#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 -3.51 3.07 0.00 0.00 -1.26 -5.09 105.19 98.39 2qx6 n GLY 2 Ca 0.00 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 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 -3.95 0.55 -0.09 1.61 -0.14 -1.26 -5.04 119.74 111.41 2qx6 s LYS 3 Ca 0.00 -0.79 0.01 0.00 -1.36 0.00 0.00 55.97 53.83 2qx6 s LYS 3 Cb 0.00 -0.29 -0.02 0.00 -1.68 0.00 0.00 37.83 35.84 2qx6 s LYS 3 CO 0.00 0.05 -0.10 0.15 -0.76 0.00 0.00 175.35 174.68 2qx6 s LYS 4 N -1.70 2.96 -0.03 1.68 1.02 -1.26 -0.91 119.74 121.49 2qx6 s LYS 4 Ca -0.09 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.32 2qx6 s LYS 4 Cb -0.09 -2.58 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 2qx6 s LYS 4 CO 0.00 0.48 -0.17 0.08 -0.92 0.00 0.00 175.35 174.82 2qx6 s VAL 5 N -0.32 1.38 -0.16 3.17 1.01 0.55 0.20 120.40 126.22 2qx6 s VAL 5 Ca 0.04 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2qx6 s VAL 5 Cb -0.13 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 2qx6 s VAL 5 CO 0.02 0.40 -0.11 -0.22 0.00 0.00 0.00 175.10 175.20 2qx6 s LEU 6 N -0.06 2.76 -0.24 3.92 2.96 -0.03 -1.54 118.68 126.44 2qx6 s LEU 6 Ca -0.01 -0.35 -0.07 0.00 -0.22 0.00 0.00 54.13 53.48 2qx6 s LEU 6 Cb -0.10 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 2qx6 s LEU 6 CO 0.01 0.11 0.05 -0.63 -1.32 0.00 0.00 176.35 174.57 2qx6 s ILE 7 N 0.71 4.18 -0.39 6.68 1.01 0.16 -0.79 121.20 132.77 2qx6 s ILE 7 Ca -0.05 -0.22 -0.14 0.00 0.00 0.00 0.00 60.65 60.25 2qx6 s ILE 7 Cb -0.15 -2.95 0.01 0.00 0.01 0.00 0.00 42.46 39.39 2qx6 s ILE 7 CO 0.02 0.36 0.26 -0.69 0.00 0.00 0.00 174.94 174.89 2qx6 s VAL 8 N 1.54 5.09 -0.15 2.92 1.01 0.97 -0.49 120.40 131.30 2qx6 s VAL 8 Ca 0.06 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 2qx6 s VAL 8 Cb -0.15 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2qx6 s VAL 8 CO 0.03 -0.23 -0.05 -0.47 0.00 0.00 0.00 175.10 174.38 2qx6 s TYR 9 N 1.66 3.01 -0.57 5.22 5.04 -0.40 -1.09 117.35 130.22 2qx6 s TYR 9 Ca 0.04 -0.29 0.05 0.00 -2.44 0.00 0.00 57.07 54.44 2qx6 s TYR 9 Cb -0.19 -1.93 0.19 0.00 0.35 0.00 0.00 41.96 40.39 2qx6 s TYR 9 CO 0.09 -0.01 0.50 0.00 -1.34 0.00 0.00 175.55 174.78 2qx6 n ALA 10 N 3.42 3.24 -3.18 3.97 0.00 -0.27 -1.59 120.51 126.08 2qx6 n ALA 10 Ca -0.17 -3.99 -0.13 0.00 0.00 0.00 0.00 53.44 49.14 2qx6 n ALA 10 Cb 0.53 -0.89 -0.11 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 -1.14 -0.30 -0.05 0.00 5.04 -1.26 -4.32 115.29 113.26 2qx6 s HIS 11 Ca 0.31 0.72 0.21 0.00 -1.54 0.00 0.00 55.06 54.76 2qx6 s HIS 11 Cb 0.04 0.10 0.56 0.00 0.04 0.00 0.00 32.58 33.32 2qx6 s HIS 11 CO -0.14 -0.18 1.67 1.96 -2.34 0.00 0.00 174.74 175.70 2qx6 h GLN 12 N 5.47 0.00 -4.94 2.88 7.50 -1.99 -3.44 115.11 120.59 2qx6 h GLN 12 Ca -0.27 0.00 -0.67 0.00 0.50 0.00 0.00 58.65 58.22 2qx6 h GLN 12 Cb 1.19 0.00 -0.31 0.00 0.05 0.00 0.00 27.48 28.41 2qx6 h GLN 12 CO 0.33 0.28 -0.75 -2.00 -1.50 0.00 0.00 178.83 175.19 2qx6 s GLU 13 N -3.35 2.96 0.53 1.46 2.56 -1.26 -5.00 118.70 116.60 2qx6 s GLU 13 Ca 0.03 -0.89 0.19 0.00 0.00 0.00 0.00 54.97 54.29 2qx6 s GLU 13 Cb 0.08 -2.95 1.39 0.00 2.00 0.00 0.00 34.13 34.65 2qx6 s GLU 13 CO 0.68 -0.34 2.17 -1.35 -0.56 0.00 0.00 175.26 175.85 2qx6 h PRO 14 N 8.03 0.00 -0.04 4.30 0.11 -1.98 -1.56 132.00 140.86 2qx6 h PRO 14 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2qx6 h PRO 14 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2qx6 h PRO 14 CO 0.59 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.01 2qx6 n LYS 15 N -4.40 1.45 -1.18 1.05 5.02 -1.26 -4.41 118.16 114.44 2qx6 n LYS 15 Ca -0.03 -0.66 -0.29 0.00 -2.02 0.00 0.00 58.31 55.31 2qx6 n LYS 15 Cb 0.09 -1.45 0.17 0.00 -0.02 0.00 0.00 35.03 33.83 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 -1.86 2.82 0.28 4.39 1.04 -0.59 -4.82 113.70 114.97 2qx6 s SER 16 Ca 0.38 1.26 -0.00 0.00 0.48 0.00 0.00 55.95 58.06 2qx6 s SER 16 Cb 0.20 -1.93 0.41 0.00 0.10 0.00 0.00 66.02 64.80 2qx6 s SER 16 CO 0.31 -3.02 1.81 0.15 0.98 0.00 0.00 173.24 173.48 2qx6 h PHE 17 N -1.81 0.80 -0.59 5.02 3.57 -1.91 -0.90 116.94 121.12 2qx6 h PHE 17 Ca -0.53 -0.09 -0.06 0.00 3.53 0.00 0.00 57.97 60.82 2qx6 h PHE 17 Cb 1.32 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 2qx6 h PHE 17 CO 0.32 0.71 0.13 -0.91 -2.23 0.00 0.00 178.31 176.33 2qx6 h ASN 18 N 0.73 0.90 -0.68 0.41 2.35 -1.91 -0.91 115.58 116.47 2qx6 h ASN 18 Ca 0.15 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2qx6 h ASN 18 Cb 0.35 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 2qx6 h ASN 18 CO 0.01 0.91 0.45 1.23 -1.65 0.00 0.00 177.43 178.37 2qx6 h GLY 19 N 0.86 0.96 1.33 2.83 0.00 -1.59 0.32 103.07 107.78 2qx6 h GLY 19 Ca 0.18 -0.37 -0.16 0.00 0.00 0.00 0.00 47.33 46.99 2qx6 h GLY 19 CO 0.00 0.36 -0.46 1.76 0.00 0.00 0.00 176.54 178.20 2qx6 h SER 20 N 0.93 0.78 -0.44 0.19 0.02 -0.62 -0.70 113.55 113.72 2qx6 h SER 20 Ca 0.25 -0.38 -0.10 0.00 -0.84 0.00 0.00 61.79 60.71 2qx6 h SER 20 Cb -0.10 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 2qx6 h SER 20 CO -0.05 1.12 -0.11 -0.07 -1.14 0.00 0.00 176.83 176.58 2qx6 h LEU 21 N 0.58 0.90 -0.29 5.07 3.38 -0.50 -0.70 115.31 123.74 2qx6 h LEU 21 Ca 0.03 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 2qx6 h LEU 21 Cb 1.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2qx6 h LEU 21 CO 0.10 1.02 0.02 0.50 0.09 0.00 0.00 178.44 180.17 2qx6 h LYS 22 N 0.81 0.49 -0.57 1.13 3.11 -0.80 -2.11 116.57 118.64 2qx6 h LYS 22 Ca 0.13 -0.15 -0.04 0.00 -2.81 0.00 0.00 60.65 57.79 2qx6 h LYS 22 Cb 0.63 -0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 31.78 2qx6 h LYS 22 CO 0.04 0.62 0.19 -0.91 -2.81 0.00 0.00 179.45 176.58 2qx6 h ASN 23 N 0.30 0.77 -0.54 4.20 2.35 -0.94 -1.26 115.58 120.46 2qx6 h ASN 23 Ca 0.08 -0.12 -0.11 0.00 -0.55 0.00 0.00 56.30 55.61 2qx6 h ASN 23 Cb 0.39 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 2qx6 h ASN 23 CO 0.01 0.72 -0.10 0.58 -1.65 0.00 0.00 177.43 176.99 2qx6 h VAL 24 N 0.82 1.27 -0.36 2.81 2.07 -1.05 -0.31 116.25 121.49 2qx6 h VAL 24 Ca 0.19 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 2qx6 h VAL 24 Cb 0.22 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2qx6 h VAL 24 CO -0.01 0.45 0.09 0.00 0.02 0.00 0.00 177.57 178.12 2qx6 h ALA 25 N 0.96 0.48 -0.34 1.67 0.00 -1.05 -0.45 119.26 120.53 2qx6 h ALA 25 Ca 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qx6 h ALA 25 Cb 0.67 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2qx6 h ALA 25 CO 0.05 0.15 0.21 0.28 0.00 0.00 0.00 179.25 179.93 2qx6 h VAL 26 N 0.44 1.11 0.11 0.00 2.07 -1.06 -1.22 116.25 117.69 2qx6 h VAL 26 Ca 0.11 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2qx6 h VAL 26 Cb 0.30 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2qx6 h VAL 26 CO 0.00 0.11 -0.09 0.44 0.02 0.00 0.00 177.57 178.04 2qx6 h ASP 27 N 0.44 -0.24 -0.33 0.57 3.32 -0.84 0.10 116.42 119.43 2qx6 h ASP 27 Ca 0.12 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 2qx6 h ASP 27 Cb -0.01 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2qx6 h ASP 27 CO -0.02 -0.15 -0.04 -0.08 -1.72 0.00 0.00 179.24 177.23 2qx6 h GLU 28 N -0.22 0.61 -0.35 3.56 4.57 -1.07 -0.17 114.58 121.53 2qx6 h GLU 28 Ca 0.00 -0.21 -0.11 0.00 -1.18 0.00 0.00 59.36 57.86 2qx6 h GLU 28 Cb 0.20 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 2qx6 h GLU 28 CO -0.02 0.76 -0.24 -0.07 -1.18 0.00 0.00 179.01 178.27 2qx6 h LEU 29 N 0.41 0.70 -0.54 1.64 3.38 -1.22 -1.93 115.31 117.75 2qx6 h LEU 29 Ca 0.09 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 2qx6 h LEU 29 Cb 0.51 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2qx6 h LEU 29 CO 0.02 0.92 -0.11 -1.28 0.09 0.00 0.00 