#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 1.41 0.23 0.00 1.04 -1.26 -1.40 113.70 113.71 1zhq s SER 2 Ca 0.00 -1.39 -0.19 0.00 0.48 0.00 0.00 55.95 54.84 1zhq s SER 2 Cb 0.00 0.13 0.03 0.00 0.10 0.00 0.00 66.02 66.28 1zhq s SER 2 CO 0.00 -0.72 0.61 -0.72 0.98 0.00 0.00 173.24 173.40 1zhq s TYR 3 N -3.67 -0.18 0.06 5.02 1.13 -0.02 -4.91 117.35 114.77 1zhq s TYR 3 Ca 0.37 -0.19 0.08 0.00 -1.41 0.00 0.00 57.07 55.93 1zhq s TYR 3 Cb 0.08 0.53 -0.03 0.00 -1.10 0.00 0.00 41.96 41.44 1zhq s TYR 3 CO 0.14 -1.05 -0.22 0.15 -2.51 0.00 0.00 175.55 172.07 1zhq s LYS 4 N -3.88 1.88 0.13 -3.49 1.02 -1.26 0.07 119.74 114.21 1zhq s LYS 4 Ca 0.10 -1.08 -0.05 0.00 0.02 0.00 0.00 55.97 54.96 1zhq s LYS 4 Cb -0.03 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 1zhq s LYS 4 CO 0.01 0.52 0.14 0.14 -0.92 0.00 0.00 175.35 175.23 1zhq s VAL 5 N -0.93 0.10 -0.16 3.17 -7.23 -1.00 -4.99 120.40 109.37 1zhq s VAL 5 Ca 0.14 -1.65 -0.06 0.00 -1.81 0.00 0.00 61.98 58.60 1zhq s VAL 5 Cb -0.10 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1zhq s VAL 5 CO 0.05 -0.47 0.05 0.20 -0.31 0.00 0.00 175.10 174.62 1zhq s ASN 6 N -2.99 5.58 -0.10 4.85 0.01 -1.26 -1.03 114.94 120.00 1zhq s ASN 6 Ca 0.18 0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.47 1zhq s ASN 6 Cb 0.06 -1.88 -0.01 0.00 0.41 0.00 0.00 41.25 39.82 1zhq s ASN 6 CO -0.01 0.23 -0.16 -0.63 -1.51 0.00 0.00 177.10 175.02 1zhq s ILE 7 N 0.02 2.80 0.53 0.60 1.01 0.44 -4.84 121.20 121.77 1zhq s ILE 7 Ca 0.05 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 59.72 1zhq s ILE 7 Cb -0.12 -2.13 -0.07 0.00 0.01 0.00 0.00 42.46 40.14 1zhq s ILE 7 CO 0.01 0.55 0.98 -2.65 0.00 0.00 0.00 174.94 173.83 1zhq n PRO 8 N 3.20 1.12 -0.05 2.79 -0.02 -1.26 -0.49 135.00 140.28 1zhq n PRO 8 Ca -0.18 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1zhq n PRO 8 Cb 0.53 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 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 -1.21 1.17 -0.29 3.55 0.00 0.22 -4.78 120.51 119.17 1zhq n ALA 9 Ca 0.12 -0.60 0.03 0.00 0.00 0.00 0.00 53.44 52.99 1zhq n ALA 9 Cb 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.83 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 -2.06 3.73 0.00 0.00 -1.25 -4.76 105.19 100.81 1zhq n GLY 10 Ca 0.00 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.79 4.45 -0.23 1.61 0.04 -1.22 -1.66 135.00 137.21 1zhq s PRO 11 Ca 0.00 1.89 -0.02 0.00 0.04 0.00 0.00 61.00 62.91 1zhq s PRO 11 Cb 0.00 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.30 1zhq s PRO 11 CO 0.00 -0.17 -0.09 -0.51 0.04 0.00 0.00 177.00 176.27 1zhq s LEU 12 N 0.16 2.88 0.35 -3.56 1.43 -1.26 -4.89 118.68 113.79 1zhq s LEU 12 Ca 0.55 -0.69 0.23 0.00 -1.03 0.00 0.00 54.13 53.19 1zhq s LEU 12 Cb -0.33 -1.64 0.28 0.00 0.03 0.00 0.00 46.19 44.53 1zhq s LEU 12 CO 0.35 -0.07 1.46 -0.50 0.23 0.00 0.00 176.35 177.82 1zhq h TRP 13 N 8.02 0.00 -3.00 0.29 4.06 -1.97 -3.48 115.95 119.87 1zhq h TRP 13 Ca -0.38 0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.63 1zhq h TRP 13 Cb 1.13 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.24 1zhq h TRP 13 CO 0.56 0.00 0.23 -1.54 -3.56 0.00 0.00 178.44 174.13 1zhq s SER 14 N -5.80 -0.24 0.22 -3.49 1.04 -1.26 -5.02 113.70 99.14 1zhq s SER 14 Ca 0.05 -0.65 -0.03 0.00 0.48 0.00 0.00 55.95 55.81 1zhq s SER 14 Cb 0.07 0.74 0.20 0.00 0.10 0.00 0.00 66.02 67.12 1zhq s SER 14 CO 0.70 -1.37 1.59 -1.13 0.98 0.00 0.00 173.24 174.01 1zhq h ASN 15 N 2.00 0.66 -0.94 7.02 -0.73 -1.99 -1.76 115.58 119.84 1zhq h ASN 15 Ca -0.20 -0.28 -0.00 0.00 1.87 0.00 0.00 56.30 57.69 1zhq h ASN 15 Cb 1.25 -0.18 -0.05 0.00 0.27 0.00 0.00 