#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qx6 n GLY 2 N 0.00 0.25 3.32 0.00 0.00 -1.26 -4.85 105.19 102.66 2qx6 n GLY 2 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2qx6 n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qx6 s LYS 3 N -1.04 1.23 -0.12 1.61 -0.14 -1.26 -5.04 119.74 114.99 2qx6 s LYS 3 Ca 0.00 -1.40 -0.00 0.00 -1.36 0.00 0.00 55.97 53.21 2qx6 s LYS 3 Cb 0.00 -1.22 -0.02 0.00 -1.68 0.00 0.00 37.83 34.91 2qx6 s LYS 3 CO 0.00 0.24 -0.11 0.15 -0.76 0.00 0.00 175.35 174.87 2qx6 s LYS 4 N -2.88 3.23 -0.04 1.68 1.02 -1.26 -0.86 119.74 120.64 2qx6 s LYS 4 Ca 0.15 -0.64 0.05 0.00 0.02 0.00 0.00 55.97 55.55 2qx6 s LYS 4 Cb -0.05 -2.65 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 2qx6 s LYS 4 CO 0.06 0.34 -0.18 0.08 -0.92 0.00 0.00 175.35 174.72 2qx6 s VAL 5 N 0.05 1.52 -0.14 3.17 1.01 0.32 -0.21 120.40 126.11 2qx6 s VAL 5 Ca -0.03 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2qx6 s VAL 5 Cb -0.14 -1.29 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 2qx6 s VAL 5 CO 0.04 0.43 -0.16 -0.22 0.00 0.00 0.00 175.10 175.19 2qx6 s LEU 6 N -0.08 2.46 -0.24 3.92 2.96 -0.13 -1.28 118.68 126.30 2qx6 s LEU 6 Ca -0.02 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.39 2qx6 s LEU 6 Cb -0.11 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 2qx6 s LEU 6 CO 0.02 0.12 0.00 -0.63 -1.32 0.00 0.00 176.35 174.54 2qx6 s ILE 7 N 0.62 3.69 -0.37 6.68 1.01 0.30 -0.27 121.20 132.87 2qx6 s ILE 7 Ca -0.09 -0.43 -0.15 0.00 0.00 0.00 0.00 60.65 59.99 2qx6 s ILE 7 Cb -0.16 -2.72 -0.00 0.00 0.01 0.00 0.00 42.46 39.59 2qx6 s ILE 7 CO 0.03 0.36 0.34 -0.69 0.00 0.00 0.00 174.94 174.98 2qx6 s VAL 8 N 1.52 5.20 -0.14 2.92 1.01 0.71 -0.66 120.40 130.96 2qx6 s VAL 8 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 2qx6 s VAL 8 Cb -0.15 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 2qx6 s VAL 8 CO -0.01 -0.18 -0.10 -0.47 0.00 0.00 0.00 175.10 174.35 2qx6 s TYR 9 N 1.91 2.88 -0.58 5.22 5.04 -0.33 -1.06 117.35 130.43 2qx6 s TYR 9 Ca 0.09 -0.53 0.05 0.00 -2.44 0.00 0.00 57.07 54.24 2qx6 s TYR 9 Cb -0.17 -1.88 0.18 0.00 0.35 0.00 0.00 41.96 40.43 2qx6 s TYR 9 CO 0.11 -0.15 0.45 0.00 -1.34 0.00 0.00 175.55 174.63 2qx6 n ALA 10 N 3.53 3.21 -3.25 3.97 0.00 -0.45 -1.78 120.51 125.74 2qx6 n ALA 10 Ca -0.18 -3.96 -0.13 0.00 0.00 0.00 0.00 53.44 49.17 2qx6 n ALA 10 Cb 0.53 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.97 2qx6 n ALA 10 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2qx6 s HIS 11 N -0.94 -0.36 -0.16 0.00 5.04 -1.26 -4.31 115.29 113.30 2qx6 s HIS 11 Ca 0.29 0.84 0.21 0.00 -1.54 0.00 0.00 55.06 54.86 2qx6 s HIS 11 Cb 0.01 0.13 0.45 0.00 0.04 0.00 0.00 32.58 33.20 2qx6 s HIS 11 CO -0.17 -0.22 1.62 1.96 -2.34 0.00 0.00 174.74 175.59 2qx6 h GLN 12 N 5.29 0.00 -4.88 2.88 7.50 -1.99 -3.44 115.11 120.47 2qx6 h GLN 12 Ca -0.27 0.00 -0.67 0.00 0.50 0.00 0.00 58.65 58.21 2qx6 h GLN 12 Cb 1.18 0.00 -0.32 0.00 0.05 0.00 0.00 27.48 28.39 2qx6 h GLN 12 CO 0.30 0.24 -0.73 -2.00 -1.50 0.00 0.00 178.83 175.14 2qx6 s GLU 13 N -3.25 2.76 0.41 1.46 2.56 -1.26 -4.99 118.70 116.38 2qx6 s GLU 13 Ca 0.04 -1.03 0.15 0.00 0.00 0.00 0.00 54.97 54.13 2qx6 s GLU 13 Cb 0.07 -3.03 1.02 0.00 2.00 0.00 0.00 34.13 34.19 2qx6 s GLU 13 CO 0.68 -0.45 1.87 -1.35 -0.56 0.00 0.00 175.26 175.46 2qx6 h PRO 14 N 8.01 0.45 -0.01 4.30 0.11 -1.98 -1.10 132.00 141.79 2qx6 h PRO 14 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2qx6 h PRO 14 Cb 1.10 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2qx6 h PRO 14 CO 0.56 0.30 0.00 1.63 -0.21 0.00 0.00 178.00 180.28 2qx6 n LYS 15 N -4.52 1.09 -1.46 1.05 5.02 -1.26 -4.40 118.16 113.68 2qx6 n LYS 15 Ca 0.18 -0.12 -0.29 0.00 -2.02 0.00 0.00 58.31 56.05 2qx6 n LYS 15 Cb 0.61 -1.45 0.16 0.00 -0.02 0.00 0.00 35.03 34.34 2qx6 n LYS 15 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qx6 s SER 16 N -1.89 3.00 0.27 4.39 1.04 -0.41 -4.83 113.70 115.26 2qx6 s SER 16 Ca 0.42 0.89 -0.02 0.00 0.48 0.00 0.00 55.95 57.72 2qx6 s SER 16 Cb 0.20 -1.40 0.35 0.00 0.10 0.00 0.00 66.02 65.27 2qx6 s SER 16 CO 0.33 -2.86 1.81 0.15 0.98 0.00 0.00 173.24 173.65 2qx6 h PHE 17 N -1.71 0.91 -0.68 5.02 3.57 -1.91 -1.04 116.94 121.10 2qx6 h PHE 17 Ca -0.50 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 60.87 2qx6 h PHE 17 Cb 1.32 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 2qx6 h PHE 17 CO -0.13 0.76 0.27 -0.91 -2.23 0.00 0.00 178.31 176.07 2qx6 h ASN 18 N 0.85 0.94 -0.93 0.41 2.35 -1.92 -1.03 115.58 116.25 2qx6 h ASN 18 Ca 0.19 -0.17 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2qx6 h ASN 18 Cb 0.30 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.38 2qx6 h ASN 18 CO -0.00 0.86 0.62 1.23 -1.65 0.00 0.00 177.43 178.49 2qx6 h GLY 19 N 0.97 1.31 1.11 2.83 0.00 -1.55 -0.20 103.07 107.55 2qx6 h GLY 19 Ca 0.23 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 2qx6 h GLY 19 CO -0.02 0.47 -0.06 1.76 0.00 0.00 0.00 176.54 178.69 2qx6 h SER 20 N 1.26 1.03 -0.62 0.19 0.02 -0.72 0.53 113.55 115.25 2qx6 h SER 20 Ca 0.34 -0.32 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 2qx6 h SER 20 Cb -0.14 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.10 2qx6 h SER 20 CO -0.08 1.12 0.10 -0.07 -1.14 0.00 0.00 176.83 176.76 2qx6 h LEU 21 N 0.94 0.98 -0.29 5.07 3.38 -0.79 0.68 115.31 125.27 2qx6 h LEU 21 Ca 0.15 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2qx6 h LEU 21 Cb 0.63 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2qx6 h LEU 21 CO 0.04 0.99 0.05 0.50 0.09 0.00 0.00 178.44 180.11 2qx6 h LYS 22 N 0.93 0.49 -0.70 1.13 3.11 -0.86 -2.27 116.57 118.39 2qx6 h LYS 22 Ca 0.19 -0.13 -0.06 0.00 -2.81 0.00 0.00 60.65 57.84 2qx6 h LYS 22 Cb 0.43 -0.06 -0.03 0.00 -1.00 0.00 0.00 32.23 31.57 2qx6 h LYS 22 CO 0.01 0.58 0.20 -0.91 -2.81 0.00 0.00 179.45 176.52 2qx6 h ASN 23 N 0.31 1.03 0.59 4.20 2.35 -0.58 -1.49 115.58 121.99 2qx6 h ASN 23 Ca 0.09 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.55 2qx6 h ASN 23 Cb 0.33 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2qx6 h ASN 23 CO 0.00 0.97 -0.40 -0.37 -1.65 0.00 0.00 177.43 175.99 2qx6 h VAL 24 N 1.05 1.10 -0.26 2.81 -1.51 -0.84 -0.64 116.25 117.96 2qx6 h VAL 24 Ca 0.22 -1.47 -0.06 0.00 -1.23 0.00 0.00 66.70 64.16 2qx6 h VAL 24 Cb 0.33 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.32 2qx6 h VAL 24 CO -0.00 0.39 -0.07 0.00 -1.23 0.00 0.00 177.57 176.66 2qx6 h ALA 25 N 1.60 0.36 -0.02 5.19 0.00 -0.80 -0.12 119.26 125.47 2qx6 h ALA 25 Ca -0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2qx6 h ALA 25 Cb 0.80 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2qx6 h ALA 25 CO 0.05 0.18 0.01 0.28 0.00 0.00 0.00 179.25 179.77 2qx6 h VAL 26 N 0.26 1.04 0.12 0.00 2.07 -1.04 -1.15 116.25 117.54 2qx6 h VAL 26 Ca 0.06 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.50 2qx6 h VAL 26 Cb 0.55 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2qx6 h VAL 26 CO 0.03 0.03 -0.17 0.44 0.02 0.00 0.00 177.57 177.92 2qx6 h ASP 27 N -0.01 -0.47 -0.42 0.57 3.32 -1.06 -0.18 116.42 118.17 2qx6 h ASP 27 Ca 0.01 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 2qx6 h ASP 27 Cb 0.04 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2qx6 h ASP 27 CO -0.00 -0.25 0.05 -0.08 -1.72 0.00 0.00 179.24 177.24 2qx6 h GLU 28 N -0.34 0.70 -0.23 3.56 4.57 -0.98 -0.86 114.58 121.01 2qx6 h GLU 28 Ca 0.02 -0.20 -0.13 0.00 -1.18 0.00 0.00 59.36 57.87 2qx6 h GLU 28 Cb 0.35 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 2qx6 h GLU 28 CO -0.08 0.75 -0.40 -0.07 -1.18 0.00 0.00 179.01 178.03 2qx6 h LEU 29 N 0.55 0.56 -0.52 1.64 3.38 -1.18 -2.12 115.31 117.63 2qx6 h LEU 29 Ca 0.13 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2qx6 h LEU 29 Cb 0.40 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2qx6 h LEU 29 CO 0.01 0.90 0.13 -1.28 0.09 