 -0.07 0.00 -2.23 0.00 0.00 178.31 177.22 1zrd h ARG 103 N 0.04 0.00 0.32 1.11 3.08 -0.42 -1.71 114.38 116.80 1zrd h ARG 103 Ca -0.18 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1zrd h ARG 103 Cb 1.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.00 1zrd h ARG 103 CO 0.14 0.07 -0.16 1.96 -1.07 0.00 0.00 179.97 180.91 1zrd h GLN 104 N 0.00 -0.42 -0.76 0.04 4.20 -1.52 -3.28 115.11 113.37 1zrd h GLN 104 Ca -0.00 0.03 0.14 0.00 0.06 0.00 0.00 58.65 58.88 1zrd h GLN 104 Cb 0.15 0.10 -0.09 0.00 0.30 0.00 0.00 27.48 27.93 1zrd h GLN 104 CO 0.01 -0.15 0.32 -0.07 -0.67 0.00 0.00 178.83 178.27 1zrd h LEU 105 N -1.02 0.32 -1.98 1.46 3.38 -1.46 0.52 115.31 116.53 1zrd h LEU 105 Ca -0.04 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1zrd h LEU 105 Cb 0.47 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1zrd h LEU 105 CO 0.07 0.13 0.22 0.40 0.09 0.00 0.00 178.44 179.36 1zrd h ILE 106 N 0.48 0.00 -0.33 1.22 2.04 -1.40 0.13 117.51 119.64 1zrd h ILE 106 Ca 0.42 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.24 1zrd h ILE 106 Cb 0.61 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1zrd h ILE 106 CO -0.39 0.00 0.01 0.00 0.00 0.00 0.00 178.15 177.77 1zrd n GLN 107 N -2.74 3.03 -0.47 2.37 6.02 0.17 -2.60 117.38 123.16 1zrd n GLN 107 Ca -0.02 -2.92 0.00 0.00 -0.01 0.00 0.00 57.00 54.05 1zrd n GLN 107 Cb 0.27 -1.91 0.00 0.00 1.02 0.00 0.00 30.24 29.62 1zrd n GLN 107 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1zrd n VAL 108 N -0.46 0.00 0.00 5.09 0.24 0.40 -4.93 118.33 118.67 1zrd n VAL 108 Ca 0.24 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.54 1zrd n VAL 108 Cb 0.97 0.52 0.00 0.00 -1.47 0.00 0.00 33.84 33.86 1zrd n VAL 108 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1zrd n ASN 109 N 0.00 0.00 0.00 -1.34 2.85 -0.95 -5.03 115.26 110.80 1zrd n ASN 109 Ca 0.00 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.54 1zrd n ASN 109 Cb 0.69 0.00 0.39 0.00 1.24 0.00 0.00 39.78 42.09 1zrd n ASN 109 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1zrd n PRO 110 N 0.00 0.50 0.30 1.20 -0.04 -1.07 -2.76 135.00 133.12 1zrd n PRO 110 Ca 0.00 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.65 1zrd n PRO 110 Cb 0.00 -1.41 0.87 0.00 -0.04 0.00 0.00 33.50 32.92 1zrd n PRO 110 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1zrd h ASP 111 N 0.00 0.00 0.85 3.54 3.58 -1.93 -1.21 116.42 121.25 1zrd h ASP 111 Ca 0.00 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.27 1zrd h ASP 111 Cb 0.00 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.02 1zrd h ASP 111 CO 0.00 0.02 -0.86 -0.29 -2.88 0.00 0.00 179.24 175.23 1zrd h ILE 112 N 0.00 1.62 -0.09 2.25 6.09 -1.89 -2.86 117.51 122.63 1zrd h ILE 112 Ca -0.00 -2.94 -0.08 0.00 -1.37 0.00 0.00 64.86 60.46 1zrd h ILE 112 Cb 0.32 2.59 0.00 0.00 0.47 0.00 0.00 36.82 40.21 1zrd h ILE 112 CO 0.00 0.84 -0.27 0.25 -3.07 0.00 0.00 178.15 175.91 1zrd h LEU 113 N 0.00 0.38 -0.89 2.19 6.46 -1.47 -2.91 115.31 119.08 1zrd h LEU 113 Ca -0.01 -0.61 0.16 0.00 -0.12 0.00 0.00 57.88 57.30 1zrd h LEU 113 Cb 1.53 -0.11 -0.10 0.00 -0.73 0.00 0.00 40.66 41.25 1zrd h LEU 113 CO 0.11 0.92 0.47 -0.03 -0.62 0.00 0.00 178.44 179.30 1zrd h MET 114 N -0.14 0.63 0.00 1.25 4.05 -1.45 0.17 114.93 119.44 1zrd h MET 114 Ca -0.01 -0.04 -0.07 0.00 -0.28 0.00 0.00 59.70 59.30 1zrd h MET 114 Cb 0.89 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.54 1zrd h MET 114 CO 0.06 0.42 -0.34 -0.09 0.23 0.00 0.00 176.91 177.18 1zrd h ARG 115 N 0.65 0.00 0.04 0.39 2.43 -1.46 -0.91 114.38 115.52 1zrd h ARG 115 Ca 0.49 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.37 1zrd h ARG 115 