178.44 178.09 2qx6 h SER 30 N 0.60 1.03 -0.34 -0.43 0.87 -0.87 -2.03 113.55 112.39 2qx6 h SER 30 Ca 0.08 -0.35 -0.02 0.00 -1.23 0.00 0.00 61.79 60.27 2qx6 h SER 30 Cb 0.73 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 2qx6 h SER 30 CO 0.06 1.14 0.14 -0.09 -0.53 0.00 0.00 176.83 177.55 2qx6 h ARG 31 N 0.91 0.57 0.00 2.24 2.43 -0.79 -1.50 114.38 118.23 2qx6 h ARG 31 Ca 0.14 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2qx6 h ARG 31 Cb 0.68 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2qx6 h ARG 31 CO 0.05 0.49 0.00 1.04 -1.51 0.00 0.00 179.97 180.04 2qx6 n GLN 32 N -4.37 0.08 -0.12 0.20 6.02 -0.74 -4.87 117.38 113.59 2qx6 n GLN 32 Ca 0.03 0.27 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 2qx6 n GLN 32 Cb 0.16 -1.65 0.00 0.00 1.02 0.00 0.00 30.24 29.77 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 0.30 0.72 3.78 1.08 0.00 -0.56 -5.06 105.19 105.44 2qx6 n GLY 33 Ca 0.04 0.00 -0.33 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 -2.24 4.97 -0.04 0.00 2.01 -0.09 -4.53 115.64 115.72 2qx6 s THR 35 Ca 0.67 1.34 0.05 0.00 0.31 0.00 0.00 61.69 64.06 2qx6 s THR 35 Cb -0.19 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 2qx6 s THR 35 CO 0.36 0.08 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.47 2qx6 s VAL 36 N 2.02 1.64 0.01 3.82 1.01 -1.26 -0.33 120.40 127.30 2qx6 s VAL 36 Ca 0.32 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2qx6 s VAL 36 Cb -0.16 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2qx6 s VAL 36 CO 0.11 0.47 -0.10 -0.89 0.00 0.00 0.00 175.10 174.69 2qx6 s THR 37 N -0.17 0.76 -0.08 3.92 2.01 -0.59 -4.99 115.64 116.50 2qx6 s THR 37 Ca -0.00 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.46 2qx6 s THR 37 Cb -0.11 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.74 2qx6 s THR 37 CO 0.02 0.10 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.17 2qx6 s VAL 38 N -0.45 1.67 -0.52 3.82 1.01 -1.26 -0.66 120.40 124.01 2qx6 s VAL 38 Ca 0.02 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.09 2qx6 s VAL 38 Cb -0.05 -1.46 0.13 0.00 0.00 0.00 0.00 36.38 35.00 2qx6 s VAL 38 CO 0.00 0.47 0.42 -0.44 0.00 0.00 0.00 175.10 175.55 2qx6 s SER 39 N 0.46 5.88 -0.94 3.32 0.01 0.36 -4.95 113.70 117.84 2qx6 s SER 39 Ca -0.17 -1.95 -0.20 0.00 1.31 0.00 0.00 55.95 54.94 2qx6 s SER 39 Cb -0.17 -2.07 0.10 0.00 0.21 0.00 0.00 66.02 64.09 2qx6 s SER 39 CO 0.07 -0.72 1.22 -0.62 0.41 0.00 0.00 173.24 173.59 2qx6 s ASP 40 N 2.84 6.56 0.22 2.44 -1.08 -1.26 -1.27 116.67 125.11 2qx6 s ASP 40 Ca 0.06 -1.78 -0.08 0.00 -0.52 0.00 0.00 52.55 50.23 2qx6 s ASP 40 Cb -0.26 -2.45 0.33 0.00 -1.46 0.00 0.00 42.92 39.07 2qx6 s ASP 40 CO -0.00 -1.23 1.72 -0.07 0.52 0.00 0.00 175.17 176.11 2qx6 h LEU 41 N 11.23 0.14 -0.60 -1.34 3.38 -1.67 -1.36 115.31 125.09 2qx6 h LEU 41 Ca 0.14 0.10 -0.12 0.00 0.09 0.00 0.00 57.88 58.08 2qx6 h LEU 41 Cb 1.02 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2qx6 h LEU 41 CO 1.21 0.07 -0.22 1.88 0.09 0.00 0.00 178.44 181.47 2qx6 h TYR 42 N 0.35 1.00 -0.04 1.13 0.05 -1.84 -1.19 116.97 116.43 2qx6 h TYR 42 Ca 0.34 -0.24 -0.06 0.00 0.05 0.00 0.00 58.73 58.82 2qx6 h TYR 42 Cb 0.48 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 2qx6 h TYR 42 CO -0.20 1.01 -0.25 0.00 -1.05 0.00 0.00 178.16 177.66 2qx6 h ALA 43 N 0.98 1.51 -0.00 3.88 0.00 -1.74 -1.37 119.26 122.53 2qx6 h ALA 43 Ca 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2qx6 h ALA 43 Cb 0.77 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2qx6 h ALA 43 CO 0.06 0.36 -0.12 -1.33 0.00 0.00 0.00 179.25 178.22 2qx6 n MET 44 N -4.22 0.27 -3.96 0.00 2.81 -0.57 -4.91 117.12 106.54 2qx6 n MET 44 Ca -0.02 -0.07 -0.29 0.00 -1.81 0.00 0.00 57.70 55.52 2qx6 n MET 44 Cb 0.32 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 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 -1.31 -2.51 -4.65 7.83 5.15 -0.52 -4.81 115.26 114.44 2qx6 n ASN 45 Ca 0.10 -0.91 -0.47 0.00 -0.60 0.00 0.00 54.58 52.70 2qx6 n ASN 45 Cb 0.30 -3.41 -0.04 0.00 -0.53 0.00 0.00 39.78 36.10 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 -4.46 2.08 -2.29 1.20 7.35 -0.55 -4.91 117.46 115.88 2qx6 n PHE 46 Ca -0.11 0.37 -0.43 0.00 -0.76 0.00 0.00 57.45 56.52 2qx6 n PHE 46 Cb 0.59 -2.48 -0.02 0.00 0.35 0.00 0.00 39.48 37.91 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 0.66 4.16 0.17 -4.13 2.56 -1.26 -4.92 118.70 115.95 2qx6 s GLU 47 Ca 0.79 1.77 0.22 0.00 0.00 0.00 0.00 54.97 57.75 2qx6 s GLU 47 Cb -0.74 -3.85 -0.04 0.00 2.00 0.00 0.00 34.13 31.50 2qx6 s GLU 47 CO 0.41 -0.82 0.98 -2.30 -0.56 0.00 0.00 175.26 172.97 2qx6 n PRO 48 N 6.88 0.61 -2.70 4.30 -0.02 -1.26 -4.69 135.00 138.11 2qx6 n PRO 48 Ca 0.15 0.10 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 2qx6 n PRO 48 Cb 0.44 -1.80 -0.04 0.00 -0.02 0.00 0.00 33.50 32.08 2qx6 n PRO 48 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qx6 s ARG 49 N -3.36 4.69 -0.65 -0.52 0.52 -1.26 -4.32 118.95 114.04 2qx6 s ARG 49 Ca -0.01 1.48 -0.23 0.00 -0.52 0.00 0.00 55.73 56.45 2qx6 s ARG 49 Cb 0.10 -3.37 0.06 0.00 0.52 0.00 0.00 34.95 32.26 2qx6 s ARG 49 CO 0.80 0.20 1.00 0.00 0.02 0.00 0.00 175.30 177.32 2qx6 s ALA 50 N -0.02 3.07 0.35 2.13 0.00 -1.26 -4.98 121.76 121.05 2qx6 s ALA 50 Ca 0.47 -1.69 0.04 0.00 0.00 0.00 0.00 51.96 50.78 2qx6 s ALA 50 Cb -0.24 -3.90 -0.04 0.00 0.00 0.00 0.00 23.12 18.95 2qx6 s ALA 50 CO 0.30 -2.79 0.13 0.95 0.00 0.00 0.00 175.76 174.36 2qx6 s THR 51 N 4.28 0.56 -1.22 0.00 -4.23 -1.26 -5.02 115.64 108.75 2qx6 s THR 51 Ca 0.25 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.89 2qx6 s THR 51 Cb -0.15 -2.50 0.17 0.00 1.34 0.00 0.00 72.50 71.37 2qx6 s THR 51 CO 0.12 0.00 1.38 -0.90 -0.54 0.00 0.00 174.62 174.68 2qx6 n ASP 52 N -1.04 0.00 0.00 3.99 5.68 -1.26 -1.65 116.55 122.27 2qx6 n ASP 52 Ca -0.02 0.29 0.11 0.00 -0.50 0.00 0.00 54.79 54.67 2qx6 n ASP 52 Cb 0.65 -0.39 0.55 0.00 -1.14 0.00 0.00 41.12 40.79 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 -1.39 0.16 0.00 0.11 5.02 -1.26 -2.64 118.16 118.16 2qx6 n LYS 53 Ca 0.05 0.08 0.13 0.00 -2.02 0.00 0.00 58.31 56.55 2qx6 n LYS 53 Cb 0.13 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.24 2qx6 n LYS 53 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2qx6 n ASP 54 N -1.40 0.00 -4.28 4.39 8.00 -0.66 -4.61 116.55 117.99 2qx6 n ASP 54 Ca 0.08 0.20 -0.33 0.00 0.71 0.00 0.00 54.79 55.46 2qx6 n ASP 54 Cb 0.23 -0.39 -0.15 0.00 -0.02 0.00 0.00 41.12 40.79 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 -2.78 2.61 0.24 0.53 1.09 -1.08 -0.90 121.20 120.92 2qx6 s ILE 55 Ca 0.19 -0.81 -0.04 0.00 -1.10 0.00 0.00 60.65 58.89 2qx6 s ILE 55 Cb 0.17 -2.08 -0.05 0.00 -1.06 0.00 0.00 42.46 39.44 2qx6 s ILE 55 CO 0.43 0.53 0.49 0.42 -0.10 0.00 0.00 174.94 176.71 2qx6 s THR 56 N 0.56 5.08 0.00 2.92 -4.23 0.69 -4.90 115.64 115.76 2qx6 s THR 56 Ca -0.10 -0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.37 2qx6 s THR 56 Cb -0.16 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 69.97 2qx6 s THR 56 CO 0.04 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 2qx6 n GLY 57 N -0.69 0.43 3.42 3.99 0.00 -1.26 -4.85 105.19 106.23 2qx6 n GLY 57 Ca -0.02 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.70 2qx6 n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qx6 s THR 58 N 0.00 2.82 0.68 2.61 -4.23 -1.26 -5.12 115.64 111.14 2qx6 s THR 58 Ca 0.00 -0.81 -0.15 0.00 -1.18 0.00 0.00 61.69 59.55 2qx6 s THR 58 Cb 0.00 -2.09 0.01 0.00 1.34 0.00 0.00 72.50 71.77 2qx6 s THR 58 CO 0.00 0.58 1.16 -0.76 -0.54 0.00 0.00 174.62 175.06 2qx6 s LEU 59 N -0.58 3.39 0.31 4.79 1.43 -1.26 -4.93 118.68 121.83 2qx6 s LEU 59 Ca 0.08 2.18 0.26 0.00 -1.03 0.00 0.00 54.13 55.62 2qx6 s LEU 59 Cb -0.11 -4.57 0.83 0.00 0.03 0.00 0.00 46.19 42.37 2qx6 s LEU 59 CO 0.01 -1.88 1.75 0.77 0.23 0.00 0.00 176.35 177.23 2qx6 h SER 60 N -0.01 0.00 -1.29 2.29 4.64 -1.97 -3.38 113.55 113.84 2qx6 h SER 60 Ca -0.47 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.59 2qx6 h SER 60 Cb 1.27 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.15 2qx6 h SER 60 CO 0.52 0.00 -0.61 -3.20 -0.87 0.00 0.00 176.83 172.67 2qx6 n ASN 61 N -2.54 -2.71 0.00 4.97 2.85 -1.26 -5.01 115.26 111.56 2qx6 n ASN 61 Ca 0.04 -2.81 0.06 0.00 -0.11 0.00 0.00 54.58 51.76 2qx6 n ASN 61 Cb 0.39 1.20 0.33 0.00 1.24 0.00 0.00 39.78 42.93 2qx6 n ASN 61 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2qx6 n PRO 62 N 2.84 0.24 0.04 1.20 -0.04 -1.26 -3.07 135.00 134.95 2qx6 n PRO 62 Ca 0.20 0.12 -0.21 0.00 -0.04 0.00 0.00 63.50 63.58 2qx6 n PRO 62 Cb 0.54 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 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 0.29 -3.84 0.54 4.39 -1.97 -3.43 114.58 110.57 2qx6 h GLU 63 Ca 0.00 -0.50 -0.56 0.00 0.34 0.00 0.00 59.36 58.64 2qx6 h GLU 63 Cb 0.08 0.19 -0.39 0.00 -0.10 0.00 0.00 28.75 28.53 2qx6 h GLU 63 CO 0.00 1.24 -0.77 0.08 -1.16 0.00 0.00 179.01 178.40 2qx6 s VAL 64 N -2.46 0.94 -0.17 3.13 1.01 -1.18 -5.12 120.40 116.55 2qx6 s VAL 64 Ca -0.16 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 60.60 2qx6 s VAL 64 Cb 0.03 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 2qx6 s VAL 64 CO 0.81 -0.24 1.11 0.12 0.00 0.00 0.00 175.10 176.90 2qx6 s PHE 65 N 1.65 3.21 -0.27 5.22 5.36 -1.26 -4.81 117.98 127.09 2qx6 s PHE 65 Ca -0.01 1.33 0.02 0.00 -0.96 0.00 0.00 56.93 57.32 2qx6 s PHE 65 Cb -0.18 -3.34 0.07 0.00 -0.34 0.00 0.00 43.02 39.23 2qx6 s PHE 65 CO -0.10 -0.87 -0.07 1.21 -1.46 0.00 0.00 175.22 173.94 2qx6 s ASN 66 N 1.43 4.33 0.18 6.13 3.84 -1.26 -5.03 114.94 124.56 2qx6 s ASN 66 Ca 0.49 -1.46 -0.13 0.00 0.21 0.00 0.00 52.86 51.97 2qx6 s ASN 66 Cb -0.18 -1.45 0.13 0.00 -0.55 0.00 0.00 41.25 39.20 2qx6 s ASN 66 CO 0.12 -0.24 1.80 0.22 -2.79 0.00 0.00 177.10 176.21 2qx6 h TYR 67 N 7.80 0.53 -0.38 0.43 3.20 -1.96 -0.85 116.97 125.73 2qx6 h TYR 67 Ca -0.16 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.72 2qx6 h TYR 67 Cb 1.04 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 2qx6 h TYR 67 CO 0.57 0.27 0.20 0.78 -1.64 0.00 0.00 178.16 178.34 2qx6 h GLY 68 N 0.56 0.58 0.83 1.82 0.00 -1.99 -1.38 103.07 103.49 2qx6 h GLY 68 Ca 0.23 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.21 2qx6 h GLY 68 CO -0.14 0.26 -0.13 -2.08 0.00 0.00 0.00 176.54 174.46 2qx6 h VAL 69 N 0.49 1.31 -0.90 4.60 2.07 -1.96 -1.84 116.25 120.01 2qx6 h VAL 69 Ca 0.13 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 2qx6 h VAL 69 Cb 0.09 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2qx6 h VAL 69 CO -0.02 0.37 0.52 -0.33 0.02 0.00 0.00 177.57 178.14 2qx6 h GLU 70 N 0.16 1.25 -0.03 1.57 4.39 -1.10 -0.93 114.58 119.89 2qx6 h GLU 70 Ca 0.04 -0.13 -0.17 0.00 0.34 0.00 0.00 59.36 59.45 2qx6 h GLU 70 Cb 0.64 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2qx6 h GLU 70 CO 0.04 0.89 -0.74 1.79 -1.16 0.00 0.00 179.01 179.83 2qx6 h THR 71 N 1.26 1.46 -0.13 1.13 1.35 -1.26 0.09 112.91 116.79 2qx6 h THR 71 Ca 0.32 -2.34 -0.01 0.00 -0.55 0.00 0.00 66.41 63.83 2qx6 h THR 71 Cb -0.01 2.26 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 2qx6 h THR 71 CO -0.06 0.68 0.05 -0.74 -0.25 0.00 0.00 175.52 175.20 2qx6 h HIS 72 N 0.11 0.21 -0.63 4.73 -0.00 -0.89 0.54 115.15 119.23 2qx6 h HIS 72 Ca -0.02 -0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.24 2qx6 h HIS 72 Cb 1.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 28.63 2qx6 h HIS 72 CO 0.02 0.32 0.05 0.93 -0.00 0.00 0.00 177.93 179.25 2qx6 h GLU 73 N 0.05 1.06 -0.65 5.26 4.39 -1.13 -2.42 114.58 121.15 2qx6 h GLU 73 Ca 0.04 -0.31 -0.06 0.00 0.34 0.00 0.00 59.36 59.38 2qx6 h GLU 73 Cb 0.20 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 2qx6 h GLU 73 CO -0.00 1.01 0.17 0.00 -1.16 0.00 0.00 179.01 179.02 2qx6 h ALA 74 N 1.06 1.08 -0.04 3.43 0.00 -0.80 0.26 119.26 124.25 2qx6 h ALA 74 Ca 0.19 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qx6 h ALA 74 Cb 0.50 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2qx6 h ALA 74 CO 0.02 0.62 0.02 -0.92 0.00 0.00 0.00 179.25 178.99 2qx6 h TYR 75 N 0.97 0.05 -0.41 0.00 3.20 -0.63 0.67 116.97 120.82 2qx6 h TYR 75 Ca 0.21 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2qx6 h TYR 75 Cb 0.33 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2qx6 h TYR 75 CO 0.02 0.11 0.14 0.87 -1.64 0.00 0.00 178.16 177.66 2qx6 h LYS 76 N -0.02 0.60 -0.45 1.82 1.57 -1.15 -2.04 116.57 116.90 2qx6 h LYS 76 Ca 0.01 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qx6 h LYS 76 Cb 0.07 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2qx6 h LYS 76 CO -0.00 0.52 0.00 1.04 -0.57 0.00 0.00 179.45 180.44 2qx6 n GLN 77 N -4.35 2.07 -3.90 3.15 1.13 0.05 -4.93 117.38 110.60 2qx6 n GLN 77 Ca 0.03 -1.66 -0.27 0.00 -1.94 0.00 0.00 57.00 53.15 2qx6 n GLN 77 Cb 0.17 -1.37 0.01 0.00 0.11 0.00 0.00 30.24 29.16 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 0.85 -4.56 -0.39 -1.09 1.74 0.38 -4.90 116.66 108.70 2qx6 n ARG 78 Ca 0.16 0.53 0.08 0.00 -0.77 0.00 0.00 57.85 57.85 2qx6 n ARG 78 Cb 0.39 -5.14 0.18 0.00 -1.02 0.00 0.00 32.46 26.88 2qx6 n ARG 78 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2qx6 n SER 79 N -2.91 1.98 -4.87 0.55 7.64 0.21 -5.01 113.62 111.21 2qx6 n SER 79 Ca -0.13 -3.58 -0.31 0.00 1.01 0.00 0.00 58.87 55.86 2qx6 n SER 79 Cb 0.60 -0.49 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 2qx6 n SER 79 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2qx6 s LEU 80 N -3.09 3.93 0.50 -3.43 1.43 -1.25 -0.22 118.68 116.54 2qx6 s LEU 80 Ca 0.36 1.18 -0.22 0.00 -1.03 0.00 0.00 54.13 54.42 2qx6 s LEU 80 Cb 0.33 -4.03 -0.08 0.00 0.03 0.00 0.00 46.19 42.45 2qx6 s LEU 80 CO -0.03 -0.32 1.09 0.00 0.23 0.00 0.00 176.35 177.33 2qx6 n ALA 81 N -0.91 0.60 0.24 4.21 0.00 -0.07 -4.75 120.51 119.82 2qx6 n ALA 81 Ca 0.03 0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.68 2qx6 n ALA 81 Cb 0.54 -2.17 0.57 0.00 0.00 0.00 0.00 19.45 18.39 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 1.26 0.00 -0.46 0.00 4.64 -1.95 -2.10 113.55 114.94 2qx6 h SER 82 Ca -0.47 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.77 2qx6 h SER 82 Cb 1.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 2qx6 h SER 82 CO 0.55 0.11 0.03 -2.24 -0.87 0.00 0.00 176.83 174.41 2qx6 h ASP 83 N 0.00 0.82 -0.02 4.97 2.03 -1.99 0.11 116.42 122.33 2qx6 h ASP 83 Ca -0.00 -0.19 -0.00 0.00 -0.73 0.00 0.00 57.03 56.10 2qx6 h ASP 83 Cb 0.20 -0.22 -0.00 0.00 -0.83 0.00 0.00 39.33 38.48 2qx6 h ASP 83 CO 0.01 0.86 -0.01 0.40 -1.03 0.00 0.00 179.24 179.48 2qx6 h ILE 84 N 0.80 1.31 0.00 4.15 2.04 -1.76 -2.79 117.51 121.26 2qx6 h ILE 84 Ca 0.16 -0.92 -0.07 0.00 1.00 0.00 0.00 64.86 65.02 2qx6 h ILE 84 Cb 0.43 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 2qx6 h ILE 84 CO 0.02 0.24 -0.35 0.71 0.00 0.00 0.00 178.15 178.77 2qx6 h THR 85 N -0.34 1.09 -0.71 -0.27 1.35 -1.24 -1.19 112.91 111.61 2qx6 h THR 85 Ca 0.00 -1.26 -0.05 0.00 -0.55 0.00 0.00 66.41 64.56 2qx6 h THR 85 Cb 0.40 1.71 -0.03 0.00 -1.73 0.00 0.00 68.15 68.50 2qx6 h THR 85 CO 0.00 0.34 0.24 0.44 -0.25 0.00 0.00 175.52 176.29 2qx6 h ASP 86 N 0.00 1.00 -0.24 5.36 3.32 -0.76 -1.44 116.42 123.66 2qx6 h ASP 86 Ca -0.00 -0.17 -0.17 0.00 0.02 0.00 0.00 57.03 56.70 2qx6 h ASP 86 Cb 0.68 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 2qx6 h ASP 86 CO 0.05 0.92 -0.51 -0.33 -1.72 0.00 0.00 