#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zhq s SER 2 N 0.00 2.75 0.21 0.00 1.04 -1.26 -1.11 113.70 115.33 1zhq s SER 2 Ca 0.00 -1.22 -0.13 0.00 0.48 0.00 0.00 55.95 55.08 1zhq s SER 2 Cb 0.00 -0.17 0.00 0.00 0.10 0.00 0.00 66.02 65.96 1zhq s SER 2 CO 0.00 -0.38 0.44 -0.72 0.98 0.00 0.00 173.24 173.56 1zhq s TYR 3 N -3.04 0.21 0.08 5.02 1.13 -0.42 -4.92 117.35 115.41 1zhq s TYR 3 Ca 0.31 -0.57 0.10 0.00 -1.41 0.00 0.00 57.07 55.49 1zhq s TYR 3 Cb 0.05 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 41.06 1zhq s TYR 3 CO 0.13 -0.89 -0.26 0.15 -2.51 0.00 0.00 175.55 172.16 1zhq s LYS 4 N -3.96 1.59 0.09 -3.49 1.02 -1.26 0.23 119.74 113.96 1zhq s LYS 4 Ca 0.16 -1.19 -0.06 0.00 0.02 0.00 0.00 55.97 54.91 1zhq s LYS 4 Cb 0.00 -1.88 -0.02 0.00 -0.52 0.00 0.00 37.83 35.41 1zhq s LYS 4 CO 0.03 0.47 0.12 0.14 -0.92 0.00 0.00 175.35 175.18 1zhq s VAL 5 N -0.91 0.15 -0.18 3.17 -7.23 -0.83 -4.99 120.40 109.58 1zhq s VAL 5 Ca 0.12 -1.48 -0.09 0.00 -1.81 0.00 0.00 61.98 58.72 1zhq s VAL 5 Cb -0.10 -1.53 -0.05 0.00 0.56 0.00 0.00 36.38 35.27 1zhq s VAL 5 CO 0.04 -0.70 0.12 0.20 -0.31 0.00 0.00 175.10 174.45 1zhq s ASN 6 N -2.91 6.19 -0.07 4.85 0.01 -1.26 -1.01 114.94 120.73 1zhq s ASN 6 Ca 0.09 0.27 0.04 0.00 -0.71 0.00 0.00 52.86 52.55 1zhq s ASN 6 Cb 0.06 -2.07 -0.02 0.00 0.41 0.00 0.00 41.25 39.64 1zhq s ASN 6 CO -0.08 0.24 -0.19 -0.63 -1.51 0.00 0.00 177.10 174.93 1zhq s ILE 7 N 0.01 2.58 0.59 0.60 1.01 -0.21 -4.87 121.20 120.90 1zhq s ILE 7 Ca 0.09 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.67 1zhq s ILE 7 Cb -0.11 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1zhq s ILE 7 CO -0.00 0.57 1.21 -2.65 0.00 0.00 0.00 174.94 174.06 1zhq n PRO 8 N 2.88 1.27 0.00 2.79 -0.02 -1.26 -0.89 135.00 139.77 1zhq n PRO 8 Ca -0.17 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1zhq n PRO 8 Cb 0.52 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1zhq n PRO 8 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1zhq n ALA 9 N -1.47 0.58 0.00 3.55 0.00 -0.48 -4.80 120.51 117.89 1zhq n ALA 9 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1zhq n ALA 9 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1zhq n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zhq n GLY 10 N 0.00 -2.27 3.75 0.00 0.00 -1.24 -4.81 105.19 100.62 1zhq n GLY 10 Ca 0.00 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.08 1zhq n GLY 10 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1zhq s PRO 11 N -0.59 4.56 -0.19 1.61 0.04 -1.23 -0.98 135.00 138.22 1zhq s PRO 11 Ca 0.00 1.84 -0.01 0.00 0.04 0.00 0.00 61.00 62.87 1zhq s PRO 11 Cb 0.00 -3.21 0.01 0.00 0.04 0.00 0.00 34.50 31.33 1zhq s PRO 11 CO 0.00 0.06 -0.13 -0.51 0.04 0.00 0.00 177.00 176.46 1zhq s LEU 12 N -0.89 2.49 0.00 -3.56 1.43 -1.26 -4.87 118.68 112.02 1zhq s LEU 12 Ca 0.48 -0.52 0.26 0.00 -1.03 0.00 0.00 54.13 53.32 1zhq s LEU 12 Cb -0.32 -1.60 0.68 0.00 0.03 0.00 0.00 46.19 44.98 1zhq s LEU 12 CO 0.39 0.00 1.52 0.79 0.23 0.00 0.00 176.35 179.28 1zhq n TRP 13 N 4.62 0.00 -3.50 0.29 7.02 -1.26 -4.97 117.44 119.64 1zhq n TRP 13 Ca -0.20 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.20 1zhq n TRP 13 Cb 0.51 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 29.31 1zhq n TRP 13 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1zhq s SER 14 N -2.34 -0.39 0.28 -0.99 1.04 -1.26 -5.00 113.70 105.04 1zhq s SER 14 Ca 0.27 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.68 1zhq s SER 14 Cb 0.20 0.42 0.40 0.00 0.10 0.00 0.00 66.02 67.14 1zhq s SER 14 CO 0.47 -0.68 1.83 -1.13 0.98 0.00 0.00 173.24 174.70 1zhq h ASN 15 N 2.00 0.77 -0.45 7.02 -0.00 -1.98 0.03 115.58 122.96 1zhq h ASN 15 Ca -0.24 -0.14 0.05 0.00 -0.00 0.00 0.00 56.30 55.97 1zhq h ASN 15 Cb 1.25 -0.20 -0.04 0.00 -0.00 0.00 0.00 