Cb 0.72 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.24 1zrd h ARG 115 CO -0.37 0.34 -1.63 1.25 -1.51 0.00 0.00 179.97 178.05 1zrd h LEU 116 N 0.00 0.13 -0.95 3.80 7.12 -0.92 -3.15 115.31 121.35 1zrd h LEU 116 Ca -0.00 -0.24 -0.10 0.00 0.13 0.00 0.00 57.88 57.66 1zrd h LEU 116 Cb 0.72 -0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.79 1zrd h LEU 116 CO 0.04 1.21 -0.38 0.28 -0.13 0.00 0.00 178.44 179.46 1zrd h SER 117 N 0.02 0.29 -0.71 1.25 0.02 -0.58 -2.11 113.55 111.75 1zrd h SER 117 Ca -0.26 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.52 1zrd h SER 117 Cb 1.99 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 64.41 1zrd h SER 117 CO 0.10 0.65 0.26 0.00 -1.14 0.00 0.00 176.83 176.70 1zrd h ALA 118 N 1.37 0.92 0.00 3.77 0.00 -1.20 0.03 119.26 124.15 1zrd h ALA 118 Ca 0.03 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 1zrd h ALA 118 Cb 0.78 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1zrd h ALA 118 CO 0.06 0.56 -0.54 1.96 0.00 0.00 0.00 179.25 181.29 1zrd h GLN 119 N 1.02 0.00 0.42 0.00 4.20 -1.43 -2.95 115.11 116.37 1zrd h GLN 119 Ca 0.23 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 1zrd h GLN 119 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1zrd h GLN 119 CO -0.01 0.54 -0.20 0.52 -0.67 0.00 0.00 178.83 179.00 1zrd h MET 120 N 0.00 -0.54 -0.90 1.46 2.86 -0.70 -2.02 114.93 115.08 1zrd h MET 120 Ca -0.01 0.04 0.24 0.00 -2.06 0.00 0.00 59.70 57.91 1zrd h MET 120 Cb 0.98 0.12 -0.16 0.00 0.06 0.00 0.00 31.60 32.61 1zrd h MET 120 CO 0.07 -0.24 0.09 0.00 1.06 0.00 0.00 176.91 177.90 1zrd h ALA 121 N -0.59 1.13 -0.65 6.32 0.00 -1.00 0.34 119.26 124.82 1zrd h ALA 121 Ca -0.06 0.28 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1zrd h ALA 121 Cb 0.56 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1zrd h ALA 121 CO 0.09 -0.51 0.17 -0.09 0.00 0.00 0.00 179.25 178.91 1zrd h ARG 122 N 0.09 1.02 0.00 0.00 9.65 -1.43 -2.02 114.38 121.69 1zrd h ARG 122 Ca 0.55 -0.23 -0.05 0.00 -1.10 0.00 0.00 59.98 59.15 1zrd h ARG 122 Cb 1.10 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.52 1zrd h ARG 122 CO -0.78 0.90 -0.23 0.00 2.80 0.00 0.00 179.97 182.66 1zrd h ARG 123 N 0.97 0.00 0.10 0.20 3.08 0.40 -1.54 114.38 117.60 1zrd h ARG 123 Ca 0.21 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.98 1zrd h ARG 123 Cb 0.33 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.40 1zrd h ARG 123 CO -0.00 0.23 -1.18 1.25 -1.07 0.00 0.00 179.97 179.20 1zrd h LEU 124 N 0.00 0.71 0.40 3.04 5.85 -0.71 0.65 115.31 125.24 1zrd h LEU 124 Ca -0.00 -0.66 -0.02 0.00 0.84 0.00 0.00 57.88 58.04 1zrd h LEU 124 Cb 0.63 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1zrd h LEU 124 CO 0.03 1.48 -0.19 1.56 -0.34 0.00 0.00 178.44 180.98 1zrd h GLN 125 N 0.22 -0.51 -0.28 1.25 4.20 -1.03 0.99 115.11 119.96 1zrd h GLN 125 Ca -0.16 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.61 1zrd h GLN 125 Cb 1.86 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.73 1zrd h GLN 125 CO 0.22 -0.33 0.13 0.28 -0.67 0.00 0.00 178.83 178.45 1zrd h VAL 126 N -0.55 0.98 -0.47 -0.54 2.07 -1.29 0.14 116.25 116.59 1zrd h VAL 126 Ca -0.05 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.30 1zrd h VAL 126 Cb 0.42 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1zrd h VAL 126 CO 0.09 0.05 -0.01 0.74 0.02 0.00 0.00 177.57 178.46 1zrd h THR 127 N 0.27 1.24 -0.12 2.57 2.02 -0.78 -1.21 112.91 116.91 1zrd h THR 127 Ca 0.12 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.27 1zrd h THR 127 Cb 0.05 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1zrd h THR 127 CO -0.09 0.36 0.07 0.28 0.37 0.00 0.00 