0.00 0.00 178.44 178.29 2qx6 h SER 30 N 0.44 0.78 -0.60 -0.43 0.87 -0.94 -1.36 113.55 112.31 2qx6 h SER 30 Ca 0.04 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2qx6 h SER 30 Cb 0.89 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.61 2qx6 h SER 30 CO 0.08 0.80 0.37 -0.09 -0.53 0.00 0.00 176.83 177.46 2qx6 h ARG 31 N 0.72 0.82 0.00 2.24 2.43 -0.95 -0.32 114.38 119.31 2qx6 h ARG 31 Ca 0.16 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2qx6 h ARG 31 Cb 0.32 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 2qx6 h ARG 31 CO 0.00 0.57 0.00 1.04 -1.51 0.00 0.00 179.97 180.07 2qx6 n GLN 32 N -4.42 0.20 -0.14 0.20 6.02 -0.81 -4.87 117.38 113.57 2qx6 n GLN 32 Ca 0.06 0.44 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 2qx6 n GLN 32 Cb 0.07 -1.89 0.00 0.00 1.02 0.00 0.00 30.24 29.44 2qx6 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qx6 n GLY 33 N -0.05 0.76 3.80 1.08 0.00 -0.13 -2.56 105.19 108.09 2qx6 n GLY 33 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2qx6 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qx6 s THR 35 N -2.62 5.04 -0.02 0.00 2.01 -0.04 -4.45 115.64 115.56 2qx6 s THR 35 Ca 0.63 1.35 0.03 0.00 0.31 0.00 0.00 61.69 64.01 2qx6 s THR 35 Cb -0.16 -3.99 -0.00 0.00 0.01 0.00 0.00 72.50 68.35 2qx6 s THR 35 CO 0.44 0.29 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.85 2qx6 s VAL 36 N 0.62 0.94 -0.01 3.82 1.01 -1.26 -0.53 120.40 124.99 2qx6 s VAL 36 Ca 0.35 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.88 2qx6 s VAL 36 Cb -0.17 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 2qx6 s VAL 36 CO 0.17 0.27 -0.10 -0.89 0.00 0.00 0.00 175.10 174.55 2qx6 s THR 37 N -0.09 0.78 -0.10 3.92 2.01 -0.40 -4.99 115.64 116.77 2qx6 s THR 37 Ca 0.01 -0.42 0.03 0.00 0.31 0.00 0.00 61.69 61.63 2qx6 s THR 37 Cb -0.07 -0.66 0.01 0.00 0.01 0.00 0.00 72.50 71.79 2qx6 s THR 37 CO 0.00 0.22 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.26 2qx6 s VAL 38 N -0.19 1.82 -0.54 3.82 1.01 -1.26 -0.54 120.40 124.52 2qx6 s VAL 38 Ca 0.03 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 2qx6 s VAL 38 Cb -0.04 -1.60 0.13 0.00 0.00 0.00 0.00 36.38 34.87 2qx6 s VAL 38 CO -0.00 0.51 0.48 -0.44 0.00 0.00 0.00 175.10 175.64 2qx6 s SER 39 N 0.54 6.10 -0.90 3.32 0.01 0.17 -4.96 113.70 117.98 2qx6 s SER 39 Ca -0.15 -1.90 -0.20 0.00 1.31 0.00 0.00 55.95 55.01 2qx6 s SER 39 Cb -0.17 -2.16 0.11 0.00 0.21 0.00 0.00 66.02 64.02 2qx6 s SER 39 CO 0.05 -0.79 1.14 -0.62 0.41 0.00 0.00 173.24 173.43 2qx6 s ASP 40 N 3.23 6.55 0.18 2.44 -1.08 -1.26 -1.19 116.67 125.54 2qx6 s ASP 40 Ca 0.05 -1.84 -0.15 0.00 -0.52 0.00 0.00 52.55 50.10 2qx6 s ASP 40 Cb -0.28 -2.42 0.15 0.00 -1.46 0.00 0.00 42.92 38.92 2qx6 s ASP 40 CO 0.01 -1.16 1.68 -0.07 0.52 0.00 0.00 175.17 176.15 2qx6 h LEU 41 N 10.78 -0.22 -0.81 -1.34 3.38 -1.72 -0.45 115.31 124.93 2qx6 h LEU 41 Ca 0.10 0.11 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 2qx6 h LEU 41 Cb 1.03 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2qx6 h LEU 41 CO 1.15 -0.07 -0.24 1.88 0.09 0.00 0.00 178.44 181.25 2qx6 h TYR 42 N 0.10 0.71 -0.16 1.13 0.05 -1.84 -0.90 116.97 116.06 2qx6 h TYR 42 Ca 0.23 -0.16 -0.10 0.00 0.05 0.00 0.00 58.73 58.76 2qx6 h TYR 42 Cb 0.34 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 2qx6 h TYR 42 CO -0.31 0.81 -0.32 0.00 -1.05 0.00 0.00 178.16 177.30 2qx6 h ALA 43 N 1.19 1.16 -0.00 3.88 0.00 -1.74 -1.57 119.26 122.18 2qx6 h ALA 43 Ca 0.08 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2qx6 h ALA 43 Cb 0.70 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2qx6 h ALA 43 CO 0.05 0.54 -0.06 -1.33 0.00 0.00 0.00 179.25 178.46 2qx6 n MET 44 N -4.09 0.44 -3.95 0.00 2.81 -0.23 -4.90 117.12 107.20 2qx6 n MET 44 Ca -0.01 -0.07 -0.29 0.00 -1.81 0.00 0.00 57.70 55.52 2qx6 n MET 44 Cb 0.42 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.44 2qx6 n MET 44 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qx6 n ASN 45 N -1.22 -3.12 -4.65 7.83 5.15 -0.58 -4.83 115.26 113.84 2qx6 n ASN 45 Ca 0.13 -0.87 -0.47 0.00 -0.60 0.00 0.00 54.58 52.77 2qx6 n ASN 45 Cb 0.27 -3.55 -0.04 0.00 -0.53 0.00 0.00 39.78 35.93 2qx6 n ASN 45 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 2qx6 n PHE 46 N -4.51 2.07 -2.32 1.20 7.35 -0.45 -4.90 117.46 115.90 2qx6 n PHE 46 Ca -0.07 0.37 -0.43 0.00 -0.76 0.00 0.00 57.45 56.57 2qx6 n PHE 46 Cb 0.57 -2.48 -0.02 0.00 0.35 0.00 0.00 39.48 37.89 2qx6 n PHE 46 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 2qx6 s GLU 47 N 0.70 4.03 0.18 -4.13 2.56 -1.26 -4.92 118.70 115.87 2qx6 s GLU 47 Ca 0.79 1.56 0.21 0.00 0.00 0.00 0.00 54.97 57.53 2qx6 s GLU 47 Cb -0.74 -3.88 -0.01 0.00 2.00 0.00 0.00 34.13 31.49 2qx6 s GLU 47 CO 0.41 -0.98 1.04 -1.35 -0.56 0.00 0.00 175.26 173.82 2qx6 h PRO 48 N 9.21 0.00 -6.55 4.30 0.11 -1.89 -3.44 132.00 133.74 2qx6 h PRO 48 Ca -0.29 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.30 2qx6 h PRO 48 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2qx6 h PRO 48 CO 1.00 0.11 0.43 1.03 -0.21 0.00 0.00 178.00 180.36 2qx6 s ARG 49 N -3.21 4.59 -0.60 1.05 0.52 -1.26 -4.32 118.95 115.73 2qx6 s ARG 49 Ca -0.00 1.59 -0.23 0.00 -0.52 0.00 0.00 55.73 56.56 2qx6 s ARG 49 Cb 0.09 -3.35 0.06 0.00 0.52 0.00 0.00 34.95 32.26 2qx6 s ARG 49 CO 0.79 0.04 0.92 0.00 0.02 0.00 0.00 175.30 177.07 2qx6 s ALA 50 N 0.29 3.16 0.32 2.13 0.00 -1.26 -4.97 121.76 121.43 2qx6 s ALA 50 Ca 0.51 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.93 2qx6 s ALA 50 Cb -0.26 -3.76 -0.04 0.00 0.00 0.00 0.00 23.12 19.06 2qx6 s ALA 50 CO 0.31 -2.53 0.13 0.95 0.00 0.00 0.00 175.76 174.62 2qx6 s THR 51 N 3.88 0.52 -1.02 0.00 -4.23 -1.26 -5.02 115.64 108.51 2qx6 s THR 51 Ca 0.25 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.85 2qx6 s THR 51 Cb -0.15 -2.53 0.08 0.00 1.34 0.00 0.00 72.50 71.24 2qx6 s THR 51 CO 0.14 0.00 1.30 -0.90 -0.54 0.00 0.00 174.62 174.62 2qx6 n ASP 52 N -0.91 0.00 0.09 3.99 5.68 -1.26 -1.48 116.55 122.65 2qx6 n ASP 52 Ca -0.01 0.48 0.11 0.00 -0.50 0.00 0.00 54.79 54.88 2qx6 n ASP 52 Cb 0.65 -0.49 0.45 0.00 -1.14 0.00 0.00 41.12 40.59 2qx6 n ASP 52 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2qx6 n LYS 53 N -1.49 0.15 0.00 0.11 4.76 -1.26 -2.64 118.16 117.80 2qx6 n LYS 53 Ca 0.02 0.31 0.12 0.00 -2.87 0.00 0.00 58.31 55.89 2qx6 n LYS 53 Cb 0.11 -1.75 0.58 0.00 -1.84 0.00 0.00 35.03 32.13 2qx6 n LYS 53 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2qx6 n ASP 54 N -2.04 0.00 -4.20 4.39 8.00 -0.55 -4.61 116.55 117.54 2qx6 n ASP 54 Ca 0.03 0.08 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 2qx6 n ASP 54 Cb 0.27 -0.34 -0.17 0.00 -0.02 0.00 0.00 41.12 40.86 2qx6 n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qx6 s ILE 55 N -2.68 1.94 -0.78 0.53 1.09 -1.08 -1.12 121.20 119.10 2qx6 s ILE 55 Ca 0.20 -0.96 0.16 0.00 -1.10 0.00 0.00 60.65 58.95 2qx6 s ILE 55 Cb 0.16 -1.68 -0.17 0.00 -1.06 0.00 0.00 42.46 39.71 2qx6 s ILE 55 CO 0.38 0.53 0.69 0.35 -0.10 0.00 0.00 174.94 176.80 2qx6 n THR 56 N 3.49 0.00 -2.90 2.92 -2.24 0.34 -4.93 114.28 110.97 2qx6 n THR 56 Ca -0.19 -0.12 -0.04 0.00 -2.27 0.00 0.00 64.05 61.42 2qx6 n THR 56 Cb 0.53 1.01 0.01 0.00 -2.10 0.00 0.00 70.33 69.78 2qx6 n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qx6 n GLY 57 N 1.38 1.75 3.74 3.38 0.00 -1.26 -5.04 105.19 109.13 2qx6 n GLY 57 Ca 0.03 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 2qx6 n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qx6 s THR 58 N 0.21 2.67 0.52 2.61 2.01 -1.26 -4.97 115.64 117.43 2qx6 s THR 58 Ca 0.12 0.53 -0.19 0.00 0.31 0.00 0.00 61.69 62.45 2qx6 s THR 58 Cb -0.01 -3.34 -0.07 0.00 0.01 0.00 0.00 72.50 69.09 2qx6 s THR 58 CO 0.07 0.07 1.07 -0.76 -0.69 0.00 0.00 174.62 174.38 2qx6 s LEU 59 N 0.15 3.77 0.22 4.42 1.43 -1.26 -4.94 118.68 122.47 2qx6 s LEU 59 Ca 0.63 2.00 