179.24 177.64 2qx6 h GLU 87 N 1.04 0.82 -0.42 3.56 4.39 -1.09 -2.88 114.58 120.00 2qx6 h GLU 87 Ca 0.23 -0.50 -0.06 0.00 0.34 0.00 0.00 59.36 59.38 2qx6 h GLU 87 Cb 0.26 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2qx6 h GLU 87 CO -0.01 1.13 0.03 1.96 -1.16 0.00 0.00 179.01 180.96 2qx6 h GLN 88 N 0.64 0.66 -0.56 2.33 4.20 -0.97 -0.96 115.11 120.45 2qx6 h GLN 88 Ca 0.02 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 2qx6 h GLN 88 Cb 1.10 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.76 2qx6 h GLN 88 CO 0.11 0.66 0.21 -0.22 -0.67 0.00 0.00 178.83 178.92 2qx6 h LYS 89 N 0.63 0.84 -0.77 1.46 3.64 -1.19 0.35 116.57 121.54 2qx6 h LYS 89 Ca 0.13 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2qx6 h LYS 89 Cb 0.35 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2qx6 h LYS 89 CO 0.01 0.74 0.31 0.87 -2.27 0.00 0.00 179.45 179.11 2qx6 h LYS 90 N 0.76 1.13 -0.23 1.90 1.57 -1.19 -2.22 116.57 118.29 2qx6 h LYS 90 Ca 0.18 -0.20 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 2qx6 h LYS 90 Cb 0.22 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 2qx6 h LYS 90 CO -0.01 0.91 -0.35 0.28 -0.57 0.00 0.00 179.45 179.71 2qx6 h VAL 91 N 1.11 1.32 -0.89 0.50 2.07 -0.81 -2.24 116.25 117.31 2qx6 h VAL 91 Ca 0.26 -1.56 0.07 0.00 0.82 0.00 0.00 66.70 66.29 2qx6 h VAL 91 Cb 0.20 1.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.67 2qx6 h VAL 91 CO -0.02 0.49 0.55 -0.09 0.02 0.00 0.00 177.57 178.52 2qx6 h ARG 92 N 0.34 0.96 0.00 1.57 2.43 -0.16 -2.42 114.38 117.10 2qx6 h ARG 92 Ca 0.02 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2qx6 h ARG 92 Cb 0.94 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2qx6 h ARG 92 CO 0.08 0.63 -0.17 0.93 -1.51 0.00 0.00 179.97 179.93 2qx6 h GLU 93 N 0.98 0.00 -6.92 0.20 5.08 -1.39 -3.47 114.58 109.06 2qx6 h GLU 93 Ca 0.40 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 58.26 2qx6 h GLU 93 Cb 0.22 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.51 2qx6 h GLU 93 CO -0.19 0.00 0.47 0.00 -1.00 0.00 0.00 179.01 178.29 2qx6 s ALA 94 N -3.20 3.18 -0.12 3.43 0.00 -0.85 -4.71 121.76 119.49 2qx6 s ALA 94 Ca 0.07 0.88 0.19 0.00 0.00 0.00 0.00 51.96 53.10 2qx6 s ALA 94 Cb 0.08 -3.34 -0.25 0.00 0.00 0.00 0.00 23.12 19.61 2qx6 s ALA 94 CO 0.67 -0.38 0.41 -0.25 0.00 0.00 0.00 175.76 176.21 2qx6 n ASP 95 N 0.23 0.23 -3.80 0.00 8.00 0.13 -4.89 116.55 116.45 2qx6 n ASP 95 Ca 0.03 0.10 -0.14 0.00 0.71 0.00 0.00 54.79 55.50 2qx6 n ASP 95 Cb 0.47 1.11 -0.15 0.00 -0.02 0.00 0.00 41.12 42.53 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 -5.24 1.38 -0.18 0.64 2.96 -0.99 -0.69 118.68 116.57 2qx6 s LEU 96 Ca -0.07 0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 2qx6 s LEU 96 Cb 0.09 0.01 0.02 0.00 0.50 0.00 0.00 46.19 46.81 2qx6 s LEU 96 CO 0.85 -0.08 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.91 2qx6 s VAL 97 N 0.67 2.10 -0.16 1.68 1.01 -0.08 -0.85 120.40 124.76 2qx6 s VAL 97 Ca -0.06 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 60.94 2qx6 s VAL 97 Cb -0.08 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2qx6 s VAL 97 CO -0.02 0.54 -0.01 -0.63 0.00 0.00 0.00 175.10 174.98 2qx6 s ILE 98 N 1.24 4.17 -0.24 2.22 1.01 0.03 -1.53 121.20 128.10 2qx6 s ILE 98 Ca 0.04 -0.26 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 2qx6 s ILE 98 Cb -0.13 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 2qx6 s ILE 98 CO -0.11 0.48 0.06 -0.36 0.00 0.00 0.00 174.94 175.00 2qx6 s PHE 99 N 0.38 3.08 -0.26 3.97 0.08 -0.50 -0.02 117.98 124.70 2qx6 s PHE 99 Ca -0.02 -0.45 -0.03 0.00 0.12 0.00 0.00 56.93 56.55 2qx6 s PHE 99 Cb -0.14 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.12 2qx6 s PHE 99 CO 0.02 -0.35 -0.02 -1.14 -0.10 0.00 0.00 175.22 173.62 2qx6 s GLN 100 N 1.54 2.84 0.07 0.44 2.00 -0.25 -0.09 119.66 126.21 2qx6 s GLN 100 Ca 0.06 -0.98 -0.26 0.00 -2.00 0.00 0.00 55.36 52.17 2qx6 s GLN 100 Cb -0.15 -3.09 0.08 0.00 0.80 0.00 0.00 33.01 30.65 2qx6 s GLN 100 CO 0.03 -0.44 0.70 -0.59 -0.50 0.00 0.00 175.29 174.49 2qx6 s PHE 101 N 1.36 -0.51 0.18 1.67 -0.12 -0.84 -1.12 117.98 118.60 2qx6 s PHE 101 Ca 0.00 0.47 -0.21 0.00 -0.05 0.00 0.00 56.93 57.15 2qx6 s PHE 101 Cb -0.17 0.52 -0.08 0.00 -0.63 0.00 0.00 43.02 42.66 2qx6 s PHE 101 CO -0.03 -0.71 0.70 -1.25 -0.05 0.00 0.00 175.22 173.88 2qx6 s PRO 102 N -2.99 4.30 0.03 1.99 0.04 -1.26 -2.04 135.00 135.07 2qx6 s PRO 102 Ca -0.01 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 61.62 2qx6 s PRO 102 Cb -0.01 -3.02 -0.07 0.00 0.04 0.00 0.00 34.50 31.44 2qx6 s PRO 102 CO -0.07 0.48 1.51 -1.17 0.04 0.00 0.00 177.00 177.78 2qx6 s LEU 103 N -1.66 4.33 -0.25 -3.56 2.96 0.38 -4.34 118.68 116.55 2qx6 s LEU 103 Ca 0.39 2.26 0.01 0.00 -0.22 0.00 0.00 54.13 56.57 2qx6 s LEU 103 Cb -0.18 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 42.99 2qx6 s LEU 103 CO 0.22 -0.79 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.04 2qx6 s TYR 104 N 2.53 3.14 -1.29 5.38 1.51 0.06 -4.76 117.35 123.92 2qx6 s TYR 104 Ca 0.68 -2.00 -0.04 0.00 -1.01 0.00 0.00 57.07 54.70 2qx6 s TYR 104 Cb -0.35 -1.98 -0.01 0.00 -0.11 0.00 0.00 41.96 39.52 2qx6 s TYR 104 CO 0.29 -0.83 0.65 0.91 -1.11 0.00 0.00 175.55 175.46 2qx6 n TRP 105 N 4.54 -1.86 -2.05 2.71 7.02 -1.26 -1.68 117.44 124.86 2qx6 n TRP 105 Ca -0.16 0.74 -0.21 0.00 -1.02 0.00 0.00 57.50 56.85 2qx6 n TRP 105 Cb 0.45 -4.02 -0.05 0.00 -2.42 0.00 0.00 31.31 25.27 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 -4.24 -0.56 -2.37 -5.99 3.01 -1.26 -4.88 117.46 101.16 2qx6 n PHE 106 Ca -0.25 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.21 2qx6 n PHE 106 Cb 0.66 -3.76 0.00 0.00 -0.01 0.00 0.00 39.48 36.37 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 -1.73 0.00 -4.88 4.37 2.88 -0.68 -4.83 113.62 108.76 2qx6 n SER 107 Ca -0.23 -0.21 -0.31 0.00 -1.33 0.00 0.00 58.87 56.79 2qx6 n SER 107 Cb 0.69 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.10 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 -2.71 4.90 0.64 2.46 -7.23 -1.26 -0.76 120.40 116.45 2qx6 s VAL 108 Ca 0.00 0.48 -0.18 0.00 -1.81 0.00 0.00 61.98 60.47 2qx6 s VAL 108 Cb 0.00 -3.65 -0.02 0.00 0.56 0.00 0.00 36.38 33.28 2qx6 s VAL 108 CO 0.00 -0.18 1.26 -2.65 -0.31 0.00 0.00 175.10 173.22 2qx6 n PRO 109 N -0.44 1.12 -0.32 4.82 -0.02 -1.26 -4.62 135.00 134.28 2qx6 n PRO 109 Ca 0.01 0.44 0.15 0.00 -2.02 0.00 0.00 63.50 62.08 2qx6 n PRO 109 Cb 0.53 -2.50 0.39 0.00 -0.02 0.00 0.00 33.50 31.90 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 0.56 1.88 -0.52 3.55 0.00 -1.96 -0.64 119.26 122.13 2qx6 h ALA 110 Ca -0.51 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2qx6 h ALA 110 Cb 1.34 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2qx6 h ALA 110 CO 0.53 -0.22 0.33 0.97 0.00 0.00 0.00 179.25 180.85 2qx6 h ILE 111 N 0.64 1.14 0.09 0.00 2.10 -1.93 0.18 117.51 119.72 2qx6 h ILE 111 Ca 0.54 -0.30 -0.25 0.00 1.08 0.00 0.00 64.86 65.92 2qx6 h ILE 111 Cb 1.01 0.40 -0.00 0.00 -1.09 0.00 0.00 36.82 37.13 2qx6 h ILE 111 CO -0.30 0.15 -1.16 0.25 -1.08 0.00 0.00 178.15 176.00 2qx6 h LEU 112 N 0.72 0.32 -1.03 2.19 5.85 -1.51 -2.70 115.31 119.14 2qx6 h LEU 112 Ca 0.19 -0.33 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 2qx6 h LEU 112 Cb -0.05 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 2qx6 h LEU 112 CO -0.04 1.25 0.39 0.50 -0.34 0.00 0.00 178.44 180.20 2qx6 h LYS 113 N 0.06 1.07 -0.40 1.25 1.63 -0.49 -1.71 116.57 117.98 2qx6 h LYS 113 Ca -0.10 -0.14 -0.06 0.00 -0.85 0.00 0.00 60.65 59.51 2qx6 h LYS 113 Cb 1.90 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 33.30 2qx6 h LYS 113 CO 0.18 0.81 0.01 0.78 -3.45 0.00 0.00 179.45 177.79 