#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qbi s VAL 2 N 0.00 4.67 0.42 2.53 1.01 -1.26 -1.07 120.40 126.71 1qbi s VAL 2 Ca 0.00 1.22 -0.26 0.00 0.00 0.00 0.00 61.98 62.94 1qbi s VAL 2 Cb 0.00 -3.89 -0.09 0.00 0.00 0.00 0.00 36.38 32.40 1qbi s VAL 2 CO 0.00 0.42 1.38 -2.84 0.00 0.00 0.00 175.10 174.06 1qbi s PRO 3 N -1.46 3.86 0.59 2.72 0.02 -1.26 -4.98 135.00 134.50 1qbi s PRO 3 Ca 0.34 2.32 -0.14 0.00 0.02 0.00 0.00 61.00 63.55 1qbi s PRO 3 Cb -0.19 -2.74 -0.04 0.00 0.02 0.00 0.00 34.50 31.55 1qbi s PRO 3 CO 0.20 -0.64 1.02 -0.51 -0.33 0.00 0.00 177.00 176.75 1qbi s LEU 4 N -2.52 3.39 0.60 -5.54 1.43 -1.26 -5.07 118.68 109.71 1qbi s LEU 4 Ca 0.58 1.57 -0.03 0.00 -1.03 0.00 0.00 54.13 55.22 1qbi s LEU 4 Cb -0.42 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.34 1qbi s LEU 4 CO 0.54 -0.92 0.87 0.42 0.23 0.00 0.00 176.35 177.49 1qbi s THR 5 N -2.85 2.88 0.34 5.49 -4.23 -1.26 -4.88 115.64 111.12 1qbi s THR 5 Ca 0.58 -0.38 0.04 0.00 -1.18 0.00 0.00 61.69 60.75 1qbi s THR 5 Cb -0.12 -3.14 0.29 0.00 1.34 0.00 0.00 72.50 70.87 1qbi s THR 5 CO 0.44 -0.13 1.92 -0.65 -0.54 0.00 0.00 174.62 175.66 1qbi h PRO 6 N -0.17 0.82 -0.01 3.99 0.11 -1.95 0.19 132.00 134.98 1qbi h PRO 6 Ca -0.44 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.47 1qbi h PRO 6 Cb 1.29 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1qbi h PRO 6 CO 0.57 0.54 -0.71 0.66 -0.21 0.00 0.00 178.00 178.86 1qbi h SER 7 N 0.85 0.11 -0.16 -2.05 4.64 -1.94 0.58 113.55 115.58 1qbi h SER 7 Ca 0.37 -0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 61.49 1qbi h SER 7 Cb 0.33 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1qbi h SER 7 CO -0.14 0.78 -0.31 1.56 -0.87 0.00 0.00 176.83 177.85 1qbi h GLN 8 N 0.06 0.65 -0.18 4.77 4.20 -1.40 -1.70 115.11 121.52 1qbi h GLN 8 Ca -0.01 -0.29 -0.12 0.00 0.06 0.00 0.00 58.65 58.28 1qbi h GLN 8 Cb 1.26 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.02 1qbi h GLN 8 CO 0.10 0.88 -0.37 0.74 -0.67 0.00 0.00 178.83 179.51 1qbi h PHE 9 N 0.56 0.72 -0.74 2.96 -1.00 -0.38 -3.18 116.94 115.89 1qbi h PHE 9 Ca 0.07 -0.26 0.08 0.00 2.81 0.00 0.00 57.97 60.66 1qbi h PHE 9 Cb 0.81 -0.13 -0.05 0.00 3.61 0.00 0.00 35.95 40.19 1qbi h PHE 9 CO 0.04 1.01 0.48 0.00 -1.61 0.00 0.00 178.31 178.23 1qbi h ALA 10 N 0.58 1.76 0.00 2.45 0.00 0.35 -1.72 119.26 122.68 1qbi h ALA 10 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1qbi h ALA 10 Cb 0.97 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1qbi h ALA 10 CO 0.08 0.10 0.00 0.36 0.00 0.00 0.00 179.25 179.80 1qbi n LYS 11 N -4.49 0.11 -1.20 0.00 2.85 -0.65 -4.27 118.16 110.51 1qbi n LYS 11 Ca 0.12 0.12 -0.34 0.00 -1.05 0.00 0.00 58.31 57.16 1qbi n LYS 11 Cb 0.28 -1.64 -0.04 0.00 -0.65 0.00 0.00 35.03 32.98 1qbi n LYS 11 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1qbi n ALA 12 N -1.63 7.05 0.62 0.58 0.00 -0.65 -4.54 120.51 121.95 1qbi n ALA 12 Ca 0.06 -3.15 0.09 0.00 0.00 0.00 0.00 53.44 50.44 1qbi n ALA 12 Cb 0.36 -3.22 0.25 0.00 0.00 0.00 0.00 19.45 16.83 1qbi n ALA 12 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1qbi n LYS 13 N 3.56 2.07 -3.73 0.00 4.76 -1.26 0.28 118.16 123.84 1qbi n LYS 13 Ca 0.71 -1.65 -0.27 0.00 -2.87 0.00 0.00 58.31 54.22 1qbi n LYS 13 Cb 0.28 -1.40 0.01 0.00 -1.84 0.00 0.00 35.03 32.08 1qbi n LYS 13 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1qbi n SER 14 N 0.85 -3.45 -4.44 4.39 7.64 -1.26 -4.44 113.62 112.91 1qbi n SER 14 Ca 0.16 -0.88 -0.44 0.00 1.01 0.00 0.00 58.87 58.73 1qbi n SER 14 Cb 0.41 -1.22 -0.03 0.00 -1.01 0.00 0.00 64.21 62.36 1qbi n SER 14 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1qbi s GLU 15 N -5.48 3.46 0.00 1.43 0.41 -1.26 -3.32 118.70 113.94 1qbi s GLU 15 Ca 0.17 -1.60 0.00 0.00 -0.41 0.00 0.00 54.97 53.13 1qbi s GLU 15 Cb -0.10 -4.70 0.00 0.00 -1.78 0.00 0.00 34.13 27.55 1qbi s GLU 15 CO 0.72 -1.73 0.00 0.27 -0.49 0.00 0.00 175.26 174.03 1qbi n ASN 16 N 6.56 0.00 -4.15 -0.19 6.94 -1.26 -5.13 115.26 118.02 1qbi n ASN 16 Ca 0.15 0.00 -0.20 0.00 -0.02 0.00 0.00 54.58 54.51 1qbi n ASN 16 Cb 0.48 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.76 1qbi n ASN 16 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1qbi s PHE 17 N 0.00 1.28 -0.20 -2.53 0.40 -1.21 -4.98 117.98 110.74 1qbi s PHE 17 Ca 0.00 -0.36 -0.13 0.00 -0.60 0.00 0.00 56.93 55.84 1qbi s PHE 17 Cb 0.00 -0.76 -0.05 0.00 0.51 0.00 0.00 43.02 42.73 1qbi s PHE 17 CO 0.00 0.04 0.24 -0.51 0.70 0.00 0.00 175.22 175.70 1qbi s ASP 18 N -1.18 6.31 -0.11 1.36 1.01 -0.42 -4.85 116.67 118.78 1qbi s ASP 18 Ca 0.02 0.35 -0.13 0.00 0.71 0.00 0.00 52.55 53.50 1qbi s ASP 18 Cb -0.08 -2.15 -0.05 0.00 1.01 0.00 0.00 42.92 41.65 1qbi s ASP 18 CO 0.01 0.07 0.30 -0.75 0.21 0.00 0.00 175.17 175.02 1qbi s LYS 19 N 0.76 4.05 -0.03 8.23 2.20 -1.26 -0.97 119.74 132.72 1qbi s LYS 19 Ca 0.13 0.14 0.00 0.00 -0.36 0.00 0.00 55.97 55.89 1qbi s LYS 19 Cb -0.13 -3.34 0.02 0.00 -1.51 0.00 0.00 37.83 32.88 1qbi s LYS 19 CO 0.03 0.43 -0.00 0.21 -0.36 0.00 0.00 175.35 175.66 1qbi s LYS 20 N -0.13 0.29 -0.09 4.03 2.47 0.17 -4.99 119.74 121.49 1qbi s LYS 20 Ca 0.18 0.06 -0.29 0.00 -1.56 0.00 0.00 55.97 54.36 1qbi s LYS 20 Cb -0.14 -0.46 -0.02 0.00 -1.46 0.00 0.00 37.83 35.76 1qbi s LYS 20 CO 0.06 -0.12 0.99 0.08 0.16 0.00 0.00 175.35 176.53 1qbi s VAL 21 N 0.93 4.80 -0.16 4.02 1.01 -1.26 -0.08 120.40 129.66 1qbi s VAL 21 Ca -0.09 2.02 -0.13 0.00 0.00 0.00 0.00 61.98 63.78 1qbi s VAL 21 Cb -0.13 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 31.86 1qbi s VAL 21 CO -0.02 0.03 0.00 0.40 0.00 0.00 0.00 175.10 175.52 1qbi h ILE 22 N 5.05 0.36 -4.20 2.22 2.04 -0.99 -3.48 117.51 118.51 1qbi h ILE 22 Ca -0.33 -1.43 -0.54 0.00 1.00 0.00 0.00 64.86 63.57 1qbi h ILE 22 Cb 1.16 0.84 -0.27 0.00 -0.74 0.00 0.00 36.82 37.81 1qbi h ILE 22 CO 0.84 0.12 -0.83 -0.76 0.00 0.00 0.00 178.15 177.52 1qbi s LEU 23 N -8.15 2.11 0.00 1.44 1.43 -0.95 -4.96 118.68 109.60 1qbi s LEU 23 Ca -0.18 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1qbi s LEU 23 Cb 0.03 -0.86 0.00 0.00 0.03 0.00 0.00 46.19 45.38 1qbi s LEU 23 CO 0.33 0.16 0.57 -1.54 0.23 0.00 0.00 176.35 176.10 1qbi n SER 24 N 2.20 0.90 -1.03 2.29 3.41 -1.26 -0.52 113.62 119.60 1qbi n SER 24 Ca -0.16 -1.33 -0.02 0.00 -0.26 0.00 0.00 58.87 57.10 1qbi n SER 24 Cb 0.54 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.69 1qbi n SER 24 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1qbi n ASN 25 N -0.16 2.25 -4.84 4.04 0.23 -1.25 -4.70 115.26 110.83 1qbi n ASN 25 Ca 0.00 -3.83 -0.32 0.00 -0.53 0.00 0.00 54.58 49.90 1qbi n ASN 25 Cb 0.25 -0.61 -0.05 0.00 -2.08 0.00 0.00 39.78 37.28 1qbi n ASN 25 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1qbi s LEU 26 N -3.26 3.85 -0.32 -4.53 1.43 -0.16 -5.03 118.68 110.66 1qbi s LEU 26 Ca 0.43 1.54 -0.06 0.00 -1.03 0.00 0.00 54.13 55.01 1qbi s LEU 26 Cb 0.40 -4.41 0.03 0.00 0.03 0.00 0.00 46.19 42.24 1qbi s LEU 26 CO -0.02 -0.41 0.08 0.21 0.23 0.00 0.00 176.35 176.44 1qbi s ASN 27 N -2.56 5.18 -1.25 2.29 3.84 -1.26 -4.41 114.94 116.76 1qbi s ASN 27 Ca 0.59 -1.06 -0.22 0.00 0.21 0.00 0.00 52.86 52.37 1qbi s ASN 27 Cb -0.10 -1.84 0.02 0.00 -0.55 0.00 0.00 41.25 38.78 1qbi s ASN 27 CO 0.21 -0.28 0.62 0.29 -2.79 0.00 0.00 177.10 175.15 1qbi n LYS 28 N 4.79 -1.03 -1.96 0.43 5.02 -1.26 -3.98 118.16 120.17 1qbi n LYS 28 Ca -0.13 0.25 -0.41 0.00 -2.02 0.00 0.00 58.31 55.99 1qbi n LYS 28 Cb 0.45 -3.43 -0.02 0.00 -0.02 0.00 0.00 35.03 32.01 1qbi n LYS 28 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1qbi s PRO 29 N -6.83 4.24 0.09 1.97 0.04 -1.26 -0.54 135.00 132.71 1qbi s PRO 29 Ca 0.38 2.36 0.00 0.00 0.04 0.00 0.00 61.00 63.78 1qbi s PRO 29 Cb -0.18 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1qbi s PRO 29 CO 0.93 -0.45 0.00 1.58 0.04 0.00 0.00 177.00 179.09 1qbi n HIS 30 N 2.17 -0.16 -4.79 0.56 -0.00 0.06 -4.77 115.22 108.29 1qbi n HIS 30 Ca 0.06 0.03 -0.30 0.00 0.46 0.00 0.00 57.72 57.97 1qbi n HIS 30 Cb 0.40 0.04 -0.14 0.00 -0.12 0.00 0.00 29.99 30.17 1qbi n HIS 30 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1qbi s ALA 31 N -2.00 2.36 0.04 1.57 0.00 -1.26 -4.49 121.76 117.97 1qbi s ALA 31 Ca 0.00 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.72 1qbi s ALA 31 Cb 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 1qbi s ALA 31 CO 0.00 0.55 -0.10 -0.48 0.00 0.00 0.00 175.76 175.73 1qbi s LEU 32 N -1.37 2.20 0.03 0.00 2.34 -1.26 -0.79 118.68 119.83 1qbi s LEU 32 Ca 0.13 -0.47 0.01 0.00 0.06 0.00 0.00 54.13 53.86 1qbi s LEU 32 Cb -0.10 -0.32 -0.02 0.00 -0.56 0.00 0.00 46.19 45.19 1qbi s LEU 32 CO 0.03 -0.10 -0.06 -0.76 -1.06 0.00 0.00 176.35 174.41 1qbi s LEU 33 N -1.29 2.25 -0.45 1.48 1.43 0.11 -4.87 118.68 117.34 1qbi s LEU 33 Ca -0.05 -0.52 -0.26 0.00 -1.03 0.00 0.00 54.13 52.27 1qbi s LEU 33 Cb -0.08 -0.07 0.03 0.00 0.03 0.00 0.00 46.19 46.09 1qbi s LEU 33 CO 0.01 -0.23 0.94 0.86 0.23 0.00 0.00 176.35 178.16 1qbi s TRP 34 N -1.39 2.93 0.86 0.29 -0.11 -1.26 -0.71 118.94 119.54 1qbi s TRP 34 Ca -0.12 0.45 -0.12 0.00 1.22 0.00 0.00 56.10 57.53 1qbi s TRP 34 Cb -0.10 -3.98 0.11 0.00 -1.50 0.00 0.00 33.47 28.00 1qbi s TRP 34 CO -0.00 -1.09 1.15 0.20 -4.62 0.00 0.00 176.95 172.60 1qbi s GLY 35 N 2.24 1.58 0.32 5.86 0.00 0.14 -4.94 107.32 112.53 1qbi s GLY 35 Ca 0.38 -0.57 0.25 0.00 0.00 0.00 0.00 44.72 44.78 1qbi s GLY 35 CO 0.26 -0.05 1.75 -0.56 0.00 0.00 0.00 173.10 174.50 1qbi h PRO 36 N -1.28 0.00 -0.70 2.90 0.13 -1.95 -0.37 132.00 130.72 1qbi h PRO 36 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1qbi h PRO 36 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1qbi h PRO 36 CO 0.64 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.01 1qbi n ASP 37 N -2.36 3.76 -1.49 1.44 5.75 -1.26 -4.91 116.55 117.48 1qbi n ASP 37 Ca 0.01 -2.00 -0.16 0.00 -0.01 0.00 0.00 54.79 52.63 1qbi n ASP 37 Cb 0.19 -0.47 -0.04 0.00 -1.03 0.00 0.00 41.12 39.76 1qbi n ASP 37 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1qbi n ASN 38 N 1.56 -4.90 -4.82 -1.12 4.13 -0.15 -5.00 115.26 104.97 1qbi n ASN 38 Ca 0.23 0.23 -0.22 0.00 1.68 0.00 0.00 54.58 56.51 1qbi n ASN 38 Cb 0.59 -3.90 -0.04 0.00 -1.54 0.00 0.00 39.78 34.89 1qbi n ASN 38 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1qbi s GLN 39 N -3.95 2.76 -0.10 3.52 -1.52 -1.26 -4.63 119.66 114.48 1qbi s GLN 39 Ca 0.00 -1.21 -0.18 0.00 -1.95 0.00 0.00 55.36 52.02 1qbi s GLN 39 Cb 0.00 -2.47 -0.04 0.00 -0.22 0.00 0.00 33.01 30.27 1qbi s GLN 39 CO 0.00 0.26 0.46 0.42 -0.25 0.00 0.00 175.29 176.18 1qbi s ILE 40 N -2.24 5.17 -0.07 1.08 1.01 -0.24 0.29 121.20 126.20 1qbi s ILE 40 Ca 0.36 0.93 0.03 0.00 0.00 0.00 0.00 60.65 61.98 1qbi s ILE 40 Cb -0.07 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 1qbi s ILE 40 CO 0.25 0.36 -0.16 0.26 0.00 0.00 0.00 174.94 175.65 1qbi s TRP 41 N 0.41 2.67 0.04 3.97 0.52 0.11 0.24 118.94 126.89 1qbi s TRP 41 Ca 0.25 -0.41 -0.04 0.00 0.02 0.00 0.00 56.10 55.92 1qbi s TRP 41 Cb -0.15 -1.68 -0.02 0.00 -1.15 0.00 0.00 33.47 30.47 1qbi s TRP 41 CO 0.10 -0.01 0.06 -0.48 0.02 0.00 0.00 176.95 176.65 1qbi s LEU 42 N -0.32 1.97 0.19 2.99 -0.00 0.34 0.08 118.68 123.92 1qbi s LEU 42 Ca 0.02 -0.61 0.07 0.00 -0.00 0.00 0.00 54.13 53.62 1qbi s LEU 42 Cb -0.13 0.47 -0.04 0.00 -0.00 0.00 0.00 46.19 46.50 1qbi s LEU 42 CO 0.02 -0.50 0.01 0.42 -0.00 0.00 0.00 176.35 176.31 1qbi s THR 43 N -2.68 3.75 -0.24 5.48 -4.23 0.03 -0.33 115.64 117.42 1qbi s THR 43 Ca -0.04 -1.46 -0.04 0.00 -1.18 0.00 0.00 61.69 58.97 1qbi s THR 43 Cb -0.01 -2.91 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1qbi s THR 43 CO -0.05 -0.15 -0.03 -1.61 -0.54 0.00 0.00 174.62 172.24 1qbi s GLU 44 N -3.07 3.20 0.17 3.99 2.02 0.54 -0.76 118.70 124.79 1qbi s GLU 44 Ca 0.28 -0.74 -0.12 0.00 0.02 0.00 0.00 54.97 54.40 1qbi s GLU 44 Cb -0.09 -3.04 0.07 0.00 0.10 0.00 0.00 34.13 31.17 1qbi s GLU 44 CO 0.19 -0.28 1.74 -0.09 0.02 0.00 0.00 175.26 176.84 1qbi h ARG 45 N 8.10 0.85 0.18 1.61 2.43 -0.94 -0.78 114.38 125.82 1qbi h ARG 45 Ca -0.38 -0.14 -0.33 0.00 -0.81 0.00 0.00 59.98 58.32 1qbi h ARG 45 Cb 1.14 