38.32 39.61 1zhq h ASN 15 CO 0.24 0.96 0.57 0.00 -0.37 0.00 0.00 177.43 178.84 1zhq h ALA 16 N 1.07 1.23 -0.21 1.57 0.00 -1.99 -0.16 119.26 120.77 1zhq h ALA 16 Ca 0.05 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1zhq h ALA 16 Cb 0.87 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1zhq h ALA 16 CO 0.08 0.66 -0.06 1.49 0.00 0.00 0.00 179.25 181.42 1zhq h GLU 17 N 1.30 0.41 -0.92 0.00 4.81 -1.89 -3.07 114.58 115.23 1zhq h GLU 17 Ca 0.34 -0.16 0.08 0.00 -0.13 0.00 0.00 59.36 59.49 1zhq h GLU 17 Cb -0.06 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.23 1zhq h GLU 17 CO -0.06 0.66 0.59 0.00 -0.73 0.00 0.00 179.01 179.47 1zhq h ALA 18 N 0.74 1.54 0.00 2.92 0.00 -0.85 0.90 119.26 124.51 1zhq h ALA 18 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1zhq h ALA 18 Cb 0.51 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1zhq h ALA 18 CO 0.02 0.30 -0.09 1.96 0.00 0.00 0.00 179.25 181.44 1zhq h GLN 19 N 1.00 0.00 0.12 0.00 1.08 -0.96 0.23 115.11 116.58 1zhq h GLN 19 Ca 0.41 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 57.27 1zhq h GLN 19 Cb 0.28 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1zhq h GLN 19 CO -0.17 0.09 -1.82 1.96 -0.95 0.00 0.00 178.83 177.94 1zhq h GLN 20 N 0.00 0.25 0.19 1.46 4.20 -0.90 -3.41 115.11 116.91 1zhq h GLN 20 Ca -0.00 -0.44 -0.31 0.00 0.06 0.00 0.00 58.65 57.97 1zhq h GLN 20 Cb 0.47 0.16 0.02 0.00 0.30 0.00 0.00 27.48 28.43 1zhq h GLN 20 CO 0.01 1.12 -1.43 0.28 -0.67 0.00 0.00 178.83 178.14 1zhq h VAL 21 N 0.07 1.18 -0.71 -0.54 2.07 -0.73 -3.39 116.25 114.20 1zhq h VAL 21 Ca -0.36 -2.57 0.14 0.00 0.82 0.00 0.00 66.70 64.74 1zhq h VAL 21 Cb 2.04 2.94 -0.13 0.00 -1.52 0.00 0.00 31.29 34.62 1zhq h VAL 21 CO 0.12 0.79 -0.23 1.23 0.02 0.00 0.00 177.57 179.51 1zhq h GLY 22 N 0.19 0.36 1.90 2.17 0.00 -0.77 0.44 103.07 107.36 1zhq h GLY 22 Ca -0.27 0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.37 1zhq h GLY 22 CO 0.19 -0.26 0.04 -2.55 0.00 0.00 0.00 176.54 173.96 1zhq h PRO 23 N -0.04 0.00 -0.06 4.80 0.11 -1.78 -0.05 132.00 134.97 1zhq h PRO 23 Ca 0.32 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.27 1zhq h PRO 23 Cb 0.54 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.66 1zhq h PRO 23 CO -0.75 0.00 -0.60 0.87 -0.21 0.00 0.00 178.00 177.31 1zhq h LYS 24 N 0.00 0.51 -0.38 1.05 1.79 -1.13 -1.24 116.57 117.18 1zhq h LYS 24 Ca 0.02 -0.47 -0.02 0.00 -2.18 0.00 0.00 60.65 58.00 1zhq h LYS 24 Cb 0.10 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 1zhq h LYS 24 CO -0.00 1.11 0.14 0.82 -1.08 0.00 0.00 179.45 180.44 1zhq h ILE 25 N 0.09 1.20 -0.42 1.86 1.08 -1.05 -1.88 117.51 118.39 1zhq h ILE 25 Ca -0.06 -0.62 0.02 0.00 -0.39 0.00 0.00 64.86 63.82 1zhq h ILE 25 Cb 1.27 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 35.89 1zhq h ILE 25 CO 0.12 0.22 0.23 0.00 -0.69 0.00 0.00 178.15 178.04 1zhq h ALA 26 N 0.98 0.53 -0.76 1.87 0.00 -1.03 -2.42 119.26 118.44 1zhq h ALA 26 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1zhq h ALA 26 Cb 0.21 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1zhq h ALA 26 CO -0.01 -0.10 0.43 0.00 0.00 0.00 0.00 179.25 179.57 1zhq h ALA 27 N 1.20 1.34 0.00 0.00 0.00 -1.01 0.15 119.26 120.93 1zhq h ALA 27 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1zhq h ALA 27 Cb 0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1zhq h ALA 27 CO -0.09 0.55 -0.09 0.00 0.00 0.00 0.00 179.25 179.62 1zhq h ALA 28 N 1.43 1.23 -0.30 0.00 0.00 -0.86 -2.24 119.26 118.51 1zhq h ALA 28 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1zhq h ALA 28 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1zhq h ALA 28 CO -0.05 