38.32 39.33 1zhq h ASN 15 CO 0.32 0.76 0.20 0.00 -0.00 0.00 0.00 177.43 178.70 1zhq h ALA 16 N 1.35 0.56 -0.24 1.57 0.00 -1.98 0.48 119.26 120.99 1zhq h ALA 16 Ca 0.17 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1zhq h ALA 16 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1zhq h ALA 16 CO -0.00 -0.18 -0.00 1.49 0.00 0.00 0.00 179.25 180.56 1zhq h GLU 17 N 0.39 0.43 -0.44 0.00 4.81 -1.80 -2.36 114.58 115.61 1zhq h GLU 17 Ca 0.20 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1zhq h GLU 17 Cb 0.16 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1zhq h GLU 17 CO -0.18 0.61 0.19 0.00 -0.73 0.00 0.00 179.01 178.91 1zhq h ALA 18 N 0.81 0.54 0.00 2.92 0.00 -0.36 0.41 119.26 123.58 1zhq h ALA 18 Ca 0.07 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1zhq h ALA 18 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1zhq h ALA 18 CO 0.01 -0.18 0.00 1.96 0.00 0.00 0.00 179.25 181.04 1zhq h GLN 19 N 0.39 0.00 0.11 0.00 1.08 0.05 0.31 115.11 117.05 1zhq h GLN 19 Ca 0.20 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 57.05 1zhq h GLN 19 Cb 0.14 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1zhq h GLN 19 CO -0.17 0.00 -1.94 1.04 -0.95 0.00 0.00 178.83 176.82 1zhq n GLN 20 N -3.01 0.74 0.12 1.46 6.02 -0.20 -4.39 117.38 118.12 1zhq n GLN 20 Ca -0.01 0.27 -0.24 0.00 -0.01 0.00 0.00 57.00 57.01 1zhq n GLN 20 Cb 0.22 -1.73 -0.16 0.00 1.02 0.00 0.00 30.24 29.59 1zhq n GLN 20 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1zhq h VAL 21 N 0.06 1.17 -0.60 5.09 2.07 0.04 -3.37 116.25 120.71 1zhq h VAL 21 Ca -0.40 -2.63 0.11 0.00 0.82 0.00 0.00 66.70 64.61 1zhq h VAL 21 Cb 2.03 2.96 -0.12 0.00 -1.52 0.00 0.00 31.29 34.64 1zhq h VAL 21 CO 0.09 0.82 -0.28 1.23 0.02 0.00 0.00 177.57 179.45 1zhq h GLY 22 N 0.30 0.07 1.13 2.17 0.00 -0.59 -0.90 103.07 105.24 1zhq h GLY 22 Ca -0.29 0.36 0.05 0.00 0.00 0.00 0.00 47.33 47.46 1zhq h GLY 22 CO 0.24 -0.22 0.45 -2.55 0.00 0.00 0.00 176.54 174.46 1zhq h PRO 23 N -0.12 0.72 -0.19 4.80 0.11 -1.77 0.28 132.00 135.83 1zhq h PRO 23 Ca 0.26 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.24 1zhq h PRO 23 Cb 0.53 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1zhq h PRO 23 CO -0.67 0.47 -0.21 0.87 -0.21 0.00 0.00 178.00 178.25 1zhq h LYS 24 N 0.74 0.48 -0.36 1.05 1.79 -1.38 -0.20 116.57 118.70 1zhq h LYS 24 Ca 0.29 -0.26 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 1zhq h LYS 24 Cb 0.20 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 1zhq h LYS 24 CO -0.09 0.84 0.18 0.82 -1.08 0.00 0.00 179.45 180.12 1zhq h ILE 25 N 0.14 1.15 -0.22 1.86 1.08 -0.84 -1.93 117.51 118.76 1zhq h ILE 25 Ca 0.03 -0.43 0.04 0.00 -0.39 0.00 0.00 64.86 64.12 1zhq h ILE 25 Cb 0.76 0.79 -0.04 0.00 -3.07 0.00 0.00 36.82 35.25 1zhq h ILE 25 CO 0.05 0.16 -0.06 0.00 -0.69 0.00 0.00 178.15 177.62 1zhq h ALA 26 N 1.04 0.15 -0.69 1.87 0.00 -0.88 -1.96 119.26 118.78 1zhq h ALA 26 Ca 0.12 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1zhq h ALA 26 Cb 0.09 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1zhq h ALA 26 CO -0.02 -0.47 0.45 0.00 0.00 0.00 0.00 179.25 179.21 1zhq h ALA 27 N 1.22 1.58 0.00 0.00 0.00 -0.74 0.65 119.26 121.97 1zhq h ALA 27 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1zhq h ALA 27 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1zhq h ALA 27 CO -0.23 0.36 -0.19 0.00 0.00 0.00 0.00 179.25 179.20 1zhq h ALA 28 N 1.59 1.28 -0.34 0.00 0.00 -0.66 -2.25 119.26 118.88 1zhq h ALA 28 Ca 0.27 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1zhq h ALA 28 Cb 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1zhq h ALA 28 CO -0.07 0.24 0.00 0.72 0.00 0.00 0.00 179.25 180.14 1zhq n HIS 29 N -3.72 1.22 -3.91 0.00 8.25 -0.14 -4.97 115.22 111.94 1zhq n HIS 29 Ca -0.02 -0.86 -0.30 0.00 -0.26 0.00 0.00 57.72 56.29 1zhq n HIS 29 Cb 0.30 -0.37 0.03 0.00 1.12 0.00 0.00 29.99 31.07 1zhq n HIS 29 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1zhq n GLN 30 N -0.27 -5.46 -2.44 -0.41 6.02 -0.36 -4.96 117.38 109.51 1zhq n GLN 30 Ca 0.23 0.59 -0.04 0.00 -0.01 0.00 0.00 57.00 57.77 1zhq n GLN 30 Cb 0.97 -5.47 -0.01 0.00 1.02 0.00 0.00 30.24 26.75 1zhq n GLN 30 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1zhq n GLY 31 N -1.69 3.91 3.08 1.08 0.00 0.04 -4.49 105.19 107.11 1zhq n GLY 31 Ca 0.03 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 1zhq n GLY 31 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zhq s ASN 32 N -1.46 2.64 0.22 1.61 0.01 -0.15 -3.97 114.94 113.85 1zhq s ASN 32 Ca 0.05 -0.48 -0.31 0.00 -0.71 0.00 0.00 52.86 51.41 1zhq s ASN 32 Cb 0.00 -1.19 -0.11 0.00 0.41 0.00 0.00 41.25 40.37 1zhq s ASN 32 CO 0.03 0.02 1.56 0.12 -1.51 0.00 0.00 177.10 177.32 1zhq s PHE 33 N 1.04 2.96 -1.28 2.20 5.36 -1.26 -0.66 117.98 126.34 1zhq s PHE 33 Ca -0.05 0.73 0.26 0.00 -0.96 0.00 0.00 56.93 56.92 1zhq s PHE 33 Cb -0.15 -3.96 0.71 0.00 -0.34 0.00 0.00 43.02 39.28 1zhq s PHE 33 CO -0.03 -3.37 1.54 0.25 -1.46 0.00 0.00 175.22 172.15 1zhq n THR 34 N 3.11 0.00 0.00 0.12 -2.24 -0.51 -4.91 114.28 109.85 1zhq n THR 34 Ca 0.11 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1zhq n THR 34 Cb 0.38 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1zhq n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zhq n GLY 35 N 1.43 3.39 3.80 3.38 0.00 -1.26 -5.05 105.19 110.88 1zhq n GLY 35 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1zhq n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1zhq s GLN 36 N -0.80 4.34 0.13 1.61 -1.52 -1.26 -4.95 119.66 117.20 1zhq s GLN 36 Ca 0.00 0.89 -0.15 0.00 -1.95 0.00 0.00 55.36 54.15 1zhq s GLN 36 Cb 0.00 -3.25 0.03 0.00 -0.22 0.00 0.00 33.01 29.57 1zhq s GLN 36 CO 0.00 0.61 0.39 1.67 -0.25 0.00 0.00 175.29 177.72 1zhq s TRP 37 N -1.11 -0.15 -0.08 0.91 1.48 -1.26 -0.60 118.94 118.13 1zhq s TRP 37 Ca 0.31 -0.18 -0.10 0.00 -1.06 0.00 0.00 56.10 55.08 1zhq s TRP 37 Cb -0.21 0.24 0.02 0.00 -1.16 0.00 0.00 33.47 32.36 1zhq s TRP 37 CO 0.22 -0.71 0.26 0.99 -4.06 0.00 0.00 176.95 173.65 1zhq s THR 38 N -3.82 0.02 -0.22 0.66 2.01 0.51 -4.98 115.64 109.82 1zhq s THR 38 Ca 0.04 -0.15 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 1zhq s THR 38 Cb 0.02 -0.42 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 1zhq s THR 38 CO -0.11 -0.08 0.58 -0.89 -0.69 0.00 0.00 174.62 173.44 1zhq s THR 39 N -0.25 5.04 -0.04 -0.82 2.01 -1.26 0.57 115.64 120.88 1zhq s THR 39 Ca -0.04 1.07 0.19 0.00 0.31 0.00 0.00 61.69 63.22 1zhq s THR 39 Cb -0.03 -3.90 -0.29 0.00 0.01 0.00 0.00 72.50 68.29 1zhq s THR 39 CO 0.01 0.11 0.37 1.33 -0.69 0.00 0.00 174.62 175.76 1zhq n VAL 40 N 4.80 0.14 -3.66 3.82 0.24 0.58 -4.84 118.33 119.41 1zhq n VAL 40 Ca -0.02 -0.47 -0.25 0.00 -2.04 0.00 0.00 64.34 61.55 1zhq n VAL 40 Cb 0.50 -0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.69 1zhq n VAL 40 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1zhq s VAL 41 N -3.21 0.09 0.04 3.34 1.01 -0.51 -4.97 120.40 116.18 1zhq s VAL 41 Ca -0.07 -0.15 -0.36 0.00 0.00 0.00 0.00 61.98 61.40 1zhq s VAL 41 Cb 0.11 -0.62 -0.15 0.00 0.00 0.00 0.00 36.38 35.73 1zhq s VAL 41 CO 0.78 -0.15 1.56 1.21 0.00 0.00 0.00 175.10 178.49 1zhq n GLU 42 N 5.22 1.64 -0.94 2.72 2.13 -1.26 -1.12 120.64 129.03 1zhq n GLU 42 Ca -0.07 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.35 1zhq n GLU 42 Cb 0.49 -2.31 0.00 0.00 0.27 0.00 0.00 31.44 29.88 1zhq n GLU 42 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1zhq n SER 43 N 3.81 -4.23 0.00 4.31 7.64 -1.26 -4.71 113.62 119.18 1zhq n SER 43 Ca 0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1zhq n