2qx6 h GLY 114 N 1.11 0.68 0.92 5.01 0.00 -0.61 0.72 103.07 110.91 2qx6 h GLY 114 Ca 0.27 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 2qx6 h GLY 114 CO -0.04 0.39 0.11 -0.25 0.00 0.00 0.00 176.54 176.75 2qx6 h TRP 115 N 0.61 0.33 -0.40 5.60 7.01 -1.02 -0.53 115.95 127.55 2qx6 h TRP 115 Ca 0.13 -0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 2qx6 h TRP 115 Cb 0.36 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.30 2qx6 h TRP 115 CO 0.02 0.33 0.24 0.52 -2.79 0.00 0.00 178.44 176.76 2qx6 h MET 116 N 0.24 0.55 -0.67 2.65 2.86 -0.82 0.13 114.93 119.87 2qx6 h MET 116 Ca 0.08 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2qx6 h MET 116 Cb 0.12 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2qx6 h MET 116 CO -0.01 0.41 0.34 -0.44 1.06 0.00 0.00 176.91 178.26 2qx6 h ASP 117 N 0.53 0.86 0.31 1.22 3.32 -0.68 -2.83 116.42 119.16 2qx6 h ASP 117 Ca 0.14 -0.12 -0.33 0.00 0.02 0.00 0.00 57.03 56.75 2qx6 h ASP 117 Cb 0.00 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 2qx6 h ASP 117 CO -0.03 0.74 -1.88 0.54 -1.72 0.00 0.00 179.24 176.89 2qx6 n ARG 118 N -4.48 0.68 0.13 3.56 1.74 -0.22 -4.50 116.66 113.56 2qx6 n ARG 118 Ca 0.05 0.26 -0.24 0.00 -0.77 0.00 0.00 57.85 57.15 2qx6 n ARG 118 Cb 0.12 -1.74 -0.16 0.00 -1.02 0.00 0.00 32.46 29.66 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 0.03 1.25 -0.84 1.55 2.07 -0.84 -3.38 116.25 116.08 2qx6 h VAL 119 Ca -0.36 -2.65 -0.73 0.00 0.82 0.00 0.00 66.70 63.78 2qx6 h VAL 119 Cb 2.03 3.02 -0.09 0.00 -1.52 0.00 0.00 31.29 34.73 2qx6 h VAL 119 CO 0.07 0.81 2.65 0.18 0.02 0.00 0.00 177.57 181.30 2qx6 n LEU 120 N -3.75 7.48 -4.91 2.57 4.77 -1.07 -4.80 117.00 117.30 2qx6 n LEU 120 Ca -0.18 -4.59 -0.27 0.00 -0.03 0.00 0.00 56.01 50.94 2qx6 n LEU 120 Cb 1.07 -1.49 0.02 0.00 -2.33 0.00 0.00 43.42 40.69 2qx6 n LEU 120 CO 0.58 1.66 0.49 0.00 -1.33 0.00 0.00 177.39 178.79 2qx6 s GLN 122 N -4.88 4.16 0.00 0.00 0.74 -1.26 -1.34 119.66 117.09 2qx6 s GLN 122 Ca 0.51 2.50 0.00 0.00 0.05 0.00 0.00 55.36 58.42 2qx6 s GLN 122 Cb -0.10 -3.04 0.00 0.00 1.10 0.00 0.00 33.01 30.97 2qx6 s GLN 122 CO 0.45 -0.55 0.00 0.41 -0.55 0.00 0.00 175.29 175.05 2qx6 n GLY 123 N 1.85 2.91 0.09 2.59 0.00 0.95 -4.42 105.19 109.17 2qx6 n GLY 123 Ca 0.06 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 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 0.52 0.02 1.61 7.35 -0.70 -4.74 117.46 121.52 2qx6 n PHE 124 Ca 0.00 0.23 0.08 0.00 -0.76 0.00 0.00 57.45 57.00 2qx6 n PHE 124 Cb 0.00 -0.77 -0.11 0.00 0.35 0.00 0.00 39.48 38.95 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 -3.95 2.51 -3.81 3.13 0.00 -0.45 -4.63 120.51 113.32 2qx6 n ALA 125 Ca -0.20 -0.53 -0.05 0.00 0.00 0.00 0.00 53.44 52.66 2qx6 n ALA 125 Cb 0.50 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 19.12 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 -3.31 -0.12 0.01 0.00 -0.71 -1.25 -2.51 117.98 110.08 2qx6 s PHE 126 Ca -0.06 -0.28 -0.10 0.00 -1.04 0.00 0.00 56.93 55.45 2qx6 s PHE 126 Cb 0.11 0.69 0.03 0.00 -1.21 0.00 0.00 43.02 42.64 2qx6 s PHE 126 CO 0.86 -1.04 0.46 -3.47 -1.34 0.00 0.00 175.22 170.68 2qx6 n ASP 127 N -0.59 -0.48 -4.57 1.98 -0.08 -0.21 -0.03 116.55 112.56 2qx6 n ASP 127 Ca -0.05 -1.14 -0.37 0.00 -1.51 0.00 0.00 54.79 51.71 2qx6 n ASP 127 Cb 0.60 0.76 -0.11 0.00 2.34 0.00 0.00 41.12 44.71 2qx6 n ASP 127 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2qx6 s ILE 128 N -2.16 5.09 -1.10 5.18 1.09 -1.26 -0.76 121.20 127.29 2qx6 s ILE 128 Ca 0.11 0.09 0.17 0.00 -1.10 0.00 0.00 60.65 59.92 2qx6 s ILE 128 Cb -0.00 -3.41 0.69 0.00 -1.06 0.00 0.00 42.46 38.67 2qx6 s ILE 128 CO 0.00 0.29 1.58 -0.81 -0.10 0.00 0.00 174.94 175.91 2qx6 n PRO 129 N 4.85 3.66 -2.62 2.79 -0.04 -1.26 -5.08 135.00 137.30 2qx6 n PRO 129 Ca -0.15 -2.70 -0.41 0.00 -0.04 0.00 0.00 63.50 60.20 2qx6 n PRO 129 Cb 0.52 -1.89 -0.03 0.00 -0.04 0.00 0.00 33.50 32.06 2qx6 n PRO 129 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2qx6 s GLY 130 N -0.85 1.37 0.06 0.55 0.00 0.06 -4.80 107.32 103.72 2qx6 s GLY 130 Ca 0.48 -2.35 -0.20 0.00 0.00 0.00 0.00 44.72 42.65 2qx6 s GLY 130 CO 0.22 2.58 0.46 -0.11 0.00 0.00 0.00 173.10 176.25 2qx6 s PHE 131 N 4.60 -0.33 0.00 1.90 -0.12 -1.21 -1.04 117.98 121.78 2qx6 s PHE 131 Ca 0.44 0.28 0.00 0.00 -0.05 0.00 0.00 56.93 57.60 2qx6 s PHE 131 Cb -0.01 0.29 0.00 0.00 -0.63 0.00 0.00 43.02 42.67 2qx6 s PHE 131 CO -0.10 -0.63 0.00 0.66 -0.05 0.00 0.00 175.22 175.10 2qx6 n TYR 132 N 0.33 0.00 -0.36 3.49 4.01 0.30 -1.99 117.16 122.94 2qx6 n TYR 132 Ca -0.18 0.00 0.35 0.00 -0.16 0.00 0.00 57.90 57.91 2qx6 n TYR 132 Cb 0.61 0.01 0.73 0.00 -0.31 0.00 0.00 39.34 40.37 2qx6 n TYR 132 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2qx6 h ASP 133 N 1.93 0.06 -0.56 7.72 3.45 -1.90 0.42 116.42 127.54 2qx6 h ASP 133 Ca 0.00 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.47 2qx6 h ASP 133 Cb 0.00 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 2qx6 h ASP 133 CO 0.00 0.00 0.00 -1.54 -1.57 0.00 0.00 179.24 176.13 2qx6 n SER 134 N -4.23 4.55 -4.49 6.45 3.41 -0.84 -4.89 113.62 113.57 2qx6 n SER 134 Ca 0.28 -2.52 -0.37 0.00 -0.26 0.00 0.00 58.87 56.00 2qx6 n SER 134 Cb 1.28 -0.55 0.05 0.00 -0.26 0.00 0.00 64.21 64.74 2qx6 n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qx6 n GLY 135 N 0.80 -1.32 0.24 5.00 0.00 0.15 -3.31 105.19 106.76 2qx6 n GLY 135 Ca 0.24 -0.26 0.17 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 0.00 -3.79 0.99 3.38 -1.42 -2.17 115.31 112.31 2qx6 h LEU 136 Ca -0.46 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.24 2qx6 h LEU 136 Cb 1.37 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.96 2qx6 h LEU 136 CO 0.46 0.00 0.34 0.18 0.09 0.00 0.00 178.44 179.51 2qx6 n LEU 137 N -2.72 6.22 -4.74 1.67 4.77 0.48 -4.97 117.00 117.69 2qx6 n LEU 137 Ca -0.01 -3.31 -0.37 0.00 -0.03 0.00 0.00 56.01 52.30 2qx6 n LEU 137 Cb 0.14 -0.76 0.05 0.00 -2.33 0.00 0.00 43.42 40.52 2qx6 n LEU 137 CO 0.19 0.86 0.89 0.00 -1.33 0.00 0.00 177.39 177.99 2qx6 s GLN 138 N -3.06 2.72 0.00 3.23 -2.07 -0.82 -2.49 119.66 117.18 2qx6 s GLN 138 Ca 0.56 1.99 0.00 0.00 -1.82 0.00 0.00 55.36 56.08 2qx6 s GLN 138 Cb 0.45 -1.89 0.00 0.00 -1.09 0.00 0.00 33.01 30.48 2qx6 s GLN 138 CO 0.13 -1.44 0.00 0.41 -1.32 0.00 0.00 175.29 173.07 2qx6 n GLY 139 N 0.76 1.19 3.85 2.60 0.00 -1.26 -5.00 105.19 107.33 2qx6 n GLY 139 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.77 3.14 0.08 1.61 1.02 -1.04 -5.00 119.74 118.78 2qx6 s LYS 140 Ca 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 55.97 55.35 2qx6 s LYS 140 Cb 0.00 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.44 2qx6 s LYS 140 CO 0.00 0.54 0.09 -0.51 -0.92 0.00 0.00 175.35 174.55 2qx6 s LEU 141 N -2.82 3.85 0.02 3.17 1.43 0.14 -1.22 118.68 123.25 2qx6 s LEU 141 Ca 0.32 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2qx6 s LEU 141 Cb -0.11 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.56 2qx6 s LEU 141 CO 0.25 0.17 -0.04 0.00 0.23 0.00 0.00 176.35 176.96 2qx6 s ALA 142 N -1.41 0.19 -0.14 4.21 0.00 -0.50 -0.90 121.76 123.21 2qx6 s ALA 142 Ca 0.30 -0.55 -0.09 0.00 0.00 0.00 0.00 51.96 51.62 2qx6 s ALA 142 Cb -0.12 0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.16 2qx6 s ALA 142 CO 0.23 -0.12 0.35 -1.17 0.00 0.00 0.00 175.76 175.05 2qx6 s LEU 143 N -1.30 0.24 -0.24 0.00 0.20 -0.58 -0.65 118.68 116.35 2qx6 s LEU 143 Ca -0.13 0.74 -0.15 0.00 0.69 0.00 0.00 54.13 55.28 2qx6 s LEU 143 Cb -0.09 1.14 -0.04 0.00 -0.43 0.00 0.00 46.19 46.77 2qx6 s LEU 143 CO -0.01 -0.17 0.36 -0.76 -0.29 0.00 0.00 176.35 175.48 2qx6 s LEU 144 N 1.06 4.09 -0.38 -0.68 1.43 -1.26 -1.41 118.68 121.52 2qx6 