#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qx9 s GLY 2 N 0.00 2.89 -0.94 0.00 0.00 -1.26 -4.58 107.32 103.43 2qx9 s GLY 2 Ca 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 44.72 44.97 2qx9 s GLY 2 CO 0.00 0.95 0.70 0.58 0.00 0.00 0.00 173.10 175.33 2qx9 n LYS 3 N 1.98 -1.30 -4.07 2.90 0.00 -1.26 -4.81 118.16 111.60 2qx9 n LYS 3 Ca -0.04 0.80 -0.35 0.00 -0.00 0.00 0.00 58.31 58.71 2qx9 n LYS 3 Cb 0.49 -3.81 -0.09 0.00 -0.00 0.00 0.00 35.03 31.62 2qx9 n LYS 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2qx9 s LYS 4 N -4.96 3.72 -0.05 -1.58 1.02 -1.26 -1.94 119.74 114.68 2qx9 s LYS 4 Ca 0.20 -0.33 0.05 0.00 0.02 0.00 0.00 55.97 55.90 2qx9 s LYS 4 Cb -0.08 -3.12 -0.01 0.00 -0.52 0.00 0.00 37.83 34.11 2qx9 s LYS 4 CO 0.85 0.42 -0.20 0.08 -0.92 0.00 0.00 175.35 175.58 2qx9 s VAL 5 N -0.05 1.65 -0.17 3.17 1.01 0.17 -0.75 120.40 125.43 2qx9 s VAL 5 Ca 0.06 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 2qx9 s VAL 5 Cb -0.12 -1.41 -0.00 0.00 0.00 0.00 0.00 36.38 34.85 2qx9 s VAL 5 CO 0.01 0.47 -0.13 -0.22 0.00 0.00 0.00 175.10 175.22 2qx9 s LEU 6 N -0.02 2.55 -0.24 3.92 2.96 -0.46 -0.91 118.68 126.48 2qx9 s LEU 6 Ca -0.04 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.37 2qx9 s LEU 6 Cb -0.12 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2qx9 s LEU 6 CO 0.03 0.07 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.49 2qx9 s ILE 7 N 0.92 3.59 -0.46 6.68 1.01 0.44 -0.38 121.20 133.01 2qx9 s ILE 7 Ca -0.03 -0.48 -0.17 0.00 0.00 0.00 0.00 60.65 59.98 2qx9 s ILE 7 Cb -0.15 -2.68 0.05 0.00 0.01 0.00 0.00 42.46 39.69 2qx9 s ILE 7 CO -0.01 0.36 0.44 -0.69 0.00 0.00 0.00 174.94 175.04 2qx9 s VAL 8 N 1.50 5.13 -0.19 2.92 1.01 0.12 -0.70 120.40 130.19 2qx9 s VAL 8 Ca 0.05 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 2qx9 s VAL 8 Cb -0.15 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 2qx9 s VAL 8 CO -0.01 -0.57 0.17 -0.47 0.00 0.00 0.00 175.10 174.21 2qx9 s TYR 9 N 1.96 3.43 -0.51 5.22 5.04 -0.62 -0.60 117.35 131.26 2qx9 s TYR 9 Ca 0.08 0.39 0.07 0.00 -2.44 0.00 0.00 57.07 55.18 2qx9 s TYR 9 Cb -0.21 -2.19 0.26 0.00 0.35 0.00 0.00 41.96 40.17 2qx9 s TYR 9 CO 0.09 0.30 0.66 0.00 -1.34 0.00 0.00 175.55 175.26 2qx9 n ALA 10 N 3.47 3.26 -3.07 3.97 0.00 0.00 -2.27 120.51 125.87 2qx9 n ALA 10 Ca -0.15 -4.08 -0.11 0.00 0.00 0.00 0.00 53.44 49.10 2qx9 n ALA 10 Cb 0.52 -0.85 -0.11 0.00 0.00 0.00 0.00 19.45 19.01 2qx9 n ALA 10 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2qx9 s HIS 11 N -1.97 -0.00 -0.22 0.00 5.04 -1.26 -4.35 115.29 112.53 2qx9 s HIS 11 Ca 0.38 0.00 0.18 0.00 -1.54 0.00 0.00 55.06 54.08 2qx9 s HIS 11 Cb 0.18 -0.03 0.08 0.00 0.04 0.00 0.00 32.58 32.86 2qx9 s HIS 11 CO -0.07 -0.21 1.34 1.96 -2.34 0.00 0.00 174.74 175.43 2qx9 h GLN 12 N 4.84 0.00 -4.98 2.88 7.50 -1.99 -3.44 115.11 119.92 2qx9 h GLN 12 Ca -0.29 0.00 -0.66 0.00 0.50 0.00 0.00 58.65 58.20 2qx9 h GLN 12 Cb 1.20 0.00 -0.27 0.00 0.05 0.00 0.00 27.48 28.46 2qx9 h GLN 12 CO 0.41 0.31 -0.71 -2.00 -1.50 0.00 0.00 178.83 175.35 2qx9 s GLU 13 N -3.05 3.40 0.50 1.46 2.56 -1.26 -4.99 118.70 117.32 2qx9 s GLU 13 Ca 0.03 -0.62 0.21 0.00 0.00 0.00 0.00 54.97 54.59 2qx9 s GLU 13 Cb 0.07 -3.06 1.30 0.00 2.00 0.00 0.00 34.13 34.44 2qx9 s GLU 13 CO 0.74 -0.21 2.08 -1.35 -0.56 0.00 0.00 175.26 175.96 2qx9 h PRO 14 N 8.13 0.00 -0.32 4.30 0.11 -1.97 -1.94 132.00 140.31 2qx9 h PRO 14 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2qx9 h PRO 14 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2qx9 h PRO 14 CO 0.60 0.12 0.00 1.63 -0.21 0.00 0.00 178.00 180.14 2qx9 n LYS 15 N -4.07 1.84 -1.70 1.05 5.02 -1.26 -4.43 118.16 114.62 2qx9 n LYS 15 Ca -0.02 -1.30 -0.30 0.00 -2.02 0.00 0.00 58.31 54.67 2qx9 n LYS 15 Cb 0.20 -1.33 0.08 0.00 -0.02 0.00 0.00 35.03 33.96 2qx9 n LYS 15 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qx9 s SER 16 N -1.17 4.74 0.17 4.39 1.04 -0.73 -4.88 113.70 117.26 2qx9 s SER 16 Ca 0.28 1.17 -0.14 0.00 0.48 0.00 0.00 55.95 57.74 2qx9 s SER 16 Cb 0.15 -1.89 0.14 0.00 0.10 0.00 0.00 66.02 64.51 2qx9 s SER 16 CO 0.20 -1.80 1.74 0.15 0.98 0.00 0.00 173.24 174.52 2qx9 h PHE 17 N -0.97 0.26 -0.91 5.02 3.57 -1.91 0.14 116.94 122.13 2qx9 h PHE 17 Ca -0.46 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.19 2qx9 h PHE 17 Cb 1.27 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 39.89 2qx9 h PHE 17 CO 0.45 0.08 0.58 -0.91 -2.23 0.00 0.00 178.31 176.28 2qx9 h ASN 18 N 0.31 0.74 -0.24 0.41 2.35 -1.92 0.14 115.58 117.37 2qx9 h ASN 18 Ca 0.22 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2qx9 h ASN 18 Cb 0.23 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2qx9 h ASN 18 CO -0.23 0.39 0.07 1.23 -1.65 0.00 0.00 177.43 177.24 2qx9 h GLY 19 N 0.79 0.50 0.72 2.83 0.00 -0.93 -2.70 103.07 104.28 2qx9 h GLY 19 Ca 0.45 -0.25 -0.19 0.00 0.00 0.00 0.00 47.33 47.33 2qx9 h GLY 19 CO -0.21 0.24 -0.85 1.76 0.00 0.00 0.00 176.54 177.49 2qx9 h SER 20 N 0.46 0.49 -0.97 0.19 0.02 -0.07 -1.57 113.55 112.11 2qx9 h SER 20 Ca 0.11 -0.95 0.20 0.00 -0.84 0.00 0.00 61.79 60.30 2qx9 h SER 20 Cb 0.19 -0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.49 2qx9 h SER 20 CO -0.00 1.41 0.61 -0.07 -1.14 0.00 0.00 176.83 177.64 2qx9 h LEU 21 N -0.34 0.61 -0.27 5.07 3.38 -1.30 0.26 115.31 122.71 2qx9 h LEU 21 Ca -0.15 0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.76 2qx9 h LEU 21 Cb 1.67 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.37 2qx9 h LEU 21 CO 0.16 0.23 -0.35 0.50 0.09 0.00 0.00 178.44 179.07 2qx9 h LYS 22 N 0.60 0.72 -0.43 1.13 3.11 -1.41 -1.39 116.57 118.90 2qx9 h LYS 22 Ca 0.53 -0.41 -0.13 0.00 -2.81 0.00 0.00 60.65 57.83 2qx9 h LYS 22 Cb 1.04 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 32.29 2qx9 h LYS 22 CO -0.28 1.03 -0.22 -0.91 -2.81 0.00 0.00 179.45 176.26 2qx9 h ASN 23 N 0.46 0.94 0.19 4.20 2.35 0.06 -1.16 115.58 122.63 2qx9 h ASN 23 Ca 0.03 -0.41 -0.10 0.00 -0.55 0.00 0.00 56.30 55.27 2qx9 h ASN 23 Cb 0.94 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 2qx9 h ASN 23 CO 0.08 1.14 -0.39 -0.37 -1.65 0.00 0.00 177.43 176.25 2qx9 h VAL 24 N 0.75 1.30 0.18 2.81 -1.51 -0.60 -0.72 116.25 118.47 2qx9 h VAL 24 Ca 0.10 -1.48 -0.01 0.00 -1.23 0.00 0.00 66.70 64.08 2qx9 h VAL 24 Cb 0.79 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 2qx9 h VAL 24 CO 0.07 0.44 -0.09 0.00 -1.23 0.00 0.00 177.57 176.76 2qx9 h ALA 25 N 1.37 -0.24 -0.51 5.19 0.00 -1.03 0.44 119.26 124.47 2qx9 h ALA 25 Ca 0.02 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2qx9 h ALA 25 Cb 0.79 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 2qx9 h ALA 25 CO 0.06 -0.54 0.17 0.28 0.00 0.00 0.00 179.25 179.21 2qx9 h VAL 26 N -0.43 0.79 -0.11 0.00 2.07 -0.92 -0.44 116.25 117.21 2qx9 h VAL 26 Ca -0.02 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2qx9 h VAL 26 Cb 0.33 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2qx9 h VAL 26 CO 0.04 0.06 -0.06 0.44 0.02 0.00 0.00 177.57 178.07 2qx9 h ASP 27 N 0.33 0.24 -0.75 0.57 3.32 -1.02 -2.09 116.42 117.02 2qx9 h ASP 27 Ca 0.25 -0.42 -0.06 0.00 0.02 0.00 0.00 57.03 56.82 2qx9 h ASP 27 Cb 0.29 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 2qx9 h ASP 27 CO -0.27 0.61 0.24 -0.08 -1.72 0.00 0.00 179.24 178.01 2qx9 h GLU 28 N -0.13 1.16 -0.11 3.56 4.57 -0.73 -0.81 114.58 122.09 2qx9 h GLU 28 Ca 0.02 -0.25 -0.18 0.00 -1.18 0.00 0.00 59.36 57.78 2qx9 h GLU 28 Cb 0.52 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 2qx9 h GLU 28 CO 0.02 0.98 -0.68 -0.07 -1.18 0.00 0.00 179.01 178.08 2qx9 h LEU 29 N 1.11 0.51 -0.54 1.64 3.38 -1.13 -2.93 115.31 117.36 2qx9 h LEU 29 Ca 0.24 -0.32 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 2qx9 h LEU 29 Cb 0.30 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2qx9 h LEU 29 CO -0.01 1.04 -0.19 0.77 0.09 0.00 0.00 178.44 180.15 2qx9 h SER 30 N 0.31 