SER 43 Cb 0.23 -2.50 0.00 0.00 -1.01 0.00 0.00 64.21 60.93 1zhq n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1zhq n ALA 44 N 1.00 0.72 -3.66 -0.43 0.00 -0.27 -4.90 120.51 112.98 1zhq n ALA 44 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1zhq n ALA 44 Cb 0.29 0.01 -0.09 0.00 0.00 0.00 0.00 19.45 19.67 1zhq n ALA 44 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1zhq s MET 45 N -0.72 0.58 0.17 0.00 -2.45 -0.30 -3.50 119.30 113.06 1zhq s MET 45 Ca 0.00 1.03 0.07 0.00 -1.25 0.00 0.00 55.69 55.54 1zhq s MET 45 Cb 0.00 0.08 -0.04 0.00 1.25 0.00 0.00 34.83 36.12 1zhq s MET 45 CO 0.00 -0.15 -0.15 -1.12 1.05 0.00 0.00 175.02 174.65 1zhq s SER 46 N 1.48 2.37 0.10 1.11 0.01 -0.16 -0.31 113.70 118.30 1zhq s SER 46 Ca -0.09 -0.93 0.07 0.00 1.31 0.00 0.00 55.95 56.31 1zhq s SER 46 Cb -0.06 -0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 1zhq s SER 46 CO -0.16 -0.15 -0.18 0.68 0.41 0.00 0.00 173.24 173.84 1zhq s VAL 47 N -2.57 1.51 -0.05 3.43 -7.23 0.19 -1.38 120.40 114.30 1zhq s VAL 47 Ca 0.17 -1.50 0.06 0.00 -1.81 0.00 0.00 61.98 58.90 1zhq s VAL 47 Cb -0.03 -1.42 -0.02 0.00 0.56 0.00 0.00 36.38 35.48 1zhq s VAL 47 CO 0.05 -0.15 -0.24 0.68 -0.31 0.00 0.00 175.10 175.13 1zhq s VAL 48 N -1.31 2.19 -0.07 1.32 -7.23 -0.07 -0.37 120.40 114.87 1zhq s VAL 48 Ca 0.04 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.89 1zhq s VAL 48 Cb -0.09 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.03 1zhq s VAL 48 CO 0.04 0.57 1.01 -0.70 -0.31 0.00 0.00 175.10 175.71 1zhq s GLU 49 N -0.33 4.46 -0.04 4.82 2.12 0.23 -1.04 118.70 128.92 1zhq s GLU 49 Ca 0.02 1.42 0.03 0.00 0.36 0.00 0.00 54.97 56.80 1zhq s GLU 49 Cb -0.12 -3.52 0.00 0.00 0.26 0.00 0.00 34.13 30.75 1zhq s GLU 49 CO 0.02 -0.24 -0.14 0.08 -0.54 0.00 0.00 175.26 174.43 1zhq s VAL 50 N 1.72 1.20 -0.20 3.70 1.01 -0.18 -1.42 120.40 126.23 1zhq s VAL 50 Ca 0.50 -0.58 -0.18 0.00 0.00 0.00 0.00 61.98 61.72 1zhq s VAL 50 Cb -0.20 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1zhq s VAL 50 CO 0.21 0.36 0.52 -0.70 0.00 0.00 0.00 175.10 175.48 1zhq s GLU 51 N 0.18 4.19 0.29 2.72 2.12 0.17 -1.97 118.70 126.39 1zhq s GLU 51 Ca -0.05 0.41 0.09 0.00 0.36 0.00 0.00 54.97 55.77 1zhq s GLU 51 Cb -0.11 -3.56 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 1zhq s GLU 51 CO 0.02 -0.15 0.07 -0.51 -0.54 0.00 0.00 175.26 174.15 1zhq s LEU 52 N 1.64 3.30 0.07 2.70 1.43 0.14 -0.98 118.68 126.98 1zhq s LEU 52 Ca 0.24 -0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 52.63 1zhq s LEU 52 Cb -0.15 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 1zhq s LEU 52 CO 0.10 -0.11 0.35 -1.10 0.23 0.00 0.00 176.35 175.81 1zhq s GLN 53 N -3.76 3.66 0.12 1.70 -1.52 -1.26 -1.30 119.66 117.30 1zhq s GLN 53 Ca 0.34 0.01 -0.15 0.00 -1.95 0.00 0.00 55.36 53.61 1zhq s GLN 53 Cb -0.05 -2.98 -0.03 0.00 -0.22 0.00 0.00 33.01 29.73 1zhq s GLN 53 CO 0.22 0.56 1.57 0.28 -0.25 0.00 0.00 175.29 177.67 1zhq h VAL 54 N 2.68 1.26 -3.13 1.09 2.07 -1.47 -3.41 116.25 115.33 1zhq h VAL 54 Ca -0.48 -0.97 -0.60 0.00 0.82 0.00 0.00 66.70 65.46 1zhq h VAL 54 Cb 1.19 1.13 -0.36 0.00 -1.52 0.00 0.00 31.29 31.73 1zhq h VAL 54 CO 0.68 0.33 -0.83 -0.70 0.02 0.00 0.00 177.57 177.07 1zhq s GLU 55 N -5.03 2.30 -0.14 1.57 2.12 -1.26 -5.07 118.70 113.19 1zhq s GLU 55 Ca -0.13 -0.56 -0.26 0.00 0.36 0.00 0.00 54.97 54.38 1zhq s GLU 55 Cb 0.10 -2.09 -0.02 0.00 0.26 0.00 0.00 34.13 32.38 1zhq s GLU 55 CO 0.79 -0.22 0.84 -0.80 -0.54 0.00 0.00 175.26 175.32 1zhq s ASN 56 N 1.44 7.01 0.36 -1.70 0.01 -1.26 -4.99 114.94 115.81 1zhq s ASN 56 Ca 0.04 1.24 0.08 0.00 -0.71 0.00 0.00 52.86 53.51 1zhq s ASN 56 Cb -0.13 -2.46 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 1zhq s ASN 56 CO -0.10 -0.35 0.06 0.42 -1.51 0.00 0.00 177.10 175.62 1zhq s THR 57 N 