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1qbi h ARG 45 CO 0.60 0.71 -1.65 0.00 -1.51 0.00 0.00 179.97 178.12 1qbi h ALA 46 N 1.10 0.13 0.00 2.80 0.00 -1.80 0.11 119.26 121.60 1qbi h ALA 46 Ca 0.20 -1.10 -0.13 0.00 0.00 0.00 0.00 54.91 53.87 1qbi h ALA 46 Cb 0.16 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1qbi h ALA 46 CO -0.02 0.95 -0.62 1.79 0.00 0.00 0.00 179.25 181.34 1qbi h THR 47 N 0.02 1.28 0.00 0.00 1.35 -1.84 -3.44 112.91 110.27 1qbi h THR 47 Ca -0.33 -2.25 0.00 0.00 -0.55 0.00 0.00 66.41 63.28 1qbi h THR 47 Cb 2.03 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 70.72 1qbi h THR 47 CO 0.16 0.61 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 1qbi n GLY 48 N 0.60 0.72 3.78 5.82 0.00 -0.30 -4.62 105.19 111.18 1qbi n GLY 48 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1qbi n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbi s LYS 49 N -0.25 3.86 -0.22 1.61 1.02 -1.22 -0.49 119.74 124.06 1qbi s LYS 49 Ca 0.00 1.60 0.02 0.00 0.02 0.00 0.00 55.97 57.60 1qbi s LYS 49 Cb 0.00 -2.36 0.04 0.00 -0.52 0.00 0.00 37.83 35.00 1qbi s LYS 49 CO 0.00 -0.42 -0.13 0.42 -0.92 0.00 0.00 175.35 174.30 1qbi s ILE 50 N -1.68 1.95 0.13 2.17 1.01 0.86 -0.34 121.20 125.29 1qbi s ILE 50 Ca 0.63 -1.25 0.05 0.00 0.00 0.00 0.00 60.65 60.08 1qbi s ILE 50 Cb -0.24 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1qbi s ILE 50 CO 0.29 0.17 0.04 -0.76 0.00 0.00 0.00 174.94 174.68 1qbi s LEU 51 N 1.25 3.54 -0.10 2.97 1.43 0.56 -0.30 118.68 128.03 1qbi s LEU 51 Ca -0.03 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 1qbi s LEU 51 Cb -0.17 -2.21 0.02 0.00 0.03 0.00 0.00 46.19 43.85 1qbi s LEU 51 CO -0.08 0.13 -0.13 -0.60 0.23 0.00 0.00 176.35 175.90 1qbi s ARG 52 N -2.68 1.94 -0.07 1.70 3.52 -0.14 -0.51 118.95 122.71 1qbi s ARG 52 Ca 0.28 -0.46 0.05 0.00 -0.13 0.00 0.00 55.73 55.47 1qbi s ARG 52 Cb -0.11 -1.71 -0.01 0.00 -1.56 0.00 0.00 34.95 31.56 1qbi s ARG 52 CO 0.20 -0.10 -0.25 0.08 -0.81 0.00 0.00 175.30 174.43 1qbi s VAL 53 N 1.09 2.06 -0.28 7.11 1.01 0.14 -1.38 120.40 130.16 1qbi s VAL 53 Ca -0.05 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.59 1qbi s VAL 53 Cb -0.14 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.48 1qbi s VAL 53 CO -0.02 0.57 1.30 0.21 0.00 0.00 0.00 175.10 177.15 1qbi s ASN 54 N 0.04 6.71 0.54 3.32 2.47 0.38 -1.07 114.94 127.32 1qbi s ASN 54 Ca -0.10 1.29 0.21 0.00 0.42 0.00 0.00 52.86 54.68 1qbi s ASN 54 Cb -0.15 -2.54 1.39 0.00 -1.45 0.00 0.00 41.25 38.50 1qbi s ASN 54 CO 0.06 -1.03 2.12 -0.65 -3.72 0.00 0.00 177.10 173.88 1qbi h PRO 55 N 9.13 0.00 0.00 0.43 0.11 -1.90 0.13 132.00 139.90 1qbi h PRO 55 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.82 1qbi h PRO 55 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1qbi h PRO 55 CO 1.02 0.00 -0.17 1.49 -0.21 0.00 0.00 178.00 180.13 1qbi h GLU 56 N 0.00 0.00 0.00 1.05 4.81 -1.94 -3.40 114.58 115.10 1qbi h GLU 56 Ca 0.06 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.14 1qbi h GLU 56 Cb 0.26 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1qbi h GLU 56 CO -0.00 0.84 -1.72 -1.13 -0.73 0.00 0.00 179.01 176.27 1qbi n SER 57 N -4.61 0.48 0.00 1.04 3.41 -1.22 -4.98 113.62 107.74 1qbi n SER 57 Ca -0.11 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1qbi n SER 57 Cb 0.44 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.18 1qbi n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qbi n GLY 58 N 1.42 0.75 3.76 5.00 0.00 0.45 -5.01 105.19 111.56 1qbi n GLY 58 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 1qbi n GLY 58 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qbi s SER 59 N -2.48 5.59 0.03 1.61 1.04 -1.26 -4.67 113.70 113.57 1qbi s SER 59 Ca 0.00 2.31 0.01 0.00 0.48 0.00 0.00 55.95 58.75 1qbi s SER 59 Cb 0.00 -2.59 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 1qbi s SER 59 CO 0.00 -1.31 -0.06 0.54 0.98 0.00 0.00 173.24 173.39 1qbi s VAL 60 N -1.64 0.38 0.00 5.02 0.11 -1.26 -0.47 120.40 122.54 1qbi s VAL 60 Ca 0.73 -0.93 0.02 0.00 -2.93 0.00 0.00 61.98 58.86 1qbi s VAL 60 Cb -0.28 -0.46 -0.01 0.00 -1.53 0.00 0.00 36.38 34.10 1qbi s VAL 60 CO 0.32 -0.37 -0.07 -0.75 -3.33 0.00 0.00 175.10 170.90 1qbi s LYS 61 N -1.39 0.51 -0.45 1.54 2.20 -0.48 -4.99 119.74 116.69 1qbi s LYS 61 Ca -0.11 -0.31 -0.25 0.00 -0.36 0.00 0.00 55.97 54.94 1qbi s LYS 61 Cb -0.09 -0.47 0.03 0.00 -1.51 0.00 0.00 37.83 35.79 1qbi s LYS 61 CO -0.00 0.12 0.91 0.99 -0.36 0.00 0.00 175.35 177.01 1qbi s THR 62 N -0.34 4.50 0.08 3.43 2.01 -1.26 -0.96 115.64 123.09 1qbi s THR 62 Ca 0.01 0.75 -0.14 0.00 0.31 0.00 0.00 61.69 62.61 1qbi s THR 62 Cb -0.04 -4.41 -0.19 0.00 0.01 0.00 0.00 72.50 67.87 1qbi s THR 62 CO -0.00 -0.79 1.23 0.58 -0.69 0.00 0.00 174.62 174.95 1qbi h VAL 63 N 6.04 1.30 -2.33 3.82 2.07 -0.96 -3.48 116.25 122.71 1qbi h VAL 63 Ca -0.24 -2.06 0.02 0.00 0.82 0.00 0.00 66.70 65.24 1qbi h VAL 63 Cb 1.08 2.21 -0.16 0.00 -1.52 0.00 0.00 31.29 32.89 1qbi h VAL 63 CO 1.01 0.64 0.33 0.12 0.02 0.00 0.00 177.57 179.70 1qbi s PHE 64 N -3.54 -0.49 -0.22 1.57 5.36 -1.17 -4.39 117.98 115.10 1qbi s PHE 64 Ca -0.11 0.55 0.01 0.00 -0.96 0.00 0.00 56.93 56.42 1qbi s PHE 64 Cb 0.07 0.50 0.05 0.00 -0.34 0.00 0.00 43.02 43.30 1qbi s PHE 64 CO 0.90 -0.63 -0.07 -1.14 -1.46 0.00 0.00 175.22 172.82 1qbi s GLN 65 N -2.53 1.71 -0.14 10.12 0.74 -1.26 -0.10 119.66 128.21 1qbi s GLN 65 Ca -0.01 -0.92 -0.29 0.00 0.05 0.00 0.00 55.36 54.19 1qbi s GLN 65 Cb -0.01 -2.50 -0.05 0.00 1.10 0.00 0.00 33.01 31.55 1qbi s GLN 65 CO -0.04 -0.54 1.83 0.08 -0.55 0.00 0.00 175.29 176.07 1qbi s VAL 66 N 1.41 3.37 0.58 1.34 1.01 0.36 -4.94 120.40 123.54 1qbi s VAL 66 Ca -0.04 0.42 -0.19 0.00 0.00 0.00 0.00 61.98 62.17 1qbi s VAL 66 Cb -0.18 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1qbi s VAL 66 CO -0.07 -0.13 1.20 -2.16 0.00 0.00 0.00 175.10 173.94 1qbi s PRO 67 N 4.90 3.05 -2.06 2.72 0.05 -1.26 -3.73 135.00 138.66 1qbi s PRO 67 Ca 0.82 1.81 0.00 0.00 0.05 0.00 0.00 61.00 63.68 1qbi s PRO 67 Cb -0.32 -1.96 0.00 0.00 0.05 0.00 0.00 34.50 32.27 1qbi s PRO 67 CO 0.34 -1.14 0.00 0.39 0.05 0.00 0.00 177.00 176.63 1qbi n GLU 68 N -1.50 -1.41 -1.84 4.56 1.02 -1.26 -4.96 120.64 115.25 1qbi n GLU 68 Ca 0.13 1.17 -0.41 0.00 -0.02 0.00 0.00 57.16 58.03 1qbi n GLU 68 Cb 0.50 -5.55 -0.02 0.00 -0.02 0.00 0.00 31.44 26.35 1qbi n GLU 68 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qbi s ILE 69 N -2.77 2.20 -0.15 -3.67 -1.09 -1.24 -4.55 121.20 109.93 1qbi s ILE 69 Ca 0.00 0.17 -0.03 0.00 -2.23 0.00 0.00 60.65 58.56 1qbi s ILE 69 Cb 0.00 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 1qbi s ILE 69 CO 0.00 0.03 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.01 1qbi s VAL 70 N -0.17 3.91 -0.03 2.92 1.01 -0.15 -5.00 120.40 122.89 1qbi s VAL 70 Ca 0.61 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 1qbi s VAL 70 Cb -0.46 -2.70 0.01 0.00 0.00 0.00 0.00 36.38 33.22 1qbi s VAL 70 CO 0.49 0.51 0.07 0.21 0.00 0.00 0.00 175.10 176.38 1qbi s ASN 71 N 0.22 -0.07 -0.16 3.32 2.47 -1.26 -2.77 114.94 116.68 1qbi s ASN 71 Ca -0.02 0.13 -0.07 0.00 0.42 0.00 0.00 52.86 53.32 1qbi s ASN 71 Cb -0.14 0.15 -0.04 0.00 -1.45 0.00 0.00 41.25 39.77 1qbi s ASN 71 CO 0.03 -0.03 0.09 -1.81 -3.72 0.00 0.00 177.10 171.65 1qbi s ASP 72 N 0.01 5.88 0.51 -4.21 1.11 -1.26 -4.98 116.67 113.72 1qbi s ASP 72 Ca -0.00 0.21 0.22 0.00 0.18 0.00 0.00 52.55 53.16 1qbi s ASP 72 Cb -0.01 -1.95 1.31 0.00 1.07 0.00 0.00 42.92 43.34 1qbi s ASP 72 CO 0.00 0.26 2.01 0.00 1.18 0.00 0.00 175.17 178.61 1qbi h ALA 73 N 6.10 2.35 -0.57 5.23 0.00 -2.01 0.17 119.26 130.53 1qbi h ALA 73 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1qbi h ALA 73 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1qbi h ALA 73 CO 0.67 -0.49 0.00 -0.40 0.00 0.00 0.00 179.25 179.03 1qbi n ASP 74 N -4.42 3.09 -4.71 0.00 5.75 -1.26 -4.97 116.55 110.03 1qbi n ASP 74 Ca 0.09 -1.99 -0.31 0.00 -0.01 0.00 0.00 54.79 52.56 1qbi n ASP 74 Cb 0.51 -0.38 -0.09 0.00 -1.03 0.00 0.00 41.12 40.14 1qbi n ASP 74 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1qbi s GLY 75 N -1.03 2.80 -0.07 6.12 0.00 0.58 -5.00 107.32 110.73 1qbi s GLY 75 Ca 0.39 -1.16 0.16 0.00 0.00 0.00 0.00 44.72 44.10 1qbi s GLY 75 CO 0.27 -2.15 1.45 -1.06 0.00 0.00 0.00 173.10 171.60 1qbi n GLN 76 N -1.16 3.15 -2.53 2.90 1.13 0.11 -4.75 117.38 116.22 1qbi n GLN 76 Ca -0.13 -2.55 -0.23 0.00 -1.94 0.00 0.00 57.00 52.15 1qbi n GLN 76 Cb 0.67 -1.62 0.06 0.00 0.11 0.00 0.00 30.24 29.47 1qbi n GLN 76 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1qbi s ASN 77 N -1.14 4.92 0.00 1.08 2.20 -1.26 -4.70 114.94 116.04 1qbi s ASN 77 Ca 0.39 -0.02 0.00 0.00 -0.94 0.00 0.00 52.86 52.29 1qbi s ASN 77 Cb 0.25 -0.68 0.00 0.00 -2.00 0.00 0.00 41.25 38.82 1qbi s ASN 77 CO 0.20 -1.44 0.00 0.61 -2.94 0.00 0.00 177.10 173.53 1qbi n GLY 78 N -2.60 0.31 3.64 0.45 0.00 -1.12 -4.62 105.19 101.25 1qbi n GLY 78 Ca 0.10 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 1qbi n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qbi s LEU 79 N 0.00 4.08 0.00 0.99 2.96 0.39 -0.32 118.68 126.77 1qbi s LEU 79 Ca 0.00 0.92 0.00 0.00 -0.22 0.00 0.00 54.13 54.83 1qbi s LEU 79 Cb 0.00 -3.07 0.00 0.00 0.50 0.00 0.00 46.19 43.62 1qbi s LEU 79 CO 0.00 -0.46 0.00 0.18 -1.32 0.00 0.00 176.35 174.75 1qbi n LEU 80 N 5.85 0.00 -4.77 -0.68 4.77 0.26 -4.39 117.00 118.05 1qbi n LEU 80 Ca 0.03 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.61 1qbi n LEU 80 Cb 0.48 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1qbi n LEU 80 CO 0.46 0.00 1.05 -0.83 -1.33 0.00 0.00 177.39 176.73 1qbi s GLY 81 N -1.96 2.92 -0.27 -0.72 0.00 -0.67 -4.76 107.32 101.87 1qbi s GLY 81 Ca 0.00 1.41 -0.11 0.00 0.00 0.00 0.00 44.72 46.03 1qbi s GLY 81 CO 0.00 2.02 0.60 -0.12 0.00 0.00 0.00 173.10 175.60 1qbi s PHE 82 N -1.21 -1.15 0.03 1.90 5.36 -1.24 -1.94 117.98 119.73 1qbi s PHE 82 Ca 0.60 2.09 -0.24 0.00 -0.96 0.00 0.00 56.93 58.41 1qbi s PHE 82 Cb -0.42 0.65 0.06 0.00 -0.34 0.00 0.00 43.02 42.96 1qbi s PHE 82 CO 0.55 -0.59 0.55 0.00 -1.46 0.00 0.00 175.22 174.27 1qbi s ALA 83 N 2.51 -1.41 0.12 11.12 0.00 -0.04 -4.72 121.76 129.33 1qbi s ALA 83 Ca -0.06 0.74 -0.00 0.00 0.00 0.00 0.00 51.96 52.64 1qbi s ALA 83 Cb -0.10 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 1qbi s ALA 83 CO -0.18 -0.48 0.29 -0.06 0.00 0.00 0.00 175.76 175.33 1qbi s PHE 84 N -2.17 3.50 0.32 0.00 0.40 -1.26 -0.36 117.98 118.41 1qbi s PHE 84 Ca -0.07 0.29 -0.29 0.00 -0.60 0.00 0.00 56.93 56.26 1qbi s PHE 84 Cb -0.01 -1.80 -0.11 0.00 0.51 0.00 0.00 43.02 41.62 1qbi s PHE 84 CO 0.01 0.51 1.47 -1.58 0.70 0.00 0.00 175.22 176.33 1qbi s HIS 85 N -1.65 2.81 0.49 0.36 5.65 -0.13 -4.83 115.29 117.99 1qbi s HIS 85 Ca 0.37 1.08 0.31 0.00 0.25 0.00 0.00 55.06 57.07 1qbi s HIS 85 Cb -0.12 -3.92 1.72 0.00 -1.18 0.00 0.00 32.58 29.08 1qbi s HIS 85 CO 0.28 -2.86 2.17 -1.00 -0.65 0.00 0.00 174.74 172.68 1qbi h PRO 86 N 4.01 0.00 -2.29 2.88 0.13 -1.91 -2.96 132.00 131.85 1qbi h PRO 86 Ca -0.48 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.01 1qbi h PRO 86 Cb 1.23 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.96 1qbi h PRO 86 CO 0.71 0.06 -0.32 -3.47 -0.23 0.00 0.00 178.00 174.74 1qbi n ASP 87 N -3.58 4.84 -0.14 1.44 2.03 -1.26 -4.90 116.55 114.97 1qbi n ASP 87 Ca -0.02 -3.62 -0.01 0.00 0.52 0.00 0.00 54.79 51.66 1qbi n ASP 87 Cb 0.17 -0.70 0.24 0.00 -0.72 0.00 0.00 41.12 40.11 1qbi n ASP 87 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1qbi h PHE 88 N 3.53 0.84 -0.92 -0.67 3.57 -1.65 0.54 116.94 122.18 1qbi h PHE 88 Ca 0.21 -0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.82 1qbi h PHE 88 Cb 0.52 -0.26 -0.07 0.00 2.79 0.00 0.00 35.95 38.92 1qbi h PHE 88 CO 0.89 0.61 0.59 0.87 -2.23 0.00 0.00 178.31 179.05 1qbi h LYS 89 N 0.85 0.75 -0.00 1.11 1.57 -1.90 -2.39 116.57 116.55 1qbi h LYS 89 Ca 0.21 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1qbi h LYS 89 Cb 0.09 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1qbi h LYS 89 CO -0.03 0.49 -0.77 0.09 -0.57 0.00 0.00 179.45 178.67 1qbi n