1.00 -0.36 -0.43 4.64 -1.18 -0.68 113.55 116.85 2qx9 h SER 30 Ca -0.02 -0.36 -0.02 0.00 -0.47 0.00 0.00 61.79 60.92 2qx9 h SER 30 Cb 1.24 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 2qx9 h SER 30 CO 0.12 1.15 0.17 -0.09 -0.87 0.00 0.00 176.83 177.31 2qx9 h ARG 31 N 0.86 0.57 0.00 4.77 2.43 -1.09 0.29 114.38 122.21 2qx9 h ARG 31 Ca 0.12 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2qx9 h ARG 31 Cb 0.75 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2qx9 h ARG 31 CO 0.06 0.47 0.00 1.04 -1.51 0.00 0.00 179.97 180.03 2qx9 n GLN 32 N -4.39 0.86 -0.43 0.20 6.02 -1.11 -4.85 117.38 113.68 2qx9 n GLN 32 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2qx9 n GLN 32 Cb 0.14 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 29.99 2qx9 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qx9 n GLY 33 N 0.65 0.77 3.82 1.08 0.00 0.09 -5.07 105.19 106.54 2qx9 n GLY 33 Ca 0.17 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 2qx9 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qx9 s THR 35 N -2.19 4.85 -0.11 0.00 2.01 -0.82 -4.28 115.64 115.10 2qx9 s THR 35 Ca 0.62 -0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.54 2qx9 s THR 35 Cb -0.09 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.17 2qx9 s THR 35 CO 0.14 -0.64 -0.04 -0.69 -0.69 0.00 0.00 174.62 172.70 2qx9 s VAL 36 N 2.75 3.92 -0.03 3.82 1.01 -1.26 0.41 120.40 131.01 2qx9 s VAL 36 Ca 0.20 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.84 2qx9 s VAL 36 Cb -0.15 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.56 2qx9 s VAL 36 CO 0.17 0.55 -0.13 -0.89 0.00 0.00 0.00 175.10 174.80 2qx9 s THR 37 N -0.31 1.11 -0.02 3.92 2.01 -0.09 -4.99 115.64 117.28 2qx9 s THR 37 Ca 0.05 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 61.56 2qx9 s THR 37 Cb -0.12 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.39 2qx9 s THR 37 CO 0.02 0.33 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.44 2qx9 s VAL 38 N 0.12 2.96 -0.42 3.82 1.01 -1.26 -0.42 120.40 126.21 2qx9 s VAL 38 Ca -0.04 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.08 2qx9 s VAL 38 Cb -0.10 -2.19 0.12 0.00 0.00 0.00 0.00 36.38 34.21 2qx9 s VAL 38 CO 0.01 0.50 0.16 -0.44 0.00 0.00 0.00 175.10 175.33 2qx9 s SER 39 N -1.00 4.44 -0.95 3.32 0.01 0.12 -4.95 113.70 114.68 2qx9 s SER 39 Ca 0.13 -2.52 -0.21 0.00 1.31 0.00 0.00 55.95 54.66 2qx9 s SER 39 Cb -0.11 -1.54 0.09 0.00 0.21 0.00 0.00 66.02 64.68 2qx9 s SER 39 CO 0.02 -0.31 1.26 -0.62 0.41 0.00 0.00 173.24 174.01 2qx9 s ASP 40 N 0.40 6.55 0.36 2.44 -1.08 -1.26 -1.59 116.67 122.48 2qx9 s ASP 40 Ca 0.14 -1.72 0.12 0.00 -0.52 0.00 0.00 52.55 50.57 2qx9 s ASP 40 Cb -0.22 -2.48 0.91 0.00 -1.46 0.00 0.00 42.92 39.68 2qx9 s ASP 40 CO -0.05 -1.28 1.81 -0.07 0.52 0.00 0.00 175.17 176.09 2qx9 h LEU 41 N 11.51 0.60 -0.36 -1.34 3.38 -1.82 -1.32 115.31 125.96 2qx9 h LEU 41 Ca 0.15 0.07 -0.17 0.00 0.09 0.00 0.00 57.88 58.02 2qx9 h LEU 41 Cb 1.02 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 2qx9 h LEU 41 CO 1.25 0.21 -0.49 1.88 0.09 0.00 0.00 178.44 181.38 2qx9 h TYR 42 N 0.59 1.07 -0.04 1.13 0.05 -1.84 0.76 116.97 118.69 2qx9 h TYR 42 Ca 0.54 -0.36 -0.12 0.00 0.05 0.00 0.00 58.73 58.84 2qx9 h TYR 42 Cb 1.08 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.59 2qx9 h TYR 42 CO -0.00 1.18 -0.51 0.00 -1.05 0.00 0.00 178.16 177.78 2qx9 h ALA 43 N 0.75 1.07 0.00 3.88 0.00 -1.71 -1.94 119.26 121.31 2qx9 h ALA 43 Ca 0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 2qx9 h ALA 43 Cb 1.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2qx9 h ALA 43 CO 0.11 0.65 -0.18 0.52 0.00 0.00 0.00 179.25 180.36 2qx9 h MET 44 N 0.09 0.00 -5.04 0.00 2.86 -1.18 -3.47 114.93 108.19 2qx9 h MET 44 Ca 0.00 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.34 2qx9 h MET 44 Cb 0.93 0.00 0.13 0.00 0.06 0.00 0.00 31.60 32.72 2qx9 h MET 44 CO 0.07 0.18 -0.60 -1.71 1.06 0.00 0.00 176.91 175.90 2qx9 n ASN 45 N -3.20 -3.87 -4.62 1.22 4.05 -0.04 -4.88 115.26 103.93 2qx9 n ASN 45 Ca 0.02 -0.48 -0.48 0.00 0.45 0.00 0.00 54.58 54.09 2qx9 n ASN 45 Cb 0.51 -4.31 -0.04 0.00 1.23 0.00 0.00 39.78 37.17 2qx9 n ASN 45 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 2qx9 n PHE 46 N -4.10 1.66 -2.83 1.20 7.35 0.06 -4.94 117.46 115.86 2qx9 n PHE 46 Ca -0.12 0.57 -0.42 0.00 -0.76 0.00 0.00 57.45 56.72 2qx9 n PHE 46 Cb 0.60 -2.36 -0.04 0.00 0.35 0.00 0.00 39.48 38.03 2qx9 n PHE 46 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 2qx9 s GLU 47 N -0.23 3.87 0.01 -4.13 2.56 -1.26 -4.92 118.70 114.60 2qx9 s GLU 47 Ca 0.73 0.59 0.22 0.00 0.00 0.00 0.00 54.97 56.51 2qx9 s GLU 47 Cb -0.78 -3.79 -0.01 0.00 2.00 0.00 0.00 34.13 31.55 2qx9 s GLU 47 CO 0.50 -0.89 1.01 -0.35 -0.56 0.00 0.00 175.26 174.97 2qx9 n PRO 48 N 6.64 0.12 -2.35 4.30 -0.04 -1.26 -4.71 135.00 137.70 2qx9 n PRO 48 Ca 0.06 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 63.09 2qx9 n PRO 48 Cb 0.48 -1.52 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 2qx9 n PRO 48 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qx9 s ARG 49 N -3.09 4.39 -1.05 0.54 0.52 -1.26 -4.44 118.95 114.55 2qx9 s ARG 49 Ca 0.06 1.84 -0.19 0.00 -0.52 0.00 0.00 55.73 56.93 2qx9 s ARG 49 Cb 0.16 -3.36 0.10 0.00 0.52 0.00 0.00 34.95 32.37 2qx9 s ARG 49 CO 0.82 -0.34 1.36 0.00 0.02 0.00 0.00 175.30 177.16 2qx9 s ALA 50 N 1.28 3.26 0.45 2.13 0.00 -1.26 -4.94 121.76 122.69 2qx9 s ALA 50 Ca 0.60 -2.73 0.03 0.00 0.00 0.00 0.00 51.96 49.86 2qx9 s ALA 50 Cb -0.31 -4.29 -0.02 0.00 0.00 0.00 0.00 23.12 18.50 2qx9 s ALA 50 CO 0.29 -3.19 0.07 0.95 0.00 0.00 0.00 175.76 173.88 2qx9 s THR 51 N 3.42 0.88 0.50 0.00 -4.23 -1.26 -5.00 115.64 109.95 2qx9 s THR 51 Ca 0.41 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.08 2qx9 s THR 51 Cb -0.02 -2.28 0.24 0.00 1.34 0.00 0.00 72.50 71.78 2qx9 s THR 51 CO -0.06 0.00 2.10 -2.24 -0.54 0.00 0.00 174.62 173.88 2qx9 h ASP 52 N 1.59 0.00 0.14 3.99 3.04 -1.96 -1.15 116.42 122.08 2qx9 h ASP 52 Ca -0.39 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.40 2qx9 h ASP 52 Cb 1.29 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.58 2qx9 h ASP 52 CO 0.65 0.06 0.00 0.29 -2.04 0.00 0.00 179.24 178.20 2qx9 n LYS 53 N -4.43 0.08 0.04 4.15 4.76 -1.26 -1.19 118.16 120.31 2qx9 n LYS 53 Ca -0.03 0.24 0.13 0.00 -2.87 0.00 0.00 58.31 55.78 2qx9 n LYS 53 Cb 0.14 -1.50 0.52 0.00 -1.84 0.00 0.00 35.03 32.35 2qx9 n LYS 53 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2qx9 n ASP 54 N -1.31 0.29 -4.29 4.39 8.00 -0.43 -4.68 116.55 118.51 2qx9 n ASP 54 Ca 0.03 0.53 -0.34 0.00 0.71 0.00 0.00 54.79 55.72 2qx9 n ASP 54 Cb 0.06 -0.61 -0.14 0.00 -0.02 0.00 0.00 41.12 40.41 2qx9 n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qx9 s ILE 55 N -3.05 3.12 0.07 0.53 1.09 -0.33 -1.17 121.20 121.46 2qx9 s ILE 55 Ca 0.12 -0.59 -0.24 0.00 -1.10 0.00 0.00 60.65 58.84 2qx9 s ILE 55 Cb 0.16 -2.39 -0.06 0.00 -1.06 0.00 0.00 42.46 39.11 2qx9 s ILE 55 CO 0.52 0.46 0.74 0.42 -0.10 0.00 0.00 174.94 176.97 2qx9 s THR 56 N 1.28 4.66 0.00 2.92 -4.23 -0.26 -4.86 115.64 115.14 2qx9 s THR 56 Ca 0.03 1.58 0.00 0.00 -1.18 0.00 0.00 61.69 62.12 2qx9 s THR 56 Cb -0.14 -4.09 0.00 0.00 1.34 0.00 0.00 72.50 69.61 2qx9 s THR 56 CO -0.04 0.42 0.00 0.61 -0.54 0.00 0.00 174.62 175.08 2qx9 n GLY 57 N 2.15 -1.73 3.70 3.99 0.00 -1.26 -4.84 105.19 107.21 2qx9 n GLY 57 Ca -0.04 -2.04 -0.37 0.00 0.00 0.00 0.00 46.02 43.57 2qx9 n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qx9 s THR 58 N 0.00 5.31 0.79 2.61 -4.23 -1.26 -5.06 115.64 113.80 2qx9 s THR 58 Ca 0.00 0.45 -0.16 0.00 -1.18 0.00 0.00 61.69 60.80 2qx9 s THR 58 Cb 0.00 -3.60 -0.07 0.00 1.34 0.00 0.00 72.50 70.17 2qx9 s THR 58 CO 0.00 0.36 0.09 0.18 -0.54 0.00 0.00 174.62 174.71 2qx9 n LEU 59 N 3.89 -1.70 -1.75 4.79 4.77 -1.26 -4.85 117.00 120.88 2qx9 n LEU 59 Ca -0.12 0.46 -0.15 0.00 -0.03 