0.05 0.00 -1.03 0.00 0.00 54.13 55.77 2qx6 s LEU 59 Cb -0.42 -4.56 0.18 0.00 0.03 0.00 0.00 46.19 41.41 2qx6 s LEU 59 CO 0.39 -0.98 1.51 0.77 0.23 0.00 0.00 176.35 178.27 2qx6 h SER 60 N 1.31 0.23 -2.62 2.29 4.64 -1.93 -3.37 113.55 114.10 2qx6 h SER 60 Ca -0.49 -0.15 -0.59 0.00 -0.47 0.00 0.00 61.79 60.09 2qx6 h SER 60 Cb 1.23 -0.07 -0.39 0.00 -0.31 0.00 0.00 62.40 62.87 2qx6 h SER 60 CO 0.58 0.85 -0.88 0.21 -0.87 0.00 0.00 176.83 176.72 2qx6 s ASN 61 N -6.90 2.49 0.00 4.97 3.84 -1.26 -4.98 114.94 113.11 2qx6 s ASN 61 Ca -0.03 -2.67 0.16 0.00 0.21 0.00 0.00 52.86 50.53 2qx6 s ASN 61 Cb 0.11 -0.54 0.92 0.00 -0.55 0.00 0.00 41.25 41.20 2qx6 s ASN 61 CO 0.80 -0.24 1.43 -0.81 -2.79 0.00 0.00 177.10 175.49 2qx6 n PRO 62 N 3.40 0.40 0.04 0.43 -0.04 -1.26 -3.05 135.00 134.92 2qx6 n PRO 62 Ca 0.19 0.06 -0.19 0.00 -0.04 0.00 0.00 63.50 63.52 2qx6 n PRO 62 Cb 0.41 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.23 2qx6 n PRO 62 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2qx6 h GLU 63 N 0.00 0.26 -3.50 0.54 4.39 -1.96 -3.44 114.58 110.87 2qx6 h GLU 63 Ca 0.00 -0.44 -0.55 0.00 0.34 0.00 0.00 59.36 58.71 2qx6 h GLU 63 Cb 0.06 0.16 -0.40 0.00 -0.10 0.00 0.00 28.75 28.48 2qx6 h GLU 63 CO 0.00 1.12 -0.76 0.08 -1.16 0.00 0.00 179.01 178.28 2qx6 s VAL 64 N -2.59 0.62 -0.18 3.13 1.01 -1.17 -5.11 120.40 116.11 2qx6 s VAL 64 Ca -0.14 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 2qx6 s VAL 64 Cb 0.07 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 2qx6 s VAL 64 CO 0.82 -0.43 1.29 0.12 0.00 0.00 0.00 175.10 176.90 2qx6 s PHE 65 N 1.78 2.78 -0.28 5.22 5.36 -1.26 -4.79 117.98 126.79 2qx6 s PHE 65 Ca 0.04 0.95 0.03 0.00 -0.96 0.00 0.00 56.93 56.98 2qx6 s PHE 65 Cb -0.17 -3.57 0.07 0.00 -0.34 0.00 0.00 43.02 39.01 2qx6 s PHE 65 CO -0.17 -1.80 -0.04 1.21 -1.46 0.00 0.00 175.22 172.96 2qx6 s ASN 66 N 2.16 4.38 0.19 6.13 3.84 -1.26 -5.03 114.94 125.36 2qx6 s ASN 66 Ca 0.56 -1.59 -0.12 0.00 0.21 0.00 0.00 52.86 51.91 2qx6 s ASN 66 Cb -0.22 -1.45 0.21 0.00 -0.55 0.00 0.00 41.25 39.25 2qx6 s ASN 66 CO 0.16 -0.27 1.72 0.22 -2.79 0.00 0.00 177.10 176.14 2qx6 h TYR 67 N 7.78 0.17 -0.31 0.43 3.20 -1.97 0.85 116.97 127.12 2qx6 h TYR 67 Ca -0.14 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.76 2qx6 h TYR 67 Cb 1.04 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.30 2qx6 h TYR 67 CO 0.54 -0.01 0.19 0.78 -1.64 0.00 0.00 178.16 178.02 2qx6 h GLY 68 N 0.24 0.46 0.81 1.82 0.00 -1.98 0.54 103.07 104.96 2qx6 h GLY 68 Ca 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 2qx6 h GLY 68 CO -0.34 0.19 0.01 -2.08 0.00 0.00 0.00 176.54 174.32 2qx6 h VAL 69 N 0.40 1.24 -0.54 4.60 2.07 -1.92 -1.35 116.25 120.75 2qx6 h VAL 69 Ca 0.11 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 2qx6 h VAL 69 Cb 0.02 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 2qx6 h VAL 69 CO -0.02 0.24 0.04 -0.33 0.02 0.00 0.00 177.57 177.52 2qx6 h GLU 70 N 0.05 0.90 -0.01 1.57 4.39 -0.71 -1.67 114.58 119.10 2qx6 h GLU 70 Ca 0.05 -0.24 -0.18 0.00 0.34 0.00 0.00 59.36 59.33 2qx6 h GLU 70 Cb 0.35 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2qx6 h GLU 70 CO 0.01 0.87 -0.80 1.79 -1.16 0.00 0.00 179.01 179.72 2qx6 h THR 71 N 0.84 1.48 -0.20 1.13 1.35 -0.88 -0.24 112.91 116.39 2qx6 h THR 71 Ca 0.17 -2.48 -0.00 0.00 -0.55 0.00 0.00 66.41 63.54 2qx6 h THR 71 Cb 0.44 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 69.21 2qx6 h THR 71 CO 0.02 0.72 0.11 -0.74 -0.25 0.00 0.00 175.52 175.38 2qx6 h HIS 72 N 0.10 0.27 -0.56 4.73 -0.00 -0.97 0.09 115.15 118.81 2qx6 h HIS 72 Ca -0.03 -0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.23 2qx6 h HIS 72 Cb 1.39 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 28.69 2qx6 h HIS 72 CO 0.02 0.25 -0.08 1.49 -0.00 0.00 0.00 177.93 179.61 2qx6 h GLU 73 N 0.21 1.04 -0.53 5.26 4.57 -1.26 -2.57 114.58 121.30 2qx6 h GLU 73 Ca 0.07 -0.37 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 2qx6 h GLU 73 Cb 0.07 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2qx6 h GLU 73 CO -0.01 1.06 0.11 0.00 -1.18 0.00 0.00 179.01 178.99 2qx6 h ALA 74 N 0.94 1.19 -0.20 2.92 0.00 -0.89 -0.91 119.26 122.32 2qx6 h ALA 74 Ca 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qx6 h ALA 74 Cb 0.64 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2qx6 h ALA 74 CO 0.04 0.55 0.12 -0.92 0.00 0.00 0.00 179.25 179.04 2qx6 h TYR 75 N 0.79 0.25 -0.14 0.00 3.20 -0.68 0.41 116.97 120.80 2qx6 h TYR 75 Ca 0.17 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 2qx6 h TYR 75 Cb 0.32 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2qx6 h TYR 75 CO 0.02 0.19 -0.17 0.87 -1.64 0.00 0.00 178.16 177.42 2qx6 h LYS 76 N 0.24 0.23 0.00 1.82 1.57 -1.13 -2.78 116.57 116.52 2qx6 h LYS 76 Ca 0.07 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qx6 h LYS 76 Cb 0.01 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2qx6 h LYS 76 CO -0.01 0.41 -0.60 1.04 -0.57 0.00 0.00 179.45 179.71 2qx6 n GLN 77 N -4.24 0.18 -2.92 3.15 1.13 -0.38 -4.97 117.38 109.33 2qx6 n GLN 77 Ca -0.01 0.04 -0.11 0.00 -1.94 0.00 0.00 57.00 54.98 2qx6 n GLN 77 Cb 0.30 -1.60 0.05 0.00 0.11 0.00 0.00 30.24 29.10 2qx6 n GLN 77 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2qx6 n ARG 78 N -1.86 -4.11 -0.31 -1.09 1.74 0.12 -4.96 116.66 106.19 2qx6 n ARG 78 Ca 0.04 0.49 0.08 0.00 -0.77 0.00 0.00 57.85 57.70 2qx6 n ARG 78 Cb 0.40 -4.48 0.16 0.00 -1.02 0.00 0.00 32.46 27.52 2qx6 n ARG 78 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qx6 n SER 79 N -1.93 2.00 -4.85 0.55 3.41 0.07 -5.03 113.62 107.83 2qx6 n SER 79 Ca -0.12 -3.33 -0.32 0.00 -0.26 0.00 0.00 58.87 54.85 2qx6 n SER 79 Cb 0.58 -0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 64.04 2qx6 n SER 79 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qx6 s LEU 80 N -2.84 3.64 0.57 1.04 1.43 -1.25 -0.50 118.68 120.77 2qx6 s LEU 80 Ca 0.33 1.50 -0.21 0.00 -1.03 0.00 0.00 54.13 54.72 2qx6 s LEU 80 Cb 0.31 -4.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 2qx6 s LEU 80 CO -0.01 -0.57 1.29 0.00 0.23 0.00 0.00 176.35 177.29 2qx6 n ALA 81 N -1.58 1.29 0.23 4.21 0.00 -0.28 -4.79 120.51 119.60 2qx6 n ALA 81 Ca 0.06 0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.67 2qx6 n ALA 81 Cb 0.54 -2.31 0.57 0.00 0.00 0.00 0.00 19.45 18.25 2qx6 n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qx6 h SER 82 N 1.13 0.00 0.14 0.00 4.64 -1.95 -2.45 113.55 115.06 2qx6 h SER 82 Ca -0.50 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.74 2qx6 h SER 82 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2qx6 h SER 82 CO 0.55 0.19 -0.28 -2.24 -0.87 0.00 0.00 176.83 174.18 2qx6 h ASP 83 N 0.00 0.24 -0.05 4.97 2.03 -2.00 0.93 116.42 122.54 2qx6 h ASP 83 Ca -0.00 -0.08 -0.03 0.00 -0.73 0.00 0.00 57.03 56.20 2qx6 h ASP 83 Cb 0.40 -0.06 -0.00 0.00 -0.83 0.00 0.00 39.33 38.84 2qx6 h ASP 83 CO 0.02 0.52 -0.08 0.40 -1.03 0.00 0.00 179.24 179.08 2qx6 h ILE 84 N 0.21 1.41 -0.26 4.15 2.04 -1.81 -2.99 117.51 120.25 2qx6 h ILE 84 Ca 0.03 -1.34 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 2qx6 h ILE 84 Cb 0.61 2.19 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 2qx6 h ILE 84 CO 0.04 0.37 -0.01 0.71 0.00 0.00 0.00 178.15 179.26 2qx6 h THR 85 N -0.35 1.17 -0.85 -0.27 1.35 -1.22 -1.01 112.91 111.73 2qx6 h THR 85 Ca 0.00 -0.65 -0.02 0.00 -0.55 0.00 0.00 66.41 65.19 2qx6 h THR 85 Cb 0.63 0.98 -0.04 0.00 -1.73 0.00 0.00 68.15 67.99 2qx6 h THR 85 CO 0.02 0.22 0.45 0.44 -0.25 0.00 0.00 175.52 176.39 2qx6 h ASP 86 N 0.38 1.08 -0.23 5.36 3.32 -0.81 -1.26 116.42 124.26 2qx6 h ASP 86 Ca 0.09 -0.10 -0.19 0.00 0.02 0.00 0.00 57.03 56.84 2qx6 h ASP 86 Cb 0.27 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2qx6 h ASP 86 CO 0.01 0.88 -0.58 -0.33 -1.72 0.00 0.00 179.24 177.50 2qx6 h GLU 87 N 1.20 0.83 -0.57 3.56 4.39 -1.18 -2.93 