0.11 0.00 0.72 0.00 0.00 0.00 179.25 180.03 1zhq n HIS 29 N -3.52 0.99 -3.72 0.00 8.25 -0.57 -4.97 115.22 111.67 1zhq n HIS 29 Ca -0.02 -0.82 -0.26 0.00 -0.26 0.00 0.00 57.72 56.37 1zhq n HIS 29 Cb 0.22 -0.30 0.05 0.00 1.12 0.00 0.00 29.99 31.09 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 -0.28 -6.50 -2.86 -0.41 6.02 -0.70 -4.98 117.38 107.67 1zhq n GLN 30 Ca 0.21 0.71 -0.09 0.00 -0.01 0.00 0.00 57.00 57.82 1zhq n GLN 30 Cb 0.87 -5.64 -0.03 0.00 1.02 0.00 0.00 30.24 26.46 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 -1.75 3.74 3.14 1.08 0.00 0.41 -4.55 105.19 107.27 1zhq n GLY 31 Ca -0.04 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.90 2.66 0.13 1.61 0.01 0.07 -3.93 114.94 113.60 1zhq s ASN 32 Ca 0.10 -0.48 -0.30 0.00 -0.71 0.00 0.00 52.86 51.47 1zhq s ASN 32 Cb 0.00 -1.22 -0.07 0.00 0.41 0.00 0.00 41.25 40.38 1zhq s ASN 32 CO 0.07 0.10 1.18 0.12 -1.51 0.00 0.00 177.10 177.05 1zhq s PHE 33 N 0.58 3.47 -0.82 2.20 5.36 -1.26 0.11 117.98 127.63 1zhq s PHE 33 Ca -0.15 1.41 0.24 0.00 -0.96 0.00 0.00 56.93 57.48 1zhq s PHE 33 Cb -0.17 -3.39 0.39 0.00 -0.34 0.00 0.00 43.02 39.51 1zhq s PHE 33 CO 0.05 -1.09 1.33 0.25 -1.46 0.00 0.00 175.22 174.29 1zhq n THR 34 N 3.05 0.15 0.00 0.12 -2.24 -0.74 -4.93 114.28 109.70 1zhq n THR 34 Ca 0.06 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1zhq n THR 34 Cb 0.46 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 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 1.42 2.58 3.84 3.38 0.00 -1.26 -5.07 105.19 110.08 1zhq n GLY 35 Ca 0.04 0.00 -0.34 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 -0.78 4.02 -0.08 1.61 -1.52 -1.26 -4.92 119.66 116.73 1zhq s GLN 36 Ca 0.00 0.61 -0.30 0.00 -1.95 0.00 0.00 55.36 53.72 1zhq s GLN 36 Cb 0.00 -2.69 0.10 0.00 -0.22 0.00 0.00 33.01 30.21 1zhq s GLN 36 CO 0.00 0.31 0.87 1.67 -0.25 0.00 0.00 175.29 177.89 1zhq s TRP 37 N -1.73 -0.45 -0.02 0.91 1.48 -1.26 -1.16 118.94 116.71 1zhq s TRP 37 Ca 0.47 0.66 -0.02 0.00 -1.06 0.00 0.00 56.10 56.15 1zhq s TRP 37 Cb -0.13 0.46 0.01 0.00 -1.16 0.00 0.00 33.47 32.65 1zhq s TRP 37 CO 0.19 -0.48 0.05 0.99 -4.06 0.00 0.00 176.95 173.64 1zhq s THR 38 N -1.70 -0.00 -0.24 0.66 2.01 -0.56 -4.99 115.64 110.82 1zhq s THR 38 Ca -0.03 0.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.78 1zhq s THR 38 Cb -0.00 -0.08 -0.02 0.00 0.01 0.00 0.00 72.50 72.40 1zhq s THR 38 CO 0.01 0.01 0.63 -0.89 -0.69 0.00 0.00 174.62 173.68 1zhq s THR 39 N 0.10 4.99 -0.17 -0.82 2.01 -1.26 -0.62 115.64 119.87 1zhq s THR 39 Ca -0.01 1.14 0.22 0.00 0.31 0.00 0.00 61.69 63.36 1zhq s THR 39 Cb -0.01 -3.94 -0.24 0.00 0.01 0.00 0.00 72.50 68.32 1zhq s THR 39 CO -0.00 0.05 0.67 1.33 -0.69 0.00 0.00 174.62 175.98 1zhq n VAL 40 N 5.09 0.15 -3.62 3.82 0.24 0.04 -4.80 118.33 119.25 1zhq n VAL 40 Ca -0.01 -0.46 -0.25 0.00 -2.04 0.00 0.00 64.34 61.58 1zhq n VAL 40 Cb 0.49 -0.01 -0.17 0.00 -1.47 0.00 0.00 33.84 32.68 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 -3.43 -0.10 -0.05 3.34 1.01 -0.59 -4.98 120.40 115.60 1zhq s VAL 41 Ca -0.05 -0.07 -0.39 0.00 0.00 0.00 0.00 61.98 61.48 1zhq s VAL 41 Cb 0.13 -0.51 -0.18 0.00 0.00 0.00 0.00 36.38 35.83 1zhq s VAL 41 CO 0.87 -0.21 1.37 1.21 0.00 0.00 0.00 175.10 178.34 1zhq n GLU 42 N 5.28 0.76 -1.24 2.72 2.13 -1.26 -0.73 120.64 128.30 1zhq n GLU 42 Ca -0.06 0.27 -0.11 0.00 0.66 0.00 0.00 57.16 57.92 1zhq n GLU 42 Cb 0.49 -1.88 -0.05 0.00 0.27 0.00 0.00 31.44 30.28 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 2.90 -4.43 0.00 4.31 7.64 -1.26 -4.66 113.62 118.12 1zhq n SER 43 Ca 0.21 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.36 1zhq n SER 43 Cb 0.13 -3.55 