175.52 176.51 1zrd h SER 128 N 0.73 0.14 -1.00 4.18 0.02 -0.18 -1.71 113.55 115.74 1zrd h SER 128 Ca 0.14 -0.06 0.12 0.00 -0.84 0.00 0.00 61.79 61.14 1zrd h SER 128 Cb 0.47 -0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.89 1zrd h SER 128 CO 0.02 0.17 0.63 -0.08 -1.14 0.00 0.00 176.83 176.43 1zrd h GLU 129 N 0.11 0.98 -0.90 3.45 4.81 -0.27 0.30 114.58 123.05 1zrd h GLU 129 Ca 0.04 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1zrd h GLU 129 Cb 0.05 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 1zrd h GLU 129 CO -0.01 0.65 0.59 -0.22 -0.73 0.00 0.00 179.01 179.28 1zrd h LYS 130 N 1.00 1.19 -0.65 1.92 1.63 -0.44 -0.40 116.57 120.82 1zrd h LYS 130 Ca 0.49 -0.08 0.01 0.00 -0.85 0.00 0.00 60.65 60.22 1zrd h LYS 130 Cb 0.46 -0.26 -0.03 0.00 -0.60 0.00 0.00 32.23 31.80 1zrd h LYS 130 CO -0.25 0.79 0.43 0.28 -3.45 0.00 0.00 179.45 177.25 1zrd h VAL 131 N 1.22 1.15 0.61 2.00 2.07 -0.12 -1.87 116.25 121.31 1zrd h VAL 131 Ca 0.33 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1zrd h VAL 131 Cb -0.13 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.85 1zrd h VAL 131 CO -0.07 0.16 -0.39 1.23 0.02 0.00 0.00 177.57 178.52 1zrd h GLY 132 N 0.86 -1.12 -0.70 2.17 0.00 -0.31 -2.93 103.07 101.05 1zrd h GLY 132 Ca 0.25 0.46 0.14 0.00 0.00 0.00 0.00 47.33 48.17 1zrd h GLY 132 CO -0.07 -0.38 -0.34 3.43 0.00 0.00 0.00 176.54 179.19 1zrd h ASN 133 N -0.93 -1.22 -0.65 0.19 2.35 -0.94 0.11 115.58 114.50 1zrd h ASN 133 Ca -0.08 0.27 0.10 0.00 -0.55 0.00 0.00 56.30 56.04 1zrd h ASN 133 Cb 0.75 0.64 -0.08 0.00 0.05 0.00 0.00 38.32 39.69 1zrd h ASN 133 CO 0.07 -0.29 0.25 -0.07 -1.65 0.00 0.00 177.43 175.74 1zrd h LEU 134 N -0.07 0.25 0.38 1.61 3.38 -1.32 0.35 115.31 119.90 1zrd h LEU 134 Ca 0.31 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.34 1zrd h LEU 134 Cb 0.58 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1zrd h LEU 134 CO -0.84 0.14 -0.18 0.00 0.09 0.00 0.00 178.44 177.64 1zrd h ALA 135 N 1.44 -0.52 -0.02 1.53 0.00 -0.84 -3.36 119.26 117.51 1zrd h ALA 135 Ca 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1zrd h ALA 135 Cb 0.42 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1zrd h ALA 135 CO -0.32 -0.53 0.00 1.19 0.00 0.00 0.00 179.25 179.59 1zrd n PHE 136 N -5.13 0.01 -4.68 0.00 3.72 0.18 -4.93 117.46 106.63 1zrd n PHE 136 Ca -0.08 -0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.04 1zrd n PHE 136 Cb 0.26 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.66 1zrd n PHE 136 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1zrd s LEU 137 N -1.97 2.19 0.41 4.37 1.43 0.11 -5.02 118.68 120.19 1zrd s LEU 137 Ca 0.41 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.78 1zrd s LEU 137 Cb 0.21 -1.07 -0.09 0.00 0.03 0.00 0.00 46.19 45.27 1zrd s LEU 137 CO 0.34 0.18 0.86 1.51 0.23 0.00 0.00 176.35 179.48 1zrd s ASP 138 N -1.30 6.75 0.35 2.29 3.84 -1.26 -4.81 116.67 122.53 1zrd s ASP 138 Ca 0.09 1.45 0.16 0.00 -0.00 0.00 0.00 52.55 54.25 1zrd s ASP 138 Cb -0.09 -2.45 1.17 0.00 -1.38 0.00 0.00 42.92 40.17 1zrd s ASP 138 CO 0.02 -0.37 1.64 0.58 -0.00 0.00 0.00 175.17 177.04 1zrd h VAL 139 N 1.57 0.20 0.02 2.11 2.07 -1.96 0.65 116.25 120.91 1zrd h VAL 139 Ca -0.48 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 66.99 1zrd h VAL 139 Cb 1.18 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1zrd h VAL 139 CO 0.63 0.04 -0.13 0.74 0.02 0.00 0.00 177.57 178.87 1zrd h THR 140 N 0.21 0.69 -0.75 2.57 2.02 -1.98 -1.02 112.91 114.66 1zrd h THR 140 Ca 0.77 0.00 0.09 0.00 0.77 0.00 0.00 66.41 68.04 1zrd h THR 140 Cb 1.85 0.69 -0.07 0.00 -1.74 0.00 0.00 68.15 68.88 1zrd h THR 140 CO -0.66 0.00 