0.00 0.00 56.01 56.17 2qx9 n LEU 59 Cb 0.52 -1.05 0.07 0.00 -2.33 0.00 0.00 43.42 40.63 2qx9 n LEU 59 CO 0.39 -4.17 1.05 -1.54 -1.33 0.00 0.00 177.39 171.78 2qx9 n SER 60 N 0.86 4.78 0.00 -1.43 3.41 -1.26 -4.27 113.62 115.71 2qx9 n SER 60 Ca 0.06 -2.95 0.00 0.00 -0.26 0.00 0.00 58.87 55.73 2qx9 n SER 60 Cb 0.52 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2qx9 n SER 60 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2qx9 n ASN 61 N -0.07 0.00 0.04 4.04 5.15 -1.26 -5.03 115.26 118.14 2qx9 n ASN 61 Ca 0.31 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.33 2qx9 n ASN 61 Cb 0.87 0.00 0.18 0.00 -0.53 0.00 0.00 39.78 40.30 2qx9 n ASN 61 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2qx9 n PRO 62 N 0.00 0.04 -0.15 1.20 -0.04 -1.26 -2.23 135.00 132.55 2qx9 n PRO 62 Ca 0.00 0.50 -0.08 0.00 -0.04 0.00 0.00 63.50 63.88 2qx9 n PRO 62 Cb 0.00 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.85 2qx9 n PRO 62 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2qx9 h GLU 63 N 0.00 0.66 -3.47 0.54 5.08 -1.96 -3.38 114.58 112.05 2qx9 h GLU 63 Ca 0.00 -0.11 -0.53 0.00 -1.00 0.00 0.00 59.36 57.72 2qx9 h GLU 63 Cb 0.04 -0.11 -0.40 0.00 0.50 0.00 0.00 28.75 28.78 2qx9 h GLU 63 CO 0.00 0.58 -0.76 0.08 -1.00 0.00 0.00 179.01 177.91 2qx9 s VAL 64 N -5.63 0.53 -0.08 3.13 1.01 -0.95 -5.12 120.40 113.29 2qx9 s VAL 64 Ca -0.13 -0.74 -0.27 0.00 0.00 0.00 0.00 61.98 60.83 2qx9 s VAL 64 Cb 0.11 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 2qx9 s VAL 64 CO 0.76 -0.36 0.88 0.12 0.00 0.00 0.00 175.10 176.50 2qx9 s PHE 65 N 1.84 3.54 -0.24 5.22 5.36 -1.26 -4.88 117.98 127.56 2qx9 s PHE 65 Ca 0.02 1.45 -0.02 0.00 -0.96 0.00 0.00 56.93 57.43 2qx9 s PHE 65 Cb -0.17 -3.03 0.07 0.00 -0.34 0.00 0.00 43.02 39.55 2qx9 s PHE 65 CO -0.14 -0.09 0.04 1.21 -1.46 0.00 0.00 175.22 174.78 2qx9 s ASN 66 N 1.02 3.41 0.15 6.13 3.84 -1.26 -5.06 114.94 123.17 2qx9 s ASN 66 Ca 0.44 -1.14 -0.22 0.00 0.21 0.00 0.00 52.86 52.15 2qx9 s ASN 66 Cb -0.18 -0.76 0.04 0.00 -0.55 0.00 0.00 41.25 39.80 2qx9 s ASN 66 CO 0.19 -0.33 1.63 0.22 -2.79 0.00 0.00 177.10 176.02 2qx9 h TYR 67 N 8.16 -0.66 0.22 0.43 3.20 -1.95 -1.21 116.97 125.15 2qx9 h TYR 67 Ca -0.16 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.75 2qx9 h TYR 67 Cb 1.08 0.33 -0.02 0.00 1.54 0.00 0.00 36.73 39.66 2qx9 h TYR 67 CO 0.34 -0.32 -0.30 0.78 -1.64 0.00 0.00 178.16 177.01 2qx9 h GLY 68 N -0.23 -1.09 -0.40 1.82 0.00 -2.00 -1.98 103.07 99.20 2qx9 h GLY 68 Ca 0.15 0.51 0.04 0.00 0.00 0.00 0.00 47.33 48.04 2qx9 h GLY 68 CO -0.42 -0.34 -0.41 -2.08 0.00 0.00 0.00 176.54 173.29 2qx9 h VAL 69 N -0.54 0.00 -0.87 4.60 2.07 -1.99 -2.29 116.25 117.23 2qx9 h VAL 69 Ca -0.03 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.70 2qx9 h VAL 69 Cb 0.49 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.14 2qx9 h VAL 69 CO -0.08 0.00 0.38 -0.33 0.02 0.00 0.00 177.57 177.56 2qx9 h GLU 70 N -0.22 0.41 -0.00 1.57 4.39 -1.16 -1.80 114.58 117.76 2qx9 h GLU 70 Ca 0.07 -0.02 -0.15 0.00 0.34 0.00 0.00 59.36 59.59 2qx9 h GLU 70 Cb 0.40 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2qx9 h GLU 70 CO -0.49 0.27 -0.72 1.79 -1.16 0.00 0.00 179.01 178.70 2qx9 h THR 71 N 0.42 1.50 -0.62 1.13 1.35 -0.92 -1.13 112.91 114.64 2qx9 h THR 71 Ca 0.53 -2.43 -0.02 0.00 -0.55 0.00 0.00 66.41 63.94 2qx9 h THR 71 Cb 0.97 2.31 -0.03 0.00 -1.73 0.00 0.00 68.15 69.67 2qx9 h THR 71 CO -0.50 0.70 0.32 -0.74 -0.25 0.00 0.00 175.52 175.05 2qx9 h HIS 72 N 0.02 0.87 0.01 4.73 -0.00 -0.79 0.13 115.15 120.13 2qx9 h HIS 72 Ca -0.01 -0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.33 2qx9 h HIS 72 Cb 1.28 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 28.41 2qx9 h HIS 72 CO 0.00 0.64 -0.01 0.93 -0.00 0.00 0.00 177.93 179.50 2qx9 h GLU 73 N 0.85 -0.01 -0.94 5.26 4.39 -1.41 -1.27 114.58 121.45 2qx9 h GLU 73 Ca 0.22 0.00 0.17 0.00 0.34 0.00 0.00 59.36 60.09 2qx9 h GLU 73 Cb 0.07 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.65 2qx9 h GLU 73 CO -0.03 0.48 0.60 0.00 -1.16 0.00 0.00 179.01 178.90 2qx9 h ALA 74 N 0.46 1.86 -0.34 3.43 0.00 -1.06 0.17 119.26 123.77 2qx9 h ALA 74 Ca -0.00 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2qx9 h ALA 74 Cb 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qx9 h ALA 74 CO 0.00 -0.15 0.03 -0.92 0.00 0.00 0.00 179.25 178.22 2qx9 h TYR 75 N 0.67 0.62 -0.64 0.00 3.20 -0.57 0.66 116.97 120.92 2qx9 h TYR 75 Ca 0.50 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 62.21 2qx9 h TYR 75 Cb 0.87 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 2qx9 h TYR 75 CO -0.00 0.66 0.15 0.87 -1.64 0.00 0.00 178.16 178.20 2qx9 h LYS 76 N 0.40 1.02 -0.73 1.82 1.57 0.41 -2.42 116.57 118.65 2qx9 h LYS 76 Ca 0.10 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2qx9 h LYS 76 Cb 0.39 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2qx9 h LYS 76 CO 0.01 0.93 0.00 1.04 -0.57 0.00 0.00 179.45 180.86 2qx9 n GLN 77 N -4.31 3.43 -3.79 3.15 1.13 0.34 -4.94 117.38 112.39 2qx9 n GLN 77 Ca 0.04 -1.99 -0.27 0.00 -1.94 0.00 0.00 57.00 52.84 2qx9 n GLN 77 Cb 0.25 -1.97 0.01 0.00 0.11 0.00 0.00 30.24 28.64 2qx9 n GLN 77 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2qx9 n ARG 78 N 0.41 -1.27 -0.71 -1.09 1.74 -0.37 -4.92 116.66 110.45 2qx9 n ARG 78 Ca 0.18 0.67 0.02 0.00 -0.77 0.00 0.00 57.85 57.95 2qx9 n ARG 78 Cb 0.84 -2.67 0.03 0.00 -1.02 0.00 0.00 32.46 29.63 2qx9 n ARG 78 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qx9 n SER 79 N -2.48 0.57 -4.84 0.55 3.41 0.22 -5.01 113.62 106.03 2qx9 n SER 79 Ca -0.25 -2.19 -0.31 0.00 -0.26 0.00 0.00 58.87 55.85 2qx9 n SER 79 Cb 0.65 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.35 2qx9 n SER 79 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qx9 s LEU 80 N -0.44 3.29 0.65 1.04 1.43 -1.25 -1.10 118.68 122.31 2qx9 s LEU 80 Ca 0.14 1.54 -0.17 0.00 -1.03 0.00 0.00 54.13 54.60 2qx9 s LEU 80 Cb 0.14 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.85 2qx9 s LEU 80 CO -0.04 -1.02 0.97 0.00 0.23 0.00 0.00 176.35 176.49 2qx9 n ALA 81 N -2.60 0.04 0.22 4.21 0.00 -0.32 -4.66 120.51 117.40 2qx9 n ALA 81 Ca 0.07 -0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.51 2qx9 n ALA 81 Cb 0.54 -2.11 0.57 0.00 0.00 0.00 0.00 19.45 18.44 2qx9 n ALA 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qx9 h SER 82 N 0.20 0.07 -0.18 0.00 4.64 -1.94 -2.24 113.55 114.09 2qx9 h SER 82 Ca -0.48 -0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.69 2qx9 h SER 82 Cb 1.36 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 2qx9 h SER 82 CO 0.49 0.10 -0.37 -2.24 -0.87 0.00 0.00 176.83 173.94 2qx9 h ASP 83 N 0.07 0.75 -0.16 4.97 2.03 -1.99 0.24 116.42 122.33 2qx9 h ASP 83 Ca 0.02 -0.32 -0.16 0.00 -0.73 0.00 0.00 57.03 55.84 2qx9 h ASP 83 Cb 0.09 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.37 2qx9 h ASP 83 CO 0.00 1.04 -0.46 0.40 -1.03 0.00 0.00 179.24 179.19 2qx9 h ILE 84 N 0.59 1.29 -0.09 4.15 2.04 -1.83 -2.60 117.51 121.06 2qx9 h ILE 84 Ca 0.05 -1.