114.58 119.88 2qx6 h GLU 87 Ca 0.30 -0.54 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 2qx6 h GLU 87 Cb 0.06 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 2qx6 h GLU 87 CO -0.04 1.17 0.26 1.96 -1.16 0.00 0.00 179.01 181.20 2qx6 h GLN 88 N 0.63 0.80 -0.63 2.33 4.20 -0.91 -1.13 115.11 120.40 2qx6 h GLN 88 Ca 0.01 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2qx6 h GLN 88 Cb 1.18 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.78 2qx6 h GLN 88 CO 0.12 0.63 0.25 -0.22 -0.67 0.00 0.00 178.83 178.94 2qx6 h LYS 89 N 0.80 0.94 -0.45 1.46 3.64 -1.16 0.17 116.57 121.98 2qx6 h LYS 89 Ca 0.20 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2qx6 h LYS 89 Cb 0.11 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2qx6 h LYS 89 CO -0.02 0.80 0.23 0.87 -2.27 0.00 0.00 179.45 179.06 2qx6 h LYS 90 N 0.88 0.63 -0.32 1.90 1.57 -1.17 -2.34 116.57 117.72 2qx6 h LYS 90 Ca 0.21 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 2qx6 h LYS 90 Cb 0.22 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2qx6 h LYS 90 CO -0.02 0.52 0.02 0.28 -0.57 0.00 0.00 179.45 179.69 2qx6 h VAL 91 N 0.58 1.25 -0.71 0.50 2.07 -1.05 -2.26 116.25 116.63 2qx6 h VAL 91 Ca 0.15 -0.90 0.10 0.00 0.82 0.00 0.00 66.70 66.88 2qx6 h VAL 91 Cb 0.09 1.20 -0.08 0.00 -1.52 0.00 0.00 31.29 30.98 2qx6 h VAL 91 CO -0.02 0.29 0.34 -0.09 0.02 0.00 0.00 177.57 178.11 2qx6 h ARG 92 N 0.37 0.55 0.00 1.57 2.43 -0.83 -2.28 114.38 116.19 2qx6 h ARG 92 Ca 0.09 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2qx6 h ARG 92 Cb 0.40 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2qx6 h ARG 92 CO 0.01 0.36 -0.15 0.93 -1.51 0.00 0.00 179.97 179.62 2qx6 h GLU 93 N 0.57 0.00 -7.03 0.20 5.08 -1.37 -3.46 114.58 108.57 2qx6 h GLU 93 Ca 0.36 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 58.22 2qx6 h GLU 93 Cb 0.41 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.72 2qx6 h GLU 93 CO -0.29 0.09 0.45 0.00 -1.00 0.00 0.00 179.01 178.26 2qx6 s ALA 94 N -3.17 2.90 -0.15 3.43 0.00 -0.86 -4.72 121.76 119.20 2qx6 s ALA 94 Ca 0.06 0.84 0.19 0.00 0.00 0.00 0.00 51.96 53.05 2qx6 s ALA 94 Cb 0.06 -3.35 -0.27 0.00 0.00 0.00 0.00 23.12 19.56 2qx6 s ALA 94 CO 0.69 -0.59 0.23 -0.25 0.00 0.00 0.00 175.76 175.84 2qx6 n ASP 95 N -0.69 0.07 -3.82 0.00 8.00 0.70 -4.90 116.55 115.90 2qx6 n ASP 95 Ca 0.08 0.03 -0.15 0.00 0.71 0.00 0.00 54.79 55.47 2qx6 n ASP 95 Cb 0.49 1.17 -0.15 0.00 -0.02 0.00 0.00 41.12 42.61 2qx6 n ASP 95 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2qx6 s LEU 96 N -5.28 1.40 -0.18 0.64 2.96 -0.99 -1.16 118.68 116.06 2qx6 s LEU 96 Ca -0.09 0.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.83 2qx6 s LEU 96 Cb 0.08 -0.10 0.02 0.00 0.50 0.00 0.00 46.19 46.69 2qx6 s LEU 96 CO 0.85 -0.08 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.92 2qx6 s VAL 97 N 0.70 2.11 -0.15 1.68 1.01 -0.24 -0.96 120.40 124.55 2qx6 s VAL 97 Ca -0.06 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 2qx6 s VAL 97 Cb -0.09 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 2qx6 s VAL 97 CO -0.02 0.52 0.02 -0.63 0.00 0.00 0.00 175.10 175.00 2qx6 s ILE 98 N 1.29 4.44 -0.22 2.22 1.01 0.63 -1.59 121.20 128.98 2qx6 s ILE 98 Ca 0.05 -0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.47 2qx6 s ILE 98 Cb -0.13 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 2qx6 s ILE 98 CO -0.13 0.51 0.03 -0.36 0.00 0.00 0.00 174.94 175.00 2qx6 s PHE 99 N -0.02 3.08 -0.27 3.97 0.08 -0.22 -0.21 117.98 124.39 2qx6 s PHE 99 Ca 0.04 -0.41 -0.02 0.00 0.12 0.00 0.00 56.93 56.67 2qx6 s PHE 99 Cb -0.13 -2.15 0.03 0.00 -0.57 0.00 0.00 43.02 40.21 2qx6 s PHE 99 CO 0.02 -0.26 -0.04 -1.14 -0.10 0.00 0.00 175.22 173.70 2qx6 s GLN 100 N 1.21 2.70 0.06 0.44 2.00 -0.22 -0.34 119.66 125.50 2qx6 s GLN 100 Ca 0.04 -1.08 -0.26 0.00 -2.00 0.00 0.00 55.36 52.06 2qx6 s GLN 100 Cb -0.14 -3.06 0.08 0.00 0.80 0.00 0.00 33.01 30.69 2qx6 s GLN 100 CO 0.02 -0.48 0.73 -0.59 -0.50 0.00 0.00 175.29 174.47 2qx6 s PHE 101 N 1.30 -0.49 0.15 1.67 -0.12 -0.90 -1.35 117.98 118.25 2qx6 s PHE 101 Ca -0.02 0.44 -0.22 0.00 -0.05 0.00 0.00 56.93 57.08 2qx6 s PHE 101 Cb -0.18 0.52 -0.08 0.00 -0.63 0.00 0.00 43.02 42.66 2qx6 s PHE 101 CO -0.03 -0.68 0.70 -1.25 -0.05 0.00 0.00 175.22 173.90 2qx6 s PRO 102 N -2.98 4.39 0.03 1.99 0.04 -1.26 -2.03 135.00 135.18 2qx6 s PRO 102 Ca 0.00 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 61.70 2qx6 s PRO 102 Cb -0.01 -3.18 -0.06 0.00 0.04 0.00 0.00 34.50 31.29 2qx6 s PRO 102 CO -0.07 0.56 1.47 -1.17 0.04 0.00 0.00 177.00 177.83 2qx6 s LEU 103 N -1.30 4.33 -0.23 -3.56 2.96 0.11 -4.34 118.68 116.65 2qx6 s LEU 103 Ca 0.35 2.24 0.02 0.00 -0.22 0.00 0.00 54.13 56.51 2qx6 s LEU 103 Cb -0.21 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 42.96 2qx6 s LEU 103 CO 0.23 -0.76 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.06 2qx6 s TYR 104 N 2.37 3.09 -1.30 5.38 1.51 -0.14 -4.75 117.35 123.51 2qx6 s TYR 104 Ca 0.67 -2.00 -0.04 0.00 -1.01 0.00 0.00 57.07 54.69 2qx6 s TYR 104 Cb -0.34 -1.95 -0.00 0.00 -0.11 0.00 0.00 41.96 39.56 2qx6 s TYR 104 CO 0.28 -0.84 0.62 0.91 -1.11 0.00 0.00 175.55 175.42 2qx6 n TRP 105 N 4.53 -1.83 -2.03 2.71 7.02 -1.26 -1.43 117.44 125.14 2qx6 n TRP 105 Ca -0.17 0.74 -0.19 0.00 -1.02 0.00 0.00 57.50 56.86 2qx6 n TRP 105 Cb 0.45 -3.98 -0.04 0.00 -2.42 0.00 0.00 31.31 25.32 2qx6 n TRP 105 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2qx6 n PHE 106 N -4.27 -0.64 -2.58 -5.99 3.01 -1.26 -4.88 117.46 100.84 2qx6 n PHE 106 Ca -0.26 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.20 2qx6 n PHE 106 Cb 0.66 -3.55 0.00 0.00 -0.01 0.00 0.00 39.48 36.58 2qx6 n PHE 106 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2qx6 n SER 107 N -1.63 0.00 -4.88 4.37 2.88 -0.51 -4.85 113.62 109.00 2qx6 n SER 107 Ca -0.21 -0.36 -0.31 0.00 -1.33 0.00 0.00 58.87 56.66 2qx6 n SER 107 Cb 0.66 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.07 2qx6 n SER 107 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2qx6 s VAL 108 N -2.63 4.86 0.65 2.46 -7.23 -1.26 -0.97 120.40 116.29 2qx6 s VAL 108 Ca 0.00 0.51 -0.18 0.00 -1.81 0.00 0.00 61.98 60.50 2qx6 s VAL 108 Cb 0.00 -3.68 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 2qx6 s VAL 108 CO 0.00 -0.28 1.18 -2.65 -0.31 0.00 0.00 175.10 173.04 2qx6 n PRO 109 N -0.70 0.95 -0.26 4.82 -0.02 -1.26 -4.61 135.00 133.92 2qx6 n PRO 109 Ca 0.01 0.38 0.18 0.00 -2.02 0.00 0.00 63.50 62.05 2qx6 n PRO 109 Cb 0.53 -2.41 0.48 0.00 -0.02 0.00 0.00 33.50 32.08 2qx6 n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qx6 h ALA 110 N 0.36 2.12 -0.39 3.55 0.00 -1.96 -0.16 119.26 122.77 2qx6 h ALA 110 Ca -0.50 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 2qx6 h ALA 110 Cb 1.34 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2qx6 h ALA 110 CO 0.51 -0.42 0.05 0.97 0.00 0.00 0.00 179.25 180.37 2qx6 h ILE 111 N 0.47 1.20 0.09 0.00 2.10 -1.94 0.66 117.51 120.09 2qx6 h ILE 111 Ca 0.49 -0.75 -0.26 0.00 1.08 0.00 0.00 64.86 65.43 2qx6 h ILE 111 Cb 1.13 0.85 -0.00 0.00 -1.09 0.00 0.00 36.82 37.70 2qx6 h ILE 111 CO -0.21 0.26 -1.16 0.25 -1.08 0.00 0.00 178.15 176.21 2qx6 h LEU 112 N 0.58 0.36 -1.22 2.19 5.85 -1.43 -2.82 115.31 118.81 2qx6 h LEU 112 Ca 0.13 -0.37 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 2qx6 h LEU 112 Cb 0.29 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2qx6 h LEU 112 CO 0.00 1.27 0.11 0.50 -0.34 0.00 0.00 178.44 179.99 2qx6 h LYS 113 N 0.08 0.65 -0.29 1.25 1.63 -0.67 -1.52 116.57 117.70 2qx6 h LYS 113 Ca -0.11 -0.11 -0.07 0.00 -0.85 0.00 0.00 60.65 59.51 2qx6 h LYS 113 Cb 1.88 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 33.39 2qx6 h LYS 113 CO 0.19 0.59 -0.13 0.78 -3.45 0.00 0.00 179.45 177.43 2qx6 h GLY 114 N 0.85 0.53 0.89 5.01 0.00 -0.79 0.31 103.07 109.86 2qx6 h GLY 114 Ca 0.15 