0.00 0.00 -1.01 0.00 0.00 64.21 59.78 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 0.83 1.16 -3.59 -0.43 0.00 0.09 -4.91 120.51 113.66 1zhq n ALA 44 Ca -0.11 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.22 1zhq n ALA 44 Cb 0.49 0.02 -0.09 0.00 0.00 0.00 0.00 19.45 19.87 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 -1.08 0.61 0.13 0.00 -2.45 -0.04 -3.46 119.30 113.02 1zhq s MET 45 Ca 0.00 0.94 0.04 0.00 -1.25 0.00 0.00 55.69 55.42 1zhq s MET 45 Cb 0.00 0.18 -0.04 0.00 1.25 0.00 0.00 34.83 36.21 1zhq s MET 45 CO 0.00 -0.12 -0.09 -1.12 1.05 0.00 0.00 175.02 174.74 1zhq s SER 46 N 1.03 1.60 0.13 1.11 0.01 -0.66 -0.78 113.70 116.13 1zhq s SER 46 Ca -0.06 -1.01 0.08 0.00 1.31 0.00 0.00 55.95 56.27 1zhq s SER 46 Cb -0.05 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.16 1zhq s SER 46 CO -0.09 -0.37 -0.19 0.68 0.41 0.00 0.00 173.24 173.67 1zhq s VAL 47 N -3.42 1.73 -0.03 3.43 -7.23 0.21 -0.61 120.40 114.49 1zhq s VAL 47 Ca 0.15 -1.71 0.07 0.00 -1.81 0.00 0.00 61.98 58.68 1zhq s VAL 47 Cb 0.03 -1.67 -0.02 0.00 0.56 0.00 0.00 36.38 35.28 1zhq s VAL 47 CO -0.01 -0.19 -0.23 0.68 -0.31 0.00 0.00 175.10 175.04 1zhq s VAL 48 N -1.61 2.33 -0.17 1.32 -7.23 0.35 -1.50 120.40 113.90 1zhq s VAL 48 Ca 0.10 -1.02 -0.27 0.00 -1.81 0.00 0.00 61.98 58.99 1zhq s VAL 48 Cb -0.08 -1.84 -0.01 0.00 0.56 0.00 0.00 36.38 35.01 1zhq s VAL 48 CO 0.05 0.57 0.91 -0.70 -0.31 0.00 0.00 175.10 175.63 1zhq s GLU 49 N -0.67 4.32 -0.08 4.82 2.12 -0.31 -0.42 118.70 128.48 1zhq s GLU 49 Ca 0.11 1.17 0.02 0.00 0.36 0.00 0.00 54.97 56.63 1zhq s GLU 49 Cb -0.10 -3.58 0.01 0.00 0.26 0.00 0.00 34.13 30.72 1zhq s GLU 49 CO -0.00 -0.39 -0.13 0.08 -0.54 0.00 0.00 175.26 174.28 1zhq s VAL 50 N 2.34 1.21 -0.04 3.70 1.01 -0.19 -1.79 120.40 126.64 1zhq s VAL 50 Ca 0.42 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 1zhq s VAL 50 Cb -0.17 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1zhq s VAL 50 CO 0.12 0.38 0.85 -0.70 0.00 0.00 0.00 175.10 175.75 1zhq s GLU 51 N 0.78 4.50 0.21 2.72 2.12 0.12 -2.38 118.70 126.78 1zhq s GLU 51 Ca -0.12 1.17 0.11 0.00 0.36 0.00 0.00 54.97 56.49 1zhq s GLU 51 Cb -0.16 -3.46 -0.05 0.00 0.26 0.00 0.00 34.13 30.73 1zhq s GLU 51 CO 0.02 -0.01 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.00 1zhq s LEU 52 N 0.97 2.48 0.02 2.70 1.43 0.11 -0.75 118.68 125.64 1zhq s LEU 52 Ca 0.45 -0.92 -0.14 0.00 -1.03 0.00 0.00 54.13 52.49 1zhq s LEU 52 Cb -0.19 -1.08 -0.06 0.00 0.03 0.00 0.00 46.19 44.89 1zhq s LEU 52 CO 0.23 0.06 0.41 -1.10 0.23 0.00 0.00 176.35 176.19 1zhq s GLN 53 N -2.96 3.89 0.26 1.70 -1.52 -1.26 -0.84 119.66 118.92 1zhq s GLN 53 Ca 0.23 0.38 -0.05 0.00 -1.95 0.00 0.00 55.36 53.96 1zhq s GLN 53 Cb -0.06 -3.18 0.29 0.00 -0.22 0.00 0.00 33.01 29.84 1zhq s GLN 53 CO 0.11 0.67 1.91 0.28 -0.25 0.00 0.00 175.29 178.00 1zhq h VAL 54 N 3.55 1.25 -3.22 1.09 2.07 -1.59 -3.40 116.25 116.00 1zhq h VAL 54 Ca -0.51 -0.53 -0.51 0.00 0.82 0.00 0.00 66.70 65.97 1zhq h VAL 54 Cb 1.22 -0.03 -0.37 0.00 -1.52 0.00 0.00 31.29 30.59 1zhq h VAL 54 CO 0.62 0.26 -0.79 -1.61 0.02 0.00 0.00 177.57 176.07 1zhq s GLU 55 N -5.92 1.27 0.07 1.57 2.02 -1.26 -5.08 118.70 111.37 1zhq s GLU 55 Ca -0.12 -0.20 -0.25 0.00 0.02 0.00 0.00 54.97 54.41 1zhq s GLU 55 Cb 0.17 -1.50 -0.06 0.00 0.10 0.00 0.00 34.13 32.84 1zhq s GLU 55 CO 0.82 -0.31 0.78 -0.80 0.02 0.00 0.00 175.26 175.77 1zhq s ASN 56 N 1.77 7.26 0.29 -0.19 0.01 -1.26 -5.00 114.94 117.81 1zhq s ASN 56 Ca 0.04 1.50 0.05 0.00 -0.71 0.00 0.00 52.86 53.75 1zhq s ASN 56 Cb -0.13 -2.48 -0.06 0.00 0.41 0.00 0.00 41.25 38.99 1zhq s ASN 56 CO -0.07 0.05 0.00 0.42 -1.51 0.00 0.00 177.10 