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.26 2qx9 h ILE 84 Cb 0.90 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.55 2qx9 h ILE 84 CO 0.08 0.53 0.05 0.74 0.00 0.00 0.00 178.15 179.56 2qx9 h THR 85 N 0.57 1.07 -0.56 -0.27 2.02 -1.21 -0.91 112.91 113.63 2qx9 h THR 85 Ca 0.03 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 67.05 2qx9 h THR 85 Cb 1.02 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.42 2qx9 h THR 85 CO 0.10 0.06 0.33 0.44 0.37 0.00 0.00 175.52 176.82 2qx9 h ASP 86 N 0.07 0.52 -0.23 4.18 3.32 -0.86 -0.72 116.42 122.69 2qx9 h ASP 86 Ca 0.03 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 2qx9 h ASP 86 Cb 0.06 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 2qx9 h ASP 86 CO -0.01 0.36 0.07 -0.33 -1.72 0.00 0.00 179.24 177.61 2qx9 h GLU 87 N 0.64 0.37 -0.69 3.56 4.39 -1.29 -1.96 114.58 119.60 2qx9 h GLU 87 Ca 0.23 -0.08 0.07 0.00 0.34 0.00 0.00 59.36 59.93 2qx9 h GLU 87 Cb 0.06 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 2qx9 h GLU 87 CO -0.12 0.46 0.36 1.96 -1.16 0.00 0.00 179.01 180.51 2qx9 h GLN 88 N 0.21 0.63 -0.53 2.33 4.20 -0.78 0.67 115.11 121.83 2qx9 h GLN 88 Ca 0.07 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 2qx9 h GLN 88 Cb 0.25 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2qx9 h GLN 88 CO -0.00 0.42 0.23 -0.22 -0.67 0.00 0.00 178.83 178.59 2qx9 h LYS 89 N 0.65 0.75 -0.51 1.46 3.64 -0.93 0.54 116.57 122.16 2qx9 h LYS 89 Ca 0.32 -0.10 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2qx9 h LYS 89 Cb 0.27 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2qx9 h LYS 89 CO -0.22 0.60 -0.01 0.87 -2.27 0.00 0.00 179.45 178.42 2qx9 h LYS 90 N 0.75 0.91 0.04 1.90 1.57 -0.18 -2.82 116.57 118.74 2qx9 h LYS 90 Ca 0.18 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2qx9 h LYS 90 Cb 0.11 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2qx9 h LYS 90 CO -0.02 0.94 -0.02 0.28 -0.57 0.00 0.00 179.45 180.06 2qx9 h VAL 91 N 0.78 1.19 -1.04 0.50 2.07 -0.32 -2.90 116.25 116.54 2qx9 h VAL 91 Ca 0.14 -0.76 0.28 0.00 0.82 0.00 0.00 66.70 67.18 2qx9 h VAL 91 Cb 0.53 1.70 -0.12 0.00 -1.52 0.00 0.00 31.29 31.88 2qx9 h VAL 91 CO 0.03 0.19 0.63 -0.09 0.02 0.00 0.00 177.57 178.35 2qx9 h ARG 92 N -0.39 0.43 0.00 1.57 2.43 -0.90 -1.13 114.38 116.39 2qx9 h ARG 92 Ca -0.01 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 2qx9 h ARG 92 Cb 0.36 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2qx9 h ARG 92 CO 0.01 0.29 -0.57 0.93 -1.51 0.00 0.00 179.97 179.11 2qx9 h GLU 93 N 0.44 0.00 -7.03 0.20 5.08 -1.43 -3.47 114.58 108.37 2qx9 h GLU 93 Ca 0.66 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 58.54 2qx9 h GLU 93 Cb 1.49 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.76 2qx9 h GLU 93 CO -0.43 0.18 0.39 0.00 -1.00 0.00 0.00 179.01 178.15 2qx9 s ALA 94 N -3.13 2.95 -0.12 3.43 0.00 -0.43 -4.76 121.76 119.70 2qx9 s ALA 94 Ca 0.03 0.63 0.18 0.00 0.00 0.00 0.00 51.96 52.80 2qx9 s ALA 94 Cb 0.07 -3.26 -0.26 0.00 0.00 0.00 0.00 23.12 19.67 2qx9 s ALA 94 CO 0.74 -0.26 0.21 -0.25 0.00 0.00 0.00 175.76 176.20 2qx9 n ASP 95 N -0.65 0.40 -3.84 0.00 8.00 0.07 -4.91 116.55 115.62 2qx9 n ASP 95 Ca 0.08 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.44 2qx9 n ASP 95 Cb 0.52 1.34 -0.15 0.00 -0.02 0.00 0.00 41.12 42.81 2qx9 n ASP 95 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2qx9 s LEU 96 N -4.98 1.67 -0.11 0.64 2.96 -1.03 0.43 118.68 118.26 2qx9 s LEU 96 Ca -0.08 0.00 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 2qx9 s LEU 96 Cb 0.08 -0.06 0.01 0.00 0.50 0.00 0.00 46.19 46.73 2qx9 s LEU 96 CO 0.79 -0.04 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.91 2qx9 s VAL 97 N 0.38 1.70 -0.08 1.68 1.01 0.11 -1.36 120.40 123.83 2qx9 s VAL 97 Ca -0.03 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2qx9 s VAL 97 Cb -0.05 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 2qx9 s VAL 97 CO -0.01 0.48 -0.14 -0.63 0.00 0.00 0.00 175.10 174.79 2qx9 s ILE 98 N 0.74 2.99 -0.27 2.22 1.01 0.49 -1.72 121.20 126.66 2qx9 s ILE 98 Ca -0.11 -0.72 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 2qx9 s ILE 98 Cb -0.16 -2.20 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2qx9 s ILE 98 CO 0.02 0.56 0.04 -0.36 0.00 0.00 0.00 174.94 175.20 2qx9 s PHE 99 N -0.23 3.10 -0.30 3.97 0.08 -0.44 0.15 117.98 124.31 2qx9 s PHE 99 Ca 0.01 -0.98 -0.05 0.00 0.12 0.00 0.00 56.93 56.02 2qx9 s PHE 99 Cb -0.13 -2.20 0.02 0.00 -0.57 0.00 0.00 43.02 40.14 2qx9 s PHE 99 CO 0.03 -0.57 0.06 -1.14 -0.10 0.00 0.00 175.22 173.50 2qx9 s GLN 100 N 1.49 2.85 0.08 0.44 2.00 0.23 0.52 119.66 127.27 2qx9 s GLN 100 Ca 0.03 -1.01 -0.26 0.00 -2.00 0.00 0.00 55.36 52.13 2qx9 s GLN 100 Cb -0.16 -3.31 0.08 0.00 0.80 0.00 0.00 33.01 30.41 2qx9 s GLN 100 CO 0.01 -0.51 0.69 -0.59 -0.50 0.00 0.00 175.29 174.38 2qx9 s PHE 101 N 1.42 -0.51 0.28 1.67 -0.12 -0.85 -0.82 117.98 119.06 2qx9 s PHE 101 Ca 0.00 0.43 -0.15 0.00 -0.05 0.00 0.00 56.93 57.16 2qx9 s PHE 101 Cb -0.18 0.53 -0.08 0.00 -0.63 0.00 0.00 43.02 42.66 2qx9 s PHE 101 CO 0.01 -0.73 0.69 -1.25 -0.05 0.00 0.00 175.22 173.90 2qx9 s PRO 102 N -3.14 4.02 -0.00 1.99 0.04 -1.26 -2.50 135.00 134.15 2qx9 s PRO 102 Ca 0.00 0.64 -0.30 0.00 0.04 0.00 0.00 61.00 61.37 2qx9 s PRO 102 Cb -0.01 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.91 2qx9 s PRO 102 CO -0.08 0.24 1.24 -1.17 0.04 0.00 0.00 177.00 177.27 2qx9 s LEU 103 N -2.71 4.32 -0.24 -3.56 2.96 0.43 -4.40 118.68 115.47 2qx9 s LEU 103 Ca 0.50 1.94 0.02 0.00 -0.22 0.00 0.00 54.13 56.37 2qx9 s LEU 103 Cb -0.12 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 43.06 2qx9 s LEU 103 CO 0.19 -0.57 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.24 2qx9 s TYR 104 N 1.82 2.86 -1.31 5.38 1.51 -0.55 -4.75 117.35 122.32 2qx9 s TYR 104 Ca 0.58 -2.00 -0.04 0.00 -1.01 0.00 0.00 57.07 54.60 2qx9 s TYR 104 Cb -0.28 -1.79 -0.00 0.00 -0.11 0.00 0.00 41.96 39.78 2qx9 s TYR 104 CO 0.25 -0.82 0.61 0.91 -1.11 0.00 0.00 175.55 175.39 2qx9 n TRP 105 N 4.55 -1.82 -1.83 2.71 7.02 -1.26 -1.52 117.44 125.29 2qx9 n TRP 105 Ca -0.14 0.73 -0.21 0.00 -1.02 0.00 0.00 57.50 56.86 2qx9 n TRP 105 Cb 0.44 -3.96 -0.07 0.00 -2.42 0.00 0.00 31.31 25.30 2qx9 n TRP 105 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2qx9 n PHE 106 N -4.28 -0.29 -1.79 -5.99 3.01 -1.26 -4.87 117.46 101.99 2qx9 n PHE 106 Ca -0.26 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.20 2qx9 n PHE 106 Cb 0.67 -3.62 0.00 0.00 -0.01 0.00 0.00 39.48 36.52 2qx9 n PHE 106 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2qx9 n SER 107 N -1.55 0.00 -4.93 4.37 2.88 -0.58 -4.85 113.62 108.97 2qx9 n SER 107 Ca -0.22 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.05 2qx9 n SER 107 Cb 0.69 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.11 2qx9 n SER 107 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2qx9 s VAL 108 N -0.90 5.29 0.60 2.46 -7.23 -1.26 -1.48 120.40 117.88 2qx9 s VAL 108 Ca 0.00 -0.65 -0.19 0.00 -1.81 0.00 0.00 61.98 59.33 2qx9 s VAL 108 Cb 0.00 -3.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.21 2qx9 s VAL 108 CO 0.00 -0.05 1.19 -2.65 -0.31 0.00 0.00 175.10 173.29 2qx9 n PRO 109 N -0.37 1.18 -0.31 4.82 -0.02 -1.26 -4.66 135.00 134.37 2qx9 n PRO 109 Ca -0.07 0.45 0.15 0.00 -2.02 0.00 0.00 63.50 62.01 2qx9 n PRO 109 Cb 0.53 -2.41 0.33 0.00 -0.02 0.00 0.00 33.50 31.94 2qx9 n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qx9 h ALA 110 N 0.74 1.50 -0.59 3.55 0.00 -1.97 -0.49 119.26 122.00 2qx9 h ALA 110 Ca -0.50 0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2qx9 h ALA 110 Cb 1.34 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 2qx9 h ALA 110 CO 0.53 -0.38 0.39 0.97 0.00 0.00 0.00 179.25 180.76 2qx9 h ILE 111 N 0.37 1.12 0.00 0.00 2.10 -1.94 0.13 117.51 119.30 2qx9 h ILE 111 Ca 0.59 -0.26 -0.16 0.00 1.08 0.00 0.00 64.86 66.10 2qx9 h ILE 111 Cb 1.16 0.30 -0.02 0.00 -1.09 0.00 0.00 36.82 37.16 2qx9 h ILE 111 CO -0.55 0.14 -0.82 0.25 -1.08 0.00 0.00 178.15 176.08 2qx9 h LEU 112 N 0.76 0.00 -0.92 2.19 5.85 -1.46 -2.83 115.31 118.89 2qx9 h LEU 112 Ca 0.22 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.83 2qx9 h LEU 112 Cb -0.03 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2qx9 h LEU 112 CO -0.05 0.75 -0.42 0.50 -0.34 0.00 0.00 178.44 178.87 2qx9 h LYS 113 N 0.00 0.24 -0.28 1.25 1.63 -0.28 -2.85 116.57 116.28 2qx9 h LYS 113 Ca -0.03 -0.12 -0.08 0.00 -0.85 0.00 0.00 60.65 59.58 2qx9 h LYS 113 Cb 1.59 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.22 2qx9 h LYS 113 CO 0.09 0.62 -0.14 0.78 -3.45 0.00 0.00 179.45 177.36 2qx9 h GLY 114 N 1.24 0.63 -0.12 5.01 0.00 -0.72 -1.13 103.07 107.98 2qx9 h GLY 114 