#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 1.08 0.24 0.00 1.04 -1.26 -1.03 113.70 113.77 1zhq s SER 2 Ca 0.00 -1.35 -0.18 0.00 0.48 0.00 0.00 55.95 54.90 1zhq s SER 2 Cb 0.00 0.18 0.02 0.00 0.10 0.00 0.00 66.02 66.32 1zhq s SER 2 CO 0.00 -0.72 0.58 -0.72 0.98 0.00 0.00 173.24 173.36 1zhq s TYR 3 N -3.78 -0.03 0.07 5.02 1.13 -0.26 -4.89 117.35 114.60 1zhq s TYR 3 Ca 0.36 -0.35 0.08 0.00 -1.41 0.00 0.00 57.07 55.75 1zhq s TYR 3 Cb 0.07 0.46 -0.03 0.00 -1.10 0.00 0.00 41.96 41.36 1zhq s TYR 3 CO 0.12 -1.05 -0.22 0.15 -2.51 0.00 0.00 175.55 172.04 1zhq s LYS 4 N -3.92 1.37 0.10 -3.49 1.02 -1.26 0.31 119.74 113.86 1zhq s LYS 4 Ca 0.13 -1.06 -0.11 0.00 0.02 0.00 0.00 55.97 54.95 1zhq s LYS 4 Cb -0.03 -1.57 0.01 0.00 -0.52 0.00 0.00 37.83 35.72 1zhq s LYS 4 CO 0.03 0.39 0.24 0.14 -0.92 0.00 0.00 175.35 175.24 1zhq s VAL 5 N -0.93 0.12 0.03 3.17 -7.23 -0.95 -4.98 120.40 109.64 1zhq s VAL 5 Ca 0.08 -1.02 -0.18 0.00 -1.81 0.00 0.00 61.98 59.06 1zhq s VAL 5 Cb -0.09 -1.28 -0.06 0.00 0.56 0.00 0.00 36.38 35.50 1zhq s VAL 5 CO 0.03 -0.56 0.50 0.20 -0.31 0.00 0.00 175.10 174.96 1zhq s ASN 6 N -2.82 6.94 -0.04 4.85 0.01 -1.26 -1.02 114.94 121.59 1zhq s ASN 6 Ca 0.04 1.12 0.06 0.00 -0.71 0.00 0.00 52.86 53.37 1zhq s ASN 6 Cb 0.04 -2.31 -0.01 0.00 0.41 0.00 0.00 41.25 39.37 1zhq s ASN 6 CO -0.11 0.27 -0.24 -0.63 -1.51 0.00 0.00 177.10 174.88 1zhq s ILE 7 N -0.96 1.94 0.57 0.60 1.01 0.17 -4.90 121.20 119.63 1zhq s ILE 7 Ca 0.27 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.69 1zhq s ILE 7 Cb -0.18 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 1zhq s ILE 7 CO 0.16 0.54 1.36 -2.84 0.00 0.00 0.00 174.94 174.16 1zhq s PRO 8 N -0.30 3.02 0.00 2.79 0.02 -1.26 -1.26 135.00 138.00 1zhq s PRO 8 Ca 0.01 2.22 0.00 0.00 0.02 0.00 0.00 61.00 63.26 1zhq s PRO 8 Cb -0.12 -2.18 0.00 0.00 0.02 0.00 0.00 34.50 32.22 1zhq s PRO 8 CO 0.02 -1.28 0.41 0.00 -0.33 0.00 0.00 177.00 175.82 1zhq n ALA 9 N -1.20 0.87 -0.07 -1.55 0.00 -0.24 -4.83 120.51 113.49 1zhq n ALA 9 Ca 0.11 -0.41 0.01 0.00 0.00 0.00 0.00 53.44 53.15 1zhq n ALA 9 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.04 -2.13 3.74 0.00 0.00 -1.24 -4.77 105.19 100.75 1zhq n GLY 10 Ca 0.00 -1.46 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.48 4.50 -0.22 1.61 0.04 -1.21 -0.70 135.00 138.53 1zhq s PRO 11 Ca 0.00 1.85 -0.02 0.00 0.04 0.00 0.00 61.00 62.87 1zhq s PRO 11 Cb 0.00 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.30 1zhq s PRO 11 CO 0.00 -0.07 -0.09 -0.51 0.04 0.00 0.00 177.00 176.37 1zhq s LEU 12 N -0.20 2.83 0.31 -3.56 1.43 -1.26 -4.86 118.68 113.37 1zhq s LEU 12 Ca 0.53 -0.64 0.24 0.00 -1.03 0.00 0.00 54.13 53.23 1zhq s LEU 12 Cb -0.32 -1.65 0.45 0.00 0.03 0.00 0.00 46.19 44.70 1zhq s LEU 12 CO 0.36 -0.06 1.57 -0.50 0.23 0.00 0.00 176.35 177.96 1zhq h TRP 13 N 8.03 0.00 -3.00 0.29 4.06 -1.96 -3.48 115.95 119.90 1zhq h TRP 13 Ca -0.39 0.00 0.05 0.00 2.06 0.00 0.00 58.89 60.61 1zhq h TRP 13 Cb 1.13 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.23 1zhq h TRP 13 CO 0.56 0.00 0.23 -1.54 -3.56 0.00 0.00 178.44 174.12 1zhq s SER 14 N -5.41 -0.32 0.24 -3.49 1.04 -1.26 -5.03 113.70 99.47 1zhq s SER 14 Ca 0.07 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 55.98 1zhq s SER 14 Cb 0.09 0.70 0.27 0.00 0.10 0.00 0.00 66.02 67.18 1zhq s SER 14 CO 0.66 -1.28 1.71 -1.13 0.98 0.00 0.00 173.24 174.18 1zhq h ASN 15 N 2.00 0.78 -0.78 7.02 -0.73 -1.99 -1.45 115.58 120.44 1zhq h ASN 15 Ca -0.22 -0.22 0.04 0.00 1.87 0.00 0.00 56.30 57.76 1zhq h ASN 15 Cb 1.26 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 39.60 1zhq h ASN 15 CO 0.26 0.90 0.51 0.00 -0.37 0.00 0.00 