ASN 90 N -4.58 0.91 -3.19 0.86 4.13 -0.98 -4.71 115.26 107.70 1qbi n ASN 90 Ca 0.18 -0.96 -0.21 0.00 1.68 0.00 0.00 54.58 55.27 1qbi n ASN 90 Cb 0.44 0.94 -0.06 0.00 -1.54 0.00 0.00 39.78 39.56 1qbi n ASN 90 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1qbi n ASN 91 N -1.27 -1.04 -3.33 6.41 3.02 0.14 -5.05 115.26 114.15 1qbi n ASN 91 Ca 0.04 -2.61 -0.31 0.00 -0.03 0.00 0.00 54.58 51.67 1qbi n ASN 91 Cb 0.28 0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.44 1qbi n ASN 91 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1qbi n PRO 92 N 2.44 2.42 -4.68 3.52 -0.04 -0.94 -3.97 135.00 133.75 1qbi n PRO 92 Ca 0.24 -1.79 -0.32 0.00 -0.04 0.00 0.00 63.50 61.60 1qbi n PRO 92 Cb 0.52 -2.68 -0.12 0.00 -0.04 0.00 0.00 33.50 31.18 1qbi n PRO 92 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1qbi s TYR 93 N 3.38 2.68 -0.09 0.54 1.51 -1.26 0.41 117.35 124.52 1qbi s TYR 93 Ca 0.50 -0.18 0.04 0.00 -1.01 0.00 0.00 57.07 56.42 1qbi s TYR 93 Cb 0.13 -1.55 -0.00 0.00 -0.11 0.00 0.00 41.96 40.43 1qbi s TYR 93 CO -0.02 0.26 -0.24 0.42 -1.11 0.00 0.00 175.55 174.86 1qbi s ILE 94 N -0.89 2.10 -0.14 2.71 1.01 -0.45 -0.96 121.20 124.59 1qbi s ILE 94 Ca 0.14 -1.01 -0.02 0.00 0.00 0.00 0.00 60.65 59.76 1qbi s ILE 94 Cb -0.11 -1.79 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1qbi s ILE 94 CO 0.05 0.56 -0.06 -0.31 0.00 0.00 0.00 174.94 175.18 1qbi s TYR 95 N 0.24 2.97 0.23 3.97 1.51 0.52 -0.05 117.35 126.73 1qbi s TYR 95 Ca -0.16 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 55.61 1qbi s TYR 95 Cb -0.17 -1.90 -0.05 0.00 -0.11 0.00 0.00 41.96 39.73 1qbi s TYR 95 CO 0.08 -0.01 0.02 0.96 -1.11 0.00 0.00 175.55 175.49 1qbi s ILE 96 N 0.18 0.86 0.09 2.71 -5.25 0.55 -0.86 121.20 119.47 1qbi s ILE 96 Ca -0.03 -2.01 0.06 0.00 -0.99 0.00 0.00 60.65 57.68 1qbi s ILE 96 Cb -0.14 -2.37 -0.03 0.00 2.95 0.00 0.00 42.46 42.87 1qbi s ILE 96 CO 0.03 -0.28 -0.17 -0.94 -1.79 0.00 0.00 174.94 171.80 1qbi s SER 97 N -3.28 2.00 0.17 4.36 1.04 -0.82 -0.04 113.70 117.13 1qbi s SER 97 Ca 0.30 -0.65 -0.22 0.00 0.48 0.00 0.00 55.95 55.85 1qbi s SER 97 Cb 0.06 -0.08 0.06 0.00 0.10 0.00 0.00 66.02 66.16 1qbi s SER 97 CO 0.09 -0.03 0.60 -0.83 0.98 0.00 0.00 173.24 174.04 1qbi s GLY 98 N -1.84 -0.55 -0.22 7.32 0.00 -0.51 -0.57 107.32 110.94 1qbi s GLY 98 Ca 0.02 0.39 -0.24 0.00 0.00 0.00 0.00 44.72 44.89 1qbi s GLY 98 CO 0.03 0.11 0.79 -1.59 0.00 0.00 0.00 173.10 172.43 1qbi s THR 99 N -3.77 4.88 0.12 0.90 2.01 0.56 -0.94 115.64 119.40 1qbi s THR 99 Ca 0.02 1.49 0.05 0.00 0.31 0.00 0.00 61.69 63.56 1qbi s THR 99 Cb -0.01 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 1qbi s THR 99 CO -0.11 -0.02 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.31 1qbi s PHE 100 N 2.57 1.29 0.44 4.92 0.40 0.61 -0.98 117.98 127.23 1qbi s PHE 100 Ca 0.34 -0.60 -0.25 0.00 -0.60 0.00 0.00 56.93 55.82 1qbi s PHE 100 Cb -0.16 -0.68 -0.09 0.00 0.51 0.00 0.00 43.02 42.61 1qbi s PHE 100 CO 0.09 0.10 1.33 1.17 0.70 0.00 0.00 175.22 178.61 1qbi n LYS 101 N 0.50 2.03 -3.46 0.44 4.81 -1.26 0.04 118.16 121.25 1qbi n LYS 101 Ca -0.15 0.72 -0.43 0.00 -0.87 0.00 0.00 58.31 57.58 1qbi n LYS 101 Cb 0.57 -2.48 -0.09 0.00 0.02 0.00 0.00 35.03 33.05 1qbi n LYS 101 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1qbi s ASN 102 N -0.53 6.01 0.48 3.14 2.47 0.15 -4.58 114.94 122.08 1qbi s ASN 102 Ca 0.62 -1.21 0.33 0.00 0.42 0.00 0.00 52.86 53.01 1qbi s ASN 102 Cb -0.48 -2.13 1.67 0.00 -1.45 0.00 0.00 41.25 38.86 1qbi s ASN 102 CO 0.57 -0.55 1.99 1.55 -3.72 0.00 0.00 177.10 176.94 1qbi h PRO 103 N 8.63 0.00 0.00 0.43 0.13 -1.98 -3.45 132.00 135.76 1qbi h PRO 103 Ca -0.27 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.79 1qbi h PRO 103 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1qbi h PRO 103 CO 0.80 0.00 -1.02 0.87 -0.23 0.00 0.00 178.00 178.42 1qbi h LYS 104 N 0.00 0.00 -0.00 0.86 1.57 -2.02 -3.55 116.57 113.43 1qbi h LYS 104 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1qbi h LYS 104 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1qbi h LYS 104 CO 0.00 0.16 -0.49 -0.35 -0.57 0.00 0.00 179.45 178.20 1qbi n PRO 111 N -2.85 0.29 -4.04 3.15 -0.04 -1.26 -5.23 135.00 125.02 1qbi n PRO 111 Ca -0.03 -0.18 -0.24 0.00 -0.04 0.00 0.00 63.50 63.01 1qbi n PRO 111 Cb 0.68 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.57 1qbi n PRO 111 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1qbi s ASN 112 N -2.84 4.54 0.20 3.54 0.01 -1.26 0.34 114.94 119.46 1qbi s ASN 112 Ca 0.15 -1.00 0.02 0.00 -0.71 0.00 0.00 52.86 51.31 1qbi s ASN 112 Cb 0.18 -0.51 -0.05 0.00 0.41 0.00 0.00 41.25 41.28 1qbi s ASN 112 CO 0.66 -0.54 0.04 0.00 -1.51 0.00 0.00 177.10 175.75 1qbi s GLN 113 N -3.93 1.21 -0.12 -0.60 -2.07 0.11 -4.26 119.66 110.00 1qbi s GLN 113 Ca 0.42 -1.61 -0.03 0.00 -1.82 0.00 0.00 55.36 52.32 1qbi s GLN 113 Cb 0.02 -0.25 -0.03 0.00 -1.09 0.00 0.00 33.01 31.66 1qbi s GLN 113 CO 0.23 -0.19 -0.01 0.99 -1.32 0.00 0.00 175.29 174.99 1qbi s THR 114 N -3.70 4.15 -0.07 3.63 2.01 0.86 -0.28 115.64 122.23 1qbi s THR 114 Ca 0.29 -0.29 0.04 0.00 0.31 0.00 0.00 61.69 62.04 1qbi s THR 114 Cb 0.07 -2.78 0.00 0.00 0.01 0.00 0.00 72.50 69.80 1qbi s THR 114 CO 0.07 0.54 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.73 1qbi s ILE 115 N -0.25 1.63 -0.25 1.82 1.01 -0.11 -1.98 121.20 123.07 1qbi s ILE 115 Ca 0.05 -0.79 -0.16 0.00 0.00 0.00 0.00 60.65 59.76 1qbi s ILE 115 Cb -0.12 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1qbi s ILE 115 CO 0.02 0.46 0.41 -0.63 0.00 0.00 0.00 174.94 175.20 1qbi s ILE 116 N 0.33 5.16 0.01 2.92 1.01 0.14 -1.43 121.20 129.35 1qbi s ILE 116 Ca -0.13 0.67 0.04 0.00 0.00 0.00 0.00 60.65 61.22 1qbi s ILE 116 Cb -0.16 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.57 1qbi s ILE 116 CO 0.05 0.16 -0.12 -0.60 0.00 0.00 0.00 174.94 174.44 1qbi s ARG 117 N 1.96 0.86 -0.05 2.79 3.52 0.94 -0.24 118.95 128.72 1qbi s ARG 117 Ca 0.17 -0.55 -0.03 0.00 -0.13 0.00 0.00 55.73 55.19 1qbi s ARG 117 Cb -0.15 -0.83 -0.04 0.00 -1.56 0.00 0.00 34.95 32.37 1qbi s ARG 117 CO 0.09 0.22 0.12 0.50 -0.81 0.00 0.00 175.30 175.41 1qbi s ARG 118 N -0.68 3.27 0.19 5.12 3.52 0.50 -0.33 118.95 130.54 1qbi s ARG 118 Ca 0.02 -0.33 0.10 0.00 -0.13 0.00 0.00 55.73 55.39 1qbi s ARG 118 Cb -0.06 -3.01 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 1qbi s ARG 118 CO 0.00 0.70 -0.20 0.71 -0.81 0.00 0.00 175.30 175.71 1qbi s TYR 119 N -1.15 1.99 -0.18 5.12 1.51 0.92 -0.32 117.35 125.25 1qbi s TYR 119 Ca 0.21 -0.43 -0.06 0.00 -1.01 0.00 0.00 57.07 55.78 1qbi s TYR 119 Cb -0.12 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 40.73 1qbi s TYR 119 CO 0.11 0.43 0.02 0.99 -1.11 0.00 0.00 175.55 175.99 1qbi s THR 120 N -2.10 4.39 0.04 -0.71 2.01 0.54 -1.33 115.64 118.48 1qbi s THR 120 Ca 0.19 -0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.73 1qbi s THR 120 Cb -0.06 -2.96 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 1qbi s THR 120 CO 0.09 0.47 0.91 -0.47 -0.69 0.00 0.00 174.62 174.92 1qbi s TYR 121 N 0.44 3.72 -0.38 4.92 5.04 0.17 -0.67 117.35 130.58 1qbi s TYR 121 Ca 0.00 1.66 -0.06 0.00 -2.44 0.00 0.00 57.07 56.23 1qbi s TYR 121 Cb -0.13 -3.02 0.07 0.00 0.35 0.00 0.00 41.96 39.23 1qbi s TYR 121 CO 0.01 0.13 0.18 1.21 -1.34 0.00 0.00 175.55 175.74 1qbi s ASN 122 N 0.44 5.40 0.35 4.32 3.84 0.08 -4.88 114.94 124.49 1qbi s ASN 122 Ca 0.47 -1.50 0.09 0.00 0.21 0.00 0.00 52.86 52.12 1qbi s ASN 122 Cb -0.21 -1.90 0.65 0.00 -0.55 0.00 0.00 41.25 39.24 1qbi s ASN 122 CO 0.27 -0.46 1.83 0.50 -2.79 0.00 0.00 177.10 176.45 1qbi h LYS 123 N 8.24 0.22 -0.03 0.43 1.63 -1.96 0.26 116.57 125.37 1qbi h LYS 123 Ca -0.21 -0.07 -0.15 0.00 -0.85 0.00 0.00 60.65 59.38 1qbi h LYS 123 Cb 1.07 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.67 1qbi h LYS 123 CO 0.68 0.47 -0.64 0.66 -3.45 0.00 0.00 179.45 177.17 1qbi h SER 124 N 0.20 0.15 -0.01 4.20 4.64 -1.96 -3.13 113.55 117.65 1qbi h SER 124 Ca 0.03 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1qbi h SER 124 Cb 0.56 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1qbi h SER 124 CO 0.04 0.75 -0.17 0.35 -0.87 0.00 0.00 176.83 176.93 1qbi n THR 125 N -3.81 0.00 -3.68 2.95 -2.24 -1.20 -5.02 114.28 101.27 1qbi n THR 125 Ca -0.02 -0.41 -0.31 0.00 -2.27 0.00 0.00 64.05 61.03 1qbi n THR 125 Cb 0.64 1.17 0.04 0.00 -2.10 0.00 0.00 70.33 70.08 1qbi n THR 125 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1qbi n ASP 126 N 0.03 -5.26 -3.30 3.42 2.03 0.89 -4.99 116.55 109.37 1qbi n ASP 126 Ca 0.05 -1.02 -0.12 0.00 0.52 0.00 0.00 54.79 54.23 1qbi n ASP 126 Cb 0.26 -3.38 -0.02 0.00 -0.72 0.00 0.00 41.12 37.25 1qbi n ASP 126 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1qbi s THR 127 N -3.47 0.00 -0.03 5.18 -1.32 -0.98 -4.79 115.64 110.22 1qbi s THR 127 Ca 0.47 -1.36 -0.01 0.00 -1.21 0.00 0.00 61.69 59.58 1qbi s THR 127 Cb -0.17 -2.61 -0.04 0.00 -1.51 0.00 0.00 72.50 68.17 1qbi s THR 127 CO 0.86 0.00 0.07 -0.76 -2.21 0.00 0.00 174.62 172.58 1qbi s LEU 128 N -3.14 3.88 0.37 9.08 1.02 -1.26 -0.74 118.68 127.88 1qbi s LEU 128 Ca 0.24 0.17 -0.04 0.00 0.02 0.00 0.00 54.13 54.52 1qbi s LEU 128 Cb -0.02 -2.16 0.01 0.00 0.02 0.00 0.00 46.19 44.04 1qbi s LEU 128 CO 0.15 0.30 0.54 -1.83 0.02 0.00 0.00 176.35 175.53 1qbi s GLU 129 N -1.51 2.03 -1.13 1.70 -1.05 0.15 -4.93 118.70 113.96 1qbi s GLU 129 Ca 0.20 -1.76 -0.21 0.00 -0.15 0.00 0.00 54.97 53.05 1qbi s GLU 129 Cb -0.12 0.48 -0.01 0.00 -0.44 0.00 0.00 34.13 34.04 1qbi s GLU 129 CO 0.11 -0.86 0.80 1.63 0.95 0.00 0.00 175.26 177.89 1qbi n LYS 130 N -0.59 -1.22 -1.84 -4.83 5.02 -1.26 -0.34 118.16 113.09 1qbi n LYS 130 Ca -0.00 0.47 -0.42 0.00 -2.02 0.00 0.00 58.31 56.34 1qbi n LYS 130 Cb 0.61 -4.15 -0.02 0.00 -0.02 0.00 0.00 35.03 31.45 1qbi n LYS 130 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1qbi s PRO 131 N -5.94 4.17 -0.11 1.97 0.04 -1.26 -4.27 135.00 129.59 1qbi s PRO 131 Ca 0.48 2.50 -0.00 0.00 0.04 0.00 0.00 61.00 64.01 1qbi s PRO 131 Cb -0.17 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1qbi s PRO 131 CO 0.86 -0.59 -0.09 0.08 0.04 0.00 0.00 177.00 177.30 1qbi s VAL 132 N 0.22 1.13 -0.44 -0.36 1.01 0.56 -4.98 120.40 117.54 1qbi s VAL 132 Ca 0.64 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.97 1qbi s VAL 132 Cb -0.46 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 34.82 1qbi s VAL 132 CO 0.44 0.38 1.18 -1.81 0.00 0.00 0.00 175.10 175.29 1qbi s ASP 133 N 1.57 6.62 0.00 3.32 1.11 -1.26 -0.37 116.67 127.67 1qbi s ASP 133 Ca 0.03 0.63 -0.18 0.00 0.18 0.00 0.00 52.55 53.21 1qbi s ASP 133 Cb -0.13 -2.55 -0.31 0.00 1.07 0.00 0.00 42.92 41.00 1qbi s ASP 133 CO -0.08 -1.23 1.00 -0.07 1.18 0.00 0.00 175.17 175.97 1qbi h LEU 134 N 11.24 0.69 -6.93 1.23 3.38 -0.91 -3.46 115.31 120.55 1qbi h LEU 134 Ca -0.24 -0.89 -0.22 0.00 0.09 0.00 0.00 57.88 56.63 1qbi h LEU 134 Cb 1.07 -0.22 -0.32 0.00 0.09 0.00 0.00 40.66 41.28 1qbi h LEU 134 CO 1.11 1.52 -0.53 -0.22 0.09 0.00 0.00 178.44 180.41 1qbi s LEU 135 N -7.85 -0.36 0.48 1.67 2.96 -0.89 -4.31 118.68 110.38 1qbi s LEU 135 Ca -0.11 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.19 1qbi s LEU 135 Cb 0.03 0.77 -0.03 0.00 0.50 0.00 0.00 46.19 47.47 1qbi s LEU 135 CO 0.89 -0.27 0.10 0.00 -1.32 0.00 0.00 176.35 175.75 1qbi s ALA 136 N 2.44 3.87 -0.67 5.97 0.00 -1.26 -0.69 121.76 131.43 1qbi s ALA 136 Ca 0.05 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.75 1qbi s ALA 136 Cb -0.14 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1qbi s ALA 136 CO -0.11 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 175.92 1qbi n GLY 137 N -1.28 0.86 3.81 0.00 0.00 -1.23 -4.95 105.19 102.40 1qbi n GLY 137 Ca -0.10 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 1qbi n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qbi s LEU 138 N -1.43 3.91 0.67 0.99 1.43 -0.84 -4.38 118.68 119.04 1qbi s LEU 138 Ca 0.00 1.83 -0.17 0.00 -1.03 0.00 0.00 54.13 54.76 1qbi s LEU 138 Cb 0.00 -4.52 -0.06 0.00 0.03 0.00 0.00 46.19 41.64 1qbi s LEU 138 CO 0.00 -0.56 0.51 -2.65 0.23 0.00 0.00 176.35 173.88 1qbi