Ca 0.02 -0.57 0.10 0.00 0.00 0.00 0.00 47.33 46.87 2qx9 h GLY 114 CO 0.07 0.52 -0.19 -0.25 0.00 0.00 0.00 176.54 176.69 2qx9 h TRP 115 N 0.32 -0.46 -0.39 5.60 7.01 -1.36 0.34 115.95 127.01 2qx9 h TRP 115 Ca 0.06 0.05 -0.06 0.00 2.11 0.00 0.00 58.89 61.06 2qx9 h TRP 115 Cb 0.66 0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.98 2qx9 h TRP 115 CO 0.06 -0.28 0.03 0.52 -2.79 0.00 0.00 178.44 175.98 2qx9 h MET 116 N -0.08 0.68 -0.62 2.65 2.86 -1.37 0.41 114.93 119.47 2qx9 h MET 116 Ca 0.24 -0.20 0.04 0.00 -2.06 0.00 0.00 59.70 57.71 2qx9 h MET 116 Cb 0.44 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.00 2qx9 h MET 116 CO -0.56 0.75 0.41 -0.44 1.06 0.00 0.00 176.91 178.14 2qx9 h ASP 117 N 0.51 0.62 0.00 1.22 3.32 -0.07 -2.83 116.42 119.20 2qx9 h ASP 117 Ca 0.11 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.94 2qx9 h ASP 117 Cb 0.43 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 2qx9 h ASP 117 CO 0.02 0.42 -2.17 0.54 -1.72 0.00 0.00 179.24 176.33 2qx9 n ARG 118 N -4.46 0.79 0.03 3.56 1.74 0.11 -4.60 116.66 113.82 2qx9 n ARG 118 Ca 0.08 -0.08 -0.15 0.00 -0.77 0.00 0.00 57.85 56.92 2qx9 n ARG 118 Cb 0.14 -1.49 -0.14 0.00 -1.02 0.00 0.00 32.46 29.95 2qx9 n ARG 118 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2qx9 h VAL 119 N 0.00 0.97 -2.48 1.55 2.07 -0.23 -3.39 116.25 114.74 2qx9 h VAL 119 Ca -0.32 -2.68 -0.78 0.00 0.82 0.00 0.00 66.70 63.74 2qx9 h VAL 119 Cb 1.70 2.61 -0.23 0.00 -1.52 0.00 0.00 31.29 33.86 2qx9 h VAL 119 CO 0.02 0.76 1.18 0.18 0.02 0.00 0.00 177.57 179.72 2qx9 n LEU 120 N -3.35 6.09 -4.96 2.57 4.77 -1.07 -4.79 117.00 116.26 2qx9 n LEU 120 Ca -0.20 -4.88 -0.22 0.00 -0.03 0.00 0.00 56.01 50.68 2qx9 n LEU 120 Cb 1.04 -1.44 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 2qx9 n LEU 120 CO 0.47 1.36 0.09 0.00 -1.33 0.00 0.00 177.39 177.98 2qx9 n GLN 122 N -1.66 2.47 0.00 0.00 7.27 -1.26 -1.22 117.38 122.98 2qx9 n GLN 122 Ca -0.05 0.88 0.00 0.00 0.07 0.00 0.00 57.00 57.90 2qx9 n GLN 122 Cb 0.57 -2.62 0.00 0.00 2.41 0.00 0.00 30.24 30.60 2qx9 n GLN 122 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2qx9 n GLY 123 N 2.31 2.91 0.35 1.69 0.00 0.44 -4.46 105.19 108.43 2qx9 n GLY 123 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 2qx9 n GLY 123 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qx9 n PHE 124 N -0.56 0.00 0.84 1.61 7.35 -0.36 -4.77 117.46 121.57 2qx9 n PHE 124 Ca 0.00 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.79 2qx9 n PHE 124 Cb 0.00 -0.52 -0.09 0.00 0.35 0.00 0.00 39.48 39.22 2qx9 n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qx9 n ALA 125 N -4.10 4.33 -3.65 3.13 0.00 -0.98 -4.67 120.51 114.58 2qx9 n ALA 125 Ca -0.23 -0.56 0.01 0.00 0.00 0.00 0.00 53.44 52.67 2qx9 n ALA 125 Cb 0.55 -0.81 -0.00 0.00 0.00 0.00 0.00 19.45 19.18 2qx9 n ALA 125 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2qx9 s PHE 126 N -3.08 -0.04 0.24 0.00 -0.71 -1.26 -2.48 117.98 110.65 2qx9 s PHE 126 Ca 0.06 -0.08 0.00 0.00 -1.04 0.00 0.00 56.93 55.88 2qx9 s PHE 126 Cb 0.16 0.56 -0.03 0.00 -1.21 0.00 0.00 43.02 42.49 2qx9 s PHE 126 CO 0.86 -0.32 0.20 0.34 -1.34 0.00 0.00 175.22 174.96 2qx9 s ASP 127 N -3.02 0.57 -0.35 1.98 -1.08 0.47 -0.42 116.67 114.81 2qx9 s ASP 127 Ca 0.15 -1.47 0.04 0.00 -0.52 0.00 0.00 52.55 50.75 2qx9 s ASP 127 Cb 0.04 0.45 0.10 0.00 -1.46 0.00 0.00 42.92 42.05 2qx9 s ASP 127 CO -0.03 -0.93 0.07 -0.63 0.52 0.00 0.00 175.17 174.16 2qx9 s ILE 128 N -3.92 2.31 0.85 4.11 -1.09 -1.26 -1.40 121.20 120.80 2qx9 s ILE 128 Ca 0.38 -2.42 -0.10 0.00 -2.23 0.00 0.00 60.65 56.29 2qx9 s ILE 128 Cb 0.05 -2.70 0.16 0.00 -1.58 0.00 0.00 42.46 38.39 2qx9 s ILE 128 CO 0.16 -0.61 1.18 -2.16 -1.23 0.00 0.00 174.94 172.28 2qx9 s PRO 129 N 0.82 1.19 0.00 2.79 0.04 -1.26 -5.16 135.00 133.43 2qx9 s PRO 129 Ca 0.11 -0.59 0.00 0.00 0.04 0.00 0.00 61.00 60.56 2qx9 s PRO 129 Cb -0.20 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2qx9 s PRO 129 CO -0.07 -1.95 0.00 0.41 0.04 0.00 0.00 177.00 175.43 2qx9 n GLY 130 N -3.36 0.19 3.56 0.56 0.00 -0.49 -5.10 105.19 100.55 2qx9 n GLY 130 Ca 0.14 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 2qx9 n GLY 130 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qx9 s PHE 131 N 0.00 0.54 0.00 1.61 -0.12 -1.10 -0.40 117.98 118.51 2qx9 s PHE 131 Ca 0.00 -0.89 0.00 0.00 -0.05 0.00 0.00 56.93 55.99 2qx9 s PHE 131 Cb 0.00 0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.53 2qx9 s PHE 131 CO 0.00 -1.05 0.00 0.66 -0.05 0.00 0.00 175.22 174.78 2qx9 n TYR 132 N -0.43 0.00 0.25 3.49 4.01 0.14 -1.04 117.16 123.58 2qx9 n TYR 132 Ca -0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.87 2qx9 n TYR 132 Cb 0.62 0.00 0.52 0.00 -0.31 0.00 0.00 39.34 40.17 2qx9 n TYR 132 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2qx9 h ASP 133 N 0.00 0.00 -0.44 7.72 3.32 -1.88 -2.65 116.42 122.49 2qx9 h ASP 133 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 2qx9 h ASP 133 Cb 0.00 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.45 2qx9 h ASP 133 CO 0.00 0.08 0.07 -1.54 -1.72 0.00 0.00 179.24 176.13 2qx9 n SER 134 N -3.19 3.38 -4.80 6.45 3.41 -0.21 -4.92 113.62 113.75 2qx9 n SER 134 Ca 0.01 -3.44 -0.35 0.00 -0.26 0.00 0.00 58.87 54.84 2qx9 n SER 134 Cb 0.39 -0.64 -0.05 0.00 -0.26 0.00 0.00 64.21 63.65 2qx9 n SER 134 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qx9 s GLY 135 N -2.02 2.56 0.00 5.00 0.00 -1.01 -2.70 107.32 109.15 2qx9 s GLY 135 Ca 0.46 0.58 0.10 0.00 0.00 0.00 0.00 44.72 45.86 2qx9 s GLY 135 CO 0.06 0.92 1.14 1.04 0.00 0.00 0.00 173.10 176.27 2qx9 n LEU 136 N -0.57 0.00 -0.48 0.66 4.77 -1.04 -2.13 117.00 118.22 2qx9 n LEU 136 Ca 0.07 0.19 0.04 0.00 -0.03 0.00 0.00 56.01 56.28 2qx9 n LEU 136 Cb 0.52 -0.19 0.10 0.00 -2.33 0.00 0.00 43.42 41.53 2qx9 n LEU 136 CO 0.41 -0.13 0.56 0.18 -1.33 0.00 0.00 177.39 177.08 2qx9 n LEU 137 N -1.19 2.53 -4.51 2.23 4.77 -0.56 -4.91 117.00 115.36 2qx9 n LEU 137 Ca 0.06 -1.80 -0.52 0.00 -0.03 0.00 0.00 56.01 53.72 2qx9 n LEU 137 Cb 0.06 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 2qx9 n LEU 137 CO 0.07 0.61 0.51 0.00 -1.33 0.00 0.00 177.39 177.26 2qx9 n GLN 138 N 0.34 0.52 0.00 3.23 10.64 -0.90 -2.82 117.38 128.38 2qx9 n GLN 138 Ca 0.08 0.19 0.00 0.00 -1.83 0.00 0.00 57.00 55.44 2qx9 n GLN 138 Cb 0.36 -1.58 0.00 0.00 -0.86 0.00 0.00 30.24 28.16 2qx9 n GLN 138 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2qx9 n GLY 139 N 1.86 0.57 3.82 2.61 0.00 -1.22 -4.99 105.19 107.83 2qx9 n GLY 139 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2qx9 n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qx9 s LYS 140 N -0.77 2.43 -0.05 1.61 1.02 -1.13 -4.99 119.74 117.86 2qx9 s LYS 140 Ca 0.00 -1.63 0.05 0.00 0.02 0.00 0.00 55.97 54.41 2qx9 s LYS 140 Cb 0.00 -2.23 -0.02 0.00 -0.52 0.00 0.00 37.83 35.06 2qx9 s LYS 140 CO 0.00 -0.13 -0.18 -0.51 -0.92 0.00 0.00 175.35 173.61 2qx9 s LEU 141 N -4.02 2.49 0.12 3.17 1.43 0.17 -1.51 118.68 120.53 2qx9 s LEU 141 Ca 0.44 -0.30 0.09 0.00 -1.03 0.00 0.00 54.13 53.33 2qx9 s LEU 141 Cb -0.01 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 2qx9 s LEU 141 CO 0.26 0.32 -0.22 0.00 0.23 0.00 0.00 176.35 176.94 2qx9 s ALA 142 N -0.61 2.02 -0.10 4.21 0.00 -0.31 0.04 121.76 127.01 2qx9 s ALA 142 Ca 0.09 -1.36 -0.09 0.00 0.00 0.00 0.00 51.96 50.60 2qx9 s ALA 142 Cb -0.11 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 22.76 2qx9 s ALA 142 CO 0.01 0.39 0.26 -1.17 0.00 0.00 0.00 175.76 175.25 2qx9 s LEU 143 N -2.10 0.95 -0.23 0.00 0.20 -0.70 -1.56 118.68 115.23 2qx9 s LEU 143 Ca 0.10 0.54 -0.06 0.00 0.69 0.00 0.00 54.13 55.40 2qx9 s LEU 143 Cb -0.09 0.90 -0.02 0.00 -0.43 0.00 0.00 46.19 46.55 2qx9 s LEU 143 CO 0.05 -0.10 0.04 -0.76 -0.29 0.00 0.00 176.35 175.29 2qx9 s LEU 144 N 0.21 3.31 -0.40 -0.68 1.43 -1.26 -1.32 118.68 119.97 2qx9 s LEU 144 Ca -0.01 