177.43 178.73 1zhq h ALA 16 N 1.18 1.54 -0.11 1.57 0.00 -1.99 0.11 119.26 121.55 1zhq h ALA 16 Ca 0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 1zhq h ALA 16 Cb 0.56 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1zhq h ALA 16 CO 0.03 0.38 -0.84 1.49 0.00 0.00 0.00 179.25 180.31 1zhq h GLU 17 N 0.95 0.75 -0.55 0.00 4.81 -1.85 -3.10 114.58 115.59 1zhq h GLU 17 Ca 0.31 -0.66 -0.03 0.00 -0.13 0.00 0.00 59.36 58.85 1zhq h GLU 17 Cb 0.05 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1zhq h GLU 17 CO -0.09 1.26 0.22 0.00 -0.73 0.00 0.00 179.01 179.66 1zhq h ALA 18 N 0.54 1.34 0.00 2.92 0.00 -0.47 0.17 119.26 123.77 1zhq h ALA 18 Ca -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1zhq h ALA 18 Cb 1.47 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1zhq h ALA 18 CO 0.17 0.49 -0.11 1.96 0.00 0.00 0.00 179.25 181.76 1zhq h GLN 19 N 0.79 0.00 0.17 0.00 1.08 -0.81 0.34 115.11 116.69 1zhq h GLN 19 Ca 0.19 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 57.04 1zhq h GLN 19 Cb 0.16 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1zhq h GLN 19 CO -0.02 0.11 -1.75 1.96 -0.95 0.00 0.00 178.83 178.18 1zhq h GLN 20 N 0.00 0.37 0.22 1.46 4.20 -1.25 -3.41 115.11 116.70 1zhq h GLN 20 Ca -0.00 -0.63 -0.34 0.00 0.06 0.00 0.00 58.65 57.74 1zhq h GLN 20 Cb 0.65 0.23 0.02 0.00 0.30 0.00 0.00 27.48 28.69 1zhq h GLN 20 CO 0.01 1.28 -1.62 0.28 -0.67 0.00 0.00 178.83 178.12 1zhq h VAL 21 N 0.10 1.09 -0.74 -0.54 2.07 -0.86 -3.38 116.25 113.98 1zhq h VAL 21 Ca -0.34 -2.59 0.16 0.00 0.82 0.00 0.00 66.70 64.75 1zhq h VAL 21 Cb 2.09 2.89 -0.13 0.00 -1.52 0.00 0.00 31.29 34.62 1zhq h VAL 21 CO 0.17 0.83 -0.07 1.23 0.02 0.00 0.00 177.57 179.75 1zhq h GLY 22 N 0.41 0.71 1.91 2.17 0.00 -0.53 -0.31 103.07 107.42 1zhq h GLY 22 Ca -0.31 0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1zhq h GLY 22 CO 0.22 -0.28 -0.02 -2.55 0.00 0.00 0.00 176.54 173.90 1zhq h PRO 23 N 0.06 0.12 -0.03 4.80 0.11 -1.78 -0.64 132.00 134.63 1zhq h PRO 23 Ca 0.38 -0.01 -0.25 0.00 0.11 0.00 0.00 66.00 66.23 1zhq h PRO 23 Cb 0.65 -0.02 0.02 0.00 0.11 0.00 0.00 31.00 31.75 1zhq h PRO 23 CO -0.70 0.16 -0.98 0.87 -0.21 0.00 0.00 178.00 177.14 1zhq h LYS 24 N 0.12 0.67 -0.38 1.05 1.79 -1.28 -0.89 116.57 117.65 1zhq h LYS 24 Ca 0.03 -0.69 -0.06 0.00 -2.18 0.00 0.00 60.65 57.75 1zhq h LYS 24 Cb 0.13 0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1zhq h LYS 24 CO 0.00 1.28 -0.00 0.82 -1.08 0.00 0.00 179.45 180.47 1zhq h ILE 25 N 0.39 1.26 -0.50 1.86 1.08 -0.96 -2.14 117.51 118.51 1zhq h ILE 25 Ca -0.11 -1.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.36 1zhq h ILE 25 Cb 1.63 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 36.52 1zhq h ILE 25 CO 0.19 0.34 0.32 0.00 -0.69 0.00 0.00 178.15 178.31 1zhq h ALA 26 N 0.87 0.63 -0.97 1.87 0.00 -1.10 -2.49 119.26 118.07 1zhq h ALA 26 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1zhq h ALA 26 Cb 0.47 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1zhq h ALA 26 CO 0.02 0.09 0.62 0.00 0.00 0.00 0.00 179.25 179.98 1zhq h ALA 27 N 1.17 1.24 0.00 0.00 0.00 -1.03 0.14 119.26 120.78 1zhq h ALA 27 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1zhq h ALA 27 Cb -0.06 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.33 1zhq h ALA 27 CO -0.04 0.66 -0.02 0.00 0.00 0.00 0.00 179.25 179.84 1zhq h ALA 28 N 1.34 1.05 -0.32 0.00 0.00 -0.95 -2.26 119.26 118.12 1zhq h ALA 28 Ca 0.35 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 1zhq h ALA 28 Cb -0.11 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1zhq h ALA 28 CO -0.07 0.03 0.00 0.72 0.00 0.00 0.00 179.25 179.93 1zhq n HIS 29 N -3.18 1.07 -3.80 0.00 8.25 -0.41 -4.96 115.22 112.18 1zhq n HIS 29 Ca -0.01 -1.15 -0.29 0.00 -0.26 0.00 0.00 57.72 56.01 1zhq n HIS 29 Cb 0.21 -0.40 0.03 0.00 1.12 0.00 0.00 29.99 30.96 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 -0.75 -5.82 -1.99 -0.41 6.02 -0.83 -4.96 117.38 108.64 1zhq n GLN 30 Ca 0.27 0.64 0.00 0.00 -0.01 0.00 0.00 57.00 57.90 1zhq n GLN 30 Cb 0.97 -5.56 0.00 0.00 1.02 0.00 0.00 30.24 26.67 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 -1.72 4.09 3.09 1.08 0.00 0.35 -4.49 105.19 107.59 1zhq n GLY 31 Ca 0.03 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.99 2.60 0.18 1.61 0.01 -0.47 -3.90 114.94 113.99 1zhq s ASN 32 Ca 0.00 -0.47 -0.31 0.00 -0.71 0.00 0.00 52.86 51.37 1zhq s ASN 32 Cb 0.00 -1.18 -0.10 0.00 0.41 0.00 0.00 41.25 40.39 1zhq s ASN 32 CO 0.00 0.04 1.50 0.12 -1.51 0.00 0.00 177.10 177.24 1zhq s PHE 33 N 0.90 3.09 -1.20 2.20 5.36 -1.26 -1.00 117.98 126.06 1zhq s PHE 33 Ca -0.08 0.80 0.26 0.00 -0.96 0.00 0.00 56.93 56.96 1zhq s PHE 33 Cb -0.15 -3.85 0.75 0.00 -0.34 0.00 0.00 43.02 39.43 1zhq s PHE 33 CO -0.01 -3.00 1.57 0.25 -1.46 0.00 0.00 175.22 172.58 1zhq n THR 34 N 3.52 0.00 0.00 0.12 -2.24 -0.67 -4.92 114.28 110.08 1zhq n THR 34 Ca 0.11 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1zhq n THR 34 Cb 0.40 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 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 1.45 2.42 3.81 3.38 0.00 -1.26 -5.05 105.19 109.93 1zhq n GLY 35 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 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 4.25 0.16 1.61 -0.21 -1.26 -4.98 119.66 118.43 1zhq s GLN 36 Ca 0.00 0.82 -0.21 0.00 0.02 0.00 0.00 55.36 55.99 1zhq s GLN 36 Cb 0.00 -3.10 0.06 0.00 1.00 0.00 0.00 33.01 30.97 1zhq s GLN 36 CO 0.00 0.54 0.56 1.67 -2.12 0.00 0.00 175.29 175.94 1zhq s TRP 37 N -1.28 -0.45 -0.04 0.91 1.48 -1.26 -0.71 118.94 117.59 1zhq s TRP 37 Ca 0.35 0.21 -0.07 0.00 -1.06 0.00 0.00 56.10 55.54 1zhq s TRP 37 Cb -0.19 0.50 0.01 0.00 -1.16 0.00 0.00 33.47 32.63 1zhq s TRP 37 CO 0.21 -0.83 0.16 0.99 -4.06 0.00 0.00 176.95 173.42 1zhq s THR 38 N -3.77 0.03 -0.26 0.66 2.01 -0.11 -5.00 115.64 109.21 1zhq s THR 38 Ca 0.02 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 61.61 1zhq s THR 38 Cb -0.01 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 1zhq s THR 38 CO -0.12 -0.15 0.34 -0.89 -0.69 0.00 0.00 174.62 173.11 1zhq s THR 39 N -0.49 5.21 -0.09 -0.82 2.01 -1.26 0.25 115.64 120.45 1zhq s THR 39 Ca -0.06 0.51 0.21 0.00 0.31 0.00 0.00 61.69 62.67 1zhq s THR 39 Cb -0.04 -3.67 -0.27 0.00 0.01 0.00 0.00 72.50 68.53 1zhq s THR 39 CO 0.01 0.20 0.49 1.33 -0.69 0.00 0.00 174.62 175.96 1zhq n VAL 40 N 4.93 0.38 -3.70 3.82 0.24 0.08 -4.79 118.33 119.29 1zhq n VAL 40 Ca -0.10 -0.58 -0.26 0.00 -2.04 0.00 0.00 64.34 61.36 1zhq n VAL 40 Cb 0.51 -0.16 -0.17 0.00 -1.47 0.00 0.00 33.84 32.55 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 -3.29 0.32 -0.06 3.34 1.01 -0.68 -4.98 120.40 116.06 1zhq s VAL 41 Ca -0.07 -0.35 -0.39 0.00 0.00 0.00 0.00 61.98 61.17 1zhq s VAL 41 Cb 0.12 -0.83 -0.17 0.00 0.00 0.00 0.00 36.38 35.50 1zhq s VAL 41 CO 0.88 -0.17 1.44 1.21 0.00 0.00 0.00 175.10 178.46 1zhq n GLU 42 N 5.13 0.95 -1.55 2.72 2.13 -1.26 -1.04 120.64 127.72 1zhq n GLU 42 Ca -0.08 0.34 -0.19 0.00 0.66 0.00 0.00 57.16 57.90 1zhq n GLU 42 Cb 0.48 -1.97 -0.08 0.00 0.27 0.00 0.00 31.44 30.14 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 3.30 -5.53 0.00 4.31 7.64 -1.26 -4.69 113.62 117.38 1zhq n SER 43 Ca 0.22 0.47 0.00 0.00 1.01 0.00 0.00 58.87 60.56 1zhq n SER 43 Cb 0.15 -4.69 0.00 0.00 -1.01 0.00 0.00 64.21 58.65 