n PRO 139 N -0.74 0.39 -3.78 1.29 -0.02 -1.26 -0.10 135.00 130.77 1qbi n PRO 139 Ca 0.08 0.17 -0.13 0.00 -2.02 0.00 0.00 63.50 61.60 1qbi n PRO 139 Cb 0.53 -1.77 -0.10 0.00 -0.02 0.00 0.00 33.50 32.14 1qbi n PRO 139 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1qbi s SER 140 N -1.35 -0.19 0.24 2.55 0.15 -1.26 -3.67 113.70 110.18 1qbi s SER 140 Ca 0.67 0.19 -0.13 0.00 0.70 0.00 0.00 55.95 57.38 1qbi s SER 140 Cb -0.38 0.38 0.05 0.00 -1.71 0.00 0.00 66.02 64.36 1qbi s SER 140 CO 0.57 -0.33 0.65 -1.54 1.20 0.00 0.00 173.24 173.79 1qbi n SER 141 N 1.82 -1.57 -0.00 5.45 3.41 -1.26 -4.83 113.62 116.64 1qbi n SER 141 Ca -0.19 -2.01 0.13 0.00 -0.26 0.00 0.00 58.87 56.55 1qbi n SER 141 Cb 0.56 2.59 0.51 0.00 -0.26 0.00 0.00 64.21 67.62 1qbi n SER 141 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1qbi n LYS 142 N -0.45 0.02 -4.29 4.33 5.02 -1.26 -4.50 118.16 117.03 1qbi n LYS 142 Ca -0.05 -0.01 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 1qbi n LYS 142 Cb 0.44 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.83 1qbi n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qbi s ASP 143 N -2.98 2.49 -1.23 4.39 1.11 -1.26 0.07 116.67 119.25 1qbi s ASP 143 Ca 0.14 -0.76 -0.26 0.00 0.18 0.00 0.00 52.55 51.85 1qbi s ASP 143 Cb 0.19 -0.13 0.02 0.00 1.07 0.00 0.00 42.92 44.06 1qbi s ASP 143 CO 0.58 -0.00 0.64 1.41 1.18 0.00 0.00 175.17 178.98 1qbi n HIS 144 N 0.75 -1.55 0.00 4.23 8.25 -1.26 -3.28 115.22 122.36 1qbi n HIS 144 Ca -0.17 0.27 -0.10 0.00 -0.26 0.00 0.00 57.72 57.47 1qbi n HIS 144 Cb 0.55 -3.05 -0.14 0.00 1.12 0.00 0.00 29.99 28.48 1qbi n HIS 144 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1qbi h GLN 145 N -2.30 0.04 0.00 -0.41 1.08 -1.88 -2.22 115.11 109.42 1qbi h GLN 145 Ca -0.69 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 56.45 1qbi h GLN 145 Cb 1.39 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.84 1qbi h GLN 145 CO 0.53 0.69 0.00 0.43 -0.95 0.00 0.00 178.83 179.53 1qbi n SER 146 N -3.17 0.00 0.00 1.46 7.64 -1.26 -1.83 113.62 116.46 1qbi n SER 146 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1qbi n SER 146 Cb 1.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.23 1qbi n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qbi n GLY 147 N 0.00 0.45 3.72 0.23 0.00 0.10 -4.86 105.19 104.84 1qbi n GLY 147 Ca 0.00 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 1qbi n GLY 147 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qbi s ARG 148 N -2.00 4.45 -0.15 1.61 6.06 -1.24 -1.66 118.95 126.01 1qbi s ARG 148 Ca 0.00 1.80 0.00 0.00 -2.50 0.00 0.00 55.73 55.03 1qbi s ARG 148 Cb 0.00 -3.31 0.02 0.00 0.06 0.00 0.00 34.95 31.72 1qbi s ARG 148 CO 0.00 -0.20 -0.14 -1.17 -2.50 0.00 0.00 175.30 171.29 1qbi s LEU 149 N 0.66 1.75 0.09 -0.88 0.20 -1.26 -1.14 118.68 118.11 1qbi s LEU 149 Ca 0.57 -0.53 0.03 0.00 0.69 0.00 0.00 54.13 54.89 1qbi s LEU 149 Cb -0.30 -1.19 -0.04 0.00 -0.43 0.00 0.00 46.19 44.23 1qbi s LEU 149 CO 0.31 -0.06 -0.09 0.68 -0.29 0.00 0.00 176.35 176.90 1qbi s VAL 150 N 1.48 0.86 -0.25 1.68 -7.23 -0.19 -4.36 120.40 112.38 1qbi s VAL 150 Ca 0.04 -1.66 -0.07 0.00 -1.81 0.00 0.00 61.98 58.48 1qbi s VAL 150 Cb -0.13 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.41 1qbi s VAL 150 CO -0.11 -0.61 0.07 -0.63 -0.31 0.00 0.00 175.10 173.51 1qbi s ILE 151 N -2.62 4.29 0.90 -0.62 -1.09 -1.26 0.14 121.20 120.94 1qbi s ILE 151 Ca 0.06 -0.20 -0.14 0.00 -2.23 0.00 0.00 60.65 58.14 1qbi s ILE 151 Cb -0.02 -3.01 0.15 0.00 -1.58 0.00 0.00 42.46 38.00 1qbi s ILE 151 CO -0.01 0.33 1.23 -0.83 -1.23 0.00 0.00 174.94 174.44 1qbi s GLY 152 N 1.61 1.67 0.66 6.18 0.00 0.05 -4.89 107.32 112.60 1qbi s GLY 152 Ca 0.06 -0.89 0.41 0.00 0.00 0.00 0.00 44.72 44.30 1qbi s GLY 152 CO 0.03 -0.25 2.26 -0.56 0.00 0.00 0.00 173.10 174.58 1qbi h PRO 153 N -1.42 0.00 -0.08 2.90 0.13 -1.94 0.03 132.00 131.62 1qbi h PRO 153 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1qbi h PRO 153 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1qbi h PRO 153 CO 0.52 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.89 1qbi n ASP 154 N -3.02 1.09 -1.77 1.44 5.68 -1.26 -4.91 116.55 113.79 1qbi n ASP 154 Ca -0.03 -1.54 -0.15 0.00 -0.50 0.00 0.00 54.79 52.58 1qbi n ASP 154 Cb 0.14 -0.05 -0.00 0.00 -1.14 0.00 0.00 41.12 40.07 1qbi n ASP 154 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1qbi n GLN 155 N -0.09 -1.54 -4.26 0.11 1.13 -0.00 -5.00 117.38 107.73 1qbi n GLN 155 Ca 0.17 0.71 -0.30 0.00 -1.94 0.00 0.00 57.00 55.64 1qbi n GLN 155 Cb 0.25 -5.04 -0.10 0.00 0.11 0.00 0.00 30.24 25.47 1qbi n GLN 155 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1qbi s LYS 156 N -4.84 2.21 0.06 -1.09 -0.14 -1.26 -4.34 119.74 110.34 1qbi s LYS 156 Ca 0.03 -0.98 -0.28 0.00 -1.36 0.00 0.00 55.97 53.38 1qbi s LYS 156 Cb -0.01 -2.34 -0.05 0.00 -1.68 0.00 0.00 37.83 33.74 1qbi s LYS 156 CO 0.04 0.52 0.89 0.42 -0.76 0.00 0.00 175.35 176.46 1qbi s ILE 157 N -1.19 4.66 -0.18 2.17 1.01 0.30 -0.77 121.20 127.20 1qbi s ILE 157 Ca 0.21 1.91 -0.02 0.00 0.00 0.00 0.00 60.65 62.75 1qbi s ILE 157 Cb -0.11 -4.25 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 1qbi s ILE 157 CO 0.13 0.30 -0.09 -0.31 0.00 0.00 0.00 174.94 174.97 1qbi s TYR 158 N 0.20 2.89 -0.05 3.97 1.51 0.12 0.01 117.35 126.01 1qbi s TYR 158 Ca 0.45 -0.82 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1qbi s TYR 158 Cb -0.22 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.68 1qbi s TYR 158 CO 0.27 -0.39 -0.07 -0.47 -1.11 0.00 0.00 175.55 173.78 1qbi s TYR 159 N 0.92 0.92 -0.17 2.71 5.04 0.57 -1.02 117.35 126.32 1qbi s TYR 159 Ca -0.02 -0.28 -0.14 0.00 -2.44 0.00 0.00 57.07 54.20 1qbi s TYR 159 Cb -0.15 -0.75 -0.05 0.00 0.35 0.00 0.00 41.96 41.37 1qbi s TYR 159 CO 0.00 -0.20 0.28 0.95 -1.34 0.00 0.00 175.55 175.24 1qbi s THR 160 N 0.78 5.31 -0.20 4.34 -4.23 -0.29 0.76 115.64 122.11 1qbi s THR 160 Ca -0.12 0.52 -0.00 0.00 -1.18 0.00 0.00 61.69 60.90 1qbi s THR 160 Cb -0.14 -3.62 0.05 0.00 1.34 0.00 0.00 72.50 70.12 1qbi s THR 160 CO 0.01 0.37 -0.04 -0.51 -0.54 0.00 0.00 174.62 173.91 1qbi s ILE 161 N 0.59 1.20 1.29 2.99 2.07 0.17 0.03 121.20 129.54 1qbi s ILE 161 Ca 0.16 -0.86 -0.18 0.00 -1.41 0.00 0.00 60.65 58.36 1qbi s ILE 161 Cb -0.13 -1.45 0.33 0.00 0.13 0.00 0.00 42.46 41.33 1qbi s ILE 161 CO 0.04 -0.01 0.98 -0.83 -1.91 0.00 0.00 174.94 173.21 1qbi s GLY 162 N 1.57 1.48 -0.01 1.50 0.00 -0.76 0.34 107.32 111.44 1qbi s GLY 162 Ca -0.02 -0.51 0.03 0.00 0.00 0.00 0.00 44.72 44.22 1qbi s GLY 162 CO -0.07 0.36 1.00 2.09 0.00 0.00 0.00 173.10 176.48 1qbi n ASP 163 N -5.26 0.77 -0.01 1.64 5.75 0.67 -1.09 116.55 119.03 1qbi n ASP 163 Ca 0.08 -2.03 -0.00 0.00 -0.01 0.00 0.00 54.79 52.83 1qbi n ASP 163 Cb 0.57 -0.16 -0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1qbi n ASP 163 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1qbi n GLN 164 N -0.14 -1.29 -0.98 0.11 1.13 -0.84 -2.71 117.38 112.66 1qbi n GLN 164 Ca 0.04 0.33 0.00 0.00 -1.94 0.00 0.00 57.00 55.42 1qbi n GLN 164 Cb 0.15 -4.29 0.00 0.00 0.11 0.00 0.00 30.24 26.20 1qbi n GLN 164 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1qbi n GLY 165 N -0.43 0.54 3.75 1.08 0.00 -1.21 -4.28 105.19 104.65 1qbi n GLY 165 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1qbi n GLY 165 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qbi s ARG 166 N -0.02 4.16 0.00 1.61 0.52 -1.10 -2.41 118.95 121.71 1qbi s ARG 166 Ca 0.00 2.50 0.00 0.00 -0.52 0.00 0.00 55.73 57.71 1qbi s ARG 166 Cb 0.00 -3.03 0.00 0.00 0.52 0.00 0.00 34.95 32.44 1qbi s ARG 166 CO 0.00 -0.55 0.00 -1.71 0.02 0.00 0.00 175.30 173.06 1qbi n ASN 167 N 1.86 -2.08 -3.64 0.23 5.15 -0.50 -4.72 115.26 111.56 1qbi n ASN 167 Ca 0.06 0.00 -0.15 0.00 -0.60 0.00 0.00 54.58 53.90 1qbi n ASN 167 Cb 0.38 -0.44 -0.07 0.00 -0.53 0.00 0.00 39.78 39.13 1qbi n ASN 167 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1qbi s GLN 168 N -2.35 0.90 1.54 1.20 1.03 -1.01 -4.78 119.66 116.18 1qbi s GLN 168 Ca 0.00 -0.11 0.00 0.00 0.04 0.00 0.00 55.36 55.29 1qbi s GLN 168 Cb 0.00 0.41 0.00 0.00 0.03 0.00 0.00 33.01 33.45 1qbi s GLN 168 CO 0.00 -0.29 0.00 1.28 -2.54 0.00 0.00 175.29 173.74 1qbi n LEU 169 N 0.86 0.00 0.25 2.60 4.77 -1.26 -1.33 117.00 122.89 1qbi n LEU 169 Ca -0.20 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 55.96 1qbi n LEU 169 Cb 0.58 0.00 0.88 0.00 -2.33 0.00 0.00 43.42 42.55 1qbi n LEU 169 CO 0.22 0.00 1.01 0.00 -1.33 0.00 0.00 177.39 177.29 1qbi h ALA 170 N -0.19 1.00 -0.18 -1.18 0.00 -2.00 -1.58 119.26 115.12 1qbi h ALA 170 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1qbi h ALA 170 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1qbi h ALA 170 CO 0.00 0.00 -0.18 0.66 0.00 0.00 0.00 179.25 179.73 1qbi n TYR 171 N -2.71 0.58 -0.27 0.00 4.02 -0.44 -4.80 117.16 113.54 1qbi n TYR 171 Ca -0.02 -1.38 0.08 0.00 -0.01 0.00 0.00 57.90 56.57 1qbi n TYR 171 Cb 0.09 -0.34 0.22 0.00 -0.02 0.00 0.00 39.34 39.29 1qbi n TYR 171 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1qbi h LEU 172 N 0.95 0.09 -1.11 7.72 5.85 -0.49 -1.06 115.31 127.26 1qbi h LEU 172 Ca 0.09 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1qbi h LEU 172 Cb 1.33 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.55 1qbi h LEU 172 CO 0.19 -0.03 0.00 0.49 -0.34 0.00 0.00 178.44 178.75 1qbi n PHE 173 N -5.13 0.16 -3.20 1.25 3.01 -1.26 -3.51 117.46 108.78 1qbi n PHE 173 Ca 0.17 -0.08 -0.39 0.00 1.01 0.00 0.00 57.45 58.16 1qbi n PHE 173 Cb 0.52 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.94 1qbi n PHE 173 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1qbi s LEU 174 N -1.68 4.48 -0.12 4.37 1.43 -0.63 -4.01 118.68 122.51 1qbi s LEU 174 Ca 0.34 1.26 -0.29 0.00 -1.03 0.00 0.00 54.13 54.40 1qbi s LEU 174 Cb 0.18 -2.96 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 1qbi s LEU 174 CO 0.28 0.18 1.48 -2.16 0.23 0.00 0.00 176.35 176.36 1qbi s PRO 175 N -0.64 4.17 0.24 1.29 0.04 -1.26 -3.39 135.00 135.45 1qbi s PRO 175 Ca 0.31 1.90 -0.31 0.00 0.04 0.00 0.00 61.00 62.94 1qbi s PRO 175 Cb -0.19 -3.89 -0.13 0.00 0.04 0.00 0.00 34.50 30.33 1qbi s PRO 175 CO 0.19 -0.83 1.54 -1.71 0.04 0.00 0.00 177.00 176.23 1qbi n ASN 176 N 7.03 3.35 -0.82 6.66 2.85 -1.26 -4.90 115.26 128.16 1qbi n ASN 176 Ca 0.16 1.13 0.07 0.00 -0.11 0.00 0.00 54.58 55.83 1qbi n ASN 176 Cb 0.44 -1.51 0.20 0.00 1.24 0.00 0.00 39.78 40.15 1qbi n ASN 176 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1qbi n GLN 177 N 2.49 2.86 -0.18 1.20 1.13 -1.26 -4.62 117.38 119.01 1qbi n GLN 177 Ca 0.12 -2.23 0.18 0.00 -1.94 0.00 0.00 57.00 53.13 1qbi n GLN 177 Cb 0.33 -1.36 0.54 0.00 0.11 0.00 0.00 30.24 29.86 1qbi n GLN 177 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1qbi h ALA 178 N 2.56 2.24 0.00 -1.58 0.00 -1.84 0.56 119.26 121.21 1qbi h ALA 178 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qbi h ALA 178 Cb 0.82 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1qbi h ALA 178 CO 0.01 -0.48 -0.49 1.04 0.00 0.00 0.00 179.25 179.34 1qbi n GLN 179 N -4.46 0.06 -3.23 0.00 1.13 -1.26 -1.19 117.38 108.42 1qbi n GLN 179 Ca 0.16 0.02 -0.34 0.00 -1.94 0.00 0.00 57.00 54.90 1qbi n GLN 179 Cb 0.64 -1.53 -0.06 0.00 0.11 0.00 0.00 30.24 29.39 1qbi n GLN 179 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1qbi s HIS 180 N -3.03 3.51 0.11 1.08 3.76 0.19 -4.95 115.29 115.95 1qbi s HIS 180 Ca 0.10 1.16 0.03 0.00 -0.15 0.00 0.00 55.06 56.21 1qbi s HIS 180 Cb 0.17 -2.47 -0.04 0.00 1.11 0.00 0.00 32.58 31.35 1qbi s HIS 180 CO 0.69 0.27 -0.09 0.95 -0.85 0.00 0.00 174.74 175.71 1qbi s THR 181 N -1.71 0.93 0.41 1.30 -4.23 -1.26 -4.78 115.64 106.31 1qbi s THR 181 Ca 0.46 -1.79 -0.24 0.00 -1.18 0.00 0.00 61.69 58.94 1qbi s THR 181 Cb -0.13 -1.53 -0.09 0.00 1.34 0.00 0.00 72.50 72.09 1qbi s THR 181 CO 0.19 -0.67 1.07 -2.16 -0.54 0.00 0.00 174.62 172.52 1qbi s PRO 182 N -3.22 4.07 0.68 3.99 0.04 -1.26 -4.95 135.00 134.34 1qbi s PRO 182 Ca 0.09 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 1qbi s PRO 182 Cb 0.00 -2.49 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 