1.86 2.57 0.00 1.60 -4.23 -1.26 -4.71 115.64 111.47 1zhq s THR 57 Ca 0.40 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 1zhq s THR 57 Cb -0.17 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 70.80 1zhq s THR 57 CO 0.15 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1zhq n GLY 58 N -1.03 0.93 0.77 3.99 0.00 -1.26 -4.12 105.19 104.46 1zhq n GLY 58 Ca -0.04 -1.49 0.09 0.00 0.00 0.00 0.00 46.02 44.58 1zhq n GLY 58 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1zhq n ILE 59 N -1.41 0.26 -4.25 -0.61 -5.35 -1.07 -4.70 119.36 102.23 1zhq n ILE 59 Ca 0.00 -0.63 -0.30 0.00 -0.27 0.00 0.00 62.75 61.55 1zhq n ILE 59 Cb 0.00 1.13 -0.10 0.00 -1.74 0.00 0.00 39.64 38.94 1zhq n ILE 59 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1zhq s HIS 60 N -1.32 2.76 0.04 4.28 3.76 0.26 -5.00 115.29 120.07 1zhq s HIS 60 Ca 0.24 -0.15 -0.01 0.00 -0.15 0.00 0.00 55.06 55.00 1zhq s HIS 60 Cb 0.15 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.36 1zhq s HIS 60 CO 0.22 0.42 -0.03 -1.83 -0.85 0.00 0.00 174.74 172.67 1zhq s GLU 61 N -2.13 0.54 -0.12 1.40 4.04 -1.26 -0.66 118.70 120.51 1zhq s GLU 61 Ca 0.21 -1.06 -0.07 0.00 0.04 0.00 0.00 54.97 54.09 1zhq s GLU 61 Cb -0.11 0.16 0.05 0.00 0.02 0.00 0.00 34.13 34.24 1zhq s GLU 61 CO 0.13 -0.09 0.29 0.12 -1.84 0.00 0.00 175.26 173.87 1zhq s PHE 62 N -3.22 -0.39 0.07 4.83 5.36 -0.82 -4.97 117.98 118.83 1zhq s PHE 62 Ca 0.01 0.91 0.06 0.00 -0.96 0.00 0.00 56.93 56.95 1zhq s PHE 62 Cb 0.03 0.11 -0.04 0.00 -0.34 0.00 0.00 43.02 42.78 1zhq s PHE 62 CO -0.07 -0.25 -0.11 0.15 -1.46 0.00 0.00 175.22 173.48 1zhq s LYS 63 N 1.17 2.21 0.13 10.12 1.02 -1.26 -0.50 119.74 132.63 1zhq s LYS 63 Ca -0.08 -0.95 -0.25 0.00 0.02 0.00 0.00 55.97 54.70 1zhq s LYS 63 Cb -0.09 -2.32 0.07 0.00 -0.52 0.00 0.00 37.83 34.96 1zhq s LYS 63 CO -0.09 0.53 0.91 -0.08 -0.92 0.00 0.00 175.35 175.71 1zhq s THR 64 N -1.11 0.00 -0.06 2.17 -1.32 -0.93 -4.99 115.64 109.40 1zhq s THR 64 Ca 0.19 -0.53 -0.06 0.00 -1.21 0.00 0.00 61.69 60.08 1zhq s THR 64 Cb -0.11 -1.75 -0.04 0.00 -1.51 0.00 0.00 72.50 69.09 1zhq s THR 64 CO 0.11 0.00 0.19 -1.81 -2.21 0.00 0.00 174.62 170.90 1zhq s ASP 65 N -2.84 6.43 0.10 8.08 1.01 -1.26 -0.63 116.67 127.56 1zhq s ASP 65 Ca 0.10 0.48 0.01 0.00 0.71 0.00 0.00 52.55 53.86 1zhq s ASP 65 Cb -0.02 -2.07 -0.04 0.00 1.01 0.00 0.00 42.92 41.81 1zhq s ASP 65 CO -0.00 0.33 -0.05 0.68 0.21 0.00 0.00 175.17 176.34 1zhq s VAL 66 N -1.17 0.63 0.37 -1.27 -7.23 -0.66 -4.95 120.40 106.12 1zhq s VAL 66 Ca 0.21 -1.93 -0.28 0.00 -1.81 0.00 0.00 61.98 58.17 1zhq s VAL 66 Cb -0.13 -1.72 -0.11 0.00 0.56 0.00 0.00 36.38 34.98 1zhq s VAL 66 CO 0.11 -0.83 1.50 -0.76 -0.31 0.00 0.00 175.10 174.81 1zhq s LEU 67 N -3.05 4.32 0.00 1.32 1.43 -1.26 -1.56 118.68 119.88 1zhq s LEU 67 Ca 0.13 3.06 0.00 0.00 -1.03 0.00 0.00 54.13 56.29 1zhq s LEU 67 Cb 0.06 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1zhq s LEU 67 CO -0.04 -0.89 0.53 0.00 0.23 0.00 0.00 176.35 176.19 1zhq n ALA 68 N 0.55 1.75 -0.18 4.21 0.00 -0.42 -4.76 120.51 121.66 1zhq n ALA 68 Ca 0.01 -0.53 0.02 0.00 0.00 0.00 0.00 53.44 52.95 1zhq n ALA 68 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.83 1zhq n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zhq n GLY 69 N -0.13 -1.43 3.74 0.00 0.00 -1.22 -4.77 105.19 101.38 1zhq n GLY 69 Ca 0.00 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 1zhq n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1zhq s PRO 70 N -1.27 4.56 -0.13 1.61 0.04 -1.25 -1.48 135.00 137.07 1zhq s PRO 70 Ca 0.00 1.79 0.01 0.00 0.04 0.00 0.00 61.00 62.85 1zhq s PRO 70 Cb 0.00 -3.25 0.02 0.00 0.04 0.00 0.00 34.50 31.31 1zhq s PRO 70 CO 0.00 0.02 -0.17 -0.51 0.04 0.00 0.00 177.00 176.39 1zhq s LEU 71 N -0.46 1.82 0.11 -3.56 1.43 -1.26 -4.88 118.68 111.88 