175.98 1zhq s THR 57 N -0.26 1.32 0.00 1.60 -4.23 -1.26 -4.78 115.64 108.03 1zhq s THR 57 Ca 0.38 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1zhq s THR 57 Cb -0.21 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.07 1zhq s THR 57 CO 0.24 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.74 1zhq n GLY 58 N -0.59 0.63 0.86 3.99 0.00 -1.26 -4.26 105.19 104.56 1zhq n GLY 58 Ca -0.04 -1.51 0.12 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 -1.40 0.00 -4.16 -0.61 -5.35 -1.13 -4.67 119.36 102.03 1zhq n ILE 59 Ca 0.00 -0.46 -0.27 0.00 -0.27 0.00 0.00 62.75 61.75 1zhq n ILE 59 Cb 0.00 1.45 -0.07 0.00 -1.74 0.00 0.00 39.64 39.28 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 -2.05 2.93 0.05 4.28 3.76 0.09 -4.99 115.29 119.37 1zhq s HIS 60 Ca 0.26 -0.09 -0.04 0.00 -0.15 0.00 0.00 55.06 55.04 1zhq s HIS 60 Cb 0.19 -1.44 -0.02 0.00 1.11 0.00 0.00 32.58 32.42 1zhq s HIS 60 CO 0.34 0.51 0.06 -1.83 -0.85 0.00 0.00 174.74 172.97 1zhq s GLU 61 N -2.82 0.64 -0.13 1.40 4.04 -1.26 -0.95 118.70 119.63 1zhq s GLU 61 Ca 0.28 -0.99 -0.06 0.00 0.04 0.00 0.00 54.97 54.24 1zhq s GLU 61 Cb -0.10 0.24 0.06 0.00 0.02 0.00 0.00 34.13 34.35 1zhq s GLU 61 CO 0.19 -0.15 0.29 0.12 -1.84 0.00 0.00 175.26 173.87 1zhq s PHE 62 N -3.38 -0.43 -0.02 4.83 5.36 -0.61 -4.96 117.98 118.77 1zhq s PHE 62 Ca 0.02 0.97 -0.01 0.00 -0.96 0.00 0.00 56.93 56.95 1zhq s PHE 62 Cb 0.04 0.07 -0.04 0.00 -0.34 0.00 0.00 43.02 42.75 1zhq s PHE 62 CO -0.08 -0.30 0.07 0.15 -1.46 0.00 0.00 175.22 173.59 1zhq s LYS 63 N 1.70 3.05 0.15 10.12 1.02 -1.26 -0.38 119.74 134.15 1zhq s LYS 63 Ca -0.06 -0.46 -0.24 0.00 0.02 0.00 0.00 55.97 55.22 1zhq s LYS 63 Cb -0.11 -2.85 0.06 0.00 -0.52 0.00 0.00 37.83 34.41 1zhq s LYS 63 CO -0.09 0.66 0.80 -0.08 -0.92 0.00 0.00 175.35 175.72 1zhq s THR 64 N -1.13 0.00 -0.11 2.17 -1.32 -0.79 -4.99 115.64 109.47 1zhq s THR 64 Ca 0.21 -0.46 -0.05 0.00 -1.21 0.00 0.00 61.69 60.17 1zhq s THR 64 Cb -0.12 -1.56 -0.04 0.00 -1.51 0.00 0.00 72.50 69.28 1zhq s THR 64 CO 0.11 0.00 0.09 -1.81 -2.21 0.00 0.00 174.62 170.81 1zhq s ASP 65 N -2.79 6.01 0.12 8.08 1.01 -1.26 -0.40 116.67 127.43 1zhq s ASP 65 Ca 0.08 0.36 0.01 0.00 0.71 0.00 0.00 52.55 53.71 1zhq s ASP 65 Cb -0.02 -1.87 -0.04 0.00 1.01 0.00 0.00 42.92 41.99 1zhq s ASP 65 CO -0.02 0.40 -0.04 0.68 0.21 0.00 0.00 175.17 176.40 1zhq s VAL 66 N -0.97 0.62 0.39 -1.27 -7.23 -0.63 -4.96 120.40 106.35 1zhq s VAL 66 Ca 0.14 -1.94 -0.27 0.00 -1.81 0.00 0.00 61.98 58.11 1zhq s VAL 66 Cb -0.12 -1.80 -0.11 0.00 0.56 0.00 0.00 36.38 34.91 1zhq s VAL 66 CO 0.03 -0.76 1.36 0.18 -0.31 0.00 0.00 175.10 175.60 1zhq n LEU 67 N -0.08 4.23 0.00 1.32 4.77 -1.26 -1.81 117.00 124.16 1zhq n LEU 67 Ca -0.10 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.05 1zhq n LEU 67 Cb 0.62 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 1zhq n LEU 67 CO 0.31 -0.32 0.17 0.00 -1.33 0.00 0.00 177.39 176.22 1zhq n ALA 68 N 0.13 1.42 0.00 -1.18 0.00 -0.29 -4.73 120.51 115.86 1zhq n ALA 68 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1zhq n ALA 68 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 -0.04 -1.80 3.72 0.00 0.00 -1.21 -4.81 105.19 101.04 1zhq n GLY 69 Ca 0.00 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.05 4.28 -0.08 1.61 0.04 -1.25 -2.23 135.00 135.32 1zhq s PRO 70 Ca 0.00 2.19 0.04 0.00 0.04 0.00 0.00 61.00 63.27 1zhq s PRO 70 Cb 0.00 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1zhq s PRO 70 CO 0.00 -0.50 -0.21 -0.51 0.04 0.00 0.00 177.00 175.82 1zhq s LEU 71 N 1.09 1.97 0.07 -3.56 1.43 -1.26 -4.88 118.68 113.54 1zhq s LEU 71 Ca 0.66 -0.47 0.18 0.00 -1.03 0.00 0.00 54.13 53.47 