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 1.35 0.95 -3.56 -0.43 0.00 -0.21 -4.93 120.51 113.69 1zhq n ALA 44 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 1zhq n ALA 44 Cb 0.66 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.00 0.48 0.12 0.00 -2.45 -0.31 -3.33 119.30 112.81 1zhq s MET 45 Ca 0.00 0.77 0.05 0.00 -1.25 0.00 0.00 55.69 55.26 1zhq s MET 45 Cb 0.00 0.10 -0.04 0.00 1.25 0.00 0.00 34.83 36.14 1zhq s MET 45 CO 0.00 -0.12 -0.12 -1.12 1.05 0.00 0.00 175.02 174.71 1zhq s SER 46 N 0.96 1.77 0.05 1.11 0.01 0.12 -0.74 113.70 116.99 1zhq s SER 46 Ca -0.06 -0.88 0.05 0.00 1.31 0.00 0.00 55.95 56.37 1zhq s SER 46 Cb -0.06 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.12 1zhq s SER 46 CO -0.08 -0.24 -0.14 0.68 0.41 0.00 0.00 173.24 173.86 1zhq s VAL 47 N -2.63 1.13 0.01 3.43 -7.23 0.14 -1.08 120.40 114.18 1zhq s VAL 47 Ca 0.11 -1.15 0.07 0.00 -1.81 0.00 0.00 61.98 59.20 1zhq s VAL 47 Cb -0.02 -1.05 -0.03 0.00 0.56 0.00 0.00 36.38 35.84 1zhq s VAL 47 CO 0.01 -0.09 -0.21 0.68 -0.31 0.00 0.00 175.10 175.18 1zhq s VAL 48 N -1.04 2.51 -0.10 1.32 -7.23 -0.39 -0.93 120.40 114.55 1zhq s VAL 48 Ca 0.00 -1.12 -0.26 0.00 -1.81 0.00 0.00 61.98 58.79 1zhq s VAL 48 Cb -0.09 -1.98 -0.02 0.00 0.56 0.00 0.00 36.38 34.84 1zhq s VAL 48 CO 0.02 0.46 0.83 -0.70 -0.31 0.00 0.00 175.10 175.39 1zhq s GLU 49 N -1.04 4.40 -0.06 4.82 2.12 0.11 -0.66 118.70 128.39 1zhq s GLU 49 Ca 0.12 1.07 0.04 0.00 0.36 0.00 0.00 54.97 56.56 1zhq s GLU 49 Cb -0.10 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1zhq s GLU 49 CO 0.02 -0.14 -0.18 0.08 -0.54 0.00 0.00 175.26 174.50 1zhq s VAL 50 N 1.47 1.55 -0.21 3.70 1.01 -0.19 -1.68 120.40 126.06 1zhq s VAL 50 Ca 0.41 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.43 1zhq s VAL 50 Cb -0.18 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1zhq s VAL 50 CO 0.18 0.44 0.61 -0.70 0.00 0.00 0.00 175.10 175.63 1zhq s GLU 51 N 0.22 4.19 0.26 2.72 2.12 -0.17 -2.23 118.70 125.81 1zhq s GLU 51 Ca -0.09 0.57 0.10 0.00 0.36 0.00 0.00 54.97 55.91 1zhq s GLU 51 Cb -0.14 -3.59 -0.04 0.00 0.26 0.00 0.00 34.13 30.62 1zhq s GLU 51 CO 0.04 -0.25 -0.02 -0.51 -0.54 0.00 0.00 175.26 173.98 1zhq s LEU 52 N 1.96 3.15 0.02 2.70 1.43 0.15 -1.36 118.68 126.72 1zhq s LEU 52 Ca 0.28 -0.65 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 1zhq s LEU 52 Cb -0.16 -1.68 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 1zhq s LEU 52 CO 0.10 0.01 0.43 -1.10 0.23 0.00 0.00 176.35 176.03 1zhq s GLN 53 N -3.58 3.94 0.23 1.70 -1.52 -1.26 -1.10 119.66 118.07 1zhq s GLN 53 Ca 0.31 0.43 -0.08 0.00 -1.95 0.00 0.00 55.36 54.07 1zhq s GLN 53 Cb -0.07 -3.19 0.22 0.00 -0.22 0.00 0.00 33.01 29.75 1zhq s GLN 53 CO 0.19 0.66 1.90 0.28 -0.25 0.00 0.00 175.29 178.08 1zhq h VAL 54 N 3.56 1.21 -3.32 1.09 2.07 -1.43 -3.40 116.25 116.03 1zhq h VAL 54 Ca -0.51 -0.40 -0.52 0.00 0.82 0.00 0.00 66.70 66.09 1zhq h VAL 54 Cb 1.22 -0.06 -0.35 0.00 -1.52 0.00 0.00 31.29 30.57 1zhq h VAL 54 CO 0.62 0.21 -0.81 -0.70 0.02 0.00 0.00 177.57 176.92 1zhq s GLU 55 N -6.12 1.63 -0.12 1.57 2.12 -1.26 -5.09 118.70 111.43 1zhq s GLU 55 Ca -0.13 -0.35 -0.22 0.00 0.36 0.00 0.00 54.97 54.63 1zhq s GLU 55 Cb 0.17 -1.48 -0.03 0.00 0.26 0.00 0.00 34.13 33.04 1zhq s GLU 55 CO 0.80 -0.10 0.66 -0.80 -0.54 0.00 0.00 175.26 175.29 1zhq s ASN 56 N 1.09 6.86 0.35 -1.70 0.01 -1.26 -5.00 114.94 115.30 1zhq s ASN 56 Ca -0.06 1.04 0.08 0.00 -0.71 0.00 0.00 52.86 53.21 1zhq s ASN 56 Cb -0.14 -2.38 -0.07 0.00 0.41 0.00 0.00 41.25 39.07 1zhq s ASN 56 CO -0.01 -0.17 -0.06 0.42 -1.51 0.00 0.00 177.10 175.76 1zhq s THR 57 N 1.21 2.09 0.00 1.60 -4.23 -1.26 -4.75 115.64 110.29 1zhq