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 2qx6 h GLY 114 CO -0.00 0.34 0.03 -0.25 0.00 0.00 0.00 176.54 176.66 2qx6 h TRP 115 N 0.45 0.55 -0.27 5.60 7.01 -1.09 -0.26 115.95 127.94 2qx6 h TRP 115 Ca 0.08 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 2qx6 h TRP 115 Cb 0.50 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 2qx6 h TRP 115 CO 0.02 0.61 0.11 0.52 -2.79 0.00 0.00 178.44 176.91 2qx6 h MET 116 N 0.32 0.39 -0.81 2.65 2.86 -0.85 0.40 114.93 119.90 2qx6 h MET 116 Ca 0.09 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2qx6 h MET 116 Cb 0.37 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 2qx6 h MET 116 CO 0.01 0.42 0.53 -0.44 1.06 0.00 0.00 176.91 178.49 2qx6 h ASP 117 N 0.28 0.93 0.35 1.22 3.32 -0.81 -2.63 116.42 119.08 2qx6 h ASP 117 Ca 0.09 -0.03 -0.32 0.00 0.02 0.00 0.00 57.03 56.79 2qx6 h ASP 117 Cb 0.17 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 2qx6 h ASP 117 CO -0.01 0.67 -1.84 0.54 -1.72 0.00 0.00 179.24 176.88 2qx6 n ARG 118 N -4.52 0.68 0.08 3.56 1.74 -0.12 -4.50 116.66 113.58 2qx6 n ARG 118 Ca 0.08 0.27 -0.21 0.00 -0.77 0.00 0.00 57.85 57.22 2qx6 n ARG 118 Cb 0.02 -1.75 -0.15 0.00 -1.02 0.00 0.00 32.46 29.56 2qx6 n ARG 118 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2qx6 h VAL 119 N 0.02 1.06 -0.63 1.55 2.07 -0.98 -3.38 116.25 115.96 2qx6 h VAL 119 Ca -0.35 -2.64 -0.71 0.00 0.82 0.00 0.00 66.70 63.82 2qx6 h VAL 119 Cb 2.03 2.80 -0.06 0.00 -1.52 0.00 0.00 31.29 34.54 2qx6 h VAL 119 CO 0.08 0.84 2.97 0.18 0.02 0.00 0.00 177.57 181.65 2qx6 n LEU 120 N -3.56 7.97 -4.91 2.57 4.77 -0.99 -4.80 117.00 118.06 2qx6 n LEU 120 Ca -0.21 -4.58 -0.27 0.00 -0.03 0.00 0.00 56.01 50.92 2qx6 n LEU 120 Cb 1.07 -1.49 0.02 0.00 -2.33 0.00 0.00 43.42 40.70 2qx6 n LEU 120 CO 0.52 1.85 0.55 0.00 -1.33 0.00 0.00 177.39 178.99 2qx6 s GLN 122 N -4.98 4.25 0.00 0.00 0.74 -1.26 -1.35 119.66 117.06 2qx6 s GLN 122 Ca 0.53 2.36 0.00 0.00 0.05 0.00 0.00 55.36 58.30 2qx6 s GLN 122 Cb -0.11 -3.03 0.00 0.00 1.10 0.00 0.00 33.01 30.97 2qx6 s GLN 122 CO 0.46 -0.34 0.00 0.41 -0.55 0.00 0.00 175.29 175.27 2qx6 n GLY 123 N 0.81 3.01 0.28 2.59 0.00 0.96 -4.41 105.19 108.44 2qx6 n GLY 123 Ca 0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 2qx6 n GLY 123 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qx6 n PHE 124 N 0.00 0.00 -0.02 1.61 7.35 -0.78 -4.79 117.46 120.83 2qx6 n PHE 124 Ca 0.00 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.67 2qx6 n PHE 124 Cb 0.00 -0.62 -0.12 0.00 0.35 0.00 0.00 39.48 39.08 2qx6 n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qx6 n ALA 125 N -4.14 1.88 -3.78 3.13 0.00 -0.45 -4.62 120.51 112.53 2qx6 n ALA 125 Ca -0.29 -0.79 -0.08 0.00 0.00 0.00 0.00 53.44 52.29 2qx6 n ALA 125 Cb 0.63 -0.70 -0.02 0.00 0.00 0.00 0.00 19.45 19.36 2qx6 n ALA 125 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2qx6 s PHE 126 N -2.85 -0.24 0.15 0.00 -0.71 -1.25 -1.89 117.98 111.18 2qx6 s PHE 126 Ca -0.06 -0.17 -0.06 0.00 -1.04 0.00 0.00 56.93 55.60 2qx6 s PHE 126 Cb 0.09 0.68 -0.02 0.00 -1.21 0.00 0.00 43.02 42.56 2qx6 s PHE 126 CO 0.83 -1.14 0.21 0.34 -1.34 0.00 0.00 175.22 174.12 2qx6 s ASP 127 N -2.89 0.13 -0.37 1.98 -1.08 -0.32 -0.03 116.67 114.09 2qx6 s ASP 127 Ca 0.09 -0.99 0.00 0.00 -0.52 0.00 0.00 52.55 51.14 2qx6 s ASP 127 Cb -0.05 0.39 0.10 0.00 -1.46 0.00 0.00 42.92 41.90 2qx6 s ASP 127 CO 0.03 -0.84 0.13 -0.63 0.52 0.00 0.00 175.17 174.39 2qx6 s ILE 128 N -4.00 2.85 0.79 4.11 -1.09 -1.26 -1.22 121.20 121.38 2qx6 s ILE 128 Ca 0.20 -2.15 -0.12 0.00 -2.23 0.00 0.00 60.65 56.35 2qx6 s ILE 128 Cb 0.05 -2.99 0.07 0.00 -1.58 0.00 0.00 42.46 38.00 2qx6 s ILE 128 CO 0.01 -0.63 1.14 -2.16 -1.23 0.00 0.00 174.94 172.07 2qx6 s PRO 129 N 1.05 2.14 0.00 2.79 0.04 -1.26 -5.14 135.00 134.62 2qx6 s PRO 129 Ca 0.09 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.43 2qx6 s PRO 129 Cb -0.21 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2qx6 s PRO 129 CO -0.06 -1.51 0.00 0.41 0.04 0.00 0.00 177.00 175.88 2qx6 n GLY 130 N -2.92 0.24 3.42 0.56 0.00 -0.36 -5.09 105.19 101.05 2qx6 n GLY 130 Ca 0.07 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 2qx6 n GLY 130 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qx6 s PHE 131 N 0.00 0.76 0.00 1.61 -0.12 -1.23 -1.18 117.98 117.82 2qx6 s PHE 131 Ca 0.00 -1.05 0.00 0.00 -0.05 0.00 0.00 56.93 55.83 2qx6 s PHE 131 Cb 0.00 -0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.25 2qx6 s PHE 131 CO 0.00 -0.87 0.00 0.66 -0.05 0.00 0.00 175.22 174.96 2qx6 n TYR 132 N -0.36 0.00 0.21 3.49 4.01 0.15 -1.28 117.16 123.38 2qx6 n TYR 132 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.83 2qx6 n TYR 132 Cb 0.63 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 40.08 2qx6 n TYR 132 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2qx6 n ASP 133 N 6.00 0.41 -1.07 7.72 8.00 -1.26 -0.59 116.55 135.76 2qx6 n ASP 133 Ca 0.00 0.66 0.08 0.00 0.71 0.00 0.00 54.79 56.25 2qx6 n ASP 133 Cb 0.00 -0.73 0.26 0.00 -0.02 0.00 0.00 41.12 40.63 2qx6 n ASP 133 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2qx6 n SER 134 N -2.02 3.73 -4.54 -2.24 7.64 -0.40 -4.96 113.62 110.83 2qx6 n SER 134 Ca 0.00 -2.21 -0.35 0.00 1.01 0.00 0.00 58.87 57.32 2qx6 n SER 134 Cb 0.08 -0.41 0.09 0.00 -1.01 0.00 0.00 64.21 62.96 2qx6 n SER 134 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qx6 n GLY 135 N 0.85 -1.05 0.21 0.23 0.00 0.24 -3.52 105.19 102.15 2qx6 n GLY 135 Ca 0.19 -0.44 0.15 0.00 0.00 0.00 0.00 46.02 45.92 2qx6 n GLY 135 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qx6 h LEU 136 N -0.60 0.00 -3.09 0.99 3.38 -1.17 -2.72 115.31 112.11 2qx6 h LEU 136 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2qx6 h LEU 136 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2qx6 h LEU 136 CO 0.43 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.14 2qx6 n LEU 137 N -2.75 4.87 -4.64 1.67 4.77 0.26 -4.97 117.00 116.22 2qx6 n LEU 137 Ca 0.02 -2.47 -0.39 0.00 -0.03 0.00 0.00 56.01 53.13 2qx6 n LEU 137 Cb 0.31 -0.65 0.03 0.00 -2.33 0.00 0.00 43.42 40.79 2qx6 n LEU 137 CO 0.26 0.57 0.64 0.00 -1.33 0.00 0.00 177.39 177.52 2qx6 n GLN 138 N 0.54 1.24 0.00 3.23 10.64 -1.03 -1.94 117.38 130.07 2qx6 n GLN 138 Ca 0.23 0.46 0.00 0.00 -1.83 0.00 0.00 57.00 55.86 2qx6 n GLN 138 Cb 1.02 -2.19 0.00 0.00 -0.86 0.00 0.00 30.24 28.21 2qx6 n GLN 138 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2qx6 n GLY 139 N 1.15 3.33 3.88 2.61 0.00 -1.26 -5.00 105.19 109.91 2qx6 n GLY 139 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2qx6 n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qx6 s LYS 140 N -0.69 3.72 0.05 1.61 1.02 -0.82 -4.23 119.74 120.40 2qx6 s LYS 140 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.11 2qx6 s LYS 140 Cb 0.00 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2qx6 s LYS 140 CO 0.00 0.41 0.18 -0.51 -0.92 0.00 0.00 175.35 174.50 2qx6 s LEU 141 N -2.65 4.24 0.04 3.17 1.43 -0.31 0.49 118.68 125.08 2qx6 s LEU 141 Ca 0.43 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 2qx6 s LEU 141 Cb -0.12 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 2qx6 s LEU 141 CO 0.22 0.18 -0.06 0.00 0.23 0.00 0.00 176.35 176.93 2qx6 s ALA 142 N -1.46 0.44 -0.15 4.21 0.00 -0.11 -1.08 121.76 123.62 2qx6 s ALA 142 Ca 0.33 -0.75 -0.09 0.00 0.00 0.00 0.00 51.96 51.45 2qx6 s ALA 142 Cb -0.13 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.13 2qx6 s ALA 142 CO 0.25 -0.08 0.36 -1.17 0.00 0.00 0.00 175.76 175.12 2qx6 s LEU 143 N -1.64 0.24 -0.27 0.00 0.20 -0.62 -0.39 118.68 116.20 2qx6 s LEU 143 Ca -0.11 0.76 -0.12 0.00 0.69 0.00 0.00 54.13 55.36 2qx6 s LEU 143 Cb -0.09 1.18 -0.05 0.00 -0.43 0.00 0.00 46.19 46.81 2qx6 s LEU 143 CO -0.01 -0.17 0.22 -0.76 -0.29 0.00 0.00 176.35 175.34 2qx6 s LEU 144 N 1.00 4.04 -0.42 -0.68 1.43 -1.26 -1.06 118.68 121.72 