1zhq s LEU 71 Ca 0.50 -0.50 0.24 0.00 -1.03 0.00 0.00 54.13 53.35 1zhq s LEU 71 Cb -0.31 -1.22 0.36 0.00 0.03 0.00 0.00 46.19 45.05 1zhq s LEU 71 CO 0.36 0.01 1.33 0.79 0.23 0.00 0.00 176.35 179.07 1zhq n TRP 72 N 4.38 0.51 -3.53 0.29 7.02 -1.26 -4.92 117.44 119.93 1zhq n TRP 72 Ca -0.19 0.15 -0.10 0.00 -1.02 0.00 0.00 57.50 56.34 1zhq n TRP 72 Cb 0.51 -0.63 -0.02 0.00 -2.42 0.00 0.00 31.31 28.75 1zhq n TRP 72 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1zhq s SER 73 N -4.13 -0.47 0.25 -0.99 1.04 -1.26 -5.02 113.70 103.13 1zhq s SER 73 Ca 0.07 -0.14 -0.04 0.00 0.48 0.00 0.00 55.95 56.31 1zhq s SER 73 Cb 0.14 0.60 0.30 0.00 0.10 0.00 0.00 66.02 67.16 1zhq s SER 73 CO 0.72 -1.01 1.84 -1.13 0.98 0.00 0.00 173.24 174.64 1zhq h ASN 74 N 2.00 0.97 -0.45 7.02 -0.00 -1.98 -0.45 115.58 122.69 1zhq h ASN 74 Ca -0.29 -0.13 0.05 0.00 -0.00 0.00 0.00 56.30 55.93 1zhq h ASN 74 Cb 1.29 -0.25 -0.04 0.00 -0.00 0.00 0.00 38.32 39.31 1zhq h ASN 74 CO 0.34 0.85 0.19 -0.78 -0.00 0.00 0.00 177.43 178.03 1zhq h ASP 75 N 1.05 0.25 -0.56 1.15 1.82 -1.99 0.20 116.42 118.34 1zhq h ASP 75 Ca 0.25 0.04 -0.09 0.00 -0.39 0.00 0.00 57.03 56.84 1zhq h ASP 75 Cb 0.16 -0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.15 1zhq h ASP 75 CO -0.03 0.18 -0.01 -0.08 -1.61 0.00 0.00 179.24 177.70 1zhq h GLU 76 N 0.39 1.00 -0.38 0.28 4.81 -1.81 -2.21 114.58 116.66 1zhq h GLU 76 Ca 0.20 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1zhq h GLU 76 Cb 0.16 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1zhq h GLU 76 CO -0.18 1.00 0.18 0.00 -0.73 0.00 0.00 179.01 179.29 1zhq h ALA 77 N 0.96 0.49 -0.13 2.92 0.00 -0.36 -1.01 119.26 122.14 1zhq h ALA 77 Ca 0.16 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1zhq h ALA 77 Cb 0.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1zhq h ALA 77 CO 0.03 0.05 -0.23 1.96 0.00 0.00 0.00 179.25 181.06 1zhq h GLN 78 N 0.47 0.22 0.01 0.00 1.08 -0.53 0.33 115.11 116.69 1zhq h GLN 78 Ca 0.13 -0.07 -0.25 0.00 -1.45 0.00 0.00 58.65 57.02 1zhq h GLN 78 Cb 0.12 -0.02 0.01 0.00 -0.05 0.00 0.00 27.48 27.54 1zhq h GLN 78 CO -0.02 0.45 -1.00 0.87 -0.95 0.00 0.00 178.83 178.18 1zhq h LYS 79 N 0.20 0.54 0.00 1.46 1.57 -1.08 -3.36 116.57 115.90 1zhq h LYS 79 Ca 0.03 -0.59 -0.25 0.00 -1.87 0.00 0.00 60.65 57.98 1zhq h LYS 79 Cb 0.53 0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.96 1zhq h LYS 79 CO 0.04 1.21 -1.77 1.28 -0.57 0.00 0.00 179.45 179.63 1zhq n LEU 80 N -3.79 0.63 -0.32 2.94 4.77 -0.41 -4.56 117.00 116.26 1zhq n LEU 80 Ca -0.09 0.29 0.04 0.00 -0.03 0.00 0.00 56.01 56.22 1zhq n LEU 80 Cb 0.86 0.20 0.11 0.00 -2.33 0.00 0.00 43.42 42.27 1zhq n LEU 80 CO 0.53 0.31 0.68 1.23 -1.33 0.00 0.00 177.39 178.81 1zhq h GLY 81 N 3.72 0.62 0.92 -0.72 0.00 -0.48 -0.47 103.07 106.66 1zhq h GLY 81 Ca -0.29 0.31 0.02 0.00 0.00 0.00 0.00 47.33 47.37 1zhq h GLY 81 CO 0.05 -0.34 0.51 -2.55 0.00 0.00 0.00 176.54 174.22 1zhq h PRO 82 N -0.00 0.98 -0.21 4.80 0.11 -1.80 0.12 132.00 136.00 1zhq h PRO 82 Ca 0.43 -0.06 -0.21 0.00 0.11 0.00 0.00 66.00 66.27 1zhq h PRO 82 Cb 0.65 -0.22 0.01 0.00 0.11 0.00 0.00 31.00 31.55 1zhq h PRO 82 CO -0.92 0.65 -0.68 1.96 -0.21 0.00 0.00 178.00 178.80 1zhq h GLN 83 N 1.01 0.83 -0.39 1.05 4.20 -1.55 -0.95 115.11 119.31 1zhq h GLN 83 Ca 0.31 -0.61 -0.02 0.00 0.06 0.00 0.00 58.65 58.38 1zhq h GLN 83 Cb -0.03 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1zhq h GLN 83 CO -0.10 1.23 0.14 0.82 -0.67 0.00 0.00 178.83 180.26 1zhq h ILE 84 N 0.59 1.20 -0.82 2.54 2.04 -0.90 -2.23 117.51 119.93 1zhq h ILE 84 Ca -0.02 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1zhq h ILE 84 Cb 1.30 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 38.23 1zhq h ILE 84 CO 0.14 0.22 0.52 0.00 0.00 0.00 0.00 178.15 179.03 1zhq h ALA 85 N 0.99 