1qbi s PRO 182 CO -0.01 -0.23 1.07 0.95 0.04 0.00 0.00 177.00 178.81 1qbi s THR 183 N -1.65 4.01 0.36 1.26 -4.23 -1.26 -4.79 115.64 109.34 1qbi s THR 183 Ca 0.59 0.65 0.04 0.00 -1.18 0.00 0.00 61.69 61.80 1qbi s THR 183 Cb -0.23 -3.60 0.22 0.00 1.34 0.00 0.00 72.50 70.23 1qbi s THR 183 CO 0.29 -0.85 1.96 -0.61 -0.54 0.00 0.00 174.62 174.86 1qbi h GLN 184 N -0.56 0.63 0.15 3.99 5.75 -1.96 -0.50 115.11 122.61 1qbi h GLN 184 Ca -0.45 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 57.97 1qbi h GLN 184 Cb 1.22 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.65 1qbi h GLN 184 CO 0.62 0.51 -0.07 -0.56 -2.65 0.00 0.00 178.83 176.68 1qbi h GLN 185 N 0.63 -0.19 -0.30 1.69 -0.00 -1.98 0.40 115.11 115.37 1qbi h GLN 185 Ca 0.16 0.01 0.05 0.00 -0.00 0.00 0.00 58.65 58.87 1qbi h GLN 185 Cb 0.10 0.04 -0.05 0.00 -0.00 0.00 0.00 27.48 27.58 1qbi h GLN 185 CO -0.02 -0.04 0.01 0.93 -0.00 0.00 0.00 178.83 179.71 1qbi h GLU 186 N -0.29 0.10 -0.34 0.06 5.08 -1.79 0.30 114.58 117.69 1qbi h GLU 186 Ca -0.02 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1qbi h GLU 186 Cb 0.23 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1qbi h GLU 186 CO 0.03 0.07 0.21 1.25 -1.00 0.00 0.00 179.01 179.56 1qbi h LEU 187 N 0.10 0.34 -2.27 1.33 5.85 -0.87 0.92 115.31 120.71 1qbi h LEU 187 Ca 0.14 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1qbi h LEU 187 Cb 0.18 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 1qbi h LEU 187 CO -0.23 0.24 -0.05 0.78 -0.34 0.00 0.00 178.44 178.85 1qbi h ASN 188 N 0.42 0.00 -0.60 1.25 2.35 0.67 0.22 115.58 119.89 1qbi h ASN 188 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1qbi h ASN 188 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 1qbi h ASN 188 CO -0.06 0.05 0.00 0.61 -1.65 0.00 0.00 177.43 176.38 1qbi n GLY 189 N -0.80 1.88 3.43 2.83 0.00 0.01 -4.92 105.19 107.63 1qbi n GLY 189 Ca -0.02 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.08 1qbi n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qbi n LYS 190 N 1.33 -5.94 -3.19 1.61 5.02 0.06 -4.94 118.16 112.12 1qbi n LYS 190 Ca 0.21 0.78 -0.44 0.00 -2.02 0.00 0.00 58.31 56.83 1qbi n LYS 190 Cb 0.53 -5.70 -0.06 0.00 -0.02 0.00 0.00 35.03 29.78 1qbi n LYS 190 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1qbi s ASP 191 N -3.03 6.20 -0.37 4.39 3.68 0.21 -4.92 116.67 122.82 1qbi s ASP 191 Ca 0.48 -1.22 0.07 0.00 2.13 0.00 0.00 52.55 54.01 1qbi s ASP 191 Cb -0.22 -2.27 0.64 0.00 -1.45 0.00 0.00 42.92 39.61 1qbi s ASP 191 CO 0.60 -0.92 1.76 -1.22 0.13 0.00 0.00 175.17 175.52 1qbi n TYR 192 N 6.00 2.36 0.27 -5.34 0.53 -1.26 -4.37 117.16 115.35 1qbi n TYR 192 Ca -0.09 -1.62 0.12 0.00 -1.02 0.00 0.00 57.90 55.28 1qbi n TYR 192 Cb 0.44 -0.76 0.77 0.00 -1.03 0.00 0.00 39.34 38.76 1qbi n TYR 192 CO 0.00 0.00 0.00 1.12 -1.02 0.00 0.00 176.86 176.96 1qbi h HIS 193 N 1.36 0.00 -0.00 -0.72 2.07 -1.91 0.22 115.15 116.16 1qbi h HIS 193 Ca 0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.95 1qbi h HIS 193 Cb 2.41 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.39 1qbi h HIS 193 CO 1.35 0.03 -0.03 0.25 -3.07 0.00 0.00 177.93 176.47 1qbi n THR 194 N -4.09 0.00 -1.31 6.12 -2.24 -1.26 -4.28 114.28 107.21 1qbi n THR 194 Ca -0.03 -0.02 -0.37 0.00 -2.27 0.00 0.00 64.05 61.36 1qbi n THR 194 Cb 0.12 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 67.93 1qbi n THR 194 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1qbi n TYR 195 N -1.16 2.49 -4.38 4.78 0.53 0.77 -4.71 117.16 115.48 1qbi n TYR 195 Ca 0.16 -2.86 -0.21 0.00 -1.02 0.00 0.00 57.90 53.96 1qbi n TYR 195 Cb 0.23 -2.36 -0.16 0.00 -1.03 0.00 0.00 39.34 36.02 1qbi n TYR 195 CO 0.00 0.00 0.00 -1.64 -1.02 0.00 0.00 176.86 174.20 1qbi s MET 196 N 2.68 1.12 -0.58 -0.72 -1.94 -1.26 -4.51 119.30 114.09 1qbi s MET 196 Ca 0.60 -0.28 -0.03 0.00 -1.71 0.00 0.00 55.69 54.28 1qbi s MET 196 Cb 0.16 -1.01 0.00 0.00 2.01 0.00 0.00 34.83 35.99 1qbi s MET 196 CO -0.06 0.04 0.50 0.41 -0.01 0.00 0.00 175.02 175.90 1qbi n GLY 197 N 3.63 0.24 3.26 -0.03 0.00 0.15 -3.64 105.19 108.81 1qbi n GLY 197 Ca -0.22 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.40 1qbi n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbi s LYS 198 N -5.33 1.11 -0.25 1.61 -0.14 0.33 -1.59 119.74 115.49 1qbi s LYS 198 Ca 0.19 -1.51 -0.07 0.00 -1.36 0.00 0.00 55.97 53.22 1qbi s LYS 198 Cb -0.08 -0.50 -0.02 0.00 -1.68 0.00 0.00 37.83 35.54 1qbi s LYS 198 CO 0.32 -0.02 0.05 0.08 -0.76 0.00 0.00 175.35 175.02 1qbi s VAL 199 N -3.45 4.11 0.20 3.17 1.01 -0.40 -0.66 120.40 124.38 1qbi s VAL 199 Ca 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1qbi s VAL 199 Cb 0.04 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 1qbi s VAL 199 CO 0.03 0.31 0.41 -0.76 0.00 0.00 0.00 175.10 175.09 1qbi s LEU 200 N 1.58 4.21 -0.14 3.92 1.43 0.23 0.11 118.68 130.02 1qbi s LEU 200 Ca 0.06 0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 53.63 1qbi s LEU 200 Cb -0.15 -3.26 0.04 0.00 0.03 0.00 0.00 46.19 42.85 1qbi s LEU 200 CO 0.02 -0.04 0.00 -0.60 0.23 0.00 0.00 176.35 175.96 1qbi s ARG 201 N -3.20 0.79 0.21 1.70 3.52 0.10 -0.31 118.95 121.77 1qbi s ARG 201 Ca 0.40 -0.21 0.10 0.00 -0.13 0.00 0.00 55.73 55.88 1qbi s ARG 201 Cb -0.11 -1.61 -0.05 0.00 -1.56 0.00 0.00 34.95 31.62 1qbi s ARG 201 CO 0.28 -0.45 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.62 1qbi s LEU 202 N 1.87 2.51 0.77 -0.88 1.43 0.10 -4.49 118.68 119.99 1qbi s LEU 202 Ca 0.02 -0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 52.06 1qbi s LEU 202 Cb -0.15 -0.89 0.06 0.00 0.03 0.00 0.00 46.19 45.24 1qbi s LEU 202 CO -0.07 -0.04 1.09 0.20 0.23 0.00 0.00 176.35 177.76 1qbi s ASN 203 N -3.08 4.52 0.66 2.29 0.01 0.38 -0.54 114.94 119.18 1qbi s ASN 203 Ca 0.22 1.81 0.41 0.00 -0.71 0.00 0.00 52.86 54.60 1qbi s ASN 203 Cb -0.04 -2.52 2.27 0.00 0.41 0.00 0.00 41.25 41.37 1qbi s ASN 203 CO 0.09 -2.03 2.29 -0.07 -1.51 0.00 0.00 177.10 175.88 1qbi h LEU 204 N -1.12 0.00 -1.90 0.60 3.38 -1.89 0.22 115.31 114.61 1qbi h LEU 204 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1qbi h LEU 204 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1qbi h LEU 204 CO 0.51 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.14 1qbi n ASP 205 N -3.11 2.82 0.00 -0.43 5.75 -1.26 -4.94 116.55 115.38 1qbi n ASP 205 Ca -0.03 -1.91 0.00 0.00 -0.01 0.00 0.00 54.79 52.84 1qbi n ASP 205 Cb 0.13 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 1qbi n ASP 205 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qbi n GLY 206 N 1.37 0.91 3.74 6.12 0.00 0.79 -4.74 105.19 113.38 1qbi n GLY 206 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1qbi n GLY 206 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qbi s SER 207 N -2.44 2.67 -0.26 1.61 1.04 -1.26 -4.62 113.70 110.44 1qbi s SER 207 Ca 0.00 0.84 -0.25 0.00 0.48 0.00 0.00 55.95 57.03 1qbi s SER 207 Cb 0.00 -1.30 -0.00 0.00 0.10 0.00 0.00 66.02 64.82 1qbi s SER 207 CO 0.00 -3.06 0.84 -0.63 0.98 0.00 0.00 173.24 171.37 1qbi s ILE 208 N -3.23 4.81 0.18 -1.02 1.01 -1.26 -0.47 121.20 121.22 1qbi s ILE 208 Ca 0.67 1.53 -0.33 0.00 0.00 0.00 0.00 60.65 62.52 1qbi s ILE 208 Cb -0.13 -4.14 -0.13 0.00 0.01 0.00 0.00 42.46 38.06 1qbi s ILE 208 CO 0.55 -0.13 1.63 -2.65 0.00 0.00 0.00 174.94 174.34 1qbi n PRO 209 N 6.10 2.38 0.16 2.79 -0.02 -1.26 -4.85 135.00 140.29 1qbi n PRO 209 Ca 0.06 0.86 0.12 0.00 -2.02 0.00 0.00 63.50 62.52 1qbi n PRO 209 Cb 0.48 -2.65 0.58 0.00 -0.02 0.00 0.00 33.50 31.88 1qbi n PRO 209 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1qbi h LYS 210 N 6.17 0.00 -0.36 -0.52 2.10 -1.98 -0.86 116.57 121.12 1qbi h LYS 210 Ca -0.44 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.11 1qbi h LYS 210 Cb 1.23 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.50 1qbi h LYS 210 CO 0.91 0.00 0.02 -0.40 -2.00 0.00 0.00 179.45 177.98 1qbi n ASP 211 N -2.34 3.44 -4.75 7.07 5.75 -1.26 -4.99 116.55 119.47 1qbi n ASP 211 Ca 0.00 -3.33 -0.32 0.00 -0.01 0.00 0.00 54.79 51.13 1qbi n ASP 211 Cb 0.15 -0.60 0.09 0.00 -1.03 0.00 0.00 41.12 39.72 1qbi n ASP 211 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1qbi s ASN 212 N -2.06 4.43 0.81 -1.12 -0.87 -0.33 -5.00 114.94 110.79 1qbi s ASN 212 Ca 0.45 2.03 -0.11 0.00 -1.57 0.00 0.00 52.86 53.66 1qbi s ASN 212 Cb 0.38 -2.55 0.08 0.00 -0.02 0.00 0.00 41.25 39.14 1qbi s ASN 212 CO 0.06 -2.09 1.10 -2.16 -2.57 0.00 0.00 177.10 171.44 1qbi s PRO 213 N -4.41 1.91 -0.13 -0.60 0.04 -1.26 -4.93 135.00 125.62 1qbi s PRO 213 Ca 0.66 1.12 -0.06 0.00 0.04 0.00 0.00 61.00 62.77 1qbi s PRO 213 Cb -0.21 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1qbi s PRO 213 CO 0.49 -1.87 0.08 0.45 0.04 0.00 0.00 177.00 176.19 1qbi s SER 214 N -3.33 5.85 -0.07 6.66 0.15 -1.26 -4.18 113.70 117.52 1qbi s SER 214 Ca 0.62 0.27 0.03 0.00 0.70 0.00 0.00 55.95 57.57 1qbi s SER 214 Cb -0.18 -1.86 0.01 0.00 -1.71 0.00 0.00 66.02 62.28 1qbi s SER 214 CO 0.56 0.33 -0.16 -0.36 1.20 0.00 0.00 173.24 174.82 1qbi s PHE 215 N -0.58 1.76 -1.36 3.44 0.40 -0.05 -4.77 117.98 116.81 1qbi s PHE 215 Ca 0.11 -0.63 -0.11 0.00 -0.60 0.00 0.00 56.93 55.70 1qbi s PHE 215 Cb -0.12 -1.23 0.08 0.00 0.51 0.00 0.00 43.02 42.27 1qbi s PHE 215 CO 0.02 -0.27 0.57 0.09 0.70 0.00 0.00 175.22 176.33 1qbi n ASN 216 N 3.56 -3.82 0.00 1.36 5.03 -1.26 -0.67 115.26 119.46 1qbi n ASN 216 Ca -0.21 -0.50 0.00 0.00 0.87 0.00 0.00 54.58 54.74 1qbi n ASN 216 Cb 0.52 -3.14 0.00 0.00 -1.02 0.00 0.00 39.78 36.14 1qbi n ASN 216 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1qbi n GLY 217 N -1.25 0.61 3.08 7.41 0.00 -1.26 -5.03 105.19 108.75 1qbi n GLY 217 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1qbi n GLY 217 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qbi s VAL 218 N -2.28 1.14 -0.28 1.61 1.01 0.16 -5.01 120.40 116.74 1qbi s VAL 218 Ca 0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.27 1qbi s VAL 218 Cb 0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1qbi s VAL 218 CO 0.00 0.34 0.36 -0.69 0.00 0.00 0.00 175.10 175.11 1qbi s VAL 219 N 0.06 5.18 0.00 2.92 1.01 -1.26 -0.87 120.40 127.44 1qbi s VAL 219 Ca -0.03 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1qbi s VAL 219 Cb -0.10 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1qbi s VAL 219 CO 0.01 0.14 0.00 -1.54 0.00 0.00 0.00 175.10 173.71 1qbi n SER 220 N 5.33 0.98 0.00 3.32 3.41 -1.26 -5.00 113.62 120.40 1qbi n SER 220 Ca -0.09 -0.60 0.10 0.00 -0.26 0.00 0.00 58.87 58.02 1qbi n SER 220 Cb 0.51 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.92 1qbi n SER 220 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1qbi n HIS 221 N 0.00 0.00 -2.08 7.33 8.25 -1.26 -4.78 115.22 122.67 1qbi n HIS 221 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 1qbi n HIS 221 Cb 0.00 -0.42 -0.03 0.00 1.12 0.00 0.00 29.99 30.66 1qbi n HIS 221 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1qbi s ILE 222 N -2.83 3.03 -0.17 1.59 1.01 -1.26 0.01 121.20 122.57 1qbi s ILE 222 Ca 0.13 0.75 -0.03 0.00 0.00 0.00 0.00 60.65 61.51 1qbi s ILE 222 Cb 0.13 -3.48 -0.10 0.00 0.01 0.00 0.00 42.46 39.03 1qbi s ILE 222 CO 0.34 0.07 -0.18 0.00 0.00 0.00 0.00 174.94 175.17 1qbi n TYR 223 N 3.74 0.00 -3.96 3.97 9.36 0.12 -4.43 117.16 125.96 1qbi n TYR 223 Ca 0.12 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.24 1qbi n TYR 223 Cb 0.41 -0.64 -0.10 0.00 -0.63 0.00 0.00 39.34 38.38 1qbi n TYR 223 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1qbi s THR 224 N -2.33 0.13 0.39 2.97 -4.23 -0.71 -1.29 115.64 110.57 1qbi s THR 224 Ca -0.23 -1.08 0.04 0.00 -1.18 0.00 0.00 61.69 59.23 1qbi s THR 224 Cb 0.07 -0.71 -0.01 0.00 1.34 0.00 0.00 72.50 73.19 1qbi s THR 224 CO 0.36 -0.60 0.13 0.00 -0.54 0.00 0.00 174.62 173.97 1qbi n LEU 225 N 1.04 0.00 -0.92 4.79 -0.00 -0.94 -1.28 117.00 119.69 1qbi n LEU 225 Ca -0.20 -2.93 -0.03 0.00 -0.00 0.00 0.00 56.01 52.84 1qbi n LEU 225 Cb 0.57 0.95 0.01 0.00 -0.00 0.00 0.00 43.42 44.95 1qbi n LEU 225 CO 0.22 -0.45 0.03 0.61 -0.00 0.00 0.00 177.39 177.80 1qbi n GLY 226 N -0.61 0.74 3.52 1.47 0.00 -0.33 -0.26 105.19 109.72 1qbi n GLY 226 Ca -0.06 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 1qbi n GLY 226 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1qbi s HIS 227 N -3.04 2.60 0.00 1.61 3.76 -0.62 -1.29 115.29 118.30 1qbi s HIS 227 Ca 0.07 -0.