0.40 1.23 0.37 0.00 0.00 175.52 176.85 1zrd h GLY 141 N -0.22 1.14 0.97 2.16 0.00 -0.07 0.42 103.07 107.46 1zrd h GLY 141 Ca 0.04 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 1zrd h GLY 141 CO -0.11 0.08 -0.12 3.21 0.00 0.00 0.00 176.54 179.61 1zrd h ARG 142 N 0.67 0.74 -0.30 4.80 3.08 -1.11 0.14 114.38 122.40 1zrd h ARG 142 Ca 0.37 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 1zrd h ARG 142 Cb 0.36 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1zrd h ARG 142 CO -0.26 0.90 0.06 0.82 -1.07 0.00 0.00 179.97 180.42 1zrd h ILE 143 N 0.54 1.23 -0.72 2.04 2.04 -0.78 0.33 117.51 122.19 1zrd h ILE 143 Ca 0.09 -0.77 0.09 0.00 1.00 0.00 0.00 64.86 65.27 1zrd h ILE 143 Cb 0.64 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.81 1zrd h ILE 143 CO 0.04 0.25 0.37 0.00 0.00 0.00 0.00 178.15 178.82 1zrd h ALA 144 N 0.89 1.00 -0.30 1.87 0.00 -0.03 -1.20 119.26 121.49 1zrd h ALA 144 Ca 0.09 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1zrd h ALA 144 Cb 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1zrd h ALA 144 CO 0.00 -0.02 0.06 0.37 0.00 0.00 0.00 179.25 179.67 1zrd h GLN 145 N 0.64 0.48 0.17 0.00 5.75 -0.04 -3.11 115.11 119.01 1zrd h GLN 145 Ca 0.35 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.72 1zrd h GLN 145 Cb 0.35 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.84 1zrd h GLN 145 CO -0.26 0.57 -0.08 1.15 -2.65 0.00 0.00 178.83 177.56 1zrd h THR 146 N 0.32 0.87 -0.64 2.39 2.02 0.49 -2.46 112.91 115.89 1zrd h THR 146 Ca 0.09 -0.15 0.13 0.00 0.77 0.00 0.00 66.41 67.25 1zrd h THR 146 Cb 0.31 0.96 -0.10 0.00 -1.74 0.00 0.00 68.15 67.58 1zrd h THR 146 CO 0.00 0.04 0.08 -0.07 0.37 0.00 0.00 175.52 175.94 1zrd h LEU 147 N -0.30 -0.12 -1.04 2.58 3.38 -1.31 0.20 115.31 118.70 1zrd h LEU 147 Ca -0.02 0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.17 1zrd h LEU 147 Cb 0.23 0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 1zrd h LEU 147 CO 0.04 -0.06 0.63 -0.07 0.09 0.00 0.00 178.44 179.07 1zrd h LEU 148 N 0.20 0.97 0.33 1.67 4.07 -1.44 0.29 115.31 121.40 1zrd h LEU 148 Ca 0.34 0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.31 1zrd h LEU 148 Cb 0.55 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1zrd h LEU 148 CO -0.48 0.58 -0.16 0.78 -1.08 0.00 0.00 178.44 178.08 1zrd h ASN 149 N 1.08 -0.37 -1.25 -0.43 -0.26 -0.48 -3.14 115.58 110.72 1zrd h ASN 149 Ca 0.45 0.01 0.37 0.00 -0.56 0.00 0.00 56.30 56.57 1zrd h ASN 149 Cb 0.30 0.10 -0.09 0.00 -1.06 0.00 0.00 38.32 37.57 1zrd h ASN 149 CO -0.20 -0.05 0.85 -0.07 -1.06 0.00 0.00 177.43 176.89 1zrd h LEU 150 N -0.87 0.22 -2.21 1.61 3.38 -0.55 3.27 115.31 120.17 1zrd h LEU 150 Ca -0.05 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1zrd h LEU 150 Cb 0.34 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1zrd h LEU 150 CO 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1zrd h ALA 151 N 1.50 1.00 -0.37 1.53 0.00 -0.38 -1.78 119.26 120.76 1zrd h ALA 151 Ca 0.69 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.60 1zrd h ALA 151 Cb 2.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.04 1zrd h ALA 151 CO -0.23 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.65 1zrd n LYS 152 N -3.02 2.36 -2.53 0.00 5.02 1.09 -4.82 118.16 116.24 1zrd n LYS 152 Ca -0.01 -2.08 -0.41 0.00 -2.02 0.00 0.00 58.31 53.79 1zrd n LYS 152 Cb 0.17 -1.38 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1zrd n LYS 152 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1zrd s GLN 153 N -1.13 4.63 0.60 1.97 -1.52 -0.67 -4.91 119.66 118.63 1zrd s GLN 153 Ca 0.30 1.71 0.28 0.00 -1.95 0.00 0.00 55.36 55.70 1zrd s GLN 153 Cb 0.17 -3.26 