s THR 57 Ca 0.34 -2.15 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 1zhq s THR 57 Cb -0.17 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 70.97 1zhq s THR 57 CO 0.14 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 1zhq n GLY 58 N -0.80 0.31 0.77 3.99 0.00 -1.26 -4.21 105.19 103.98 1zhq n GLY 58 Ca -0.05 -1.37 0.10 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.19 0.00 -4.24 -0.61 -5.35 -1.01 -4.70 119.36 102.27 1zhq n ILE 59 Ca 0.00 -0.50 -0.25 0.00 -0.27 0.00 0.00 62.75 61.73 1zhq n ILE 59 Cb 0.00 1.40 -0.08 0.00 -1.74 0.00 0.00 39.64 39.22 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 -1.61 2.78 0.03 4.28 0.09 -0.25 -4.99 115.29 115.62 1zhq s HIS 60 Ca 0.23 -0.17 -0.07 0.00 -0.00 0.00 0.00 55.06 55.04 1zhq s HIS 60 Cb 0.16 -1.31 -0.00 0.00 -0.00 0.00 0.00 32.58 31.42 1zhq s HIS 60 CO 0.24 0.55 0.14 -1.83 -0.00 0.00 0.00 174.74 173.84 1zhq s GLU 61 N -3.17 0.61 -0.09 1.40 4.04 -1.26 -1.03 118.70 119.20 1zhq s GLU 61 Ca 0.28 -0.63 -0.04 0.00 0.04 0.00 0.00 54.97 54.63 1zhq s GLU 61 Cb -0.08 0.25 0.05 0.00 0.02 0.00 0.00 34.13 34.36 1zhq s GLU 61 CO 0.19 -0.16 0.18 0.12 -1.84 0.00 0.00 175.26 173.74 1zhq s PHE 62 N -2.32 -0.22 -0.12 4.83 5.36 -0.46 -4.95 117.98 120.10 1zhq s PHE 62 Ca -0.07 0.63 -0.05 0.00 -0.96 0.00 0.00 56.93 56.47 1zhq s PHE 62 Cb -0.03 -0.14 -0.04 0.00 -0.34 0.00 0.00 43.02 42.48 1zhq s PHE 62 CO -0.03 -0.24 0.08 0.15 -1.46 0.00 0.00 175.22 173.72 1zhq s LYS 63 N 1.82 3.40 0.24 10.12 1.02 -1.26 -0.62 119.74 134.45 1zhq s LYS 63 Ca -0.03 -0.26 -0.19 0.00 0.02 0.00 0.00 55.97 55.51 1zhq s LYS 63 Cb -0.12 -3.06 0.03 0.00 -0.52 0.00 0.00 37.83 34.15 1zhq s LYS 63 CO -0.06 0.65 0.62 -0.08 -0.92 0.00 0.00 175.35 175.56 1zhq s THR 64 N -0.70 0.01 -0.10 2.17 -1.32 -0.77 -4.98 115.64 109.94 1zhq s THR 64 Ca 0.12 -0.86 -0.05 0.00 -1.21 0.00 0.00 61.69 59.69 1zhq s THR 64 Cb -0.12 -1.78 -0.04 0.00 -1.51 0.00 0.00 72.50 69.05 1zhq s THR 64 CO 0.03 -0.03 0.08 -1.81 -2.21 0.00 0.00 174.62 170.67 1zhq s ASP 65 N -2.90 5.85 0.13 8.08 1.01 -1.26 -0.35 116.67 127.23 1zhq s ASP 65 Ca 0.11 0.32 0.01 0.00 0.71 0.00 0.00 52.55 53.70 1zhq s ASP 65 Cb -0.03 -1.79 -0.04 0.00 1.01 0.00 0.00 42.92 42.06 1zhq s ASP 65 CO 0.02 0.39 -0.02 0.68 0.21 0.00 0.00 175.17 176.45 1zhq s VAL 66 N -0.95 0.62 0.42 -1.27 -7.23 -0.60 -4.96 120.40 106.43 1zhq s VAL 66 Ca 0.14 -1.95 -0.26 0.00 -1.81 0.00 0.00 61.98 58.10 1zhq s VAL 66 Cb -0.12 -1.90 -0.09 0.00 0.56 0.00 0.00 36.38 34.83 1zhq s VAL 66 CO 0.03 -0.67 1.45 -0.76 -0.31 0.00 0.00 175.10 174.84 1zhq s LEU 67 N -3.10 4.19 0.00 1.32 1.43 -1.26 -1.71 118.68 119.55 1zhq s LEU 67 Ca 0.18 2.96 0.00 0.00 -1.03 0.00 0.00 54.13 56.24 1zhq s LEU 67 Cb 0.06 -3.83 0.00 0.00 0.03 0.00 0.00 46.19 42.44 1zhq s LEU 67 CO -0.01 -1.06 0.58 0.00 0.23 0.00 0.00 176.35 176.10 1zhq n ALA 68 N 0.06 1.50 -0.19 4.21 0.00 -0.38 -4.73 120.51 120.98 1zhq n ALA 68 Ca 0.03 -0.58 0.03 0.00 0.00 0.00 0.00 53.44 52.92 1zhq n ALA 68 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 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 -0.17 -1.49 3.74 0.00 0.00 -1.24 -4.78 105.19 101.25 1zhq n GLY 69 Ca 0.00 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.36 4.47 -0.11 1.61 0.04 -1.24 -1.76 135.00 136.65 1zhq s PRO 70 Ca 0.00 1.