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 1qbi s HIS 227 Cb -0.03 -1.35 0.00 0.00 1.11 0.00 0.00 32.58 32.31 1qbi s HIS 227 CO 0.09 0.43 0.00 -2.13 -0.85 0.00 0.00 174.74 172.28 1qbi n ARG 228 N 0.60 0.00 -3.56 1.40 0.63 -1.26 -4.20 116.66 110.27 1qbi n ARG 228 Ca -0.14 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.52 1qbi n ARG 228 Cb 0.53 -0.04 -0.10 0.00 0.45 0.00 0.00 32.46 33.30 1qbi n ARG 228 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1qbi n ASN 229 N -0.98 1.67 -4.55 6.15 4.05 -1.22 -0.24 115.26 120.14 1qbi n ASN 229 Ca 0.00 -2.92 -0.41 0.00 0.45 0.00 0.00 54.58 51.69 1qbi n ASN 229 Cb 0.00 -0.66 -0.03 0.00 1.23 0.00 0.00 39.78 40.32 1qbi n ASN 229 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1qbi s PRO 230 N -1.14 3.58 0.00 1.20 0.04 -1.26 -0.96 135.00 136.46 1qbi s PRO 230 Ca 0.31 -1.19 0.26 0.00 0.04 0.00 0.00 61.00 60.43 1qbi s PRO 230 Cb 0.05 -5.28 0.67 0.00 0.04 0.00 0.00 34.50 29.98 1qbi s PRO 230 CO -0.14 -2.15 1.52 1.04 0.04 0.00 0.00 177.00 177.30 1qbi n GLN 231 N 8.59 1.25 -5.20 4.56 6.02 -1.10 -4.56 117.38 126.93 1qbi n GLN 231 Ca 0.31 -0.82 -0.32 0.00 -0.01 0.00 0.00 57.00 56.16 1qbi n GLN 231 Cb 0.51 -1.48 -0.17 0.00 1.02 0.00 0.00 30.24 30.12 1qbi n GLN 231 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1qbi s GLY 232 N -2.32 1.34 -0.18 1.08 0.00 -0.96 -4.13 107.32 102.14 1qbi s GLY 232 Ca 0.27 -0.99 -0.07 0.00 0.00 0.00 0.00 44.72 43.93 1qbi s GLY 232 CO 0.46 -0.45 0.40 -2.27 0.00 0.00 0.00 173.10 171.24 1qbi s LEU 233 N 0.13 -0.47 -0.20 0.66 2.96 -1.26 -1.47 118.68 119.03 1qbi s LEU 233 Ca -0.12 0.93 -0.13 0.00 -0.22 0.00 0.00 54.13 54.59 1qbi s LEU 233 Cb -0.16 1.29 0.06 0.00 0.50 0.00 0.00 46.19 47.88 1qbi s LEU 233 CO 0.07 -0.22 0.50 0.00 -1.32 0.00 0.00 176.35 175.37 1qbi s ALA 234 N 2.28 -1.28 0.46 5.97 0.00 0.19 -4.82 121.76 124.56 1qbi s ALA 234 Ca -0.03 1.70 -0.20 0.00 0.00 0.00 0.00 51.96 53.42 1qbi s ALA 234 Cb -0.11 -1.01 -0.10 0.00 0.00 0.00 0.00 23.12 21.90 1qbi s ALA 234 CO -0.12 -0.28 0.97 -0.06 0.00 0.00 0.00 175.76 176.26 1qbi s PHE 235 N 1.14 3.32 0.39 0.00 0.40 -1.26 -0.63 117.98 121.35 1qbi s PHE 235 Ca -0.07 1.57 0.03 0.00 -0.60 0.00 0.00 56.93 57.86 1qbi s PHE 235 Cb -0.06 -2.85 -0.00 0.00 0.51 0.00 0.00 43.02 40.61 1qbi s PHE 235 CO -0.11 -0.24 0.57 0.95 0.70 0.00 0.00 175.22 177.09 1qbi s THR 236 N -2.29 4.00 0.54 0.64 -4.23 0.59 -4.75 115.64 110.15 1qbi s THR 236 Ca 0.62 -0.75 0.23 0.00 -1.18 0.00 0.00 61.69 60.61 1qbi s THR 236 Cb -0.10 -3.43 0.35 0.00 1.34 0.00 0.00 72.50 70.66 1qbi s THR 236 CO 0.19 -0.23 2.08 -0.65 -0.54 0.00 0.00 174.62 175.46 1qbi h PRO 237 N 0.64 0.00 -0.67 3.99 0.11 -1.98 0.37 132.00 134.47 1qbi h PRO 237 Ca -0.46 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 1qbi h PRO 237 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1qbi h PRO 237 CO 0.55 0.00 0.03 0.27 -0.21 0.00 0.00 178.00 178.64 1qbi n ASN 238 N -4.27 4.95 0.00 -2.05 2.04 -1.26 -4.92 115.26 109.75 1qbi n ASN 238 Ca 0.03 -2.82 0.00 0.00 -0.44 0.00 0.00 54.58 51.35 1qbi n ASN 238 Cb 0.36 -0.67 0.00 0.00 -2.53 0.00 0.00 39.78 36.95 1qbi n ASN 238 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1qbi n GLY 239 N 0.45 0.61 3.87 4.83 0.00 0.12 -5.05 105.19 110.03 1qbi n GLY 239 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 1qbi n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbi s LYS 240 N -0.20 3.78 -0.30 1.61 1.02 -1.26 -4.79 119.74 119.60 1qbi s LYS 240 Ca 0.00 0.60 -0.02 0.00 0.02 0.00 0.00 55.97 56.56 1qbi s LYS 240 Cb 0.00 -2.29 0.05 0.00 -0.52 0.00 0.00 37.83 35.07 1qbi s LYS 240 CO 0.00 -0.18 0.01 -1.17 -0.92 0.00 0.00 175.35 173.09 1qbi s LEU 241 N -4.16 3.88 0.20 3.17 2.96 -1.26 -0.30 118.68 123.17 1qbi s LEU 241 Ca 0.53 -1.22 -0.02 0.00 -0.22 0.00 0.00 54.13 53.20 1qbi s LEU 241 Cb -0.10 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 1qbi s LEU 241 CO 0.35 -0.26 0.41 -0.76 -1.32 0.00 0.00 176.35 174.77 1qbi s LEU 242 N 1.28 4.22 -0.04 -0.68 1.43 0.20 0.06 118.68 125.15 1qbi s LEU 242 Ca -0.04 0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 53.39 1qbi s LEU 242 Cb -0.19 -3.25 0.03 0.00 0.03 0.00 0.00 46.19 42.81 1qbi s LEU 242 CO -0.01 -0.04 0.34 -1.58 0.23 0.00 0.00 176.35 175.29 1qbi s GLN 243 N -3.19 0.65 0.19 1.70 -0.44 0.14 -0.64 119.66 118.07 1qbi s GLN 243 Ca 0.40 -0.06 0.10 0.00 -2.50 0.00 0.00 55.36 53.30 1qbi s GLN 243 Cb -0.11 0.29 -0.04 0.00 -1.64 0.00 0.00 33.01 31.51 1qbi s GLN 243 CO 0.28 -0.17 -0.21 -1.54 0.50 0.00 0.00 175.29 174.15 1qbi s SER 244 N -1.07 3.11 -0.17 6.67 1.04 -0.54 -0.53 113.70 122.21 1qbi s SER 244 Ca -0.11 -0.87 -0.13 0.00 0.48 0.00 0.00 55.95 55.31 1qbi s SER 244 Cb -0.05 -0.21 0.05 0.00 0.10 0.00 0.00 66.02 65.91 1qbi s SER 244 CO 0.04 0.05 0.43 -0.70 0.98 0.00 0.00 173.24 174.03 1qbi s GLU 245 N -2.77 0.47 0.05 4.02 2.12 -0.02 -2.25 118.70 120.32 1qbi s GLU 245 Ca 0.19 0.66 -0.29 0.00 0.36 0.00 0.00 54.97 55.89 1qbi s GLU 245 Cb -0.07 0.17 -0.05 0.00 0.26 0.00 0.00 34.13 34.45 1qbi s GLU 245 CO 0.09 -0.09 0.93 -0.65 -0.54 0.00 0.00 175.26 175.00 1qbi s GLN 246 N 0.56 4.60 0.32 4.30 -0.21 -0.14 -0.43 119.66 128.67 1qbi s GLN 246 Ca -0.03 1.36 0.01 0.00 0.02 0.00 0.00 55.36 56.72 1qbi s GLN 246 Cb -0.04 -3.41 0.06 0.00 1.00 0.00 0.00 33.01 30.62 1qbi s GLN 246 CO -0.03 0.11 0.44 0.41 -2.12 0.00 0.00 175.29 174.11 1qbi n GLY 247 N 2.57 1.08 0.00 3.09 0.00 -1.25 -3.41 105.19 107.26 1qbi n GLY 247 Ca 0.03 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1qbi n GLY 247 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1qbi n PRO 248 N -1.79 0.00 0.00 1.61 -0.04 -1.26 -4.68 135.00 128.84 1qbi n PRO 248 Ca 0.08 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.68 1qbi n PRO 248 Cb 0.28 0.00 0.58 0.00 -0.04 0.00 0.00 33.50 34.32 1qbi n PRO 248 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1qbi n ASN 249 N 0.00 0.15 -2.45 3.54 4.13 -1.26 -4.90 115.26 114.46 1qbi n ASN 249 Ca 0.00 0.12 -0.11 0.00 1.68 0.00 0.00 54.58 56.27 1qbi n ASN 249 Cb 0.00 -0.28 -0.03 0.00 -1.54 0.00 0.00 39.78 37.93 1qbi n ASN 249 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1qbi n SER 250 N -1.39 -0.94 -3.65 6.41 3.41 -1.26 -3.14 113.62 113.07 1qbi n SER 250 Ca 0.09 -2.38 -0.21 0.00 -0.26 0.00 0.00 58.87 56.11 1qbi n SER 250 Cb 0.31 1.78 0.05 0.00 -0.26 0.00 0.00 64.21 66.09 1qbi n SER 250 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1qbi n ASP 251 N -1.79 -1.55 -4.76 4.04 8.00 0.23 -4.30 116.55 116.42 1qbi n ASP 251 Ca 0.01 -0.77 -0.34 0.00 0.71 0.00 0.00 54.79 54.39 1qbi n ASP 251 Cb 0.42 -4.29 0.04 0.00 -0.02 0.00 0.00 41.12 37.27 1qbi n ASP 251 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1qbi s ASP 252 N -4.31 5.13 0.12 -2.24 1.01 -1.03 -3.88 116.67 111.47 1qbi s ASP 252 Ca 0.03 2.19 0.06 0.00 0.71 0.00 0.00 52.55 55.55 1qbi s ASP 252 Cb -0.02 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1qbi s ASP 252 CO 0.79 -1.62 -0.14 -1.61 0.21 0.00 0.00 175.17 172.80 1qbi s GLU 253 N -3.68 1.04 -0.20 8.23 2.02 0.42 -0.81 118.70 125.72 1qbi s GLU 253 Ca 0.72 -1.25 -0.04 0.00 0.02 0.00 0.00 54.97 54.42 1qbi s GLU 253 Cb -0.25 -0.93 -0.02 0.00 0.10 0.00 0.00 34.13 33.03 1qbi s GLU 253 CO 0.36 0.18 -0.03 0.42 0.02 0.00 0.00 175.26 176.22 1qbi s ILE 254 N -2.13 3.66 0.17 -1.63 -1.09 0.32 -0.84 121.20 119.66 1qbi s ILE 254 Ca 0.09 -0.41 0.10 0.00 -2.23 0.00 0.00 60.65 58.21 1qbi s ILE 254 Cb -0.05 -2.65 -0.04 0.00 -1.58 0.00 0.00 42.46 38.14 1qbi s ILE 254 CO 0.03 0.43 -0.23 0.20 -1.23 0.00 0.00 174.94 174.15 1qbi s ASN 255 N 1.13 3.13 -0.25 3.58 0.01 0.31 -0.20 114.94 122.65 1qbi s ASN 255 Ca 0.02 -0.83 -0.09 0.00 -0.71 0.00 0.00 52.86 51.26 1qbi s ASN 255 Cb -0.15 -0.21 -0.04 0.00 0.41 0.00 0.00 41.25 41.26 1qbi s ASN 255 CO 0.00 0.09 0.11 -0.22 -1.51 0.00 0.00 177.10 175.57 1qbi s LEU 256 N -2.49 3.72 -0.28 0.60 2.96 -1.26 -0.68 118.68 121.25 1qbi s LEU 256 Ca 0.17 -0.09 -0.23 0.00 -0.22 0.00 0.00 54.13 53.76 1qbi s LEU 256 Cb -0.08 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 1qbi s LEU 256 CO 0.08 -0.01 0.77 -0.63 -1.32 0.00 0.00 176.35 175.24 1qbi s ILE 257 N 1.47 4.84 -0.10 6.68 -1.09 0.11 -5.01 121.20 128.11 1qbi s ILE 257 Ca 0.06 1.28 0.02 0.00 -2.23 0.00 0.00 60.65 59.79 1qbi s ILE 257 Cb -0.15 -4.10 -0.02 0.00 -1.58 0.00 0.00 42.46 36.62 1qbi s ILE 257 CO 0.06 -0.15 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.77 1qbi s VAL 258 N 2.84 2.82 -0.12 2.92 1.01 -1.26 -4.39 120.40 124.22 1qbi s VAL 258 Ca 0.32 -0.77 -0.38 0.00 0.00 0.00 0.00 61.98 61.15 1qbi s VAL 258 Cb -0.15 -2.14 -0.16 0.00 0.00 0.00 0.00 36.38 33.94 1qbi s VAL 258 CO 0.10 0.55 1.58 1.17 0.00 0.00 0.00 175.10 178.51 1qbi n LYS 259 N 3.16 1.21 -0.93 2.72 4.81 -1.26 -0.62 118.16 127.25 1qbi n LYS 259 Ca -0.18 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1qbi n LYS 259 Cb 0.53 -2.11 0.00 0.00 0.02 0.00 0.00 35.03 33.46 1qbi n LYS 259 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qbi n GLY 260 N 3.51 0.75 3.78 3.14 0.00 -0.42 -5.02 105.19 110.94 1qbi n GLY 260 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 1qbi n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qbi s GLY 261 N -1.96 2.39 -0.23 -0.02 0.00 0.21 -4.91 107.32 102.80 1qbi s GLY 261 Ca 0.00 0.65 -0.02 0.00 0.00 0.00 0.00 44.72 45.34 1qbi s GLY 261 CO 0.00 0.99 -0.07 0.21 0.00 0.00 0.00 173.10 174.23 1qbi s ASN 262 N -2.20 4.16 -0.08 1.64 3.84 0.47 -2.21 114.94 120.55 1qbi s ASN 262 Ca 0.69 -0.61 0.13 0.00 0.21 0.00 0.00 52.86 53.27 1qbi s ASN 262 Cb -0.21 -1.68 0.51 0.00 -0.55 0.00 0.00 41.25 39.32 1qbi s ASN 262 CO 0.32 -0.06 1.37 -1.22 -2.79 0.00 0.00 177.10 174.71 1qbi n TYR 263 N 4.73 1.06 0.00 0.43 4.02 0.64 -0.36 117.16 127.67 1qbi n TYR 263 Ca -0.18 -0.42 0.00 0.00 -0.01 0.00 0.00 57.90 57.29 1qbi n TYR 263 Cb 0.49 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 1qbi n TYR 263 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1qbi n GLY 264 N 0.87 2.58 3.76 2.72 0.00 -1.17 -4.76 105.19 109.19 1qbi n GLY 264 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1qbi n GLY 264 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1qbi s TRP 265 N -0.95 2.65 -2.34 1.61 -0.11 -0.41 -0.02 118.94 119.37 1qbi s TRP 265 Ca 0.00 1.43 0.21 0.00 1.22 0.00 0.00 56.10 58.96 1qbi s TRP 265 Cb 0.00 -3.64 0.62 0.00 -1.50 0.00 0.00 33.47 28.95 1qbi s TRP 265 CO 0.00 -2.23 1.49 -0.35 -4.62 0.00 0.00 176.95 171.24 1qbi n PRO 266 N -0.43 1.98 0.13 5.86 -0.04 -1.26 -4.16 135.00 137.08 1qbi n PRO 266 Ca 0.07 -1.48 -0.02 0.00 -0.04 0.00 0.00 63.50 62.04 1qbi n PRO 266 Cb 0.45 -1.43 0.19 0.00 -0.04 0.00 0.00 33.50 32.68 1qbi n PRO 266 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1qbi h ASN 267 N 2.93 0.08 -3.35 3.54 4.21 -1.28 -3.43 115.58 118.28 1qbi h ASN 267 Ca 0.00 -0.04 -0.46 0.00 1.21 0.00 0.00 56.30 57.01 1qbi h ASN 267 Cb 0.64 -0.02 -0.35 0.00 -1.12 0.00 0.00 38.32 37.47 1qbi h ASN 267 CO 0.00 0.63 -0.78 -0.69 -1.29 0.00 0.00 177.43 175.29 1qbi s VAL 268 N -3.76 0.71 -0.31 2.81 1.01 0.97 -4.15 120.40 117.68 1qbi s VAL 268 Ca -0.02 -0.17 -0.10 0.00 0.00 0.00 0.00 61.98 61.69 1qbi s VAL 268 Cb 0.13 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 1qbi s VAL 268 CO 0.77 0.29 0.16 0.00 0.00 0.00 0.00 175.10 176.31 1qbi s ALA 269 N 1.26 3.32 0.00 5.51 0.00 -1.26 -3.31 121.76 127.27 1qbi s ALA 269 Ca -0.05 -1.36 0.00 0.00 0.00 0.00 0.00 51.96 50.55 1qbi s ALA 269 Cb -0.14 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.57 1qbi s ALA 269 CO -0.02 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.27 1qbi n GLY 270 N 5.00 0.82 3.78 0.00 0.00 -1.26 -4.76 105.19 108.77 1qbi n GLY 270 Ca -0.14 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.79 1qbi n GLY 270 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qbi s TYR 271 N 