1zhq s LEU 71 Cb -0.39 -1.23 -0.13 0.00 0.03 0.00 0.00 46.19 44.46 1zhq s LEU 71 CO 0.31 0.15 0.81 0.79 0.23 0.00 0.00 176.35 178.63 1zhq n TRP 72 N 3.45 0.89 -3.91 0.29 7.02 -1.26 -4.88 117.44 119.04 1zhq n TRP 72 Ca -0.19 0.29 -0.09 0.00 -1.02 0.00 0.00 57.50 56.48 1zhq n TRP 72 Cb 0.53 -1.03 -0.05 0.00 -2.42 0.00 0.00 31.31 28.33 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 -5.63 -0.12 0.30 -0.99 1.04 -1.26 -5.03 113.70 102.01 1zhq s SER 73 Ca -0.03 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 55.64 1zhq s SER 73 Cb 0.09 0.56 0.47 0.00 0.10 0.00 0.00 66.02 67.25 1zhq s SER 73 CO 0.81 -1.08 1.81 -1.13 0.98 0.00 0.00 173.24 174.64 1zhq h ASN 74 N 2.28 0.59 -0.49 7.02 -0.00 -1.98 -0.54 115.58 122.46 1zhq h ASN 74 Ca -0.28 -0.13 -0.10 0.00 -0.00 0.00 0.00 56.30 55.79 1zhq h ASN 74 Cb 1.25 -0.16 -0.02 0.00 -0.00 0.00 0.00 38.32 39.40 1zhq h ASN 74 CO 0.38 0.68 -0.09 0.44 -0.00 0.00 0.00 177.43 178.84 1zhq h ASP 75 N 0.59 0.94 -0.32 1.15 3.32 -1.98 0.57 116.42 120.67 1zhq h ASP 75 Ca 0.12 -0.35 -0.12 0.00 0.02 0.00 0.00 57.03 56.70 1zhq h ASP 75 Cb 0.41 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1zhq h ASP 75 CO 0.02 1.07 -0.23 -0.08 -1.72 0.00 0.00 179.24 178.30 1zhq h GLU 76 N 0.79 0.82 -0.49 3.56 4.81 -1.86 -0.83 114.58 121.38 1zhq h GLU 76 Ca 0.13 -0.34 -0.07 0.00 -0.13 0.00 0.00 59.36 58.96 1zhq h GLU 76 Cb 0.64 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1zhq h GLU 76 CO 0.04 0.96 0.05 0.00 -0.73 0.00 0.00 179.01 179.33 1zhq h ALA 77 N 1.03 0.65 -0.07 2.92 0.00 -0.90 -0.11 119.26 122.78 1zhq h ALA 77 Ca 0.10 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1zhq h ALA 77 Cb 0.76 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1zhq h ALA 77 CO 0.06 0.41 -0.40 1.96 0.00 0.00 0.00 179.25 181.28 1zhq h GLN 78 N 0.69 0.16 -0.04 0.00 1.08 -0.71 0.57 115.11 116.85 1zhq h GLN 78 Ca 0.14 -0.07 -0.15 0.00 -1.45 0.00 0.00 58.65 57.12 1zhq h GLN 78 Cb 0.44 -0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1zhq h GLN 78 CO 0.02 0.54 -0.56 0.87 -0.95 0.00 0.00 178.83 178.75 1zhq h LYS 79 N 0.13 0.45 0.00 1.46 1.57 -0.90 -3.37 116.57 115.92 1zhq h LYS 79 Ca 0.01 -0.43 -0.22 0.00 -1.87 0.00 0.00 60.65 58.14 1zhq h LYS 79 Cb 0.78 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.16 1zhq h LYS 79 CO 0.06 1.08 -1.49 -0.07 -0.57 0.00 0.00 179.45 178.45 1zhq h LEU 80 N -0.01 0.00 -0.86 2.94 3.38 -0.99 -3.41 115.31 116.35 1zhq h LEU 80 Ca -0.06 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.07 1zhq h LEU 80 Cb 1.24 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.83 1zhq h LEU 80 CO 0.11 0.76 -0.29 1.23 0.09 0.00 0.00 178.44 180.34 1zhq h GLY 81 N 3.60 0.35 0.51 0.83 0.00 -0.00 -1.15 103.07 107.21 1zhq h GLY 81 Ca -0.20 0.38 0.06 0.00 0.00 0.00 0.00 47.33 47.57 1zhq h GLY 81 CO 0.06 -0.28 0.06 -2.55 0.00 0.00 0.00 176.54 173.84 1zhq h PRO 82 N -0.03 0.18 -0.24 4.80 0.11 -1.79 0.13 132.00 135.15 1zhq h PRO 82 Ca 0.37 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.32 1zhq h PRO 82 Cb 0.62 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 1zhq h PRO 82 CO -0.89 0.12 -0.46 1.96 -0.21 0.00 0.00 178.00 178.51 1zhq h GLN 83 N 0.18 0.61 -0.40 1.05 4.20 -1.63 0.45 115.11 119.57 1zhq h GLN 83 Ca 0.18 -0.35 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 1zhq h GLN 83 Cb 0.22 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1zhq h GLN 83 CO -0.25 0.95 0.05 0.82 -0.67 0.00 0.00 178.83 179.73 1zhq h ILE 84 N 0.49 1.25 -0.71 2.54 2.04 -0.91 -1.52 117.51 120.69 1zhq h ILE 84 Ca 0.03 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1zhq h ILE 84 Cb 1.00 