s LEU 144 Ca -0.07 0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 53.35 2qx6 s LEU 144 Cb -0.07 -2.42 0.09 0.00 0.03 0.00 0.00 46.19 43.81 2qx6 s LEU 144 CO -0.08 -0.11 0.16 -0.55 0.23 0.00 0.00 176.35 176.00 2qx6 s SER 145 N 1.33 5.23 0.05 2.29 0.15 0.88 -0.71 113.70 122.90 2qx6 s SER 145 Ca 0.16 -1.76 0.05 0.00 0.70 0.00 0.00 55.95 55.09 2qx6 s SER 145 Cb -0.15 -1.82 -0.04 0.00 -1.71 0.00 0.00 66.02 62.30 2qx6 s SER 145 CO 0.08 -0.47 -0.08 -0.69 1.20 0.00 0.00 173.24 173.28 2qx6 s VAL 146 N 1.21 3.54 0.04 4.45 1.01 0.47 -1.98 120.40 129.14 2qx6 s VAL 146 Ca 0.04 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.13 2qx6 s VAL 146 Cb -0.22 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2qx6 s VAL 146 CO -0.02 0.27 -0.25 0.42 0.00 0.00 0.00 175.10 175.52 2qx6 s THR 147 N -1.09 2.24 0.36 3.92 -4.23 -0.86 -0.55 115.64 115.41 2qx6 s THR 147 Ca 0.19 -1.33 0.08 0.00 -1.18 0.00 0.00 61.69 59.45 2qx6 s THR 147 Cb -0.11 -1.87 -0.07 0.00 1.34 0.00 0.00 72.50 71.79 2qx6 s THR 147 CO 0.11 0.38 -0.04 0.42 -0.54 0.00 0.00 174.62 174.95 2qx6 s THR 148 N -0.80 2.02 -0.16 3.99 -4.23 -0.98 -0.47 115.64 115.00 2qx6 s THR 148 Ca 0.12 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.57 2qx6 s THR 148 Cb -0.10 -2.76 -0.23 0.00 1.34 0.00 0.00 72.50 70.75 2qx6 s THR 148 CO 0.02 -0.12 0.20 0.61 -0.54 0.00 0.00 174.62 174.79 2qx6 n GLY 149 N -0.83 -0.67 3.81 3.99 0.00 -1.26 -2.02 105.19 108.22 2qx6 n GLY 149 Ca -0.05 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 -5.74 2.44 0.69 -0.02 0.00 -1.26 -4.45 107.32 98.98 2qx6 s GLY 150 Ca -0.20 0.46 -0.11 0.00 0.00 0.00 0.00 44.72 44.87 2qx6 s GLY 150 CO 0.74 0.76 1.06 -0.51 0.00 0.00 0.00 173.10 175.15 2qx6 s THR 151 N -2.10 4.04 0.26 0.90 -4.23 -1.26 -3.47 115.64 109.79 2qx6 s THR 151 Ca 0.63 0.66 -0.01 0.00 -1.18 0.00 0.00 61.69 61.79 2qx6 s THR 151 Cb -0.11 -3.47 0.25 0.00 1.34 0.00 0.00 72.50 70.51 2qx6 s THR 151 CO 0.15 -0.87 1.80 0.00 -0.54 0.00 0.00 174.62 175.16 2qx6 h ALA 152 N -0.68 1.32 -0.60 3.99 0.00 -1.96 -0.47 119.26 120.87 2qx6 h ALA 152 Ca -0.44 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2qx6 h ALA 152 Cb 1.21 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2qx6 h ALA 152 CO 0.58 0.05 0.36 1.49 0.00 0.00 0.00 179.25 181.73 2qx6 h GLU 153 N 0.77 0.81 0.00 0.00 4.57 -2.00 -0.87 114.58 117.87 2qx6 h GLU 153 Ca 0.46 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.53 2qx6 h GLU 153 Cb 0.54 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 2qx6 h GLU 153 CO -0.30 0.58 -0.20 0.52 -1.18 0.00 0.00 179.01 178.43 2qx6 h MET 154 N 0.83 0.00 -1.37 1.92 2.86 -1.45 -2.86 114.93 114.86 2qx6 h MET 154 Ca 0.22 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.36 2qx6 h MET 154 Cb -0.02 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 31.43 2qx6 h MET 154 CO -0.04 0.20 0.62 0.66 1.06 0.00 0.00 176.91 179.41 2qx6 n TYR 155 N -4.09 2.27 -4.15 -0.22 4.01 -0.33 -2.00 117.16 112.65 2qx6 n TYR 155 Ca -0.02 -2.40 -0.23 0.00 -0.16 0.00 0.00 57.90 55.09 2qx6 n TYR 155 Cb 0.27 -1.19 -0.07 0.00 -0.31 0.00 0.00 39.34 38.04 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 -3.40 3.16 0.30 -0.72 -4.23 -1.08 -3.06 115.64 106.61 2qx6 s THR 156 Ca 0.47 -1.74 0.06 0.00 -1.18 0.00 0.00 61.69 59.29 2qx6 s THR 156 Cb 0.37 -2.96 0.30 0.00 1.34 0.00 0.00 72.50 71.55 2qx6 s THR 156 CO -0.04 -0.23 1.69 0.11 -0.54 0.00 0.00 174.62 175.60 2qx6 h LYS 157 N 1.63 0.36 -0.49 3.99 1.79 -1.90 0.57 116.57 122.52 2qx6 h LYS 157 Ca -0.44 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 2qx6 h LYS 157 Cb 1.25 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2qx6 h LYS 157 CO 0.63 0.24 0.00 0.25 -1.08 0.00 0.00 179.45 179.48 2qx6 n THR 158 N -5.06 0.67 -1.97 -0.16 -2.24 -1.26 -4.65 114.28 99.61 2qx6 n THR 158 Ca 0.24 -0.84 -0.28 0.00 -2.27 0.00 0.00 64.05 60.90 2qx6 n THR 158 Cb 0.72 0.82 0.08 0.00 -2.10 0.00 0.00 70.33 69.85 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 -1.30 1.61 0.23 3.38 0.00 0.19 -4.98 107.32 106.45 2qx6 s GLY 159 Ca 0.41 -0.67 -0.06 0.00 0.00 0.00 0.00 44.72 44.40 2qx6 s GLY 159 CO 0.31 -0.21 1.81 -0.39 0.00 0.00 0.00 173.10 174.62 2qx6 h VAL 160 N -0.90 1.26 0.00 1.40 -1.51 -1.82 -2.89 116.25 111.78 2qx6 h VAL 160 Ca -0.46 -0.76 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 2qx6 h VAL 160 Cb 1.32 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 2qx6 h VAL 160 CO 0.65 0.32 -0.15 0.59 -1.23 0.00 0.00 177.57 177.74 2qx6 n ASN 161 N -4.29 0.34 0.00 4.19 3.02 -0.85 -5.05 115.26 112.62 2qx6 n ASN 161 Ca 0.07 0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.97 2qx6 n ASN 161 Cb 0.16 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 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 1.44 -2.42 3.77 7.41 0.00 -1.09 -4.88 105.19 109.41 2qx6 n GLY 162 Ca 0.06 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.01 6.86 0.37 1.61 2.15 -1.21 -2.77 116.67 121.66 2qx6 s ASP 163 Ca 0.00 2.47 0.07 0.00 0.43 0.00 0.00 52.55 55.52 2qx6 s ASP 163 Cb 0.00 -2.63 0.79 0.00 -0.30 0.00 0.00 42.92 40.77 2qx6 s ASP 163 CO 0.00 -0.45 1.93 0.28 -0.17 0.00 0.00 175.17 176.76 2qx6 h SER 164 N 3.31 0.64 -0.08 -0.34 0.02 -1.88 -0.04 113.55 115.19 2qx6 h SER 164 Ca -0.48 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 60.50 2qx6 h SER 164 Cb 1.22 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.64 2qx6 h SER 164 CO 0.65 0.39 0.11 0.03 -1.14 0.00 0.00 176.83 176.86 2qx6 h ARG 165 N 0.71 0.00 -0.22 3.45 3.08 -1.91 -2.10 114.38 117.39 2qx6 h ARG 165 Ca 0.35 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.39 2qx6 h ARG 165 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2qx6 h ARG 165 CO -0.13 0.00 0.08 1.88 -1.07 0.00 0.00 179.97 180.73 2qx6 h TYR 166 N 0.00 0.35 0.00 3.04 0.05 -1.17 -2.81 116.97 116.43 2qx6 h TYR 166 Ca 0.04 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2qx6 h TYR 166 Cb 0.25 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.89 2qx6 h TYR 166 CO 0.00 0.39 0.00 0.27 -1.05 0.00 0.00 178.16 177.77 2qx6 h PHE 167 N 0.20 0.00 0.00 4.88 -5.15 -1.52 -3.24 116.94 112.12 2qx6 h PHE 167 Ca 0.07 0.00 -0.09 0.00 -0.20 0.00 0.00 57.97 57.75 2qx6 h PHE 167 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.35 2qx6 h PHE 167 CO -0.01 0.00 -0.43 -0.07 -2.00 0.00 0.00 178.31 175.81 2qx6 h LEU 168 N 0.00 0.00 -0.45 2.10 3.38 -1.21 -3.35 115.31 115.78 2qx6 h LEU 168 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2qx6 h LEU 168 Cb 0.78 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.43 2qx6 h LEU 168 CO 0.00 0.43 -0.40 -0.25 0.09 0.00 0.00 178.44 178.30 2qx6 h TRP 169 N 0.00 -1.16 -0.60 1.13 2.91 -1.54 0.26 115.95 116.95 2qx6 h TRP 169 Ca -0.00 0.07 0.03 0.00 1.13 0.00 0.00 58.89 60.11 2qx6 h TRP 169 Cb 0.95 0.57 -0.03 0.00 -0.51 0.00 0.00 29.16 30.14 2qx6 h TRP 169 CO 0.00 -0.42 0.40 -1.35 -1.03 0.00 0.00 178.44 176.03 2qx6 h PRO 170 N -0.29 0.70 0.01 2.65 0.11 -1.83 -0.10 132.00 133.25 2qx6 h PRO 170 Ca 0.16 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 2qx6 h PRO 170 Cb 0.57 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.52 2qx6 h PRO 170 CO -0.59 0.46 -0.00 -0.07 -0.21 0.00 0.00 178.00 177.58 2qx6 h LEU 171 N 0.72 -0.01 0.07 2.35 3.38 -1.53 -2.04 115.31 118.25 2qx6 h LEU 171 Ca 0.24 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2qx6 h LEU 171 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2qx6 h LEU 171 CO -0.06 0.56 -0.03 1.56 0.09 0.00 0.00 178.44 180.55 2qx6 h GLN 172 N -1.00 -0.09 0.00 1.13 4.20 -0.56 -0.77 115.11 118.01 2qx6 h GLN 172 Ca -0.00 0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 2qx6 h GLN 172 Cb 0.15 