1.04 -0.21 1.87 0.00 -0.68 -1.42 119.26 120.84 1zhq h ALA 85 Ca 0.13 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1zhq h ALA 85 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1zhq h ALA 85 CO -0.01 0.48 0.14 0.00 0.00 0.00 0.00 179.25 179.87 1zhq h ALA 86 N 1.28 1.98 0.00 0.00 0.00 -0.88 0.12 119.26 121.76 1zhq h ALA 86 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1zhq h ALA 86 Cb -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1zhq h ALA 86 CO -0.06 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.05 1zhq n SER 87 N -4.50 0.06 -0.50 0.00 3.41 -0.54 -1.10 113.62 110.46 1zhq n SER 87 Ca 0.01 0.52 0.05 0.00 -0.26 0.00 0.00 58.87 59.18 1zhq n SER 87 Cb 0.16 -0.53 0.11 0.00 -0.26 0.00 0.00 64.21 63.69 1zhq n SER 87 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1zhq n TYR 88 N -1.57 0.31 -3.04 7.33 4.02 0.33 -4.98 117.16 119.55 1zhq n TYR 88 Ca 0.03 -0.40 -0.14 0.00 -0.01 0.00 0.00 57.90 57.38 1zhq n TYR 88 Cb 0.15 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.48 1zhq n TYR 88 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1zhq n GLY 89 N 0.38 0.04 3.46 2.72 0.00 -0.26 -5.01 105.19 106.52 1zhq n GLY 89 Ca 0.09 -0.15 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 1zhq n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zhq s ALA 90 N -3.12 0.87 0.10 4.61 0.00 -0.69 -4.81 121.76 118.70 1zhq s ALA 90 Ca 0.31 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.73 1zhq s ALA 90 Cb -0.14 1.20 -0.04 0.00 0.00 0.00 0.00 23.12 24.15 1zhq s ALA 90 CO 0.38 -0.77 0.16 -1.21 0.00 0.00 0.00 175.76 174.32 1zhq s GLU 91 N -3.22 3.14 -0.02 0.00 2.02 -0.62 -2.93 118.70 117.07 1zhq s GLU 91 Ca 0.32 -0.63 -0.17 0.00 0.02 0.00 0.00 54.97 54.51 1zhq s GLU 91 Cb 0.00 -2.85 -0.05 0.00 0.10 0.00 0.00 34.13 31.33 1zhq s GLU 91 CO 0.20 0.56 0.47 0.12 0.02 0.00 0.00 175.26 176.64 1zhq s PHE 92 N -1.53 3.67 -0.86 1.61 5.36 -1.26 0.01 117.98 124.98 1zhq s PHE 92 Ca 0.32 1.03 0.24 0.00 -0.96 0.00 0.00 56.93 57.56 1zhq s PHE 92 Cb -0.12 -2.44 0.28 0.00 -0.34 0.00 0.00 43.02 40.40 1zhq s PHE 92 CO 0.25 0.46 1.24 0.25 -1.46 0.00 0.00 175.22 175.96 1zhq n THR 93 N 2.45 0.09 0.00 0.12 -2.24 -0.90 -4.90 114.28 108.90 1zhq n THR 93 Ca -0.11 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1zhq n THR 93 Cb 0.52 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 1zhq n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zhq n GLY 94 N 1.45 0.08 3.77 3.38 0.00 -1.26 -5.07 105.19 107.54 1zhq n GLY 94 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1zhq n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1zhq s GLN 95 N -0.97 3.41 0.24 1.61 -1.52 -1.26 -4.99 119.66 116.18 1zhq s GLN 95 Ca 0.00 -0.25 -0.19 0.00 -1.95 0.00 0.00 55.36 52.96 1zhq s GLN 95 Cb 0.00 -3.08 0.02 0.00 -0.22 0.00 0.00 33.01 29.74 1zhq s GLN 95 CO 0.00 0.66 0.62 1.67 -0.25 0.00 0.00 175.29 177.99 1zhq s TRP 96 N -0.71 -0.14 -0.02 0.91 1.48 -1.26 -0.25 118.94 118.95 1zhq s TRP 96 Ca 0.12 -0.25 -0.29 0.00 -1.06 0.00 0.00 56.10 54.63 1zhq s TRP 96 Cb -0.12 0.53 0.09 0.00 -1.16 0.00 0.00 33.47 32.81 1zhq s TRP 96 CO 0.03 -1.07 0.75 -0.98 -4.06 0.00 0.00 176.95 171.62 1zhq s ARG 97 N -3.90 0.99 -0.11 3.25 1.70 -0.45 -5.00 118.95 115.42 1zhq s ARG 97 Ca 0.11 -0.01 -0.20 0.00 -0.47 0.00 0.00 55.73 55.16 1zhq s ARG 97 Cb -0.03 0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 34.77 1zhq s ARG 97 CO 0.02 -0.36 0.56 0.99 -1.08 0.00 0.00 175.30 175.43 1zhq s THR 98 N -2.02 5.13 -0.10 4.99 2.01 -1.26 -0.12 115.64 124.26 1zhq s THR 98 Ca -0.04 1.12 0.20 0.00 0.31 0.00 0.00 61.69 63.27 1zhq s THR 98 Cb -0.00 -3.89 -0.29 0.00 0.01 0.00 0.00 72.50 68.32 1zhq s THR 98 CO 0.01 0.28 0.29 2.30 -0.69 0.00 0.00 174.62 176.81 1zhq n ILE 99 N 3.84 0.57 -3.60 1.82 -5.35 -0.33 -4.84 