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 52.79 2qx9 s LEU 144 Cb -0.02 -1.87 0.08 0.00 0.03 0.00 0.00 46.19 44.40 2qx9 s LEU 144 CO -0.00 -0.01 0.22 -0.55 0.23 0.00 0.00 176.35 176.24 2qx9 s SER 145 N 1.45 5.51 -0.05 2.29 0.15 0.18 -0.38 113.70 122.85 2qx9 s SER 145 Ca 0.05 -1.54 0.04 0.00 0.70 0.00 0.00 55.95 55.20 2qx9 s SER 145 Cb -0.15 -1.94 -0.02 0.00 -1.71 0.00 0.00 66.02 62.20 2qx9 s SER 145 CO 0.02 -0.50 -0.15 -0.69 1.20 0.00 0.00 173.24 173.11 2qx9 s VAL 146 N 1.37 2.98 0.09 4.45 1.01 0.15 -2.00 120.40 128.46 2qx9 s VAL 146 Ca 0.03 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.33 2qx9 s VAL 146 Cb -0.22 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 2qx9 s VAL 146 CO 0.01 0.59 -0.12 0.42 0.00 0.00 0.00 175.10 175.99 2qx9 s THR 147 N -0.65 3.21 0.26 3.92 -4.23 -1.04 0.59 115.64 117.70 2qx9 s THR 147 Ca 0.10 -1.28 0.04 0.00 -1.18 0.00 0.00 61.69 59.36 2qx9 s THR 147 Cb -0.11 -2.47 -0.06 0.00 1.34 0.00 0.00 72.50 71.20 2qx9 s THR 147 CO 0.01 0.15 0.01 0.42 -0.54 0.00 0.00 174.62 174.67 2qx9 s THR 148 N -1.15 1.14 -0.14 3.99 -4.23 -0.91 -0.43 115.64 113.90 2qx9 s THR 148 Ca 0.20 -2.04 -0.05 0.00 -1.18 0.00 0.00 61.69 58.62 2qx9 s THR 148 Cb -0.11 -2.50 -0.25 0.00 1.34 0.00 0.00 72.50 70.99 2qx9 s THR 148 CO 0.12 -0.22 0.29 0.61 -0.54 0.00 0.00 174.62 174.88 2qx9 n GLY 149 N -0.52 -0.54 3.76 3.99 0.00 -1.26 -2.41 105.19 108.21 2qx9 n GLY 149 Ca -0.04 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2qx9 n GLY 149 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qx9 s GLY 150 N -5.71 2.38 0.52 -0.02 0.00 -1.26 -4.38 107.32 98.86 2qx9 s GLY 150 Ca -0.24 0.76 -0.03 0.00 0.00 0.00 0.00 44.72 45.21 2qx9 s GLY 150 CO 0.75 1.13 0.79 -0.51 0.00 0.00 0.00 173.10 175.26 2qx9 s THR 151 N -2.03 3.77 0.17 0.90 -4.23 -1.26 -2.89 115.64 110.07 2qx9 s THR 151 Ca 0.72 -0.25 -0.22 0.00 -1.18 0.00 0.00 61.69 60.75 2qx9 s THR 151 Cb -0.25 -3.45 0.07 0.00 1.34 0.00 0.00 72.50 70.21 2qx9 s THR 151 CO 0.39 -0.39 1.60 0.00 -0.54 0.00 0.00 174.62 175.68 2qx9 h ALA 152 N 0.10 -0.13 -0.44 3.99 0.00 -1.96 -1.92 119.26 118.90 2qx9 h ALA 152 Ca -0.46 0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2qx9 h ALA 152 Cb 1.26 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 2qx9 h ALA 152 CO 0.59 -0.69 0.29 1.49 0.00 0.00 0.00 179.25 180.93 2qx9 h GLU 153 N -0.23 0.41 0.00 0.00 4.57 -1.99 -0.61 114.58 116.72 2qx9 h GLU 153 Ca 0.18 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.31 2qx9 h GLU 153 Cb 0.52 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2qx9 h GLU 153 CO -0.53 0.27 -0.12 0.52 -1.18 0.00 0.00 179.01 177.97 2qx9 h MET 154 N 0.42 0.00 -1.95 1.92 2.86 -1.74 -3.05 114.93 113.39 2qx9 h MET 154 Ca 0.19 0.00 -0.74 0.00 -2.06 0.00 0.00 59.70 57.08 2qx9 h MET 154 Cb 0.21 0.00 -0.26 0.00 0.06 0.00 0.00 31.60 31.61 2qx9 h MET 154 CO -0.05 0.12 1.00 0.66 1.06 0.00 0.00 176.91 179.70 2qx9 n TYR 155 N -4.09 2.87 -4.36 -0.22 4.01 -0.24 -1.30 117.16 113.83 2qx9 n TYR 155 Ca -0.02 -2.32 -0.18 0.00 -0.16 0.00 0.00 57.90 55.22 2qx9 n TYR 155 Cb 0.20 -1.22 -0.10 0.00 -0.31 0.00 0.00 39.34 37.91 2qx9 n TYR 155 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2qx9 s THR 156 N -4.82 0.85 0.64 -0.72 -4.23 -1.15 -3.65 115.64 102.56 2qx9 s THR 156 Ca 0.53 -2.01 0.34 0.00 -1.18 0.00 0.00 61.69 59.38 2qx9 s THR 156 Cb 0.44 -2.61 0.37 0.00 1.34 0.00 0.00 72.50 72.03 2qx9 s THR 156 CO -0.38 -0.08 2.12 0.11 -0.54 0.00 0.00 174.62 175.84 2qx9 h LYS 157 N 2.33 0.00 0.00 3.99 1.57 -1.89 -0.90 116.57 121.66 2qx9 h LYS 157 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2qx9 h LYS 157 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2qx9 h LYS 157 CO 0.64 0.00 -1.30 0.25 -0.57 0.00 0.00 179.45 178.48 2qx9 n THR 158 N -3.28 0.00 -1.64 -0.16 -2.24 -1.26 -4.84 114.28 100.86 2qx9 n THR 158 Ca -0.01 -0.21 -0.29 0.00 -2.27 0.00 0.00 64.05 61.27 2qx9 n THR 158 Cb 0.27 0.62 0.14 0.00 -2.10 0.00 0.00 70.33 69.26 2qx9 n THR 158 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2qx9 s GLY 159 N -3.38 1.61 0.51 3.38 0.00 -0.35 -4.96 107.32 104.13 2qx9 s GLY 159 Ca 0.01 -0.67 0.30 0.00 0.00 0.00 0.00 44.72 44.36 2qx9 s GLY 159 CO 0.79 -0.08 1.89 -0.39 0.00 0.00 0.00 173.10 175.32 2qx9 h VAL 160 N -1.49 0.16 -0.00 1.40 -1.51 -1.82 -3.19 116.25 109.80 2qx9 h VAL 160 Ca -0.48 -0.75 0.00 0.00 -1.23 0.00 0.00 66.70 64.24 2qx9 h VAL 160 Cb 1.32 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 32.12 2qx9 h VAL 160 CO 0.58 0.06 -0.74 0.59 -1.23 0.00 0.00 177.57 176.83 2qx9 n ASN 161 N -3.18 0.87 -0.34 4.19 3.02 -0.42 -5.08 115.26 114.33 2qx9 n ASN 161 Ca 0.01 -0.74 0.04 0.00 -0.03 0.00 0.00 54.58 53.86 2qx9 n ASN 161 Cb 0.37 0.64 -0.02 0.00 -0.61 0.00 0.00 39.78 40.15 2qx9 n ASN 161 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qx9 n GLY 162 N 1.49 -2.63 3.68 7.41 0.00 -1.21 -4.84 105.19 109.09 2qx9 n GLY 162 Ca 0.05 -1.37 -0.45 0.00 0.00 0.00 0.00 46.02 44.26 2qx9 n GLY 162 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qx9 n ASP 163 N -2.65 3.00 0.00 1.61 2.03 -1.21 -3.65 116.55 115.68 2qx9 n ASP 163 Ca -0.02 1.13 0.22 0.00 0.52 0.00 0.00 54.79 56.64 2qx9 n ASP 163 Cb 0.16 -1.45 0.73 0.00 -0.72 0.00 0.00 41.12 39.84 2qx9 n ASP 163 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2qx9 h SER 164 N 4.72 0.00 0.01 1.67 4.64 -1.89 0.76 113.55 123.46 2qx9 h SER 164 Ca -0.45 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2qx9 h SER 164 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2qx9 h SER 164 CO 0.79 0.00 -0.00 0.03 -0.87 0.00 0.00 176.83 176.78 2qx9 h ARG 165 N 0.00 0.00 -0.78 4.77 3.08 -1.89 -2.52 114.38 117.04 2qx9 h ARG 165 Ca 0.26 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.28 2qx9 h ARG 165 Cb 1.21 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.22 2qx9 h ARG 165 CO -0.00 0.00 0.38 1.88 -1.07 0.00 0.00 179.97 181.16 2qx9 h TYR 166 N 0.00 1.12 -0.00 3.04 0.05 -0.98 -2.47 116.97 117.73 2qx9 h TYR 166 Ca -0.00 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.73 2qx9 h TYR 166 Cb 0.01 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.40 2qx9 h TYR 166 CO 0.00 0.82 -0.26 1.97 -1.05 0.00 0.00 178.16 179.64 2qx9 n PHE 167 N -4.37 0.00 0.13 4.88 1.16 -0.96 -3.60 117.46 114.69 2qx9 n PHE 167 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.65 2qx9 n PHE 167 Cb 0.13 -0.23 0.06 0.00 -1.61 0.00 0.00 39.48 37.84 2qx9 n PHE 167 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2qx9 h LEU 168 N 0.47 0.00 -0.57 5.98 3.38 -1.27 -3.37 115.31 119.94 2qx9 h LEU 168 Ca 0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2qx9 h LEU 168 Cb 0.46 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.11 2qx9 h LEU 168 CO 0.00 0.61 -0.53 -0.25 0.09 0.00 0.00 178.44 178.36 2qx9 h TRP 169 N 0.00 -1.64 -1.00 1.13 2.91 -1.59 0.29 115.95 116.04 2qx9 h TRP 169 Ca -0.01 0.09 0.08 0.00 1.13 0.00 0.00 58.89 60.19 2qx9 h TRP 169 Cb 1.37 0.79 -0.07 0.00 -0.51 0.00 0.00 29.16 30.73 2qx9 h TRP 169 CO 0.00 -0.45 0.64 -1.35 -1.03 0.00 0.00 178.44 176.25 2qx9 h PRO 170 N -0.28 1.09 0.17 2.65 0.11 -1.83 0.17 132.00 134.07 2qx9 h PRO 170 Ca 0.12 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 2qx9 h PRO 170 Cb 0.55 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.42 2qx9 h PRO 170 CO -0.69 0.72 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.67 2qx9 h LEU 171 N 1.12 -0.20 -0.21 2.35 3.38 -1.59 -2.17 115.31 118.00 2qx9 h LEU 171 Ca 0.45 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 2qx9 h LEU 171 Cb 0.27 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2qx9 h LEU 171 CO -0.20 0.34 0.04 1.56 0.09 0.00 0.00 178.44 180.27 2qx9 h GLN 172 N -1.01 0.34 0.00 1.13 4.20 -0.45 -2.24 115.11 117.07 2qx9 h GLN 172 Ca -0.02 -0.09 -0.23 0.00 0.06 0.00 0.00 58.65 58.37 2qx9 h GLN 172 Cb 0.36 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 