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2qx6 h GLN 172 CO 0.00 0.19 -0.84 1.25 -0.67 0.00 0.00 178.83 178.76 2qx6 h HIS 173 N -0.38 0.00 0.00 2.96 2.76 -1.23 0.50 115.15 119.76 2qx6 h HIS 173 Ca -0.01 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 2qx6 h HIS 173 Cb 0.33 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.29 2qx6 h HIS 173 CO 0.02 0.96 -0.08 0.78 -1.30 0.00 0.00 177.93 178.32 2qx6 h GLY 174 N -1.00 0.00 0.00 5.26 0.00 -1.01 -2.53 103.07 103.79 2qx6 h GLY 174 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2qx6 h GLY 174 CO -0.12 0.00 -0.12 2.41 0.00 0.00 0.00 176.54 178.71 2qx6 n THR 175 N -3.54 0.80 0.16 4.70 -1.04 -0.78 -4.54 114.28 110.04 2qx6 n THR 175 Ca -0.02 0.26 -0.14 0.00 -2.04 0.00 0.00 64.05 62.11 2qx6 n THR 175 Cb 0.20 -1.50 -0.08 0.00 -1.82 0.00 0.00 70.33 67.13 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 -0.12 -0.34 -1.07 -4.42 3.38 -1.13 -2.30 115.31 109.32 2qx6 h LEU 176 Ca 0.00 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2qx6 h LEU 176 Cb 0.12 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2qx6 h LEU 176 CO 0.00 -0.05 0.18 -0.74 0.09 0.00 0.00 178.44 177.92 2qx6 h HIS 177 N -0.62 0.86 -0.58 1.13 2.76 -0.96 -1.65 115.15 116.09 2qx6 h HIS 177 Ca -0.04 -0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.11 2qx6 h HIS 177 Cb 0.45 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.12 2qx6 h HIS 177 CO 0.00 0.70 0.38 0.35 -1.30 0.00 0.00 177.93 178.06 2qx6 h PHE 178 N 0.82 0.62 -0.18 5.26 3.57 -1.34 -0.11 116.94 125.58 2qx6 h PHE 178 Ca 0.19 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2qx6 h PHE 178 Cb 0.23 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.77 2qx6 h PHE 178 CO 0.01 0.35 0.00 0.00 -2.23 0.00 0.00 178.31 176.45 2qx6 n GLY 180 N 0.95 0.72 3.77 0.00 0.00 -0.06 -0.39 105.19 110.18 2qx6 n GLY 180 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.73 2.92 -0.17 1.61 0.08 -0.68 -3.31 117.98 115.70 2qx6 s PHE 181 Ca 0.00 1.46 -0.19 0.00 0.12 0.00 0.00 56.93 58.32 2qx6 s PHE 181 Cb 0.00 -3.58 -0.03 0.00 -0.57 0.00 0.00 43.02 38.84 2qx6 s PHE 181 CO 0.00 -1.80 0.55 0.15 -0.10 0.00 0.00 175.22 174.02 2qx6 s LYS 182 N -2.22 4.24 -0.26 0.44 -0.14 -0.35 -4.28 119.74 117.17 2qx6 s LYS 182 Ca 0.56 0.51 -0.14 0.00 -1.36 0.00 0.00 55.97 55.54 2qx6 s LYS 182 Cb -0.36 -3.53 -0.04 0.00 -1.68 0.00 0.00 37.83 32.22 2qx6 s LYS 182 CO 0.46 -0.10 0.33 0.08 -0.76 0.00 0.00 175.35 175.36 2qx6 s VAL 183 N 1.44 5.21 0.49 3.17 1.01 -1.26 -1.40 120.40 129.06 2qx6 s VAL 183 Ca 0.27 0.49 -0.13 0.00 0.00 0.00 0.00 61.98 62.61 2qx6 s VAL 183 Cb -0.16 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.50 2qx6 s VAL 183 CO 0.11 0.20 0.90 -0.76 0.00 0.00 0.00 175.10 175.55 2qx6 s LEU 184 N 1.83 3.65 0.27 3.92 1.43 0.18 -0.26 118.68 129.69 2qx6 s LEU 184 Ca 0.14 1.36 -0.30 0.00 -1.03 0.00 0.00 54.13 54.30 2qx6 s LEU 184 Cb -0.15 -4.30 -0.13 0.00 0.03 0.00 0.00 46.19 41.64 2qx6 s LEU 184 CO 0.09 -0.55 1.40 0.00 0.23 0.00 0.00 176.35 177.52 2qx6 n ALA 185 N -1.64 1.30 -1.59 4.21 0.00 -1.26 -4.62 120.51 116.91 2qx6 n ALA 185 Ca 0.05 0.40 -0.35 0.00 0.00 0.00 0.00 53.44 53.53 2qx6 n ALA 185 Cb 0.54 -2.29 0.06 0.00 0.00 0.00 0.00 19.45 17.77 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 -0.76 2.57 -0.30 0.00 0.04 -1.26 -4.76 135.00 130.53 2qx6 s PRO 186 Ca 0.65 1.83 -0.08 0.00 0.04 0.00 0.00 61.00 63.43 2qx6 s PRO 186 Cb -0.61 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.05 2qx6 s PRO 186 CO 0.52 -1.52 0.11 -1.14 0.04 0.00 0.00 177.00 175.02 2qx6 s GLN 187 N -3.60 3.22 -0.23 4.56 2.00 0.11 -5.01 119.66 120.71 2qx6 s GLN 187 Ca 0.77 -0.78 0.00 0.00 -2.00 0.00 0.00 55.36 53.35 2qx6 s GLN 187 Cb -0.31 -3.46 0.03 0.00 0.80 0.00 0.00 33.01 30.08 2qx6 s GLN 187 CO 0.39 -0.42 -0.11 0.42 -0.50 0.00 0.00 175.29 175.07 2qx6 s ILE 188 N 1.55 2.49 -0.65 -2.34 1.01 -1.26 -0.39 121.20 121.61 2qx6 s ILE 188 Ca 0.04 -1.17 -0.15 0.00 0.00 0.00 0.00 60.65 59.37 2qx6 s ILE 188 Cb -0.17 -2.27 0.16 0.00 0.01 0.00 0.00 42.46 40.20 2qx6 s ILE 188 CO 0.04 0.22 0.59 -0.44 0.00 0.00 0.00 174.94 175.36 2qx6 s SER 189 N 1.26 6.37 0.14 3.58 0.01 0.28 -5.00 113.70 120.34 2qx6 s SER 189 Ca -0.01 -2.15 -0.31 0.00 1.31 0.00 0.00 55.95 54.79 2qx6 s SER 189 Cb -0.17 -2.20 -0.09 0.00 0.21 0.00 0.00 66.02 63.78 2qx6 s SER 189 CO -0.07 -0.74 1.42 -0.36 0.41 0.00 0.00 173.24 173.90 2qx6 s PHE 190 N 1.03 3.19 -0.54 2.43 0.08 -1.26 -2.32 117.98 120.59 2qx6 s PHE 190 Ca 0.09 0.92 -0.06 0.00 0.12 0.00 0.00 56.93 58.00 2qx6 s PHE 190 Cb -0.22 -3.73 0.01 0.00 -0.57 0.00 0.00 43.02 38.50 2qx6 s PHE 190 CO -0.02 -2.56 0.36 0.00 -0.10 0.00 0.00 175.22 172.90 2qx6 n ALA 191 N 3.69 -2.01 0.26 5.36 0.00 -0.85 -4.85 120.51 122.10 2qx6 n ALA 191 Ca 0.11 -0.21 0.14 0.00 0.00 0.00 0.00 53.44 53.47 2qx6 n ALA 191 Cb 0.41 -0.70 0.65 0.00 0.00 0.00 0.00 19.45 19.82 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 0.12 0.00 -0.07 0.00 0.13 -1.76 -2.75 132.00 127.67 2qx6 h PRO 192 Ca -0.38 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.66 2qx6 h PRO 192 Cb 0.81 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2qx6 h PRO 192 CO 0.24 0.11 -0.35 0.93 -0.23 0.00 0.00 178.00 178.70 2qx6 h GLU 193 N 0.00 0.15 0.09 0.86 5.08 -1.89 -3.22 114.58 115.65 2qx6 h GLU 193 Ca -0.00 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 2qx6 h GLU 193 Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2qx6 h GLU 193 CO 0.01 0.49 -0.89 0.82 -1.00 0.00 0.00 179.01 178.44 2qx6 h ILE 194 N 0.13 1.35 -2.64 3.13 2.04 -1.88 -3.48 117.51 116.16 2qx6 h ILE 194 Ca 0.01 -2.42 -0.52 0.00 1.00 0.00 0.00 64.86 62.93 2qx6 h ILE 194 Cb 0.69 2.98 0.23 0.00 -0.74 0.00 0.00 36.82 39.98 2qx6 h ILE 194 CO 0.05 0.65 -1.20 0.00 0.00 0.00 0.00 178.15 177.65 2qx6 n ALA 195 N -2.83 -3.94 -2.00 1.87 0.00 -1.06 -5.01 120.51 107.53 2qx6 n ALA 195 Ca -0.19 -0.80 -0.24 0.00 0.00 0.00 0.00 53.44 52.21 2qx6 n ALA 195 Cb 0.77 -1.49 0.05 0.00 0.00 0.00 0.00 19.45 18.78 2qx6 n ALA 195 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qx6 s SER 196 N -1.62 5.18 0.25 0.00 1.04 -1.26 -4.86 113.70 112.43 2qx6 s SER 196 Ca 0.50 0.36 -0.04 0.00 0.48 0.00 0.00 55.95 57.26 2qx6 s SER 196 Cb -0.16 -1.20 0.43 0.00 0.10 0.00 0.00 66.02 65.20 2qx6 s SER 196 CO 0.72 -1.29 1.77 -0.33 0.98 0.00 0.00 173.24 175.09 2qx6 h GLU 197 N -0.25 0.61 0.00 4.02 4.39 -1.96 0.11 114.58 121.51 2qx6 h GLU 197 Ca -0.44 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.22 2qx6 h GLU 197 Cb 1.29 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2qx6 h GLU 197 CO 0.58 0.40 -0.00 0.93 -1.16 0.00 0.00 179.01 179.76 2qx6 h GLU 198 N 0.63 -0.00 -0.55 2.33 3.07 -1.98 0.23 114.58 118.32 2qx6 h GLU 198 Ca 0.41 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.26 2qx6 h GLU 198 Cb 0.50 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.38 2qx6 h GLU 198 CO -0.31 0.14 0.29 0.93 -1.40 0.00 0.00 179.01 178.65 2qx6 h GLU 199 N -0.14 0.75 0.20 2.33 5.08 -1.79 0.22 114.58 121.22 2qx6 h GLU 199 Ca -0.00 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2qx6 h GLU 199 Cb 0.14 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2qx6 h GLU 199 CO 0.00 0.56 -0.09 -0.09 -1.00 0.00 0.00 179.01 178.39 2qx6 h ARG 200 N 0.76 -0.26 0.00 2.33 2.43 -0.50 -0.55 114.38 118.59 2qx6 h ARG 200 Ca 0.19 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2qx6 h ARG 200 Cb 0.04 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2qx6 h ARG 200 CO -0.03 0.03 -0.02 0.87 -1.51 0.00 0.00 179.97 179.31 2qx6 h LYS 201 N -0.54 0.00 0.06 0.20 1.79 -0.09 -1.90 116.57 116.10 2qx6 h LYS 201 Ca -0.03 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.19 2qx6 