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 1zhq h ILE 84 CO 0.09 0.31 0.44 0.00 0.00 0.00 0.00 178.15 178.99 1zhq h ALA 85 N 0.92 0.90 -0.28 1.87 0.00 -0.64 -1.44 119.26 120.59 1zhq h ALA 85 Ca 0.12 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1zhq h ALA 85 Cb 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1zhq h ALA 85 CO 0.01 0.35 0.19 0.00 0.00 0.00 0.00 179.25 179.80 1zhq h ALA 86 N 1.24 2.06 0.00 0.00 0.00 -0.45 0.16 119.26 122.28 1zhq h ALA 86 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1zhq h ALA 86 Cb -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1zhq h ALA 86 CO -0.05 -0.12 0.00 -1.13 0.00 0.00 0.00 179.25 177.95 1zhq n SER 87 N -4.48 0.47 -0.86 0.00 3.41 -0.55 -1.31 113.62 110.30 1zhq n SER 87 Ca 0.03 0.62 0.08 0.00 -0.26 0.00 0.00 58.87 59.34 1zhq n SER 87 Cb 0.24 -0.72 0.17 0.00 -0.26 0.00 0.00 64.21 63.65 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 -2.02 0.43 -2.76 7.33 4.02 0.49 -4.96 117.16 119.69 1zhq n TYR 88 Ca 0.02 -0.30 -0.12 0.00 -0.01 0.00 0.00 57.90 57.49 1zhq n TYR 88 Cb 0.21 -0.01 0.02 0.00 -0.02 0.00 0.00 39.34 39.54 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 1.01 0.06 2.78 2.72 0.00 -0.43 -5.01 105.19 106.32 1zhq n GLY 89 Ca 0.15 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.98 0.14 -2.74 4.61 0.00 -0.68 -4.83 120.51 114.02 1zhq n ALA 90 Ca -0.05 -1.50 -0.30 0.00 0.00 0.00 0.00 53.44 51.59 1zhq n ALA 90 Cb 0.56 1.21 -0.07 0.00 0.00 0.00 0.00 19.45 21.15 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 -2.90 2.74 -0.05 0.00 2.02 -0.73 -2.97 118.70 116.81 1zhq s GLU 91 Ca 0.29 -0.76 -0.20 0.00 0.02 0.00 0.00 54.97 54.33 1zhq s GLU 91 Cb 0.00 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.54 1zhq s GLU 91 CO 0.21 0.55 0.56 0.12 0.02 0.00 0.00 175.26 176.72 1zhq s PHE 92 N -1.37 3.62 -0.79 1.61 5.36 -1.26 0.61 117.98 125.75 1zhq s PHE 92 Ca 0.28 1.10 0.24 0.00 -0.96 0.00 0.00 56.93 57.59 1zhq s PHE 92 Cb -0.12 -2.60 0.34 0.00 -0.34 0.00 0.00 43.02 40.30 1zhq s PHE 92 CO 0.21 0.27 1.29 0.25 -1.46 0.00 0.00 175.22 175.78 1zhq n THR 93 N 3.13 0.16 0.00 0.12 -2.24 -0.97 -4.90 114.28 109.58 1zhq n THR 93 Ca -0.06 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1zhq n THR 93 Cb 0.51 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 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 1.41 2.78 3.76 3.38 0.00 -1.26 -5.07 105.19 110.20 1zhq n GLY 94 Ca 0.04 0.00 -0.39 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 -0.43 4.75 -0.01 1.61 -1.52 -1.26 -4.92 119.66 117.86 1zhq s GLN 95 Ca 0.00 1.40 -0.30 0.00 -1.95 0.00 0.00 55.36 54.52 1zhq s GLN 95 Cb 0.00 -3.13 0.10 0.00 -0.22 0.00 0.00 33.01 29.76 1zhq s GLN 95 CO 0.00 0.45 1.02 1.67 -0.25 0.00 0.00 175.29 178.18 1zhq s TRP 96 N -1.31 -0.22 -0.02 0.91 1.48 -1.26 -1.00 118.94 117.52 1zhq s TRP 96 Ca 0.43 0.07 -0.29 0.00 -1.06 0.00 0.00 56.10 55.26 1zhq s TRP 96 Cb -0.23 0.56 0.09 0.00 -1.16 0.00 0.00 33.47 32.72 1zhq s TRP 96 CO 0.29 -0.50 0.75 -0.98 -4.06 0.00 0.00 176.95 172.45 1zhq s ARG 97 N -2.92 0.99 -0.05 3.25 1.70 -0.84 -5.02 118.95 116.06 1zhq s ARG 97 Ca 0.08 -0.00 -0.22 0.00 -0.47 0.00 0.00 55.73 55.12 1zhq s ARG 97 Cb -0.00 0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 1zhq s ARG 97 CO -0.05 -0.36 0.65 0.99 -1.08 0.00 0.00 175.30 175.45 1zhq s THR 98 N -2.01 5.01 -0.05 4.99 2.01 -1.26 -1.05 115.64 123.28 1zhq s THR 98 Ca -0.04 1.35 0.19 0.00 0.31 0.00 0.00 61.69 63.50 1zhq s THR 98 Cb -0.00 -3.99 -0.29 0.00 0.01 0.00 0.00 72.50 68.22 1zhq s THR 98 CO 0.01 0.31 0.37 2.30 -0.69 0.00 0.00 174.62 176.92 1zhq n ILE 99 N 3.45 0.20 -3.57 1.82 -5.35 0.16 -4.84 119.36 111.23 1zhq