2qx6 s LEU 144 Ca -0.07 0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.04 2qx6 s LEU 144 Cb -0.07 -2.17 0.10 0.00 0.03 0.00 0.00 46.19 44.08 2qx6 s LEU 144 CO -0.08 -0.05 0.24 -0.55 0.23 0.00 0.00 176.35 176.14 2qx6 s SER 145 N 1.62 5.44 0.06 2.29 0.15 0.54 -0.50 113.70 123.30 2qx6 s SER 145 Ca 0.08 -1.81 0.05 0.00 0.70 0.00 0.00 55.95 54.98 2qx6 s SER 145 Cb -0.16 -1.91 -0.04 0.00 -1.71 0.00 0.00 66.02 62.21 2qx6 s SER 145 CO 0.10 -0.56 -0.08 -0.69 1.20 0.00 0.00 173.24 173.20 2qx6 s VAL 146 N 1.28 3.48 0.16 4.45 1.01 0.65 -2.11 120.40 129.33 2qx6 s VAL 146 Ca 0.05 -1.06 0.10 0.00 0.00 0.00 0.00 61.98 61.07 2qx6 s VAL 146 Cb -0.24 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 2qx6 s VAL 146 CO -0.02 0.23 -0.18 0.42 0.00 0.00 0.00 175.10 175.56 2qx6 s THR 147 N -1.12 2.77 0.30 3.92 -4.23 -0.86 -0.64 115.64 115.78 2qx6 s THR 147 Ca 0.20 -1.73 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 2qx6 s THR 147 Cb -0.11 -2.32 -0.06 0.00 1.34 0.00 0.00 72.50 71.35 2qx6 s THR 147 CO 0.11 -0.04 0.03 0.42 -0.54 0.00 0.00 174.62 174.60 2qx6 s THR 148 N -1.48 1.23 -0.15 3.99 -4.23 -0.98 -0.71 115.64 113.31 2qx6 s THR 148 Ca 0.21 -2.03 0.01 0.00 -1.18 0.00 0.00 61.69 58.70 2qx6 s THR 148 Cb -0.09 -2.64 -0.23 0.00 1.34 0.00 0.00 72.50 70.87 2qx6 s THR 148 CO 0.11 -0.12 0.24 0.61 -0.54 0.00 0.00 174.62 174.93 2qx6 n GLY 149 N -0.61 -0.63 3.83 3.99 0.00 -1.26 -2.24 105.19 108.28 2qx6 n GLY 149 Ca -0.03 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2qx6 n GLY 149 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qx6 s GLY 150 N -5.72 2.20 0.76 -0.02 0.00 -1.26 -4.39 107.32 98.88 2qx6 s GLY 150 Ca -0.21 0.28 -0.12 0.00 0.00 0.00 0.00 44.72 44.67 2qx6 s GLY 150 CO 0.74 0.56 1.12 -0.51 0.00 0.00 0.00 173.10 175.01 2qx6 s THR 151 N -2.44 2.99 0.28 0.90 -4.23 -1.26 -3.13 115.64 108.76 2qx6 s THR 151 Ca 0.60 0.32 -0.01 0.00 -1.18 0.00 0.00 61.69 61.43 2qx6 s THR 151 Cb -0.10 -3.26 0.28 0.00 1.34 0.00 0.00 72.50 70.76 2qx6 s THR 151 CO 0.24 -0.42 1.88 0.00 -0.54 0.00 0.00 174.62 175.78 2qx6 h ALA 152 N -0.87 1.47 -0.93 3.99 0.00 -1.94 -1.71 119.26 119.27 2qx6 h ALA 152 Ca -0.46 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.44 2qx6 h ALA 152 Cb 1.28 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 2qx6 h ALA 152 CO 0.63 0.37 0.61 1.49 0.00 0.00 0.00 179.25 182.36 2qx6 h GLU 153 N 1.09 1.23 0.00 0.00 4.57 -2.00 -0.95 114.58 118.52 2qx6 h GLU 153 Ca 0.43 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.49 2qx6 h GLU 153 Cb 0.24 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2qx6 h GLU 153 CO -0.18 0.82 -0.22 0.52 -1.18 0.00 0.00 179.01 178.77 2qx6 h MET 154 N 1.27 0.00 -2.08 1.92 2.86 -1.68 -3.16 114.93 114.05 2qx6 h MET 154 Ca 0.34 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 57.30 2qx6 h MET 154 Cb -0.14 0.00 -0.23 0.00 0.06 0.00 0.00 31.60 31.30 2qx6 h MET 154 CO -0.07 0.22 0.94 0.66 1.06 0.00 0.00 176.91 179.72 2qx6 n TYR 155 N -3.92 2.44 -4.42 -0.22 4.01 -0.36 -1.41 117.16 113.28 2qx6 n TYR 155 Ca -0.02 -2.26 -0.20 0.00 -0.16 0.00 0.00 57.90 55.26 2qx6 n TYR 155 Cb 0.30 -1.31 -0.10 0.00 -0.31 0.00 0.00 39.34 37.92 2qx6 n TYR 155 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2qx6 s THR 156 N -3.69 1.17 0.31 -0.72 -4.23 -0.95 -2.26 115.64 105.27 2qx6 s THR 156 Ca 0.53 -2.02 0.06 0.00 -1.18 0.00 0.00 61.69 59.09 2qx6 s THR 156 Cb 0.37 -2.68 0.31 0.00 1.34 0.00 0.00 72.50 71.83 2qx6 s THR 156 CO -0.29 -0.08 1.80 0.11 -0.54 0.00 0.00 174.62 175.62 2qx6 h LYS 157 N 2.20 0.75 -0.63 3.99 1.57 -1.91 -0.29 116.57 122.24 2qx6 h LYS 157 Ca -0.40 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2qx6 h LYS 157 Cb 1.24 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2qx6 h LYS 157 CO 0.68 0.49 0.00 0.25 -0.57 0.00 0.00 179.45 180.30 2qx6 n THR 158 N -4.71 1.74 -3.01 -0.16 -2.24 -1.26 -4.70 114.28 99.94 2qx6 n THR 158 Ca 0.22 -1.20 -0.22 0.00 -2.27 0.00 0.00 64.05 60.58 2qx6 n THR 158 Cb 0.55 0.17 0.01 0.00 -2.10 0.00 0.00 70.33 68.96 2qx6 n THR 158 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2qx6 s GLY 159 N -0.96 1.61 0.33 3.38 0.00 -0.16 -5.00 107.32 106.51 2qx6 s GLY 159 Ca 0.50 -1.15 0.03 0.00 0.00 0.00 0.00 44.72 44.09 2qx6 s GLY 159 CO 0.25 -0.98 1.92 -0.39 0.00 0.00 0.00 173.10 173.90 2qx6 h VAL 160 N 0.43 1.02 -0.00 1.40 -1.51 -1.82 -2.60 116.25 113.16 2qx6 h VAL 160 Ca -0.45 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.70 2qx6 h VAL 160 Cb 1.26 0.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.46 2qx6 h VAL 160 CO 0.56 0.17 -0.32 0.59 -1.23 0.00 0.00 177.57 177.34 2qx6 n ASN 161 N -4.50 0.64 -0.05 4.19 3.02 -0.50 -5.07 115.26 112.99 2qx6 n ASN 161 Ca 0.13 -0.47 0.01 0.00 -0.03 0.00 0.00 54.58 54.22 2qx6 n ASN 161 Cb 0.24 0.10 -0.00 0.00 -0.61 0.00 0.00 39.78 39.51 2qx6 n ASN 161 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qx6 n GLY 162 N 1.41 -2.00 3.77 7.41 0.00 -0.98 -4.85 105.19 109.95 2qx6 n GLY 162 Ca 0.09 -1.48 -0.40 0.00 0.00 0.00 0.00 46.02 44.23 2qx6 n GLY 162 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qx6 s ASP 163 N -5.04 5.99 0.46 1.61 2.15 -0.96 -2.24 116.67 118.64 2qx6 s ASP 163 Ca 0.00 2.99 0.14 0.00 0.43 0.00 0.00 52.55 56.12 2qx6 s ASP 163 Cb 0.00 -2.66 1.09 0.00 -0.30 0.00 0.00 42.92 41.05 2qx6 s ASP 163 CO 0.00 -1.11 2.04 0.77 -0.17 0.00 0.00 175.17 176.70 2qx6 h SER 164 N 2.52 0.26 0.11 -0.34 4.64 -1.78 -1.58 113.55 117.38 2qx6 h SER 164 Ca -0.51 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 2qx6 h SER 164 Cb 1.26 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2qx6 h SER 164 CO 0.62 0.17 -0.06 0.03 -0.87 0.00 0.00 176.83 176.72 2qx6 h ARG 165 N 0.30 0.00 -0.69 4.77 3.08 -1.88 -2.67 114.38 117.28 2qx6 h ARG 165 Ca 0.18 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 2qx6 h ARG 165 Cb 0.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2qx6 h ARG 165 CO -0.04 0.06 0.42 1.88 -1.07 0.00 0.00 179.97 181.22 2qx6 h TYR 166 N 0.00 0.91 0.00 3.04 0.05 -1.43 -2.35 116.97 117.19 2qx6 h TYR 166 Ca -0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2qx6 h TYR 166 Cb 0.13 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 37.57 2qx6 h TYR 166 CO 0.00 0.61 0.00 1.97 -1.05 0.00 0.00 178.16 179.69 2qx6 n PHE 167 N -4.55 0.00 0.44 4.88 1.16 -1.01 -3.22 117.46 115.16 2qx6 n PHE 167 Ca 0.06 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.76 2qx6 n PHE 167 Cb 0.05 -0.42 0.25 0.00 -1.61 0.00 0.00 39.48 37.75 2qx6 n PHE 167 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2qx6 h LEU 168 N 0.00 0.00 -0.16 5.98 3.38 -1.41 -3.39 115.31 119.70 2qx6 h LEU 168 Ca 0.00 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.97 2qx6 h LEU 168 Cb 0.41 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 2qx6 h LEU 168 CO 0.00 0.02 -0.40 -0.25 0.09 0.00 0.00 178.44 177.90 2qx6 h TRP 169 N 0.00 -1.14 -0.50 1.13 2.91 -1.55 0.43 115.95 117.23 2qx6 h TRP 169 Ca 0.00 0.05 0.03 0.00 1.13 0.00 0.00 58.89 60.10 2qx6 h TRP 169 Cb 0.84 0.52 -0.03 0.00 -0.51 0.00 0.00 29.16 29.99 2qx6 h TRP 169 CO 0.00 -0.46 0.33 -1.35 -1.03 0.00 0.00 178.44 175.94 2qx6 h PRO 170 N -0.45 0.55 0.00 2.65 0.11 -1.84 0.62 132.00 133.63 2qx6 h PRO 170 Ca 0.09 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 2qx6 h PRO 170 Cb 0.61 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.59 2qx6 h PRO 170 CO -0.41 0.36 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.60 2qx6 h LEU 171 N 0.56 0.00 -0.19 2.35 3.38 -1.68 -1.71 115.31 118.02 2qx6 h LEU 171 Ca 0.20 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2qx6 h LEU 171 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2qx6 h LEU 171 CO -0.05 0.69 -0.03 1.56 0.09 0.00 0.00 178.44 180.70 2qx6 h GLN 172 N -1.00 0.36 0.00 1.13 4.20 -0.15 -1.32 115.11 118.33 2qx6 h GLN 172 Ca -0.01 -0.13 -0.14 0.00 0.06 0.00 0.00 