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1zhq s PRO 70 Cb 0.00 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 31.34 1zhq s PRO 70 CO 0.00 -0.11 -0.06 -0.51 0.04 0.00 0.00 177.00 176.37 1zhq s LEU 71 N -0.33 1.12 0.10 -3.56 1.43 -1.26 -4.89 118.68 111.29 1zhq s LEU 71 Ca 0.53 -0.31 0.25 0.00 -1.03 0.00 0.00 54.13 53.56 1zhq s LEU 71 Cb -0.34 -0.77 0.43 0.00 0.03 0.00 0.00 46.19 45.54 1zhq s LEU 71 CO 0.38 -0.14 1.38 0.79 0.23 0.00 0.00 176.35 178.99 1zhq n TRP 72 N 4.97 0.47 -3.55 0.29 7.02 -1.26 -4.83 117.44 120.56 1zhq n TRP 72 Ca -0.11 0.14 -0.11 0.00 -1.02 0.00 0.00 57.50 56.40 1zhq n TRP 72 Cb 0.50 -0.60 -0.02 0.00 -2.42 0.00 0.00 31.31 28.76 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 -4.01 -0.46 0.21 -0.99 1.04 -1.26 -5.02 113.70 103.21 1zhq s SER 73 Ca 0.07 -0.18 -0.10 0.00 0.48 0.00 0.00 55.95 56.22 1zhq s SER 73 Cb 0.14 0.62 0.15 0.00 0.10 0.00 0.00 66.02 67.03 1zhq s SER 73 CO 0.70 -1.04 1.86 -1.13 0.98 0.00 0.00 173.24 174.61 1zhq h ASN 74 N 2.04 0.89 -0.68 7.02 -0.00 -1.98 -0.37 115.58 122.49 1zhq h ASN 74 Ca -0.31 -0.05 0.06 0.00 -0.00 0.00 0.00 56.30 56.01 1zhq h ASN 74 Cb 1.29 -0.22 -0.06 0.00 -0.00 0.00 0.00 38.32 39.33 1zhq h ASN 74 CO 0.36 0.67 0.37 0.44 -0.00 0.00 0.00 177.43 179.27 1zhq h ASP 75 N 1.02 0.55 -0.43 1.15 3.32 -1.98 0.53 116.42 120.58 1zhq h ASP 75 Ca 0.27 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.26 1zhq h ASP 75 Cb -0.07 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1zhq h ASP 75 CO -0.05 0.35 -0.10 -0.08 -1.72 0.00 0.00 179.24 177.64 1zhq h GLU 76 N 0.68 0.83 -0.73 3.56 4.81 -1.83 -2.24 114.58 119.66 1zhq h GLU 76 Ca 0.31 -0.31 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1zhq h GLU 76 Cb 0.21 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 1zhq h GLU 76 CO -0.19 0.94 0.24 0.00 -0.73 0.00 0.00 179.01 179.27 1zhq h ALA 77 N 0.86 1.04 0.00 2.92 0.00 -0.18 -0.76 119.26 123.16 1zhq h ALA 77 Ca 0.11 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1zhq h ALA 77 Cb 0.63 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1zhq h ALA 77 CO 0.04 0.65 -0.41 1.96 0.00 0.00 0.00 179.25 181.49 1zhq h GLN 78 N 1.08 0.00 0.13 0.00 1.08 0.14 0.32 115.11 117.86 1zhq h GLN 78 Ca 0.24 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.22 1zhq h GLN 78 Cb 0.28 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.73 1zhq h GLN 78 CO -0.01 0.41 -0.93 -0.22 -0.95 0.00 0.00 178.83 177.13 1zhq h LYS 79 N 0.00 0.41 0.00 1.46 3.64 -0.93 -3.38 116.57 117.77 1zhq h LYS 79 Ca -0.00 -0.61 -0.09 0.00 -1.27 0.00 0.00 60.65 58.68 1zhq h LYS 79 Cb 0.83 0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 1zhq h LYS 79 CO 0.05 1.27 -1.22 1.28 -2.27 0.00 0.00 179.45 178.56 1zhq n LEU 80 N -4.04 0.86 -0.26 5.20 4.77 -0.33 -4.50 117.00 118.69 1zhq n LEU 80 Ca -0.14 0.36 -0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1zhq n LEU 80 Cb 0.86 0.01 0.07 0.00 -2.33 0.00 0.00 43.42 42.03 1zhq n LEU 80 CO 0.51 -0.01 0.68 1.23 -1.33 0.00 0.00 177.39 178.47 1zhq h GLY 81 N 3.85 0.35 0.61 -0.72 0.00 -1.10 -1.07 103.07 104.99 1zhq h GLY 81 Ca -0.09 0.32 0.06 0.00 0.00 0.00 0.00 47.33 47.63 1zhq h GLY 81 CO 0.02 -0.26 0.22 -2.55 0.00 0.00 0.00 176.54 173.97 1zhq h PRO 82 N -0.04 0.42 -0.14 4.80 0.11 -1.81 0.95 132.00 136.28 1zhq h PRO 82 Ca 0.33 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.25 1zhq h PRO 82 Cb 0.56 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1zhq h PRO 82 CO -0.78 0.28 -0.60 1.96 -0.21 0.00 0.00 178.00 178.65 1zhq h GLN 83 N 0.43 0.48 -0.67 1.05 4.20 -1.71 -0.06 115.11 118.85 1zhq h GLN 83 Ca 0.24 -0.33 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 1zhq h GLN 83 Cb 0.21 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1zhq h GLN 83 CO -0.21 0.94 0.18 0.82 -0.67 0.00 0.00 178.83 179.89 1zhq h ILE 84 N 0.36 1.26 -0.58 2.54 2.04 -0.78 -1.84 117.51 120.51 1zhq h ILE 84 Ca -0.00 -0.92 -0.07 0.00 1.00 0.00 0.00 64.86 64.87 1zhq h ILE 84 Cb 1.14 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1zhq