n ILE 99 Ca -0.03 -0.51 -0.24 0.00 -0.27 0.00 0.00 62.75 61.70 1zhq n ILE 99 Cb 0.51 -0.04 -0.16 0.00 -1.74 0.00 0.00 39.64 38.21 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 -3.22 -0.17 -0.13 7.28 1.01 -0.68 -4.98 120.40 119.51 1zhq s VAL 100 Ca -0.08 -0.17 -0.39 0.00 0.00 0.00 0.00 61.98 61.34 1zhq s VAL 100 Cb 0.12 -0.62 -0.16 0.00 0.00 0.00 0.00 36.38 35.71 1zhq s VAL 100 CO 0.81 -0.27 1.55 1.21 0.00 0.00 0.00 175.10 178.39 1zhq n GLU 101 N 5.29 1.05 -0.97 2.72 2.13 -1.26 -0.66 120.64 128.94 1zhq n GLU 101 Ca -0.06 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.14 1zhq n GLU 101 Cb 0.49 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.17 1zhq n GLU 101 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1zhq n GLY 102 N 3.40 0.28 1.19 8.31 0.00 -1.26 -4.77 105.19 112.34 1zhq n GLY 102 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.43 0.00 -3.70 1.61 0.31 0.16 -5.02 118.33 109.27 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 0.22 -0.80 -0.09 0.00 -0.91 0.00 0.00 33.84 32.26 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 -1.88 0.64 0.24 5.55 -2.45 -0.37 -3.83 119.30 117.20 1zhq s MET 104 Ca 0.00 0.51 0.04 0.00 -1.25 0.00 0.00 55.69 55.00 1zhq s MET 104 Cb 0.00 0.30 -0.05 0.00 1.25 0.00 0.00 34.83 36.33 1zhq s MET 104 CO 0.00 -0.11 -0.02 -1.12 1.05 0.00 0.00 175.02 174.82 1zhq s SER 105 N -0.12 2.11 0.10 1.11 0.01 -0.94 -0.67 113.70 115.30 1zhq s SER 105 Ca -0.03 -1.20 0.04 0.00 1.31 0.00 0.00 55.95 56.06 1zhq s SER 105 Cb -0.03 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.11 1zhq s SER 105 CO 0.02 -0.46 -0.10 0.68 0.41 0.00 0.00 173.24 173.79 1zhq s VAL 106 N -3.29 1.00 0.09 3.43 -7.23 -0.22 -1.14 120.40 113.04 1zhq s VAL 106 Ca 0.28 -1.70 0.08 0.00 -1.81 0.00 0.00 61.98 58.83 1zhq s VAL 106 Cb 0.05 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.52 1zhq s VAL 106 CO 0.09 -0.57 -0.20 0.27 -0.31 0.00 0.00 175.10 174.39 1zhq s ILE 107 N -2.52 1.61 -0.05 -0.62 -4.36 -0.75 -1.99 121.20 112.52 1zhq s ILE 107 Ca 0.07 -1.44 -0.21 0.00 -0.26 0.00 0.00 60.65 58.81 1zhq s ILE 107 Cb -0.02 -1.46 -0.04 0.00 1.25 0.00 0.00 42.46 42.18 1zhq s ILE 107 CO 0.00 -0.03 0.61 -1.58 0.24 0.00 0.00 174.94 174.18 1zhq s GLN 108 N -1.73 4.37 0.28 0.37 0.74 -0.17 -1.60 119.66 121.91 1zhq s GLN 108 Ca 0.05 0.72 0.12 0.00 0.05 0.00 0.00 55.36 56.30 1zhq s GLN 108 Cb -0.10 -3.40 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 1zhq s GLN 108 CO 0.03 0.21 -0.19 0.96 -0.55 0.00 0.00 175.29 175.75 1zhq s ILE 109 N 0.35 2.44 -0.13 -2.34 -4.36 0.47 -2.30 121.20 115.33 1zhq s ILE 109 Ca 0.32 -2.39 0.01 0.00 -0.26 0.00 0.00 60.65 58.33 1zhq s ILE 109 Cb -0.17 -2.32 0.02 0.00 1.25 0.00 0.00 42.46 41.24 1zhq s ILE 109 CO 0.16 -0.39 -0.15 -0.75 0.24 0.00 0.00 174.94 174.05 1zhq s LYS 110 N -3.52 2.25 0.07 0.37 2.20 0.20 -1.88 119.74 119.43 1zhq s LYS 110 Ca 0.30 -0.55 -0.15 0.00 -0.36 0.00 0.00 55.97 55.21 1zhq s LYS 110 Cb -0.04 -2.00 -0.06 0.00 -1.51 0.00 0.00 37.83 34.22 1zhq s LYS 110 CO 0.15 -0.15 0.48 0.71 -0.36 0.00 0.00 175.35 176.17 1zhq s TYR 111 N 1.26 3.69 -0.11 4.03 1.51 0.49 -1.78 117.35 126.45 1zhq s TYR 111 Ca -0.00 1.05 0.04 0.00 -1.01 0.00 0.00 57.07 57.14 1zhq s TYR 111 Cb -0.14 -2.34 0.00 0.00 -0.11 0.00 0.00 41.96 39.38 1zhq s TYR 111 CO -0.06 0.56 -0.23 0.99 -1.11 0.00 0.00 175.55 175.70 1zhq s THR 112 N -1.23 2.01 0.00 -0.71 2.01 -1.26 -1.57 115.64 114.88 1zhq s THR 112 Ca 0.30 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 61.32 1zhq s THR 112 Cb -0.16 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.60 1zhq s THR 112 CO 0.17 0.55 0.00 2.22 -0.69 0.00 0.00 174.62 176.86