1.13 0.00 -0.22 0.00 0.00 33.01 30.83 1zrd s GLN 153 CO 0.23 0.15 1.51 -1.00 -0.25 0.00 0.00 175.29 175.93 1zrd h PRO 154 N 4.74 0.00 -0.65 2.91 0.13 -1.93 -0.28 132.00 136.92 1zrd h PRO 154 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1zrd h PRO 154 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1zrd h PRO 154 CO 0.71 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.08 1zrd n ASP 155 N -3.39 3.90 -4.89 1.44 5.75 -1.26 -4.94 116.55 113.15 1zrd n ASP 155 Ca 0.18 -2.46 -0.29 0.00 -0.01 0.00 0.00 54.79 52.20 1zrd n ASP 155 Cb 1.23 -0.55 0.06 0.00 -1.03 0.00 0.00 41.12 40.84 1zrd n ASP 155 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1zrd s ALA 156 N -1.97 2.84 -0.01 2.12 0.00 -0.12 -4.97 121.76 119.65 1zrd s ALA 156 Ca 0.38 -0.49 0.06 0.00 0.00 0.00 0.00 51.96 51.91 1zrd s ALA 156 Cb 0.26 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 20.39 1zrd s ALA 156 CO 0.15 -1.32 -0.21 -1.64 0.00 0.00 0.00 175.76 172.74 1zrd s MET 157 N -5.42 2.20 0.42 0.00 -1.94 -0.42 -4.94 119.30 109.20 1zrd s MET 157 Ca 0.59 -0.88 -0.25 0.00 -1.71 0.00 0.00 55.69 53.44 1zrd s MET 157 Cb -0.11 -2.18 -0.08 0.00 2.01 0.00 0.00 34.83 34.47 1zrd s MET 157 CO 0.50 0.57 1.22 0.95 -0.01 0.00 0.00 175.02 178.25 1zrd s THR 158 N -0.73 2.92 0.01 2.05 -4.23 -1.26 0.64 115.64 115.03 1zrd s THR 158 Ca 0.12 0.77 0.02 0.00 -1.18 0.00 0.00 61.69 61.41 1zrd s THR 158 Cb -0.10 -3.43 -0.01 0.00 1.34 0.00 0.00 72.50 70.30 1zrd s THR 158 CO 0.01 0.07 -0.06 -2.28 -0.54 0.00 0.00 174.62 171.82 1zrd s HIS 159 N -1.38 0.51 0.36 3.99 5.04 0.75 -4.71 115.29 119.85 1zrd s HIS 159 Ca 0.59 -0.20 0.18 0.00 -1.54 0.00 0.00 55.06 54.09 1zrd s HIS 159 Cb -0.33 -0.32 1.18 0.00 0.04 0.00 0.00 32.58 33.15 1zrd s HIS 159 CO 0.42 -0.03 1.65 -1.00 -2.34 0.00 0.00 174.74 173.43 1zrd h PRO 160 N 5.60 0.23 -0.46 2.88 0.13 -1.98 0.21 132.00 138.61 1zrd h PRO 160 Ca -0.30 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1zrd h PRO 160 Cb 1.20 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1zrd h PRO 160 CO 0.48 0.15 0.00 -0.25 -0.23 0.00 0.00 178.00 178.15 1zrd n ASP 161 N -5.02 3.84 0.00 1.44 8.00 -1.26 -5.04 116.55 118.51 1zrd n ASP 161 Ca 0.33 -2.38 0.00 0.00 0.71 0.00 0.00 54.79 53.46 1zrd n ASP 161 Cb 1.09 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1zrd n ASP 161 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zrd n GLY 162 N 0.58 -0.42 3.46 0.44 0.00 0.72 -0.29 105.19 109.68 1zrd n GLY 162 Ca 0.20 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1zrd n GLY 162 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1zrd s MET 163 N -1.23 1.66 -0.03 1.61 1.75 -0.89 -0.18 119.30 121.98 1zrd s MET 163 Ca 0.00 -1.25 0.05 0.00 -1.25 0.00 0.00 55.69 53.24 1zrd s MET 163 Cb 0.00 -2.03 -0.01 0.00 2.84 0.00 0.00 34.83 35.63 1zrd s MET 163 CO 0.00 0.47 -0.18 -1.14 -0.65 0.00 0.00 175.02 173.52 1zrd s GLN 164 N -2.16 1.62 0.09 4.11 0.74 0.21 -0.83 119.66 123.44 1zrd s GLN 164 Ca 0.17 -0.63 0.04 0.00 0.05 0.00 0.00 55.36 54.98 1zrd s GLN 164 Cb -0.10 -1.49 -0.03 0.00 1.10 0.00 0.00 33.01 32.48 1zrd s GLN 164 CO 0.09 0.32 -0.10 0.96 -0.55 0.00 0.00 175.29 176.01 1zrd s ILE 165 N -0.21 0.90 -0.32 -2.34 -4.36 -0.15 -1.31 121.20 113.41 1zrd s ILE 165 Ca 0.02 -1.59 -0.01 0.00 -0.26 0.00 0.00 60.65 58.81 1zrd s ILE 165 Cb -0.09 -1.29 0.06 0.00 1.25 0.00 0.00 42.46 42.39 1zrd s ILE 165 CO 0.01 -0.54 0.03 -0.54 0.24 0.00 0.00 174.94 174.13 1zrd s LYS 166 N -2.68 2.28 -0.04 0.37 -0.14 -1.26 -0.13 119.74 118.15 1zrd s LYS 166 Ca 0.04 -1.40 -0.29 0.00 -1.36 0.00 0.00 55.97 52.96 1zrd s LYS 166 Cb -0.03 -3.22 0.07 0.00 -1.68 0.00 0.00 37.83 32.96 1zrd s LYS 166 