2qx9 h GLN 172 CO 0.04 0.49 -1.48 1.58 -0.67 0.00 0.00 178.83 178.78 2qx9 n HIS 173 N -4.74 0.56 0.28 2.96 -0.00 0.53 -1.40 115.22 113.41 2qx9 n HIS 173 Ca -0.04 0.24 0.15 0.00 0.46 0.00 0.00 57.72 58.54 2qx9 n HIS 173 Cb 0.19 -0.93 0.82 0.00 -0.12 0.00 0.00 29.99 29.95 2qx9 n HIS 173 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2qx9 h GLY 174 N -1.00 0.00 0.00 1.57 0.00 -1.23 -2.67 103.07 99.75 2qx9 h GLY 174 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2qx9 h GLY 174 CO -0.21 0.00 -0.19 2.41 0.00 0.00 0.00 176.54 178.55 2qx9 n THR 175 N -3.45 0.60 0.41 4.70 -1.04 -0.84 -4.55 114.28 110.12 2qx9 n THR 175 Ca -0.02 0.25 -0.17 0.00 -2.04 0.00 0.00 64.05 62.08 2qx9 n THR 175 Cb 0.21 -1.53 -0.08 0.00 -1.82 0.00 0.00 70.33 67.12 2qx9 n THR 175 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2qx9 h LEU 176 N -0.19 -0.91 -0.97 -4.42 3.38 -1.47 -1.39 115.31 109.34 2qx9 h LEU 176 Ca 0.00 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.10 2qx9 h LEU 176 Cb 0.19 0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 2qx9 h LEU 176 CO 0.00 -0.55 0.61 -0.74 0.09 0.00 0.00 178.44 177.85 2qx9 h HIS 177 N -1.29 1.12 -0.69 1.13 2.76 -1.32 0.18 115.15 117.04 2qx9 h HIS 177 Ca -0.11 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.16 2qx9 h HIS 177 Cb 0.83 -0.36 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 2qx9 h HIS 177 CO 0.00 0.49 0.46 0.35 -1.30 0.00 0.00 177.93 177.93 2qx9 h PHE 178 N 1.02 0.71 -0.08 5.26 3.57 -1.38 0.21 116.94 126.26 2qx9 h PHE 178 Ca 0.46 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.98 2qx9 h PHE 178 Cb 0.36 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.87 2qx9 h PHE 178 CO -0.01 0.38 0.00 0.00 -2.23 0.00 0.00 178.31 176.44 2qx9 n GLY 180 N 0.88 0.73 3.76 0.00 0.00 0.75 -1.50 105.19 109.81 2qx9 n GLY 180 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2qx9 n GLY 180 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qx9 s PHE 181 N -2.66 2.47 -0.21 1.61 0.08 -0.72 -3.27 117.98 115.26 2qx9 s PHE 181 Ca 0.00 1.58 -0.09 0.00 0.12 0.00 0.00 56.93 58.54 2qx9 s PHE 181 Cb 0.00 -3.19 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 2qx9 s PHE 181 CO 0.00 -1.92 0.11 0.15 -0.10 0.00 0.00 175.22 173.47 2qx9 s LYS 182 N -4.32 4.02 -0.29 0.44 -0.14 -0.57 -4.32 119.74 114.56 2qx9 s LYS 182 Ca 0.66 -0.30 -0.09 0.00 -1.36 0.00 0.00 55.97 54.87 2qx9 s LYS 182 Cb -0.21 -3.39 -0.02 0.00 -1.68 0.00 0.00 37.83 32.53 2qx9 s LYS 182 CO 0.47 0.16 0.14 0.08 -0.76 0.00 0.00 175.35 175.44 2qx9 s VAL 183 N 0.74 4.71 0.52 3.17 1.01 -1.26 -1.17 120.40 128.12 2qx9 s VAL 183 Ca 0.06 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 2qx9 s VAL 183 Cb -0.13 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 32.87 2qx9 s VAL 183 CO 0.02 0.17 0.95 -0.76 0.00 0.00 0.00 175.10 175.48 2qx9 s LEU 184 N 1.65 3.55 0.33 3.92 1.43 -0.60 -0.58 118.68 128.37 2qx9 s LEU 184 Ca 0.06 1.43 -0.28 0.00 -1.03 0.00 0.00 54.13 54.31 2qx9 s LEU 184 Cb -0.16 -4.39 -0.13 0.00 0.03 0.00 0.00 46.19 41.54 2qx9 s LEU 184 CO 0.07 -0.63 1.25 0.00 0.23 0.00 0.00 176.35 177.26 2qx9 n ALA 185 N -1.89 1.04 -1.78 4.21 0.00 -1.26 -4.69 120.51 116.15 2qx9 n ALA 185 Ca 0.05 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.51 2qx9 n ALA 185 Cb 0.54 -2.22 -0.00 0.00 0.00 0.00 0.00 19.45 17.77 2qx9 n ALA 185 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2qx9 s PRO 186 N -1.78 3.40 -0.28 0.00 0.04 -1.26 -4.73 135.00 130.38 2qx9 s PRO 186 Ca 0.56 1.60 -0.08 0.00 0.04 0.00 0.00 61.00 63.12 2qx9 s PRO 186 Cb -0.59 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 31.91 2qx9 s PRO 186 CO 0.62 -0.81 0.11 -1.14 0.04 0.00 0.00 177.00 175.82 2qx9 s GLN 187 N -3.26 3.47 -0.16 4.56 2.00 0.49 -4.98 119.66 121.78 2qx9 s GLN 187 Ca 0.72 -0.62 0.02 0.00 -2.00 0.00 0.00 55.36 53.48 2qx9 s GLN 187 Cb -0.23 -3.44 0.02 0.00 0.80 0.00 0.00 33.01 30.15 2qx9 s GLN 187 CO 0.27 -0.31 -0.21 0.42 -0.50 0.00 0.00 175.29 174.96 2qx9 s ILE 188 N 1.61 2.02 -0.38 -2.34 1.01 -1.26 0.33 121.20 122.19 2qx9 s ILE 188 Ca 0.05 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.67 2qx9 s ILE 188 Cb -0.16 -1.81 0.04 0.00 0.01 0.00 0.00 42.46 40.55 2qx9 s ILE 188 CO 0.05 0.54 0.19 -0.44 0.00 0.00 0.00 174.94 175.28 2qx9 s SER 189 N 1.06 5.60 -0.06 3.58 0.01 0.20 -4.97 113.70 119.12 2qx9 s SER 189 Ca -0.01 -1.15 -0.30 0.00 1.31 0.00 0.00 55.95 55.79 2qx9 s SER 189 Cb -0.14 -1.97 -0.03 0.00 0.21 0.00 0.00 66.02 64.08 2qx9 s SER 189 CO -0.07 -0.41 1.16 -0.36 0.41 0.00 0.00 173.24 173.97 2qx9 s PHE 190 N 1.48 3.27 -1.18 2.43 0.08 -1.26 -2.14 117.98 120.66 2qx9 s PHE 190 Ca 0.01 1.30 -0.29 0.00 0.12 0.00 0.00 56.93 58.06 2qx9 s PHE 190 Cb -0.20 -3.37 0.04 0.00 -0.57 0.00 0.00 43.02 38.92 2qx9 s PHE 190 CO 0.05 -1.09 0.56 0.00 -0.10 0.00 0.00 175.22 174.63 2qx9 n ALA 191 N 5.07 -2.44 0.31 5.36 0.00 -1.01 -4.86 120.51 122.95 2qx9 n ALA 191 Ca 0.10 -0.55 0.19 0.00 0.00 0.00 0.00 53.44 53.18 2qx9 n ALA 191 Cb 0.47 -2.19 1.00 0.00 0.00 0.00 0.00 19.45 18.73 2qx9 n ALA 191 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qx9 h PRO 192 N -2.24 0.00 -0.02 0.00 0.13 -1.78 -1.99 132.00 126.10 2qx9 h PRO 192 Ca -0.67 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.29 2qx9 h PRO 192 Cb 1.32 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.46 2qx9 h PRO 192 CO 0.51 0.00 -0.66 0.93 -0.23 0.00 0.00 178.00 178.55 2qx9 h GLU 193 N 0.00 0.49 0.00 0.86 5.08 -1.89 -3.25 114.58 115.87 2qx9 h GLU 193 Ca 0.02 -0.49 -0.14 0.00 -1.00 0.00 0.00 59.36 57.74 2qx9 h GLU 193 Cb 0.33 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2qx9 h GLU 193 CO -0.00 1.13 -0.66 0.82 -1.00 0.00 0.00 179.01 179.30 2qx9 h ILE 194 N 0.04 1.47 -3.23 3.13 2.04 -1.79 -3.45 117.51 115.71 2qx9 h ILE 194 Ca -0.08 -2.29 -0.42 0.00 1.00 0.00 0.00 64.86 63.08 2qx9 h ILE 194 Cb 1.35 2.24 0.21 0.00 -0.74 0.00 0.00 36.82 39.87 2qx9 h ILE 194 CO 0.13 0.65 -0.01 0.00 0.00 0.00 0.00 178.15 178.92 2qx9 s ALA 195 N -3.49 -0.49 0.31 1.87 0.00 -0.80 -5.04 121.76 114.13 2qx9 s ALA 195 Ca -0.01 -0.37 0.07 0.00 0.00 0.00 0.00 51.96 51.64 2qx9 s ALA 195 Cb 0.12 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 2qx9 s ALA 195 CO 0.77 -4.00 0.34 -1.54 0.00 0.00 0.00 175.76 171.33 2qx9 s SER 196 N -2.79 5.63 0.20 0.00 1.04 -1.26 -4.89 113.70 111.63 2qx9 s SER 196 Ca 0.68 -0.31 -0.17 0.00 0.48 0.00 0.00 55.95 56.63 2qx9 s SER 196 Cb -0.21 -1.20 0.19 0.00 0.10 0.00 0.00 66.02 64.90 2qx9 s SER 196 CO 0.62 -0.30 1.60 -0.33 0.98 0.00 0.00 173.24 175.81 2qx9 h GLU 197 N 1.17 -0.08 -0.32 4.02 4.39 -1.96 0.35 114.58 122.15 2qx9 h GLU 197 Ca -0.46 0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.31 2qx9 h GLU 197 Cb 1.25 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.85 2qx9 h GLU 197 CO 0.57 -0.06 -0.16 0.93 -1.16 0.00 0.00 179.01 179.14 2qx9 h GLU 198 N -0.09 -0.11 -0.41 2.33 3.07 -1.99 -1.19 114.58 116.20 2qx9 h GLU 198 Ca 0.27 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 59.08 2qx9 h GLU 198 Cb 0.52 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.44 2qx9 h GLU 198 CO -0.68 -0.07 0.01 0.93 -1.40 0.00 0.00 179.01 177.81 2qx9 h GLU 199 N -0.11 0.71 -0.65 2.33 5.08 -1.34 -2.79 114.58 117.81 2qx9 h GLU 199 Ca 0.17 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2qx9 h GLU 199 Cb 0.36 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2qx9 h GLU 199 CO -0.39 0.79 0.36 0.00 -1.00 0.00 0.00 179.01 178.76 2qx9 h ARG 200 N 0.54 0.91 0.00 2.33 3.08 -0.16 -0.51 114.38 120.58 2qx9 h ARG 200 Ca 0.12 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2qx9 h ARG 200 Cb 0.46 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 2qx9 h ARG 200 CO 0.02 0.68 -0.05 0.87 -1.07 0.00 0.00 179.97 180.42 2qx9 h LYS 201 N 0.89 0.00 -0.04 0.04 1.79 -1.16 -0.89 116.57 117.20 2qx9 h LYS 201 Ca 0.23 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.47 