0.00 2.73 -1.27 1.61 1.51 -1.26 -4.50 117.35 116.17 1qbi s TYR 271 Ca 0.00 1.52 -0.15 0.00 -1.01 0.00 0.00 57.07 57.43 1qbi s TYR 271 Cb 0.00 -3.00 0.12 0.00 -0.11 0.00 0.00 41.96 38.97 1qbi s TYR 271 CO 0.00 -1.63 1.66 1.17 -1.11 0.00 0.00 175.55 175.64 1qbi n LYS 272 N -3.38 3.29 0.00 -0.62 4.81 -1.26 -4.57 118.16 116.42 1qbi n LYS 272 Ca 0.09 -3.50 0.00 0.00 -0.87 0.00 0.00 58.31 54.03 1qbi n LYS 272 Cb 0.53 -3.22 0.00 0.00 0.02 0.00 0.00 35.03 32.36 1qbi n LYS 272 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1qbi n ASP 273 N 6.53 0.55 -2.66 3.14 5.68 -1.26 -4.87 116.55 123.66 1qbi n ASP 273 Ca 0.43 -0.78 -0.18 0.00 -0.50 0.00 0.00 54.79 53.76 1qbi n ASP 273 Cb 0.43 0.38 -0.00 0.00 -1.14 0.00 0.00 41.12 40.79 1qbi n ASP 273 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1qbi n ASP 274 N -0.38 -4.70 -4.07 -1.12 9.92 -1.26 -4.93 116.55 110.01 1qbi n ASP 274 Ca 0.00 -0.02 -0.32 0.00 -0.53 0.00 0.00 54.79 53.92 1qbi n ASP 274 Cb 0.01 -3.92 -0.15 0.00 -0.64 0.00 0.00 41.12 36.42 1qbi n ASP 274 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1qbi s SER 275 N -2.24 4.51 0.00 -2.24 0.15 -1.26 -4.76 113.70 107.86 1qbi s SER 275 Ca 0.11 -1.48 0.00 0.00 0.70 0.00 0.00 55.95 55.28 1qbi s SER 275 Cb -0.05 -1.57 0.00 0.00 -1.71 0.00 0.00 66.02 62.69 1qbi s SER 275 CO 0.13 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.96 1qbi n GLY 276 N 4.42 1.94 3.13 9.45 0.00 -1.16 -4.47 105.19 118.51 1qbi n GLY 276 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1qbi n GLY 276 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1qbi s TYR 277 N -3.42 0.02 0.07 1.61 5.04 -1.26 -4.79 117.35 114.62 1qbi s TYR 277 Ca 0.00 -0.11 -0.12 0.00 -2.44 0.00 0.00 57.07 54.40 1qbi s TYR 277 Cb 0.00 -0.03 0.01 0.00 0.35 0.00 0.00 41.96 42.29 1qbi s TYR 277 CO 0.00 -0.32 0.26 0.00 -1.34 0.00 0.00 175.55 174.15 1qbi s ALA 278 N -1.54 -0.52 -0.54 3.97 0.00 -0.80 -4.70 121.76 117.64 1qbi s ALA 278 Ca -0.13 -0.24 -0.20 0.00 0.00 0.00 0.00 51.96 51.38 1qbi s ALA 278 Cb -0.06 0.41 0.06 0.00 0.00 0.00 0.00 23.12 23.52 1qbi s ALA 278 CO 0.01 -0.46 0.73 -0.47 0.00 0.00 0.00 175.76 175.57 1qbi s TYR 279 N -3.09 2.96 -0.44 0.00 5.04 -0.33 -4.11 117.35 117.38 1qbi s TYR 279 Ca -0.01 -0.47 -0.16 0.00 -2.44 0.00 0.00 57.07 53.98 1qbi s TYR 279 Cb 0.01 -3.76 0.04 0.00 0.35 0.00 0.00 41.96 38.59 1qbi s TYR 279 CO -0.07 -1.18 0.40 0.00 -1.34 0.00 0.00 175.55 173.37 1qbi s ALA 280 N 3.03 3.47 -0.72 3.97 0.00 -1.26 -0.88 121.76 129.37 1qbi s ALA 280 Ca 0.19 -1.73 -0.19 0.00 0.00 0.00 0.00 51.96 50.22 1qbi s ALA 280 Cb -0.18 -3.04 0.12 0.00 0.00 0.00 0.00 23.12 20.02 1qbi s ALA 280 CO 0.13 -1.62 0.86 1.21 0.00 0.00 0.00 175.76 176.33 1qbi s ASN 281 N 2.03 6.37 0.41 0.00 3.04 -0.63 -4.90 114.94 121.26 1qbi s ASN 281 Ca 0.08 -1.68 0.17 0.00 0.04 0.00 0.00 52.86 51.48 1qbi s ASN 281 Cb -0.19 -2.33 0.90 0.00 -1.54 0.00 0.00 41.25 38.09 1qbi s ASN 281 CO 0.11 -1.09 1.88 1.88 -3.04 0.00 0.00 177.10 176.84 1qbi h TYR 282 N 8.98 0.00 0.00 0.43 -1.99 -1.87 -1.11 116.97 121.41 1qbi h TYR 282 Ca -0.13 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.60 1qbi h TYR 282 Cb 1.06 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.79 1qbi h TYR 282 CO 0.96 0.30 -0.01 0.66 -0.00 0.00 0.00 178.16 180.08 1qbi h SER 283 N 0.00 0.00 -0.05 3.88 4.64 -1.70 -0.72 113.55 119.60 1qbi h SER 283 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qbi h SER 283 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1qbi h SER 283 CO 0.04 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1qbi n ALA 284 N -2.13 2.46 -2.57 5.18 0.00 -0.43 -4.87 120.51 118.15 1qbi n ALA 284 Ca -0.03 -0.70 -0.43 0.00 0.00 0.00 0.00 53.44 52.29 1qbi n ALA 284 Cb 0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 1qbi n ALA 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qbi s ALA 285 N -1.97 3.60 0.45 0.00 0.00 -0.28 -4.71 121.76 118.85 1qbi s ALA 285 Ca 0.29 0.36 0.21 0.00 0.00 0.00 0.00 51.96 52.83 1qbi s ALA 285 Cb 0.20 -3.54 1.28 0.00 0.00 0.00 0.00 23.12 21.06 1qbi s ALA 285 CO 0.30 -0.96 2.06 0.00 0.00 0.00 0.00 175.76 177.16 1qbi h ALA 286 N 7.60 1.51 -2.43 0.00 0.00 -1.87 -3.39 119.26 120.68 1qbi h ALA 286 Ca -0.26 -0.12 -0.70 0.00 0.00 0.00 0.00 54.91 53.84 1qbi h ALA 286 Cb 1.10 -0.02 -0.19 0.00 0.00 0.00 0.00 17.79 18.68 1qbi h ALA 286 CO 0.94 0.17 -0.27 1.21 0.00 0.00 0.00 179.25 181.29 1qbi s ASN 287 N -6.57 6.17 0.00 0.00 3.84 -1.26 -4.93 114.94 112.19 1qbi s ASN 287 Ca -0.04 -0.67 0.10 0.00 0.21 0.00 0.00 52.86 52.46 1qbi s ASN 287 Cb 0.15 -2.20 0.59 0.00 -0.55 0.00 0.00 41.25 39.24 1qbi s ASN 287 CO 0.63 -0.52 1.39 0.29 -2.79 0.00 0.00 177.10 176.10 1qbi n LYS 288 N 5.47 1.04 0.00 0.43 4.76 -1.26 -2.24 118.16 126.36 1qbi n LYS 288 Ca -0.08 -0.06 0.12 0.00 -2.87 0.00 0.00 58.31 55.41 1qbi n LYS 288 Cb 0.48 -1.17 0.11 0.00 -1.84 0.00 0.00 35.03 32.61 1qbi n LYS 288 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1qbi n SER 289 N -0.60 2.47 -4.73 4.39 3.41 -1.26 -4.95 113.62 112.35 1qbi n SER 289 Ca 0.08 -1.75 -0.40 0.00 -0.26 0.00 0.00 58.87 56.54 1qbi n SER 289 Cb 0.05 0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.19 1qbi n SER 289 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qbi n ILE 290 N 0.71 2.71 -3.82 -1.33 3.06 -0.95 -4.99 119.36 114.74 1qbi n ILE 290 Ca 0.13 -0.50 -0.32 0.00 -2.50 0.00 0.00 62.75 59.56 1qbi n ILE 290 Cb 0.53 -1.71 -0.05 0.00 0.54 0.00 0.00 39.64 38.95 1qbi n ILE 290 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 1qbi s LYS 291 N -2.34 3.52 -0.48 9.51 -0.14 -1.26 -5.07 119.74 123.47 1qbi s LYS 291 Ca 0.61 -0.25 -0.20 0.00 -1.36 0.00 0.00 55.97 54.76 1qbi s LYS 291 Cb -0.48 -3.00 0.04 0.00 -1.68 0.00 0.00 37.83 32.71 1qbi s LYS 291 CO 0.58 0.59 0.67 0.34 -0.76 0.00 0.00 175.35 176.76 1qbi s ASP 292 N -2.26 6.28 0.31 2.83 -1.08 -1.26 -4.42 116.67 117.08 1qbi s ASP 292 Ca 0.34 -0.56 0.23 0.00 -0.52 0.00 0.00 52.55 52.04 1qbi s ASP 292 Cb -0.13 -2.32 1.14 0.00 -1.46 0.00 0.00 42.92 40.15 1qbi s ASP 292 CO 0.24 -0.87 1.69 0.18 0.52 0.00 0.00 175.17 176.93 1qbi n LEU 293 N 6.36 0.62 -3.59 -1.34 4.77 -1.26 -4.88 117.00 117.68 1qbi n LEU 293 Ca -0.03 0.74 -0.24 0.00 -0.03 0.00 0.00 56.01 56.45 1qbi n LEU 293 Cb 0.47 -0.75 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 1qbi n LEU 293 CO 0.55 -0.84 0.24 0.00 -1.33 0.00 0.00 177.39 176.01 1qbi n ALA 294 N -1.79 -1.37 -1.30 -1.18 0.00 -1.26 -4.88 120.51 108.73 1qbi n ALA 294 Ca -0.00 0.37 -0.05 0.00 0.00 0.00 0.00 53.44 53.75 1qbi n ALA 294 Cb 0.10 -5.26 0.22 0.00 0.00 0.00 0.00 19.45 14.50 1qbi n ALA 294 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1qbi n GLN 295 N -4.94 2.25 -1.97 0.00 1.13 -1.26 -4.93 117.38 107.66 1qbi n GLN 295 Ca -0.01 -3.09 -0.17 0.00 -1.94 0.00 0.00 57.00 51.79 1qbi n GLN 295 Cb 0.57 -1.91 -0.04 0.00 0.11 0.00 0.00 30.24 28.97 1qbi n GLN 295 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1qbi n ASN 296 N -0.94 -5.04 0.00 1.08 5.15 -1.26 -2.15 115.26 112.10 1qbi n ASN 296 Ca 0.36 0.17 0.00 0.00 -0.60 0.00 0.00 54.58 54.51 1qbi n ASN 296 Cb 1.15 -4.09 0.00 0.00 -0.53 0.00 0.00 39.78 36.30 1qbi n ASN 296 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1qbi n GLY 297 N -0.96 1.49 0.14 8.20 0.00 -1.26 -1.90 105.19 110.90 1qbi n GLY 297 Ca -0.19 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 1qbi n GLY 297 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1qbi h VAL 298 N 0.00 1.44 -3.19 1.61 2.07 -1.70 -3.39 116.25 113.08 1qbi h VAL 298 Ca 0.00 -2.70 -0.53 0.00 0.82 0.00 0.00 66.70 64.29 1qbi h VAL 298 Cb 0.00 2.66 -0.37 0.00 -1.52 0.00 0.00 31.29 32.06 1qbi h VAL 298 CO 0.00 0.80 -0.80 -0.54 0.02 0.00 0.00 177.57 177.05 1qbi s LYS 299 N -3.00 1.50 0.21 1.57 1.02 -1.25 -5.06 119.74 114.72 1qbi s LYS 299 Ca -0.05 -0.27 0.05 0.00 0.02 0.00 0.00 55.97 55.72 1qbi s LYS 299 Cb 0.08 -1.61 -0.05 0.00 -0.52 0.00 0.00 37.83 35.73 1qbi s LYS 299 CO 0.88 -0.28 -0.06 0.14 -0.92 0.00 0.00 175.35 175.10 1qbi s VAL 300 N 1.71 1.26 0.64 3.17 -7.23 -1.26 -4.30 120.40 114.39 1qbi s VAL 300 Ca 0.05 -2.08 -0.11 0.00 -1.81 0.00 0.00 61.98 58.03 1qbi s VAL 300 Cb -0.13 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.63 1qbi s VAL 300 CO -0.08 -0.50 1.04 0.00 -0.31 0.00 0.00 175.10 175.25 1qbi s ALA 301 N -3.27 3.00 0.33 1.32 0.00 -1.26 -5.00 121.76 116.88 1qbi s ALA 301 Ca 0.24 -0.05 -0.29 0.00 0.00 0.00 0.00 51.96 51.86 1qbi s ALA 301 Cb 0.03 -3.10 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 1qbi s ALA 301 CO 0.06 -0.82 1.37 0.00 0.00 0.00 0.00 175.76 176.38 1qbi s ALA 302 N -3.15 3.54 0.00 0.00 0.00 -1.26 -3.83 121.76 117.06 1qbi s ALA 302 Ca 0.56 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.87 1qbi s ALA 302 Cb -0.12 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1qbi s ALA 302 CO 0.54 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1qbi n GLY 303 N 0.90 0.74 3.26 0.00 0.00 -1.26 -4.97 105.19 103.87 1qbi n GLY 303 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1qbi n GLY 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbi s VAL 304 N -2.00 2.82 0.16 1.61 0.11 -1.25 -4.01 120.40 117.85 1qbi s VAL 304 Ca 0.00 -0.70 -0.32 0.00 -2.93 0.00 0.00 61.98 58.03 1qbi s VAL 304 Cb 0.00 -2.22 -0.10 0.00 -1.53 0.00 0.00 36.38 32.52 1qbi s VAL 304 CO 0.00 0.49 1.64 -2.16 -3.33 0.00 0.00 175.10 171.74 1qbi s PRO 305 N 1.07 4.18 -0.08 1.54 0.04 -1.26 -4.86 135.00 135.64 1qbi s PRO 305 Ca -0.00 2.44 0.03 0.00 0.04 0.00 0.00 61.00 63.51 1qbi s PRO 305 Cb -0.15 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.17 1qbi s PRO 305 CO -0.03 -0.67 -0.15 0.08 0.04 0.00 0.00 177.00 176.26 1qbi s VAL 306 N 1.40 2.91 -0.10 -0.36 1.01 -1.26 -1.61 120.40 122.39 1qbi s VAL 306 Ca 0.72 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1qbi s VAL 306 Cb -0.45 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 33.77 1qbi s VAL 306 CO 0.32 0.56 -0.22 -0.89 0.00 0.00 0.00 175.10 174.87 1qbi s THR 307 N -0.27 1.93 0.64 3.92 2.01 -0.06 -4.96 115.64 118.85 1qbi s THR 307 Ca 0.01 -0.93 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 1qbi s THR 307 Cb -0.13 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 1qbi s THR 307 CO 0.03 0.53 1.09 -0.54 -0.69 0.00 0.00 174.62 175.03 1qbi s LYS 308 N 0.50 2.97 0.30 4.92 1.02 -1.26 -1.19 119.74 127.00 1qbi s LYS 308 Ca -0.16 1.29 0.02 0.00 0.02 0.00 0.00 55.97 57.14 1qbi s LYS 308 Cb -0.17 -1.98 0.58 0.00 -0.52 0.00 0.00 37.83 35.74 1qbi s LYS 308 CO 0.06 -1.10 1.87 0.93 -0.92 0.00 0.00 175.35 176.18 1qbi h GLU 309 N 0.08 0.94 0.00 1.68 5.08 -1.84 -0.75 114.58 119.77 1qbi h GLU 309 Ca -0.46 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1qbi h GLU 309 Cb 1.23 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1qbi h GLU 309 CO 0.55 0.62 0.00 -1.13 -1.00 0.00 0.00 179.01 178.05 1qbi n SER 310 N -4.56 0.00 0.04 1.42 3.41 -1.26 -2.69 113.62 109.98 1qbi n SER 310 Ca 0.17 0.34 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 1qbi n SER 310 Cb 0.32 -0.44 0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1qbi n SER 310 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1qbi n GLU 311 N -1.44 0.36 -1.95 4.33 1.02 -0.30 -4.91 120.64 117.75 1qbi n GLU 311 Ca 0.07 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.82 1qbi n GLU 311 Cb 0.23 -1.64 -0.02 0.00 -0.02 0.00 0.00 31.44 29.99 1qbi n GLU 311 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1qbi s TRP 312 N -3.24 2.94 -0.90 -0.32 -0.00 -1.09 -4.94 118.94 111.39 1qbi s TRP 312 Ca 0.03 1.00 -0.16 0.00 -0.00 0.00 0.00 56.10 56.96 1qbi s TRP 312 Cb 0.13 -3.88 0.18 0.00 -0.00 0.00 0.00 33.47 29.91 1qbi s TRP 312 CO 0.79 -2.85 0.97 0.95 -0.00 0.00 0.00 176.95 176.80 1qbi s THR 313 N -0.11 5.23 0.15 5.86 -4.23 -1.26 -5.01 115.64 116.28 1qbi s THR 313 Ca 0.59 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1qbi s THR 313 Cb -0.43 -4.63 -0.04 0.00 1.34 0.00 0.00 72.50 68.74 1qbi s THR 313 CO 0.46 -1.27 0.32 -0.83 -0.54 0.00 0.00 174.62 172.76 1qbi s GLY 314 N 2.78 1.87 -0.07 3.99 0.00 -1.26 -5.12 107.32 109.51 1qbi s GLY 314 Ca 