CO -0.00 -0.71 0.64 -1.50 -0.76 0.00 0.00 175.35 173.02 1zrd s ILE 167 N 1.20 0.01 0.49 2.17 2.07 -0.37 -5.01 121.20 121.75 1zrd s ILE 167 Ca -0.02 -0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.15 1zrd s ILE 167 Cb -0.20 -0.96 -0.00 0.00 0.13 0.00 0.00 42.46 41.42 1zrd s ILE 167 CO -0.02 -0.03 0.74 0.42 -1.91 0.00 0.00 174.94 174.14 1zrd s THR 168 N -1.33 4.04 0.26 4.00 -4.23 -1.26 -4.65 115.64 112.47 1zrd s THR 168 Ca -0.11 -0.28 0.01 0.00 -1.18 0.00 0.00 61.69 60.13 1zrd s THR 168 Cb -0.01 -3.53 0.05 0.00 1.34 0.00 0.00 72.50 70.35 1zrd s THR 168 CO 0.08 -0.43 1.68 0.03 -0.54 0.00 0.00 174.62 175.44 1zrd h ARG 169 N 0.23 0.54 0.49 3.99 -0.00 -1.94 -1.59 114.38 116.10 1zrd h ARG 169 Ca -0.46 -0.22 -0.02 0.00 -0.50 0.00 0.00 59.98 58.78 1zrd h ARG 169 Cb 1.25 -0.02 -0.02 0.00 0.00 0.00 0.00 29.97 31.18 1zrd h ARG 169 CO 0.59 0.77 -0.46 0.37 0.00 0.00 0.00 179.97 181.24 1zrd h GLN 170 N 0.47 -0.90 -0.24 0.04 4.15 -1.93 -1.59 115.11 115.10 1zrd h GLN 170 Ca 0.06 0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.59 1zrd h GLN 170 Cb 0.74 0.21 -0.05 0.00 0.21 0.00 0.00 27.48 28.59 1zrd h GLN 170 CO 0.06 -0.60 -0.06 1.49 -1.93 0.00 0.00 178.83 177.78 1zrd h GLU 171 N -0.94 -0.00 -1.03 1.69 4.81 -1.91 -1.62 114.58 115.58 1zrd h GLU 171 Ca -0.06 0.00 0.26 0.00 -0.13 0.00 0.00 59.36 59.43 1zrd h GLU 171 Cb 0.81 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.09 1zrd h GLU 171 CO -0.04 -0.00 0.65 0.82 -0.73 0.00 0.00 179.01 179.71 1zrd h ILE 172 N -0.00 0.53 0.00 2.32 2.04 -0.98 0.87 117.51 122.29 1zrd h ILE 172 Ca 0.12 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1zrd h ILE 172 Cb 0.18 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1zrd h ILE 172 CO -0.25 0.08 0.00 1.23 0.00 0.00 0.00 178.15 179.21 1zrd h GLY 173 N 0.45 0.00 -0.85 5.37 0.00 -0.30 -2.33 103.07 105.41 1zrd h GLY 173 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.93 1zrd h GLY 173 CO -0.34 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.14 1zrd n GLN 174 N -2.87 1.60 0.00 4.80 6.02 0.30 -0.73 117.38 126.49 1zrd n GLN 174 Ca 0.02 -0.92 0.00 0.00 -0.01 0.00 0.00 57.00 56.08 1zrd n GLN 174 Cb 0.32 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.33 1zrd n GLN 174 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1zrd n ILE 175 N 0.22 0.00 0.45 5.09 5.41 -0.90 0.12 119.36 129.74 1zrd n ILE 175 Ca 0.11 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.90 1zrd n ILE 175 Cb 0.23 -0.53 -0.02 0.00 -0.71 0.00 0.00 39.64 38.62 1zrd n ILE 175 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1zrd n VAL 176 N -1.68 0.00 -2.57 1.39 0.24 -1.08 -4.92 118.33 109.72 1zrd n VAL 176 Ca 0.00 -0.36 -0.01 0.00 -2.04 0.00 0.00 64.34 61.92 1zrd n VAL 176 Cb 0.32 1.09 -0.01 0.00 -1.47 0.00 0.00 33.84 33.77 1zrd n VAL 176 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1zrd n GLY 177 N 0.98 -4.39 0.00 7.63 0.00 0.09 -4.97 105.19 104.53 1zrd n GLY 177 Ca 0.04 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.73 1zrd n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zrd s SER 179 N 0.00 5.65 0.23 0.00 1.04 -1.26 -4.56 113.70 114.80 1zrd s SER 179 Ca 0.00 1.09 -0.06 0.00 0.48 0.00 0.00 55.95 57.46 1zrd s SER 179 Cb 0.00 -1.99 0.21 0.00 0.10 0.00 0.00 66.02 64.34 1zrd s SER 179 CO 0.00 -1.17 1.76 0.08 0.98 0.00 0.00 173.24 174.89 1zrd h ARG 180 N -0.46 1.05 -0.82 4.02 0.11 -1.89 -2.60 114.38 113.79 1zrd h ARG 180 Ca -0.45 -0.24 0.12 0.00 0.10 0.00 0.00 59.98 59.51 1zrd h ARG 180 Cb 1.24 -0.15 -0.08 0.00 1.11 0.00 0.00 29.97 32.09 1zrd h ARG 180 CO 0.63 0.92 0.44 0.93 0.10 0.00 0.00 179.97 182.99 1zrd h GLU 181 N 1.00 0.67 -0.10 0.08 3.07 -1.94 -1.07 114.58 116.29 1zrd h GLU 181 Ca 0.21 -0.04 -0.18 0.00 -0.50 0.00 0.00 59.36 58.85 1zrd h GLU 181 Cb 0.34 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.10 1zrd h GLU 181 CO -0.00 0.44 -0.69 1.15 -1.40 0.00 0.00 179.01 178.51 1zrd h THR 182 N 0.69 1.36 -0.15 1.13 2.02 -1.86 -2.35 112.91 113.74 1zrd h THR 182 Ca 0.42 -2.06 -0.08 0.00 0.77 0.00 0.00 66.41 65.46 1zrd h THR 182 Cb 0.50 2.