58.65 58.42 2qx6 h GLN 172 Cb 0.36 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2qx6 h GLN 172 CO -0.01 0.60 -1.02 1.58 -0.67 0.00 0.00 178.83 179.32 2qx6 n HIS 173 N -4.66 0.91 0.26 2.96 -0.00 0.14 -0.49 115.22 114.35 2qx6 n HIS 173 Ca -0.05 0.39 0.13 0.00 0.46 0.00 0.00 57.72 58.65 2qx6 n HIS 173 Cb 0.26 -0.95 0.73 0.00 -0.12 0.00 0.00 29.99 29.91 2qx6 n HIS 173 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2qx6 h GLY 174 N -1.00 0.00 0.00 1.57 0.00 -1.21 -1.97 103.07 100.46 2qx6 h GLY 174 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2qx6 h GLY 174 CO -0.13 0.00 -0.08 2.41 0.00 0.00 0.00 176.54 178.74 2qx6 n THR 175 N -3.68 0.32 0.18 4.70 -1.04 -0.66 -4.50 114.28 109.60 2qx6 n THR 175 Ca -0.02 0.21 -0.14 0.00 -2.04 0.00 0.00 64.05 62.06 2qx6 n THR 175 Cb 0.23 -1.34 -0.08 0.00 -1.82 0.00 0.00 70.33 67.32 2qx6 n THR 175 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2qx6 h LEU 176 N -0.08 -0.38 -0.95 -4.42 3.38 -1.25 -1.77 115.31 109.84 2qx6 h LEU 176 Ca 0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2qx6 h LEU 176 Cb 0.08 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 2qx6 h LEU 176 CO 0.00 -0.09 0.57 -0.74 0.09 0.00 0.00 178.44 178.27 2qx6 h HIS 177 N -0.68 1.24 -0.94 1.13 2.76 -0.84 -1.53 115.15 116.29 2qx6 h HIS 177 Ca -0.05 -0.00 0.13 0.00 -2.20 0.00 0.00 60.37 58.25 2qx6 h HIS 177 Cb 0.48 -0.41 -0.08 0.00 1.55 0.00 0.00 27.41 28.95 2qx6 h HIS 177 CO 0.00 0.82 0.60 0.35 -1.30 0.00 0.00 177.93 178.40 2qx6 h PHE 178 N 1.30 0.97 -0.04 5.26 3.57 -1.19 0.13 116.94 126.93 2qx6 h PHE 178 Ca 0.34 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.87 2qx6 h PHE 178 Cb -0.06 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.37 2qx6 h PHE 178 CO 0.00 0.37 0.00 0.00 -2.23 0.00 0.00 178.31 176.45 2qx6 n GLY 180 N 0.99 0.58 3.77 0.00 0.00 0.45 -0.57 105.19 110.40 2qx6 n GLY 180 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2qx6 n GLY 180 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qx6 s PHE 181 N -2.32 2.85 -0.10 1.61 0.08 -0.75 -3.39 117.98 115.96 2qx6 s PHE 181 Ca 0.00 1.24 -0.20 0.00 0.12 0.00 0.00 56.93 58.09 2qx6 s PHE 181 Cb 0.00 -3.85 -0.04 0.00 -0.57 0.00 0.00 43.02 38.56 2qx6 s PHE 181 CO 0.00 -2.48 0.56 0.15 -0.10 0.00 0.00 175.22 173.34 2qx6 s LYS 182 N -1.70 4.37 -0.02 0.44 -0.14 1.82 -4.29 119.74 120.23 2qx6 s LYS 182 Ca 0.52 0.60 -0.30 0.00 -1.36 0.00 0.00 55.97 55.44 2qx6 s LYS 182 Cb -0.43 -3.44 -0.06 0.00 -1.68 0.00 0.00 37.83 32.22 2qx6 s LYS 182 CO 0.56 0.13 1.68 0.08 -0.76 0.00 0.00 175.35 177.04 2qx6 s VAL 183 N 0.67 3.41 0.56 3.17 1.01 -1.26 -0.94 120.40 127.02 2qx6 s VAL 183 Ca 0.30 0.59 -0.09 0.00 0.00 0.00 0.00 61.98 62.78 2qx6 s VAL 183 Cb -0.16 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2qx6 s VAL 183 CO 0.13 -0.04 0.93 -0.76 0.00 0.00 0.00 175.10 175.36 2qx6 s LEU 184 N 3.73 3.41 0.33 3.92 1.43 0.48 -0.36 118.68 131.63 2qx6 s LEU 184 Ca 0.75 1.25 -0.29 0.00 -1.03 0.00 0.00 54.13 54.81 2qx6 s LEU 184 Cb -0.36 -4.26 -0.12 0.00 0.03 0.00 0.00 46.19 41.49 2qx6 s LEU 184 CO 0.31 -0.73 1.43 0.00 0.23 0.00 0.00 176.35 177.59 2qx6 n ALA 185 N -2.45 1.88 -1.76 4.21 0.00 -1.26 -4.64 120.51 116.49 2qx6 n ALA 185 Ca 0.04 0.36 -0.36 0.00 0.00 0.00 0.00 53.44 53.48 2qx6 n ALA 185 Cb 0.54 -2.35 0.02 0.00 0.00 0.00 0.00 19.45 17.66 2qx6 n ALA 185 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2qx6 s PRO 186 N -1.55 3.20 -0.35 0.00 0.04 -1.26 -4.72 135.00 130.36 2qx6 s PRO 186 Ca 0.58 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 63.32 2qx6 s PRO 186 Cb -0.53 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 31.95 2qx6 s PRO 186 CO 0.59 -1.02 0.20 -1.14 0.04 0.00 0.00 177.00 175.67 2qx6 s GLN 187 N -3.17 3.13 -0.22 4.56 2.00 0.35 -5.00 119.66 121.31 2qx6 s GLN 187 Ca 0.74 -0.87 -0.02 0.00 -2.00 0.00 0.00 55.36 53.20 2qx6 s GLN 187 Cb -0.30 -3.69 0.01 0.00 0.80 0.00 0.00 33.01 29.83 2qx6 s GLN 187 CO 0.34 -0.55 -0.08 0.42 -0.50 0.00 0.00 175.29 174.91 2qx6 s ILE 188 N 1.61 2.96 -0.53 -2.34 1.01 -1.26 -0.25 121.20 122.41 2qx6 s ILE 188 Ca 0.04 -0.73 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 2qx6 s ILE 188 Cb -0.18 -2.37 0.13 0.00 0.01 0.00 0.00 42.46 40.04 2qx6 s ILE 188 CO 0.07 0.39 0.46 -0.44 0.00 0.00 0.00 174.94 175.42 2qx6 s SER 189 N 1.40 6.06 0.15 3.58 0.01 0.19 -5.00 113.70 120.09 2qx6 s SER 189 Ca 0.04 -1.85 -0.30 0.00 1.31 0.00 0.00 55.95 55.16 2qx6 s SER 189 Cb -0.15 -2.15 -0.07 0.00 0.21 0.00 0.00 66.02 63.86 2qx6 s SER 189 CO -0.06 -0.81 1.17 -0.36 0.41 0.00 0.00 173.24 173.59 2qx6 s PHE 190 N 1.50 3.48 -0.72 2.43 0.08 -1.26 -2.31 117.98 121.18 2qx6 s PHE 190 Ca 0.04 1.44 -0.19 0.00 0.12 0.00 0.00 56.93 58.34 2qx6 s PHE 190 Cb -0.29 -3.38 0.03 0.00 -0.57 0.00 0.00 43.02 38.81 2qx6 s PHE 190 CO 0.02 -1.04 0.41 0.00 -0.10 0.00 0.00 175.22 174.51 2qx6 n ALA 191 N 2.89 -2.02 0.28 5.36 0.00 -0.95 -4.85 120.51 121.23 2qx6 n ALA 191 Ca 0.05 -0.35 0.15 0.00 0.00 0.00 0.00 53.44 53.30 2qx6 n ALA 191 Cb 0.46 -1.41 0.80 0.00 0.00 0.00 0.00 19.45 19.29 2qx6 n ALA 191 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qx6 h PRO 192 N -0.36 0.00 -0.41 0.00 0.13 -1.78 -2.63 132.00 126.95 2qx6 h PRO 192 Ca -0.44 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 2qx6 h PRO 192 Cb 0.87 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 2qx6 h PRO 192 CO 0.31 0.08 -0.19 0.93 -0.23 0.00 0.00 178.00 178.90 2qx6 h GLU 193 N 0.00 0.79 -0.01 0.86 5.08 -1.88 -3.03 114.58 116.38 2qx6 h GLU 193 Ca -0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2qx6 h GLU 193 Cb 0.32 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2qx6 h GLU 193 CO 0.01 0.92 -0.25 0.44 -1.00 0.00 0.00 179.01 179.13 2qx6 n ILE 194 N -4.13 0.00 -1.78 3.13 -5.35 -1.08 -4.94 119.36 105.21 2qx6 n ILE 194 Ca 0.01 -0.24 -0.31 0.00 -0.27 0.00 0.00 62.75 61.94 2qx6 n ILE 194 Cb 0.41 0.83 0.02 0.00 -1.74 0.00 0.00 39.64 39.16 2qx6 n ILE 194 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qx6 s ALA 195 N -2.34 2.95 0.78 -1.28 0.00 -1.01 -5.06 121.76 115.79 2qx6 s ALA 195 Ca 0.25 -0.02 -0.10 0.00 0.00 0.00 0.00 51.96 52.10 2qx6 s ALA 195 Cb 0.19 -3.12 0.09 0.00 0.00 0.00 0.00 23.12 20.28 2qx6 s ALA 195 CO 0.47 -0.87 1.11 -1.54 0.00 0.00 0.00 175.76 174.94 2qx6 s SER 196 N -4.00 4.47 0.21 0.00 1.04 -1.26 -4.85 113.70 109.31 2qx6 s SER 196 Ca 0.56 0.52 -0.09 0.00 0.48 0.00 0.00 55.95 57.42 2qx6 s SER 196 Cb -0.12 -1.02 0.17 0.00 0.10 0.00 0.00 66.02 65.14 2qx6 s SER 196 CO 0.54 -1.86 1.85 -0.33 0.98 0.00 0.00 173.24 174.41 2qx6 h GLU 197 N -0.90 1.10 -0.76 4.02 4.39 -1.97 -0.77 114.58 119.70 2qx6 h GLU 197 Ca -0.45 -0.11 0.04 0.00 0.34 0.00 0.00 59.36 59.18 2qx6 h GLU 197 Cb 1.31 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 29.68 2qx6 h GLU 197 CO 0.59 0.79 0.47 0.93 -1.16 0.00 0.00 179.01 180.63 2qx6 h GLU 198 N 1.10 0.88 -0.37 2.33 3.07 -1.99 -0.53 114.58 119.07 2qx6 h GLU 198 Ca 0.29 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 58.94 2qx6 h GLU 198 Cb -0.02 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 2qx6 h GLU 198 CO -0.05 0.58 -0.37 0.93 -1.40 0.00 0.00 179.01 178.70 2qx6 h GLU 199 N 0.90 0.87 -0.09 2.33 5.08 -1.78 -1.57 114.58 120.32 2qx6 h GLU 199 Ca 0.31 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 2qx6 h GLU 199 Cb 0.06 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2qx6 h GLU 199 CO -0.13 1.09 -0.00 0.00 -1.00 0.00 0.00 179.01 178.97 2qx6 h ARG 200 N 0.72 0.17 -0.93 2.33 3.08 -0.68 0.01 114.38 119.08 2qx6 h ARG 200 Ca 0.06 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.13 2qx6 h ARG 200 Cb 0.94 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.91 2qx6 h ARG 200 CO 0.09 0.43 0.60 0.87 -1.07 0.00 0.00 179.97 180.89 2qx6 h LYS 201 N -0.11 1.02 -0.48 0.04 1.79 -1.13 -0.83 116.57 116.88 2qx6 h LYS 201 Ca 0.03 