2qx9 h LYS 201 Cb 0.04 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.69 2qx9 h LYS 201 CO -0.04 0.05 -0.90 0.78 -1.08 0.00 0.00 179.45 178.27 2qx9 h GLY 202 N 0.33 0.58 1.49 3.86 0.00 -0.84 -2.48 103.07 106.01 2qx9 h GLY 202 Ca -0.00 -0.95 -0.15 0.00 0.00 0.00 0.00 47.33 46.24 2qx9 h GLY 202 CO 0.01 0.84 -0.48 -0.33 0.00 0.00 0.00 176.54 176.57 2qx9 h MET 203 N 0.32 0.55 -0.64 4.80 2.86 -0.55 -2.27 114.93 119.99 2qx9 h MET 203 Ca -0.08 -0.31 -0.07 0.00 -2.06 0.00 0.00 59.70 57.18 2qx9 h MET 203 Cb 1.52 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 33.18 2qx9 h MET 203 CO 0.16 0.91 0.12 0.28 1.06 0.00 0.00 176.91 179.44 2qx9 h VAL 204 N 0.43 1.25 -0.64 -2.22 2.07 -1.18 -2.13 116.25 113.84 2qx9 h VAL 204 Ca 0.02 -0.97 -0.08 0.00 0.82 0.00 0.00 66.70 66.49 2qx9 h VAL 204 Cb 1.00 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2qx9 h VAL 204 CO 0.09 0.37 0.09 0.00 0.02 0.00 0.00 177.57 178.14 2qx9 h ALA 205 N 1.15 0.94 -0.11 1.67 0.00 -1.27 -2.30 119.26 119.35 2qx9 h ALA 205 Ca 0.20 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2qx9 h ALA 205 Cb 0.39 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2qx9 h ALA 205 CO 0.01 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.90 2qx9 h ALA 206 N 1.09 0.08 -0.92 0.00 0.00 -1.01 -1.16 119.26 117.35 2qx9 h ALA 206 Ca 0.19 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2qx9 h ALA 206 Cb 0.45 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2qx9 h ALA 206 CO 0.01 -0.47 0.59 2.35 0.00 0.00 0.00 179.25 181.74 2qx9 h TRP 207 N 0.02 1.12 0.36 0.00 -0.00 -1.26 -2.26 115.95 113.93 2qx9 h TRP 207 Ca 0.05 0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 58.95 2qx9 h TRP 207 Cb 0.06 -0.37 0.00 0.00 -0.00 0.00 0.00 29.16 28.86 2qx9 h TRP 207 CO -0.14 0.64 -0.17 1.03 -0.00 0.00 0.00 178.44 179.80 2qx9 h SER 208 N 1.16 -0.40 -0.66 2.65 0.87 -0.80 -2.03 113.55 114.33 2qx9 h SER 208 Ca 0.36 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2qx9 h SER 208 Cb 0.00 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 2qx9 h SER 208 CO -0.12 -0.17 0.40 -0.61 -0.53 0.00 0.00 176.83 175.80 2qx9 h GLN 209 N -0.62 0.90 -0.68 2.24 5.75 -1.15 -1.57 115.11 119.99 2qx9 h GLN 209 Ca -0.05 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.37 2qx9 h GLN 209 Cb 0.45 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.78 2qx9 h GLN 209 CO 0.08 0.63 0.40 -0.09 -2.65 0.00 0.00 178.83 177.20 2qx9 h ARG 210 N 0.92 0.92 0.00 1.69 2.43 -1.26 -1.04 114.38 118.03 2qx9 h ARG 210 Ca 0.24 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2qx9 h ARG 210 Cb -0.03 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.32 2qx9 h ARG 210 CO -0.05 0.65 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.97 2qx9 h LEU 211 N 0.93 0.00 -0.80 3.80 3.38 -0.53 -1.22 115.31 120.87 2qx9 h LEU 211 Ca 0.24 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 2qx9 h LEU 211 Cb -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2qx9 h LEU 211 CO -0.04 0.02 -0.59 1.56 0.09 0.00 0.00 178.44 179.48 2qx9 h GLN 212 N 0.00 0.00 -0.07 1.13 4.20 -1.10 -3.27 115.11 116.00 2qx9 h GLN 212 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qx9 h GLN 212 Cb 0.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2qx9 h GLN 212 CO 0.00 0.59 0.00 0.25 -0.67 0.00 0.00 178.83 179.00 2qx9 n THR 213 N -3.80 0.30 -0.15 -0.54 -2.24 -0.94 -4.68 114.28 102.23 2qx9 n THR 213 Ca -0.01 -0.65 0.29 0.00 -2.27 0.00 0.00 64.05 61.40 2qx9 n THR 213 Cb 0.60 0.94 0.69 0.00 -2.10 0.00 0.00 70.33 70.46 2qx9 n THR 213 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2qx9 h ILE 214 N 1.25 0.31 0.00 2.28 6.09 -1.29 0.43 117.51 126.58 2qx9 h ILE 214 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2qx9 h ILE 214 Cb 0.38 0.41 0.00 0.00 0.47 0.00 0.00 36.82 38.09 2qx9 h ILE 214 CO 0.00 0.00 0.00 0.79 -3.07 0.00 0.00 178.15 175.87 2qx9 n TRP 215 N -3.83 0.39 0.19 2.19 7.02 -1.26 -3.25 117.44 118.89 2qx9 n TRP 215 Ca 0.19 0.12 0.08 0.00 -1.02 0.00 0.00 57.50 56.86 2qx9 n TRP 215 Cb 1.08 -0.69 0.14 0.00 -2.42 0.00 0.00 31.31 29.42 2qx9 n TRP 215 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2qx9 n LYS 216 N -1.82 1.99 -2.87 -0.99 5.02 0.15 -4.99 118.16 114.66 2qx9 n LYS 216 Ca 0.06 -1.84 -0.39 0.00 -2.02 0.00 0.00 58.31 54.12 2qx9 n LYS 216 Cb 0.36 -1.33 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 2qx9 n LYS 216 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2qx9 s GLU 217 N -1.13 4.67 0.16 1.97 2.02 -1.18 -5.05 118.70 120.16 2qx9 s GLU 217 Ca 0.25 1.30 -0.23 0.00 0.02 0.00 0.00 54.97 56.30 2qx9 s GLU 217 Cb 0.15 -3.18 -0.08 0.00 0.10 0.00 0.00 34.13 31.12 2qx9 s GLU 217 CO 0.20 0.50 0.74 -1.21 0.02 0.00 0.00 175.26 175.51 2qx9 s GLU 218 N -1.35 4.46 0.63 1.61 0.41 -1.26 -5.04 118.70 118.16 2qx9 s GLU 218 Ca 0.40 1.05 -0.17 0.00 -0.41 0.00 0.00 54.97 55.84 2qx9 s GLU 218 Cb -0.23 -3.19 -0.02 0.00 -1.78 0.00 0.00 34.13 28.91 2qx9 s GLU 218 CO 0.28 0.55 1.16 -1.25 -0.49 0.00 0.00 175.26 175.51 2qx9 s PRO 219 N -1.30 2.86 0.65 0.39 0.04 -1.26 -4.70 135.00 131.68 2qx9 s PRO 219 Ca 0.36 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 2qx9 s PRO 219 Cb -0.21 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 2qx9 s PRO 219 CO 0.24 -1.25 1.05 0.96 0.04 0.00 0.00 177.00 178.04 2qx9 s ILE 220 N -1.92 4.05 -1.31 0.56 -4.36 0.25 -4.93 121.20 113.55 2qx9 s ILE 220 Ca 0.73 0.76 -0.15 0.00 -0.26 0.00 0.00 60.65 61.74 2qx9 s ILE 220 Cb -0.26 -3.45 0.10 0.00 1.25 0.00 0.00 42.46 40.11 2qx9 s ILE 220 CO 0.36 -0.77 1.80 -0.81 0.24 0.00 0.00 174.94 175.75 2qx9 n PRO 221 N -2.71 3.23 -0.82 0.37 -0.04 -1.26 -4.73 135.00 129.04 2qx9 n PRO 221 Ca 0.08 -3.31 -0.36 0.00 -0.04 0.00 0.00 63.50 59.86 2qx9 n PRO 221 Cb 0.53 -3.25 -0.12 0.00 -0.04 0.00 0.00 33.50 30.63 2qx9 n PRO 221 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qx9 s THR 223 N 9.96 2.35 0.41 0.00 -4.23 -1.26 -4.94 115.64 117.92 2qx9 s THR 223 Ca 0.72 -2.01 0.14 0.00 -1.18 0.00 0.00 61.69 59.37 2qx9 s THR 223 Cb 0.09 -2.83 0.35 0.00 1.34 0.00 0.00 72.50 71.45 2qx9 s THR 223 CO 0.30 -0.13 1.92 0.00 -0.54 0.00 0.00 174.62 176.17 2qx9 h ALA 224 N 1.81 2.05 -0.24 3.99 0.00 -2.00 -1.20 119.26 123.67 2qx9 h ALA 224 Ca -0.43 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.29 2qx9 h ALA 224 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2qx9 h ALA 224 CO 0.71 -0.26 -0.61 1.25 0.00 0.00 0.00 179.25 180.35 2qx9 h HIS 225 N 0.47 1.03 -0.45 0.00 -0.00 -1.92 -2.57 115.15 111.71 2qx9 h HIS 225 Ca 0.37 -0.39 0.03 0.00 -0.00 0.00 0.00 60.37 60.39 2qx9 h HIS 225 Cb 0.79 -0.18 -0.04 0.00 -0.00 0.00 0.00 27.41 27.98 2qx9 h HIS 225 CO -0.00 1.21 0.23 2.35 -0.00 0.00 0.00 177.93 181.72 2qx9 h TRP 226 N 0.60 0.43 -0.20 5.26 7.01 -1.44 -0.46 115.95 127.15 2qx9 h TRP 226 Ca -0.00 0.02 -0.18 0.00 2.11 0.00 0.00 58.89 60.83 2qx9 h TRP 226 Cb 1.21 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 28.15 2qx9 h TRP 226 CO 0.07 0.22 -0.61 0.45 -2.79 0.00 0.00 178.44 175.78 2qx9 h HIS 227 N 0.46 0.87 -0.13 2.65 3.86 -1.53 -3.37 115.15 117.96 2qx9 h HIS 227 Ca 0.19 -0.33 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 2qx9 h HIS 227 Cb 0.09 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.40 2qx9 h HIS 227 CO -0.10 1.11 0.00 1.19 0.86 0.00 0.00 177.93 181.00 2qx9 n PHE 228 N -3.95 0.16 -2.48 2.45 3.72 -0.97 -4.06 117.46 112.33 2qx9 n PHE 228 Ca -0.04 -0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 2qx9 n PHE 228 Cb 0.65 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.18 2qx9 n PHE 228 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qx9 n GLY 229 N 0.55 -2.19 0.00 1.37 0.00 -0.19 -5.03 105.19 99.69 2qx9 n GLY 229 Ca 0.08 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2qx9 n GLY 229 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26