h ILE 84 CO 0.11 0.35 0.10 0.00 0.00 0.00 0.00 178.15 178.71 1zhq h ALA 85 N 1.07 0.77 -0.74 1.87 0.00 -0.61 -2.25 119.26 119.38 1zhq h ALA 85 Ca 0.21 -0.25 0.10 0.00 0.00 0.00 0.00 54.91 54.97 1zhq h ALA 85 Cb 0.34 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1zhq h ALA 85 CO -0.00 0.51 0.49 0.00 0.00 0.00 0.00 179.25 180.25 1zhq h ALA 86 N 1.01 1.84 0.00 0.00 0.00 -0.58 0.17 119.26 121.70 1zhq h ALA 86 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1zhq h ALA 86 Cb 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1zhq h ALA 86 CO 0.01 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 1zhq n SER 87 N -4.49 0.61 -0.95 0.00 3.41 -0.73 -0.91 113.62 110.55 1zhq n SER 87 Ca 0.12 0.69 0.09 0.00 -0.26 0.00 0.00 58.87 59.52 1zhq n SER 87 Cb 0.34 -0.80 0.19 0.00 -0.26 0.00 0.00 64.21 63.68 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 -2.22 0.50 -2.42 7.33 4.02 0.53 -4.96 117.16 119.94 1zhq n TYR 88 Ca 0.01 -0.33 -0.12 0.00 -0.01 0.00 0.00 57.90 57.45 1zhq n TYR 88 Cb 0.16 -0.01 0.01 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 1.14 -0.05 2.81 2.72 0.00 -0.09 -5.01 105.19 106.71 1zhq n GLY 89 Ca 0.16 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 1zhq n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zhq n ALA 90 N -2.09 0.63 -2.71 4.61 0.00 -0.78 -4.83 120.51 115.34 1zhq n ALA 90 Ca -0.11 -1.71 -0.29 0.00 0.00 0.00 0.00 53.44 51.34 1zhq n ALA 90 Cb 0.59 1.38 -0.07 0.00 0.00 0.00 0.00 19.45 21.35 1zhq n ALA 90 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1zhq s GLU 91 N -3.19 2.60 -0.18 0.00 2.02 -0.75 -2.92 118.70 116.29 1zhq s GLU 91 Ca 0.35 -0.90 -0.19 0.00 0.02 0.00 0.00 54.97 54.24 1zhq s GLU 91 Cb 0.02 -2.53 -0.03 0.00 0.10 0.00 0.00 34.13 31.69 1zhq s GLU 91 CO 0.25 0.51 0.56 0.12 0.02 0.00 0.00 175.26 176.72 1zhq s PHE 92 N -1.50 3.40 -0.21 1.61 5.36 -1.26 -0.07 117.98 125.31 1zhq s PHE 92 Ca 0.27 0.87 0.17 0.00 -0.96 0.00 0.00 56.93 57.29 1zhq s PHE 92 Cb -0.11 -2.71 0.18 0.00 -0.34 0.00 0.00 43.02 40.05 1zhq s PHE 92 CO 0.20 -0.08 1.51 1.79 -1.46 0.00 0.00 175.22 177.17 1zhq h THR 93 N 5.07 0.63 0.00 0.12 1.35 -1.77 -3.48 112.91 114.84 1zhq h THR 93 Ca -0.34 -1.86 0.00 0.00 -0.55 0.00 0.00 66.41 63.66 1zhq h THR 93 Cb 1.16 2.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.86 1zhq h THR 93 CO 0.75 0.36 0.00 0.61 -0.25 0.00 0.00 175.52 176.99 1zhq n GLY 94 N 1.13 2.08 3.83 5.82 0.00 -1.26 -5.09 105.19 111.70 1zhq n GLY 94 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.30 4.00 0.05 1.61 -1.52 -1.26 -4.97 119.66 117.27 1zhq s GLN 95 Ca 0.00 0.51 -0.27 0.00 -1.95 0.00 0.00 55.36 53.64 1zhq s GLN 95 Cb 0.00 -3.11 0.09 0.00 -0.22 0.00 0.00 33.01 29.77 1zhq s GLN 95 CO 0.00 0.59 0.95 1.67 -0.25 0.00 0.00 175.29 178.25 1zhq s TRP 96 N -1.25 -0.23 -0.05 0.91 1.48 -1.26 -0.77 118.94 117.77 1zhq s TRP 96 Ca 0.31 0.03 -0.29 0.00 -1.06 0.00 0.00 56.10 55.09 1zhq s TRP 96 Cb -0.17 0.58 0.09 0.00 -1.16 0.00 0.00 33.47 32.82 1zhq s TRP 96 CO 0.17 -0.64 0.80 -0.98 -4.06 0.00 0.00 176.95 172.25 1zhq s ARG 97 N -3.13 0.91 0.05 3.25 1.70 -0.46 -5.00 118.95 116.27 1zhq s ARG 97 Ca 0.09 0.02 -0.28 0.00 -0.47 0.00 0.00 55.73 55.09 1zhq s ARG 97 Cb -0.01 0.42 -0.05 0.00 -0.57 0.00 0.00 34.95 34.75 1zhq s ARG 97 CO -0.04 -0.32 0.88 0.99 -1.08 0.00 0.00 175.30 175.72 1zhq s THR 98 N -1.87 4.70 -0.03 4.99 2.01 -1.26 -0.20 115.64 123.98 1zhq s THR 98 Ca -0.04 1.87 0.17 0.00 0.31 0.00 0.00 61.69 64.00 1zhq s THR 98 Cb -0.00 -4.23 -0.26 0.00 0.01 0.00 0.00 72.50 68.02 1zhq s THR 98 CO 0.01 0.29 0.36 2.30 -0.69 0.00 0.00 174.62 176.89 1zhq n ILE 99 N 3.11 0.04 -3.59 1.82 -5.35 0.47 -4.85 