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2qx6 h LYS 201 Cb 0.35 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.75 2qx6 h LYS 201 CO 0.00 0.68 0.25 0.78 -1.08 0.00 0.00 179.45 180.08 2qx6 h GLY 202 N 1.06 0.72 1.41 3.86 0.00 -0.87 -0.27 103.07 108.98 2qx6 h GLY 202 Ca 0.40 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 47.31 2qx6 h GLY 202 CO -0.15 0.32 -0.07 -0.33 0.00 0.00 0.00 176.54 176.31 2qx6 h MET 203 N 0.63 0.71 -0.22 4.80 2.86 0.16 -0.28 114.93 123.58 2qx6 h MET 203 Ca 0.17 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 2qx6 h MET 203 Cb 0.07 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2qx6 h MET 203 CO -0.02 0.77 -0.07 0.28 1.06 0.00 0.00 176.91 178.92 2qx6 h VAL 204 N 0.65 1.29 -0.20 -2.22 2.07 -0.92 -2.56 116.25 114.36 2qx6 h VAL 204 Ca 0.12 -1.10 -0.06 0.00 0.82 0.00 0.00 66.70 66.48 2qx6 h VAL 204 Cb 0.51 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 2qx6 h VAL 204 CO 0.03 0.34 -0.15 0.00 0.02 0.00 0.00 177.57 177.81 2qx6 h ALA 205 N 0.73 1.38 -0.71 1.67 0.00 -0.86 -1.11 119.26 120.36 2qx6 h ALA 205 Ca 0.05 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2qx6 h ALA 205 Cb 0.55 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2qx6 h ALA 205 CO 0.03 0.43 0.17 0.00 0.00 0.00 0.00 179.25 179.87 2qx6 h ALA 206 N 1.54 0.95 -0.18 0.00 0.00 -0.91 0.18 119.26 120.84 2qx6 h ALA 206 Ca 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2qx6 h ALA 206 Cb 0.45 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2qx6 h ALA 206 CO 0.03 0.67 -0.05 2.35 0.00 0.00 0.00 179.25 182.25 2qx6 h TRP 207 N 1.08 0.40 -0.42 0.00 -0.00 -1.03 0.00 115.95 115.98 2qx6 h TRP 207 Ca 0.22 -0.09 0.01 0.00 -0.00 0.00 0.00 58.89 59.04 2qx6 h TRP 207 Cb 0.38 -0.10 -0.02 0.00 -0.00 0.00 0.00 29.16 29.42 2qx6 h TRP 207 CO 0.03 0.62 0.27 1.03 -0.00 0.00 0.00 178.44 180.39 2qx6 h SER 208 N 0.06 0.45 -0.53 2.65 0.87 -1.04 -1.12 113.55 114.89 2qx6 h SER 208 Ca 0.04 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 2qx6 h SER 208 Cb 0.50 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 2qx6 h SER 208 CO 0.02 0.33 0.30 -0.61 -0.53 0.00 0.00 176.83 176.34 2qx6 h GLN 209 N 0.55 0.73 -0.99 2.24 5.75 -0.55 -2.54 115.11 120.30 2qx6 h GLN 209 Ca 0.16 -0.08 0.01 0.00 -0.15 0.00 0.00 58.65 58.59 2qx6 h GLN 209 Cb -0.04 -0.15 -0.05 0.00 1.07 0.00 0.00 27.48 28.32 2qx6 h GLN 209 CO -0.05 0.55 0.65 -0.09 -2.65 0.00 0.00 178.83 177.24 2qx6 h ARG 210 N 0.71 1.31 0.00 1.69 2.43 -0.39 -1.99 114.38 118.13 2qx6 h ARG 210 Ca 0.19 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2qx6 h ARG 210 Cb 0.02 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.28 2qx6 h ARG 210 CO -0.03 0.87 -0.09 -0.07 -1.51 0.00 0.00 179.97 179.14 2qx6 h LEU 211 N 1.34 0.00 -1.64 3.80 3.38 -0.81 -2.16 115.31 119.22 2qx6 h LEU 211 Ca 0.36 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.42 2qx6 h LEU 211 Cb -0.15 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2qx6 h LEU 211 CO -0.08 0.09 0.39 1.56 0.09 0.00 0.00 178.44 180.49 2qx6 h GLN 212 N 0.00 0.40 0.00 1.13 4.20 -1.09 -2.74 115.11 117.01 2qx6 h GLN 212 Ca -0.00 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2qx6 h GLN 212 Cb 0.21 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2qx6 h GLN 212 CO 0.01 0.26 -0.24 0.25 -0.67 0.00 0.00 178.83 178.45 2qx6 n THR 213 N -4.47 1.90 -0.14 -0.54 -2.24 -0.84 -4.80 114.28 103.15 2qx6 n THR 213 Ca 0.09 -2.55 0.10 0.00 -2.27 0.00 0.00 64.05 59.42 2qx6 n THR 213 Cb 0.35 -0.18 0.43 0.00 -2.10 0.00 0.00 70.33 68.82 2qx6 n THR 213 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2qx6 h ILE 214 N 0.80 0.94 0.00 2.28 6.09 -1.15 -1.53 117.51 124.94 2qx6 h ILE 214 Ca -0.01 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 2qx6 h ILE 214 Cb 1.04 0.31 0.00 0.00 0.47 0.00 0.00 36.82 38.64 2qx6 h ILE 214 CO 0.00 0.11 0.00 0.79 -3.07 0.00 0.00 178.15 175.98 2qx6 n TRP 215 N -4.48 0.31 1.00 2.19 7.02 -1.26 -2.20 117.44 120.03 2qx6 n TRP 215 Ca 0.11 0.11 0.11 0.00 -1.02 0.00 0.00 57.50 56.81 2qx6 n TRP 215 Cb 0.32 -0.68 0.08 0.00 -2.42 0.00 0.00 31.31 28.61 2qx6 n TRP 215 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2qx6 n LYS 216 N -1.78 0.02 -2.00 -0.99 5.02 -0.58 -4.97 118.16 112.89 2qx6 n LYS 216 Ca 0.04 -0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.98 2qx6 n LYS 216 Cb 0.24 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.77 2qx6 n LYS 216 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2qx6 s GLU 217 N -2.99 3.15 0.06 1.97 2.02 -0.93 -5.06 118.70 116.92 2qx6 s GLU 217 Ca 0.10 1.37 0.02 0.00 0.02 0.00 0.00 54.97 56.48 2qx6 s GLU 217 Cb 0.17 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.36 2qx6 s GLU 217 CO 0.77 -0.97 0.07 -1.21 0.02 0.00 0.00 175.26 173.94 2qx6 s GLU 218 N -3.87 2.90 0.87 1.61 0.41 -1.26 -5.10 118.70 114.26 2qx6 s GLU 218 Ca 0.67 -0.65 -0.11 0.00 -0.41 0.00 0.00 54.97 54.46 2qx6 s GLU 218 Cb -0.19 -2.74 0.12 0.00 -1.78 0.00 0.00 34.13 29.53 2qx6 s GLU 218 CO 0.36 0.58 1.09 -1.25 -0.49 0.00 0.00 175.26 175.55 2qx6 s PRO 219 N -2.21 1.45 0.66 0.39 0.04 -1.26 -4.68 135.00 129.38 2qx6 s PRO 219 Ca 0.27 0.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.04 2qx6 s PRO 219 Cb -0.12 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2qx6 s PRO 219 CO 0.20 -2.12 1.05 0.96 0.04 0.00 0.00 177.00 177.13 2qx6 s ILE 220 N -2.95 3.98 -0.57 0.56 -4.36 0.52 -4.95 121.20 113.41 2qx6 s ILE 220 Ca 0.63 0.59 -0.25 0.00 -0.26 0.00 0.00 60.65 61.36 2qx6 s ILE 220 Cb -0.17 -3.63 0.04 0.00 1.25 0.00 0.00 42.46 39.95 2qx6 s ILE 220 CO 0.57 -0.81 0.99 -2.16 0.24 0.00 0.00 174.94 173.76 2qx6 s PRO 221 N -5.26 3.32 -1.25 0.37 0.04 -1.26 -4.73 135.00 126.23 2qx6 s PRO 221 Ca 0.56 -0.27 -0.19 0.00 0.04 0.00 0.00 61.00 61.14 2qx6 s PRO 221 Cb -0.11 -4.07 0.01 0.00 0.04 0.00 0.00 34.50 30.36 2qx6 s PRO 221 CO 0.52 -1.57 1.86 0.00 0.04 0.00 0.00 177.00 177.85 2qx6 s THR 223 N 6.15 0.84 0.29 0.00 -4.23 -1.26 -4.96 115.64 112.47 2qx6 s THR 223 Ca 0.58 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 59.07 2qx6 s THR 223 Cb 0.04 -2.70 0.23 0.00 1.34 0.00 0.00 72.50 71.42 2qx6 s THR 223 CO 0.08 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 176.09 2qx6 h ALA 224 N 2.24 1.35 -0.37 3.99 0.00 -1.99 -2.37 119.26 122.11 2qx6 h ALA 224 Ca -0.39 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2qx6 h ALA 224 Cb 1.25 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2qx6 h ALA 224 CO 0.65 0.55 0.14 1.25 0.00 0.00 0.00 179.25 181.83 2qx6 h HIS 225 N 1.05 0.58 -0.70 0.00 -0.00 -1.94 0.38 115.15 114.52 2qx6 h HIS 225 Ca 0.27 -0.05 0.04 0.00 -0.00 0.00 0.00 60.37 60.63 2qx6 h HIS 225 Cb -0.02 -0.17 -0.05 0.00 -0.00 0.00 0.00 27.41 27.17 2qx6 h HIS 225 CO 0.00 0.53 0.43 2.35 -0.00 0.00 0.00 177.93 181.25 2qx6 h TRP 226 N 0.45 0.80 -0.00 5.26 7.01 -1.73 0.86 115.95 128.60 2qx6 h TRP 226 Ca 0.12 0.02 -0.23 0.00 2.11 0.00 0.00 58.89 60.92 2qx6 h TRP 226 Cb 0.21 -0.26 0.02 0.00 -2.10 0.00 0.00 29.16 27.03 2qx6 h TRP 226 CO 0.00 0.44 -0.89 0.45 -2.79 0.00 0.00 178.44 175.65 2qx6 h HIS 227 N 0.83 0.91 0.00 2.65 3.86 -1.12 -3.39 115.15 118.89 2qx6 h HIS 227 Ca 0.29 -0.49 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 2qx6 h HIS 227 Cb 0.06 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.42 2qx6 h HIS 227 CO -0.05 1.32 -0.55 1.19 0.86 0.00 0.00 177.93 180.70 2qx6 n PHE 228 N -3.98 0.00 -4.58 2.45 3.72 0.13 -4.12 117.46 111.09 2qx6 n PHE 228 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 2qx6 n PHE 228 Cb 0.81 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 2qx6 n PHE 228 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qx6 n GLY 229 N 1.42 0.11 3.86 1.37 0.00 0.30 -5.00 105.19 107.24 2qx6 n GLY 229 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2qx6 n GLY 229 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14