119.36 111.47 1zhq n ILE 99 Ca -0.05 -0.63 -0.24 0.00 -0.27 0.00 0.00 62.75 61.56 1zhq n ILE 99 Cb 0.51 -0.19 -0.16 0.00 -1.74 0.00 0.00 39.64 38.06 1zhq n ILE 99 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1zhq s VAL 100 N -3.04 -0.13 0.10 7.28 1.01 -0.82 -4.99 120.40 119.80 1zhq s VAL 100 Ca -0.09 -0.09 -0.36 0.00 0.00 0.00 0.00 61.98 61.45 1zhq s VAL 100 Cb 0.10 -0.55 -0.15 0.00 0.00 0.00 0.00 36.38 35.78 1zhq s VAL 100 CO 0.84 -0.22 1.47 -0.62 0.00 0.00 0.00 175.10 176.57 1zhq n GLU 101 N 5.29 1.61 -0.78 2.72 1.02 -1.26 -0.88 120.64 128.35 1zhq n GLU 101 Ca -0.06 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 1zhq n GLU 101 Cb 0.49 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 1zhq n GLU 101 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zhq n GLY 102 N 3.01 0.45 0.95 0.62 0.00 -1.26 -4.75 105.19 104.22 1zhq n GLY 102 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1zhq n GLY 102 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1zhq n VAL 103 N -2.07 0.00 -3.67 1.61 0.31 -0.06 -5.01 118.33 109.44 1zhq n VAL 103 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1zhq n VAL 103 Cb 0.04 -1.17 -0.08 0.00 -0.91 0.00 0.00 33.84 31.71 1zhq n VAL 103 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1zhq s MET 104 N -1.97 0.72 0.30 5.55 -2.45 -0.28 -3.86 119.30 117.31 1zhq s MET 104 Ca 0.00 0.43 0.03 0.00 -1.25 0.00 0.00 55.69 54.90 1zhq s MET 104 Cb 0.00 0.34 -0.06 0.00 1.25 0.00 0.00 34.83 36.36 1zhq s MET 104 CO 0.00 -0.15 0.06 -1.12 1.05 0.00 0.00 175.02 174.86 1zhq s SER 105 N -0.39 1.98 0.09 1.11 0.01 -0.55 -1.18 113.70 114.77 1zhq s SER 105 Ca -0.05 -1.36 0.03 0.00 1.31 0.00 0.00 55.95 55.88 1zhq s SER 105 Cb -0.03 -0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.16 1zhq s SER 105 CO 0.03 -0.63 -0.09 0.68 0.41 0.00 0.00 173.24 173.64 1zhq s VAL 106 N -3.44 0.86 0.13 3.43 -7.23 0.82 -1.30 120.40 113.68 1zhq s VAL 106 Ca 0.36 -1.66 0.09 0.00 -1.81 0.00 0.00 61.98 58.96 1zhq s VAL 106 Cb 0.08 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 1zhq s VAL 106 CO 0.14 -0.61 -0.22 0.27 -0.31 0.00 0.00 175.10 174.37 1zhq s ILE 107 N -2.61 1.91 -0.13 -0.62 -4.36 -0.60 -1.35 121.20 113.45 1zhq s ILE 107 Ca 0.06 -1.73 -0.19 0.00 -0.26 0.00 0.00 60.65 58.53 1zhq s ILE 107 Cb -0.02 -1.77 -0.04 0.00 1.25 0.00 0.00 42.46 41.88 1zhq s ILE 107 CO -0.01 -0.11 0.51 -1.58 0.24 0.00 0.00 174.94 173.99 1zhq s GLN 108 N -2.25 4.33 0.34 0.37 0.74 0.65 -1.65 119.66 122.18 1zhq s GLN 108 Ca 0.12 0.49 0.09 0.00 0.05 0.00 0.00 55.36 56.11 1zhq s GLN 108 Cb -0.09 -3.46 -0.05 0.00 1.10 0.00 0.00 33.01 30.51 1zhq s GLN 108 CO 0.06 0.10 0.00 0.96 -0.55 0.00 0.00 175.29 175.86 1zhq s ILE 109 N 0.80 2.64 -0.10 -2.34 -4.36 0.19 -2.12 121.20 115.92 1zhq s ILE 109 Ca 0.27 -1.99 -0.00 0.00 -0.26 0.00 0.00 60.65 58.67 1zhq s ILE 109 Cb -0.15 -2.78 0.02 0.00 1.25 0.00 0.00 42.46 40.80 1zhq s ILE 109 CO 0.11 -0.21 -0.07 -0.75 0.24 0.00 0.00 174.94 174.26 1zhq s LYS 110 N -3.70 1.40 0.06 0.37 2.20 0.10 -2.19 119.74 117.98 1zhq s LYS 110 Ca 0.34 -0.22 -0.10 0.00 -0.36 0.00 0.00 55.97 55.64 1zhq s LYS 110 Cb -0.00 -1.46 -0.06 0.00 -1.51 0.00 0.00 37.83 34.80 1zhq s LYS 110 CO 0.19 -0.23 0.38 0.71 -0.36 0.00 0.00 175.35 176.04 1zhq s TYR 111 N 1.60 3.59 -0.09 4.03 1.51 0.34 -1.59 117.35 126.75 1zhq s TYR 111 Ca 0.02 0.77 0.04 0.00 -1.01 0.00 0.00 57.07 56.90 1zhq s TYR 111 Cb -0.13 -2.14 0.00 0.00 -0.11 0.00 0.00 41.96 39.58 1zhq s TYR 111 CO -0.06 0.54 -0.23 0.99 -1.11 0.00 0.00 175.55 175.69 1zhq s THR 112 N -1.35 1.94 0.00 -0.71 2.01 -1.26 -1.95 115.64 114.32 1zhq s THR 112 Ca 0.31 -0.95 0.00 0.00 0.31 0.00 0.00 61.69 61.36 1zhq s THR 112 Cb -0.14 -1.68 0.00 0.00 0.01 0.00 0.00 72.50 70.69 1zhq s THR 112 CO 0.17 0.53 0.00 2.22 -0.69 0.00 0.00 174.62 176.86