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 1zrd h THR 182 CO -0.31 0.62 -0.26 0.58 0.37 0.00 0.00 175.52 176.52 1zrd h VAL 183 N 0.31 1.25 0.15 3.16 2.07 -1.06 -0.51 116.25 121.62 1zrd h VAL 183 Ca -0.02 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 1zrd h VAL 183 Cb 1.26 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1zrd h VAL 183 CO 0.12 0.36 -0.07 1.23 0.02 0.00 0.00 177.57 179.22 1zrd h GLY 184 N 0.99 -0.22 0.63 2.17 0.00 -1.00 -1.01 103.07 104.64 1zrd h GLY 184 Ca 0.04 0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.46 1zrd h GLY 184 CO 0.04 -0.08 -0.23 3.21 0.00 0.00 0.00 176.54 179.49 1zrd h ARG 185 N -0.58 -0.42 -0.87 4.80 3.08 -1.27 -2.17 114.38 116.95 1zrd h ARG 185 Ca -0.02 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.09 1zrd h ARG 185 Cb 0.44 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.54 1zrd h ARG 185 CO 0.03 -0.28 0.57 0.82 -1.07 0.00 0.00 179.97 180.05 1zrd h ILE 186 N -0.44 1.16 -0.50 2.04 2.04 -1.14 -2.13 117.51 118.55 1zrd h ILE 186 Ca 0.02 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.57 1zrd h ILE 186 Cb 0.45 -0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.43 1zrd h ILE 186 CO -0.11 0.20 0.18 0.25 0.00 0.00 0.00 178.15 178.67 1zrd h LEU 187 N 1.10 0.19 -1.49 1.44 5.85 -0.60 -1.04 115.31 120.76 1zrd h LEU 187 Ca 0.34 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 1zrd h LEU 187 Cb -0.00 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1zrd h LEU 187 CO -0.10 0.14 0.09 0.50 -0.34 0.00 0.00 178.44 178.72 1zrd h LYS 188 N 0.36 0.42 -0.09 1.25 1.63 -0.79 -2.09 116.57 117.26 1zrd h LYS 188 Ca 0.24 -0.06 -0.19 0.00 -0.85 0.00 0.00 60.65 59.79 1zrd h LYS 188 Cb 0.25 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1zrd h LYS 188 CO -0.24 0.39 -0.75 0.52 -3.45 0.00 0.00 179.45 175.92 1zrd h MET 189 N 0.42 0.49 0.00 1.90 2.86 -1.04 -1.03 114.93 118.54 1zrd h MET 189 Ca 0.10 -0.41 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 1zrd h MET 189 Cb 0.15 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 1zrd h MET 189 CO -0.01 1.04 -0.07 -0.07 1.06 0.00 0.00 176.91 178.87 1zrd h LEU 190 N 0.34 0.00 0.19 1.22 3.38 -0.60 -1.93 115.31 117.90 1zrd h LEU 190 Ca -0.04 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.63 1zrd h LEU 190 Cb 1.34 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.11 1zrd h LEU 190 CO 0.13 0.07 -1.42 -0.08 0.09 0.00 0.00 178.44 177.23 1zrd h GLU 191 N 0.00 0.40 -0.91 1.13 4.81 -1.01 -1.29 114.58 117.70 1zrd h GLU 191 Ca -0.00 -0.68 0.19 0.00 -0.13 0.00 0.00 59.36 58.74 1zrd h GLU 191 Cb 0.33 0.25 -0.07 0.00 0.63 0.00 0.00 28.75 29.89 1zrd h GLU 191 CO 0.01 1.32 0.59 -0.44 -0.73 0.00 0.00 179.01 179.76 1zrd h ASP 192 N -0.05 0.49 -0.28 1.04 3.45 -0.62 0.31 116.42 120.76 1zrd h ASP 192 Ca -0.27 0.05 -0.06 0.00 0.43 0.00 0.00 57.03 57.17 1zrd h ASP 192 Cb 1.97 -0.04 -0.04 0.00 -0.56 0.00 0.00 39.33 40.66 1zrd h ASP 192 CO 0.18 0.20 0.08 0.00 -1.57 0.00 0.00 179.24 178.14 1zrd n GLN 193 N -4.55 2.24 -4.48 3.56 6.02 -0.78 -4.88 117.38 114.52 1zrd n GLN 193 Ca 0.19 -1.25 -0.42 0.00 -0.01 0.00 0.00 57.00 55.52 1zrd n GLN 193 Cb 0.64 -1.71 -0.07 0.00 1.02 0.00 0.00 30.24 30.13 1zrd n GLN 193 