h LYS 201 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 2qx6 h LYS 201 CO 0.04 0.02 -1.09 0.78 -1.08 0.00 0.00 179.45 178.13 2qx6 h GLY 202 N 0.16 0.40 1.71 3.86 0.00 -0.04 -2.43 103.07 106.73 2qx6 h GLY 202 Ca -0.00 -0.82 -0.16 0.00 0.00 0.00 0.00 47.33 46.35 2qx6 h GLY 202 CO 0.00 0.72 -0.65 -0.33 0.00 0.00 0.00 176.54 176.29 2qx6 h MET 203 N 0.16 0.30 -0.41 4.80 2.86 -0.34 -1.75 114.93 120.54 2qx6 h MET 203 Ca -0.11 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.20 2qx6 h MET 203 Cb 1.76 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.45 2qx6 h MET 203 CO 0.18 0.84 -0.20 0.28 1.06 0.00 0.00 176.91 179.08 2qx6 h VAL 204 N 0.21 1.28 -0.35 -2.22 2.07 -1.47 -2.66 116.25 113.12 2qx6 h VAL 204 Ca -0.01 -1.34 -0.11 0.00 0.82 0.00 0.00 66.70 66.06 2qx6 h VAL 204 Cb 1.18 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 2qx6 h VAL 204 CO 0.10 0.45 -0.22 0.00 0.02 0.00 0.00 177.57 177.92 2qx6 h ALA 205 N 0.82 0.96 -0.81 1.67 0.00 -1.34 -0.71 119.26 119.85 2qx6 h ALA 205 Ca 0.09 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2qx6 h ALA 205 Cb 0.76 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2qx6 h ALA 205 CO 0.06 0.60 0.36 0.00 0.00 0.00 0.00 179.25 180.28 2qx6 h ALA 206 N 1.16 1.04 -0.06 0.00 0.00 -1.23 0.36 119.26 120.54 2qx6 h ALA 206 Ca 0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2qx6 h ALA 206 Cb 0.70 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2qx6 h ALA 206 CO 0.05 0.63 0.00 2.35 0.00 0.00 0.00 179.25 182.29 2qx6 h TRP 207 N 1.15 0.10 -0.91 0.00 -0.00 -1.17 0.26 115.95 115.39 2qx6 h TRP 207 Ca 0.27 -0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.15 2qx6 h TRP 207 Cb 0.16 -0.03 -0.04 0.00 -0.00 0.00 0.00 29.16 29.25 2qx6 h TRP 207 CO 0.02 0.35 0.58 1.03 -0.00 0.00 0.00 178.44 180.41 2qx6 h SER 208 N -0.17 1.07 -0.42 2.65 0.87 -0.85 -0.90 113.55 115.79 2qx6 h SER 208 Ca 0.02 -0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 2qx6 h SER 208 Cb 0.30 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2qx6 h SER 208 CO 0.00 0.80 0.02 1.56 -0.53 0.00 0.00 176.83 178.68 2qx6 h GLN 209 N 1.24 0.74 -0.46 2.24 4.20 -0.08 -2.90 115.11 120.09 2qx6 h GLN 209 Ca 0.33 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 2qx6 h GLN 209 Cb -0.10 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 2qx6 h GLN 209 CO -0.07 0.80 0.08 -0.09 -0.67 0.00 0.00 178.83 178.88 2qx6 h ARG 210 N 0.58 0.71 0.00 1.46 2.43 0.00 -2.43 114.38 117.13 2qx6 h ARG 210 Ca 0.12 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2qx6 h ARG 210 Cb 0.45 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2qx6 h ARG 210 CO 0.02 0.67 -0.06 -0.07 -1.51 0.00 0.00 179.97 179.02 2qx6 h LEU 211 N 0.68 0.00 -1.26 3.80 3.38 -0.98 -2.29 115.31 118.64 2qx6 h LEU 211 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2qx6 h LEU 211 Cb 0.31 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2qx6 h LEU 211 CO 0.00 0.06 0.33 1.56 0.09 0.00 0.00 178.44 180.48 2qx6 h GLN 212 N 0.00 0.83 -0.12 1.13 4.20 -1.30 -3.04 115.11 116.81 2qx6 h GLN 212 Ca -0.00 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 2qx6 h GLN 212 Cb 0.27 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2qx6 h GLN 212 CO 0.01 0.61 -0.09 0.25 -0.67 0.00 0.00 178.83 178.94 2qx6 n THR 213 N -4.38 2.14 -0.28 -0.54 -2.24 -0.90 -4.76 114.28 103.31 2qx6 n THR 213 Ca 0.06 -2.40 0.14 0.00 -2.27 0.00 0.00 64.05 59.57 2qx6 n THR 213 Cb 0.10 -0.26 0.40 0.00 -2.10 0.00 0.00 70.33 68.47 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 0.78 0.77 0.00 2.28 6.09 -1.33 0.99 117.51 127.09 2qx6 h ILE 214 Ca 0.03 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.30 2qx6 h ILE 214 Cb 1.21 0.08 0.00 0.00 0.47 0.00 0.00 36.82 38.58 2qx6 h ILE 214 CO 0.12 0.12 0.00 0.79 -3.07 0.00 0.00 178.15 176.10 2qx6 n TRP 215 N -4.59 0.00 0.92 2.19 7.02 -1.26 -2.65 117.44 119.07 2qx6 n TRP 215 Ca 0.19 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.77 2qx6 n TRP 215 Cb 0.55 -0.27 -0.06 0.00 -2.42 0.00 0.00 31.31 29.10 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 -1.27 0.05 -2.25 -0.99 4.01 0.33 -4.99 118.16 113.06 2qx6 n LYS 216 Ca 0.12 -0.01 -0.36 0.00 -0.51 0.00 0.00 58.31 57.55 2qx6 n LYS 216 Cb 0.19 -1.51 -0.00 0.00 -0.51 0.00 0.00 35.03 33.21 2qx6 n LYS 216 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 2qx6 s GLU 217 N -3.04 3.45 -0.09 1.97 2.02 -1.09 -5.05 118.70 116.88 2qx6 s GLU 217 Ca 0.07 1.66 -0.06 0.00 0.02 0.00 0.00 54.97 56.66 2qx6 s GLU 217 Cb 0.16 -2.11 -0.04 0.00 0.10 0.00 0.00 34.13 32.24 2qx6 s GLU 217 CO 0.84 -0.78 0.17 -1.21 0.02 0.00 0.00 175.26 174.30 2qx6 s GLU 218 N -3.13 3.47 0.63 1.61 2.02 -1.26 -5.08 118.70 116.96 2qx6 s GLU 218 Ca 0.70 -0.15 -0.17 0.00 0.02 0.00 0.00 54.97 55.38 2qx6 s GLU 218 Cb -0.25 -3.17 -0.02 0.00 0.10 0.00 0.00 34.13 30.79 2qx6 s GLU 218 CO 0.29 0.75 1.18 -2.14 0.02 0.00 0.00 175.26 175.36 2qx6 s PRO 219 N -1.26 2.80 0.59 0.39 0.02 -1.26 -4.72 135.00 131.56 2qx6 s PRO 219 Ca 0.19 1.71 -0.15 0.00 0.02 0.00 0.00 61.00 62.77 2qx6 s PRO 219 Cb -0.12 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.43 2qx6 s PRO 219 CO 0.08 -1.31 1.03 0.96 -0.33 0.00 0.00 177.00 177.43 2qx6 s ILE 220 N -1.83 4.24 -0.73 2.83 -4.36 0.64 -4.95 121.20 117.04 2qx6 s ILE 220 Ca 0.74 0.96 -0.25 0.00 -0.26 0.00 0.00 60.65 61.84 2qx6 s ILE 220 Cb -0.28 -3.58 0.04 0.00 1.25 0.00 0.00 42.46 39.90 2qx6 s ILE 220 CO 0.36 -0.73 1.19 -2.16 0.24 0.00 0.00 174.94 173.85 2qx6 s PRO 221 N -4.40 3.19 -1.19 0.37 0.04 -1.26 -4.66 135.00 127.09 2qx6 s PRO 221 Ca 0.60 -0.49 -0.22 0.00 0.04 0.00 0.00 61.00 60.93 2qx6 s PRO 221 Cb -0.13 -4.26 -0.05 0.00 0.04 0.00 0.00 34.50 30.10 2qx6 s PRO 221 CO 0.40 -2.05 1.88 0.00 0.04 0.00 0.00 177.00 177.28 2qx6 s THR 223 N 9.32 1.21 0.39 0.00 -4.23 -1.26 -4.99 115.64 116.08 2qx6 s THR 223 Ca 0.65 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 2qx6 s THR 223 Cb 0.00 -2.21 0.27 0.00 1.34 0.00 0.00 72.50 71.89 2qx6 s THR 223 CO 0.11 -0.45 2.04 0.00 -0.54 0.00 0.00 174.62 175.78 2qx6 h ALA 224 N 2.53 1.65 -0.29 3.99 0.00 -1.99 -1.73 119.26 123.41 2qx6 h ALA 224 Ca -0.38 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2qx6 h ALA 224 Cb 1.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2qx6 h ALA 224 CO 0.64 0.32 0.16 1.25 0.00 0.00 0.00 179.25 181.63 2qx6 h HIS 225 N 0.67 0.40 -0.63 0.00 -0.00 -1.94 0.54 115.15 114.19 2qx6 h HIS 225 Ca 0.18 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.57 2qx6 h HIS 225 Cb -0.07 -0.13 -0.04 0.00 -0.00 0.00 0.00 27.41 27.17 2qx6 h HIS 225 CO -0.00 0.33 0.39 2.35 -0.00 0.00 0.00 177.93 181.00 2qx6 h TRP 226 N 0.35 0.73 0.06 5.26 7.01 -1.57 0.76 115.95 128.55 2qx6 h TRP 226 Ca 0.10 0.02 -0.24 0.00 2.11 0.00 0.00 58.89 60.88 2qx6 h TRP 226 Cb 0.06 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 26.88 2qx6 h TRP 226 CO -0.03 0.42 -1.06 0.45 -2.79 0.00 0.00 178.44 175.43 2qx6 h HIS 227 N 0.77 0.45 0.00 2.65 3.86 -1.14 -3.41 115.15 118.33 2qx6 h HIS 227 Ca 0.25 -0.28 -0.05 0.00 -1.16 0.00 0.00 60.37 59.13 2qx6 h HIS 227 Cb 0.00 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 2qx6 h HIS 227 CO -0.05 1.16 -1.18 1.19 0.86 0.00 0.00 177.93 179.91 2qx6 n PHE 228 N -3.61 0.00 -0.34 2.45 3.72 0.19 -4.23 117.46 115.64 2qx6 n PHE 228 Ca -0.06 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.05 2qx6 n PHE 228 Cb 0.92 -0.12 0.27 0.00 -0.94 0.00 0.00 39.48 39.60 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 3.04 -3.23 0.36 1.37 0.00 0.27 -5.01 105.19 101.99 2qx6 n GLY 229 Ca -0.05 -1.45 0.15 0.00 0.00 0.00 0.00 46.02 44.67 2qx6 n GLY 229 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14