119.36 111.01 1zhq n ILE 99 Ca 0.01 -0.39 -0.25 0.00 -0.27 0.00 0.00 62.75 61.85 1zhq n ILE 99 Cb 0.50 0.09 -0.16 0.00 -1.74 0.00 0.00 39.64 38.33 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 -3.14 -0.12 0.11 7.28 1.01 -0.75 -4.99 120.40 119.80 1zhq s VAL 100 Ca -0.06 -0.19 -0.35 0.00 0.00 0.00 0.00 61.98 61.38 1zhq s VAL 100 Cb 0.11 -0.61 -0.17 0.00 0.00 0.00 0.00 36.38 35.71 1zhq s VAL 100 CO 0.70 -0.30 1.18 -0.62 0.00 0.00 0.00 175.10 176.06 1zhq n GLU 101 N 5.28 0.89 -0.87 2.72 1.02 -1.26 -0.64 120.64 127.78 1zhq n GLU 101 Ca -0.07 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1zhq n GLU 101 Cb 0.49 -1.85 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 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 2.12 0.21 1.44 0.62 0.00 -1.26 -4.73 105.19 103.59 1zhq n GLY 102 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.19 0.41 -3.83 1.61 0.31 0.19 -5.03 118.33 109.79 1zhq n VAL 103 Ca 0.00 0.14 -0.12 0.00 -0.01 0.00 0.00 64.34 64.35 1zhq n VAL 103 Cb 0.22 -1.11 -0.10 0.00 -0.91 0.00 0.00 33.84 31.93 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 -2.00 0.42 0.31 5.55 -2.45 -0.65 -3.65 119.30 116.82 1zhq s MET 104 Ca 0.00 -0.12 0.03 0.00 -1.25 0.00 0.00 55.69 54.35 1zhq s MET 104 Cb 0.00 0.18 -0.05 0.00 1.25 0.00 0.00 34.83 36.22 1zhq s MET 104 CO 0.00 -0.09 0.10 -1.54 1.05 0.00 0.00 175.02 174.54 1zhq s SER 105 N -0.83 1.81 0.04 1.11 1.04 -0.72 -0.40 113.70 115.76 1zhq s SER 105 Ca -0.09 -1.45 0.02 0.00 0.48 0.00 0.00 55.95 54.91 1zhq s SER 105 Cb -0.05 0.17 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 1zhq s SER 105 CO 0.01 -0.75 -0.07 0.68 0.98 0.00 0.00 173.24 174.10 1zhq s VAL 106 N -3.52 0.51 0.17 5.02 -7.23 0.72 -1.25 120.40 114.83 1zhq s VAL 106 Ca 0.35 -1.13 0.10 0.00 -1.81 0.00 0.00 61.98 59.50 1zhq s VAL 106 Cb 0.07 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 36.31 1zhq s VAL 106 CO 0.15 -0.43 -0.20 0.27 -0.31 0.00 0.00 175.10 174.58 1zhq s ILE 107 N -1.55 2.61 -0.18 -0.62 -4.36 -0.70 -1.36 121.20 115.04 1zhq s ILE 107 Ca -0.09 -1.85 -0.18 0.00 -0.26 0.00 0.00 60.65 58.27 1zhq s ILE 107 Cb -0.09 -2.25 -0.04 0.00 1.25 0.00 0.00 42.46 41.34 1zhq s ILE 107 CO -0.00 -0.07 0.50 -1.58 0.24 0.00 0.00 174.94 174.03 1zhq s GLN 108 N -2.59 4.23 0.26 0.37 0.74 0.05 -1.56 119.66 121.16 1zhq s GLN 108 Ca 0.21 0.41 0.10 0.00 0.05 0.00 0.00 55.36 56.12 1zhq s GLN 108 Cb -0.09 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 1zhq s GLN 108 CO 0.11 -0.06 -0.03 0.96 -0.55 0.00 0.00 175.29 175.71 1zhq s ILE 109 N 1.35 3.32 -0.15 -2.34 -4.36 0.53 -2.16 121.20 117.39 1zhq s ILE 109 Ca 0.24 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.69 1zhq s ILE 109 Cb -0.15 -2.76 0.03 0.00 1.25 0.00 0.00 42.46 40.82 1zhq s ILE 109 CO 0.10 -0.36 -0.12 -0.75 0.24 0.00 0.00 174.94 174.05 1zhq s LYS 110 N -3.59 2.08 0.16 0.37 2.20 0.90 -1.85 119.74 120.01 1zhq s LYS 110 Ca 0.31 -0.55 -0.13 0.00 -0.36 0.00 0.00 55.97 55.24 1zhq s LYS 110 Cb -0.06 -2.06 -0.07 0.00 -1.51 0.00 0.00 37.83 34.12 1zhq s LYS 110 CO 0.19 -0.28 0.55 0.71 -0.36 0.00 0.00 175.35 176.16 1zhq s TYR 111 N 1.52 3.57 -0.12 4.03 1.51 0.21 -1.81 117.35 126.26 1zhq s TYR 111 Ca 0.04 1.03 0.02 0.00 -1.01 0.00 0.00 57.07 57.14 1zhq s TYR 111 Cb -0.13 -2.35 0.01 0.00 -0.11 0.00 0.00 41.96 39.38 1zhq s TYR 111 CO -0.10 0.40 -0.17 0.99 -1.11 0.00 0.00 175.55 175.56 1zhq s THR 112 N -1.53 1.67 0.00 -0.71 2.01 -1.26 -1.35 115.64 114.46 1zhq s THR 112 Ca 0.40 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1zhq s THR 112 Cb -0.14 -1.50 0.00 0.00 0.01 0.00 0.00 72.50 70.86 1zhq s THR 112 CO 0.19 0.47 0.00 2.22 -0.69 0.00 0.00 174.62 176.82