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1zrd n ASN 194 N 0.13 -2.14 -0.06 1.08 4.13 0.11 -4.78 115.26 113.73 1zrd n ASN 194 Ca 0.15 -1.20 -0.03 0.00 1.68 0.00 0.00 54.58 55.18 1zrd n ASN 194 Cb 0.74 -1.85 -0.16 0.00 -1.54 0.00 0.00 39.78 36.97 1zrd n ASN 194 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1zrd n LEU 195 N -4.13 0.10 -3.90 3.41 4.77 -0.50 -4.98 117.00 111.77 1zrd n LEU 195 Ca 0.11 0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 56.04 1zrd n LEU 195 Cb 0.46 0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.81 1zrd n LEU 195 CO 0.95 0.31 0.26 0.27 -1.33 0.00 0.00 177.39 177.85 1zrd s ILE 196 N -2.84 0.01 -0.10 -0.08 -4.36 -1.16 -3.25 121.20 109.41 1zrd s ILE 196 Ca -0.09 -1.15 -0.00 0.00 -0.26 0.00 0.00 60.65 59.15 1zrd s ILE 196 Cb 0.09 -1.98 0.02 0.00 1.25 0.00 0.00 42.46 41.85 1zrd s ILE 196 CO 0.85 -0.04 -0.06 -0.55 0.24 0.00 0.00 174.94 175.38 1zrd s SER 197 N -2.95 1.98 -0.27 4.36 0.15 -0.83 -4.15 113.70 111.98 1zrd s SER 197 Ca 0.16 -0.25 0.02 0.00 0.70 0.00 0.00 55.95 56.58 1zrd s SER 197 Cb -0.02 -0.74 0.06 0.00 -1.71 0.00 0.00 66.02 63.61 1zrd s SER 197 CO 0.05 -0.12 -0.08 0.00 1.20 0.00 0.00 173.24 174.29 1zrd s ALA 198 N 1.66 2.63 -0.29 5.45 0.00 -1.26 -0.57 121.76 129.37 1zrd s ALA 198 Ca 0.03 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.18 1zrd s ALA 198 Cb -0.13 -1.66 0.06 0.00 0.00 0.00 0.00 23.12 21.38 1zrd s ALA 198 CO -0.06 -1.24 -0.04 -1.01 0.00 0.00 0.00 175.76 173.40 1zrd s HIS 199 N 1.11 3.28 0.00 0.00 3.76 -0.48 -5.02 115.29 117.94 1zrd s HIS 199 Ca -0.07 -2.11 0.00 0.00 -0.15 0.00 0.00 55.06 52.73 1zrd s HIS 199 Cb -0.20 -2.07 0.00 0.00 1.11 0.00 0.00 32.58 31.42 1zrd s HIS 199 CO -0.05 -0.84 0.00 0.41 -0.85 0.00 0.00 174.74 173.41 1zrd n GLY 200 N 4.53 3.05 0.02 -2.22 0.00 -1.26 -1.79 105.19 107.53 1zrd n GLY 200 Ca -0.13 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.74 1zrd n GLY 200 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1zrd n LYS 201 N 13.80 0.09 -3.11 1.61 4.81 -1.26 -4.79 118.16 129.31 1zrd n LYS 201 Ca 0.00 0.04 -0.40 0.00 -0.87 0.00 0.00 58.31 57.08 1zrd n LYS 201 Cb 0.00 -1.57 -0.06 0.00 0.02 0.00 0.00 35.03 33.42 1zrd n LYS 201 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1zrd s THR 202 N -3.04 5.03 -0.09 3.15 2.01 -0.74 -1.24 115.64 120.72 1zrd s THR 202 Ca 0.11 1.22 0.02 0.00 0.31 0.00 0.00 61.69 63.35 1zrd s THR 202 Cb 0.17 -3.96 0.01 0.00 0.01 0.00 0.00 72.50 68.73 1zrd s THR 202 CO 0.64 0.13 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.94 1zrd s ILE 203 N 1.72 1.34 -0.24 1.82 1.01 0.82 -1.39 121.20 126.28 1zrd s ILE 203 Ca 0.30 -0.57 -0.10 0.00 0.00 0.00 0.00 60.65 60.28 1zrd s ILE 203 Cb -0.16 -1.23 -0.05 0.00 0.01 0.00 0.00 42.46 41.03 1zrd s ILE 203 CO 0.11 0.41 0.14 -0.69 0.00 0.00 0.00 174.94 174.91 1zrd s VAL 204 N 0.88 5.18 -0.50 2.92 1.01 0.26 -0.98 120.40 129.18 1zrd s VAL 204 Ca -0.10 0.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.83 1zrd s VAL 204 Cb -0.15 -3.42 0.07 0.00 0.00 0.00 0.00 36.38 32.88 1zrd s VAL 204 CO 0.01 0.34 0.51 -0.69 0.00 0.00 0.00 175.10 175.26 1zrd s VAL 205 N 1.16 5.07 0.20 2.92 1.01 -0.01 -1.97 120.40 128.79 1zrd s VAL 205 Ca 0.07 -0.87 -0.33 0.00 0.00 0.00 0.00 61.98 60.85 1zrd s VAL 205 Cb -0.14 -4.22 -0.13 0.00 0.00 0.00 0.00 36.38 31.89 1zrd s VAL 205 CO 0.05 -0.71 1.59 -1.22 0.00 0.00 0.00 175.10 174.81 1zrd n TYR 206 N 5.63 2.45 0.16 5.22 4.01 -1.20 -2.10 117.16 131.33 1zrd n TYR 206 Ca -0.10 0.23 0.01 0.00 -0.16 0.00 0.00 57.90 57.88 1zrd n TYR 206 Cb 0.44 -2.57 0.07 0.00 -0.31 0.00 0.00 39.34 36.97 1zrd n TYR 206 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81