0.26 -0.88 0.04 0.00 0.00 0.00 0.00 44.72 44.14 1qbi s GLY 314 CO -0.09 -0.85 -0.18 0.54 0.00 0.00 0.00 173.10 172.52 1qbi s LYS 315 N -3.09 2.29 -1.39 2.90 3.01 -1.26 -4.78 119.74 117.42 1qbi s LYS 315 Ca 0.37 -0.66 -0.04 0.00 -1.01 0.00 0.00 55.97 54.63 1qbi s LYS 315 Cb -0.11 -1.83 0.00 0.00 -1.01 0.00 0.00 37.83 34.88 1qbi s LYS 315 CO 0.28 0.15 0.46 0.09 0.51 0.00 0.00 175.35 176.84 1qbi n ASN 316 N 3.53 -5.55 -4.68 2.83 4.13 -1.26 -4.49 115.26 109.77 1qbi n ASN 316 Ca -0.20 -0.22 -0.42 0.00 1.68 0.00 0.00 54.58 55.42 1qbi n ASN 316 Cb 0.52 -4.41 -0.03 0.00 -1.54 0.00 0.00 39.78 34.33 1qbi n ASN 316 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1qbi s PHE 317 N -3.08 2.32 -0.25 3.10 5.36 -1.25 -0.40 117.98 123.79 1qbi s PHE 317 Ca 0.23 0.38 -0.03 0.00 -0.96 0.00 0.00 56.93 56.55 1qbi s PHE 317 Cb -0.10 -3.87 0.01 0.00 -0.34 0.00 0.00 43.02 38.73 1qbi s PHE 317 CO 0.28 -3.51 -0.02 0.08 -1.46 0.00 0.00 175.22 170.59 1qbi s VAL 318 N 3.23 3.25 0.62 3.12 1.01 0.51 -4.90 120.40 127.25 1qbi s VAL 318 Ca 0.71 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.73 1qbi s VAL 318 Cb -0.35 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1qbi s VAL 318 CO 0.29 0.22 1.05 -2.16 0.00 0.00 0.00 175.10 174.50 1qbi s PRO 319 N 1.40 3.27 0.69 2.72 0.04 -1.26 -4.57 135.00 137.30 1qbi s PRO 319 Ca 0.02 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 61.95 1qbi s PRO 319 Cb -0.16 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.36 1qbi s PRO 319 CO -0.03 -0.83 1.16 -1.25 0.04 0.00 0.00 177.00 176.09 1qbi s PRO 320 N -4.53 2.49 0.21 0.56 0.04 -1.26 -4.79 135.00 127.71 1qbi s PRO 320 Ca 0.60 1.58 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1qbi s PRO 320 Cb -0.14 -1.89 0.19 0.00 0.04 0.00 0.00 34.50 32.69 1qbi s PRO 320 CO 0.44 -1.53 1.54 -0.07 0.04 0.00 0.00 177.00 177.42 1qbi h LEU 321 N -0.10 0.46 -7.18 -3.56 3.38 -0.93 -3.46 115.31 103.92 1qbi h LEU 321 Ca -0.47 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.16 1qbi h LEU 321 Cb 1.27 -0.13 -0.22 0.00 0.09 0.00 0.00 40.66 41.67 1qbi h LEU 321 CO 0.52 0.93 -0.06 -0.75 0.09 0.00 0.00 178.44 179.17 1qbi s LYS 322 N -3.92 0.68 -0.01 1.13 2.20 -1.14 -4.79 119.74 113.90 1qbi s LYS 322 Ca -0.06 0.65 0.05 0.00 -0.36 0.00 0.00 55.97 56.25 1qbi s LYS 322 Cb 0.12 0.33 -0.03 0.00 -1.51 0.00 0.00 37.83 36.74 1qbi s LYS 322 CO 0.82 -0.11 -0.16 0.95 -0.36 0.00 0.00 175.35 176.50 1qbi s THR 323 N 0.04 2.97 -0.51 3.43 -4.23 -1.26 -0.52 115.64 115.55 1qbi s THR 323 Ca -0.02 -0.93 0.05 0.00 -1.18 0.00 0.00 61.69 59.60 1qbi s THR 323 Cb -0.04 -2.21 0.18 0.00 1.34 0.00 0.00 72.50 71.78 1qbi s THR 323 CO 0.02 0.47 0.43 0.18 -0.54 0.00 0.00 174.62 175.17 1qbi n LEU 324 N 1.93 0.84 -4.23 4.79 4.77 0.01 -1.52 117.00 123.60 1qbi n LEU 324 Ca -0.16 -4.71 -0.14 0.00 -0.03 0.00 0.00 56.01 50.96 1qbi n LEU 324 Cb 0.52 0.11 -0.09 0.00 -2.33 0.00 0.00 43.42 41.63 1qbi n LEU 324 CO 0.26 1.86 -0.20 -0.31 -1.33 0.00 0.00 177.39 177.68 1qbi s TYR 325 N -0.66 1.34 -0.12 -1.77 1.51 0.05 -2.46 117.35 115.24 1qbi s TYR 325 Ca 0.31 -1.46 -0.02 0.00 -1.01 0.00 0.00 57.07 54.89 1qbi s TYR 325 Cb 0.04 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.25 1qbi s TYR 325 CO -0.17 -0.70 -0.04 0.99 -1.11 0.00 0.00 175.55 174.52 1qbi s THR 326 N -3.95 3.95 0.30 -0.71 2.01 -0.23 0.78 115.64 117.79 1qbi s THR 326 Ca 0.40 -0.36 0.03 0.00 0.31 0.00 0.00 61.69 62.06 1qbi s THR 326 Cb 0.06 -2.68 -0.06 0.00 0.01 0.00 0.00 72.50 69.82 1qbi s THR 326 CO 0.17 0.54 0.07 0.68 -0.69 0.00 0.00 174.62 175.39 1qbi s VAL 327 N -0.21 1.00 0.51 3.82 -7.23 -1.26 -4.57 120.40 112.46 1qbi s VAL 327 Ca 0.04 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1qbi s VAL 327 Cb -0.13 -2.75 0.02 0.00 0.56 0.00 0.00 36.38 34.08 1qbi s VAL 327 CO 0.02 -0.00 0.74 -1.10 -0.31 0.00 0.00 175.10 174.45 1qbi s GLN 328 N -3.93 2.80 0.62 4.82 -0.21 -1.26 -2.99 119.66 119.50 1qbi s GLN 328 Ca 0.37 -0.59 0.36 0.00 0.02 0.00 0.00 55.36 55.52 1qbi s GLN 328 Cb 0.08 -2.50 2.07 0.00 1.00 0.00 0.00 33.01 33.66 1qbi s GLN 328 CO 0.15 -0.52 2.30 -0.44 -2.12 0.00 0.00 175.29 174.66 1qbi h ASP 329 N 0.19 0.00 0.74 5.90 3.32 -1.88 -0.98 116.42 123.71 1qbi h ASP 329 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1qbi h ASP 329 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1qbi h ASP 329 CO 0.55 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 178.42 1qbi n THR 330 N -3.54 0.14 -1.75 0.35 -2.24 -1.26 -4.89 114.28 101.10 1qbi n THR 330 Ca -0.03 0.04 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1qbi n THR 330 Cb 0.08 -0.58 0.02 0.00 -2.10 0.00 0.00 70.33 67.75 1qbi n THR 330 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qbi n TYR 331 N -1.40 2.61 -3.63 4.78 9.36 -0.37 -4.97 117.16 123.53 1qbi n TYR 331 Ca 0.09 0.45 -0.40 0.00 3.32 0.00 0.00 57.90 61.37 1qbi n TYR 331 Cb 0.27 -2.45 -0.11 0.00 -0.63 0.00 0.00 39.34 36.42 1qbi n TYR 331 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1qbi s ASN 332 N -0.45 5.60 0.00 2.98 3.04 -1.26 -4.94 114.94 119.92 1qbi s ASN 332 Ca 0.60 -1.33 0.27 0.00 0.04 0.00 0.00 52.86 52.44 1qbi s ASN 332 Cb -0.47 -1.97 1.55 0.00 -1.54 0.00 0.00 41.25 38.82 1qbi s ASN 332 CO 0.58 -0.47 1.93 -1.22 -3.04 0.00 0.00 177.10 174.89 1qbi n TYR 333 N 4.91 0.00 -3.15 0.43 4.02 -1.26 -5.02 117.16 117.09 1qbi n TYR 333 Ca -0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.38 1qbi n TYR 333 Cb 0.44 -0.05 -0.01 0.00 -0.02 0.00 0.00 39.34 39.70 1qbi n TYR 333 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1qbi n ASN 334 N -1.05 5.72 0.00 7.72 3.02 -1.26 -4.84 115.26 124.57 1qbi n ASN 334 Ca 0.19 -3.37 0.00 0.00 -0.03 0.00 0.00 54.58 51.37 1qbi n ASN 334 Cb 0.11 -1.16 0.00 0.00 -0.61 0.00 0.00 39.78 38.12 1qbi n ASN 334 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qbi n TRP 346 N 0.00 1.13 -1.02 0.00 8.01 -1.26 -4.80 117.44 119.50 1qbi n TRP 346 Ca 0.00 0.47 -0.30 0.00 -1.31 0.00 0.00 57.50 56.36 1qbi n TRP 346 Cb 0.00 -2.20 -0.02 0.00 -2.01 0.00 0.00 31.31 27.08 1qbi n TRP 346 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 1qbi n PRO 347 N -0.58 2.71 -4.31 -0.99 -0.04 -1.19 -4.77 135.00 125.83 1qbi n PRO 347 Ca 0.11 -1.81 -0.17 0.00 -0.04 0.00 0.00 63.50 61.60 1qbi n PRO 347 Cb 0.44 -2.64 -0.09 0.00 -0.04 0.00 0.00 33.50 31.17 1qbi n PRO 347 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1qbi s THR 348 N 3.00 0.29 0.00 0.52 -4.23 -1.26 -0.77 115.64 113.19 1qbi s THR 348 Ca 0.52 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1qbi s THR 348 Cb 0.13 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.45 1qbi s THR 348 CO -0.04 0.00 0.00 1.33 -0.54 0.00 0.00 174.62 175.37 1qbi n VAL 349 N -0.52 0.00 -3.33 2.29 0.24 -1.21 -4.85 118.33 110.95 1qbi n VAL 349 Ca 0.01 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 61.95 1qbi n VAL 349 Cb 0.65 0.99 0.01 0.00 -1.47 0.00 0.00 33.84 34.03 1qbi n VAL 349 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qbi n ALA 350 N -0.50 -2.57 -1.86 2.33 0.00 -1.26 -3.18 120.51 113.46 1qbi n ALA 350 Ca 0.00 -0.08 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1qbi n ALA 350 Cb 0.00 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.19 1qbi n ALA 350 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1qbi s PRO 351 N -4.02 4.24 0.00 0.00 0.04 -1.26 -1.13 135.00 132.87 1qbi s PRO 351 Ca 0.13 2.35 0.10 0.00 0.04 0.00 0.00 61.00 63.62 1qbi s PRO 351 Cb -0.03 -3.10 -0.06 0.00 0.04 0.00 0.00 34.50 31.35 1qbi s PRO 351 CO 0.80 -0.47 0.52 -1.13 0.04 0.00 0.00 177.00 176.76 1qbi n SER 352 N 2.41 0.82 -0.92 6.66 3.41 -0.38 -4.54 113.62 121.07 1qbi n SER 352 Ca 0.07 -0.91 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 1qbi n SER 352 Cb 0.40 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 1qbi n SER 352 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1qbi n SER 353 N -0.76 0.00 -3.61 4.04 2.88 -1.26 -4.52 113.62 110.38 1qbi n SER 353 Ca 0.03 -0.92 -0.01 0.00 -1.33 0.00 0.00 58.87 56.64 1qbi n SER 353 Cb 0.18 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.60 1qbi n SER 353 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qbi s ALA 354 N -1.00 -2.14 -0.06 -1.46 0.00 -1.26 -4.30 121.76 111.53 1qbi s ALA 354 Ca 0.00 2.31 0.01 0.00 0.00 0.00 0.00 51.96 54.28 1qbi s ALA 354 Cb 0.00 -1.80 0.02 0.00 0.00 0.00 0.00 23.12 21.34 1qbi s ALA 354 CO 0.00 -0.89 -0.07 -0.47 0.00 0.00 0.00 175.76 174.33 1qbi s TYR 355 N 2.73 1.11 -0.37 0.00 5.04 0.46 -4.28 117.35 122.05 1qbi s TYR 355 Ca -0.06 -0.41 -0.25 0.00 -2.44 0.00 0.00 57.07 53.91 1qbi s TYR 355 Cb -0.11 -0.91 0.01 0.00 0.35 0.00 0.00 41.96 41.31 1qbi s TYR 355 CO -0.19 -0.28 0.89 0.08 -1.34 0.00 0.00 175.55 174.71 1qbi s VAL 356 N 1.03 4.62 -0.18 3.14 1.01 -1.26 0.11 120.40 128.87 1qbi s VAL 356 Ca -0.09 1.12 -0.29 0.00 0.00 0.00 0.00 61.98 62.72 1qbi s VAL 356 Cb -0.14 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 1qbi s VAL 356 CO -0.00 -0.51 1.26 -0.47 0.00 0.00 0.00 175.10 175.38 1qbi s TYR 357 N 3.37 2.85 -2.55 5.22 5.04 -0.47 -4.90 117.35 125.91 1qbi s TYR 357 Ca 0.36 1.01 0.24 0.00 -2.44 0.00 0.00 57.07 56.25 1qbi s TYR 357 Cb -0.12 -3.53 0.27 0.00 0.35 0.00 0.00 41.96 38.94 1qbi s TYR 357 CO 0.18 -1.66 1.29 1.63 -1.34 0.00 0.00 175.55 175.65 1qbi n LYS 358 N 6.66 1.79 0.00 4.97 5.02 -1.26 -4.33 118.16 131.01 1qbi n LYS 358 Ca 0.14 -1.42 0.00 0.00 -2.02 0.00 0.00 58.31 55.01 1qbi n LYS 358 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 1qbi n LYS 358 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qbi n GLY 359 N 1.35 2.16 0.00 0.72 0.00 -1.26 -5.03 105.19 103.13 1qbi n GLY 359 Ca 0.13 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1qbi n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qbi n GLY 360 N 0.00 0.62 0.29 -0.02 0.00 -1.25 -3.04 105.19 101.78 1qbi n GLY 360 Ca 0.00 -2.15 0.17 0.00 0.00 0.00 0.00 46.02 44.04 1qbi n GLY 360 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1qbi h LYS 361 N 8.42 0.00 -0.66 1.61 2.10 -1.76 -0.94 116.57 125.34 1qbi h LYS 361 Ca 0.00 0.00 -0.47 0.00 -2.00 0.00 0.00 60.65 58.18 1qbi h LYS 361 Cb 0.00 0.00 -0.34 0.00 -0.90 0.00 0.00 32.23 30.99 1qbi h LYS 361 CO 0.00 0.05 -0.56 1.63 -2.00 0.00 0.00 179.45 178.57 1qbi n LYS 362 N -3.33 3.16 -1.56 0.07 5.02 0.74 -5.06 118.16 117.20 1qbi n LYS 362 Ca -0.01 -3.91 -0.41 0.00 -2.02 0.00 0.00 58.31 51.95 1qbi n LYS 362 Cb 0.21 -2.17 0.01 0.00 -0.02 0.00 0.00 35.03 33.06 1qbi n LYS 362 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qbi n ALA 363 N -0.81 -0.35 -2.50 7.82 0.00 -0.36 -3.15 120.51 121.16 1qbi n ALA 363 Ca 0.42 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.62 1qbi n ALA 363 Cb 0.91 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 1qbi n ALA 363 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1qbi s ILE 364 N -1.36 4.33 0.15 0.00 1.01 -1.26 -4.89 121.20 119.18 1qbi s ILE 364 Ca 0.65 1.65 -0.34 0.00 0.00 0.00 0.00 60.65 62.61 1qbi s ILE 364 Cb -0.56 -4.06 -0.15 0.00 0.01 0.00 0.00 42.46 37.71 1qbi s ILE 364 CO 0.56 0.03 1.49 0.41 0.00 0.00 0.00 174.94 177.42 1qbi n THR 365 N 4.46 0.15 -0.63 2.92 -1.04 -1.26 -1.81 114.28 117.07 1qbi n THR 365 Ca 0.10 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1qbi n THR 365 Cb 0.47 -1.34 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 1qbi n THR 365 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qbi n GLY 366 N 3.00 0.96 1.55 3.41 0.00 -1.26 -4.92 105.19 107.93 1qbi n GLY 366 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 1qbi n GLY 366 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1qbi n TRP 367 N -2.00 1.51 -1.74 1.61 7.02 -0.75 -4.96 117.44 118.13 1qbi n TRP 367 Ca 0.00 -0.56 -0.41 0.00 -1.02 0.00 0.00 57.50 55.50 1qbi n TRP 367 Cb 0.00 -0.32 0.00 0.00 -2.42 0.00 0.00 31.31 28.57 1qbi n TRP 367 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1qbi n GLU 368 N 0.80 2.34 -4.01 -0.99 4.71 -1.26 -2.66 120.64 119.56 1qbi n GLU 368 Ca 0.23 0.82 -0.30 0.00 -0.01 0.00 0.00 57.16 57.90 1qbi n GLU 368 Cb 0.91 -2.52 -0.00 0.00 -1.01 0.00 0.00 31.44 28.81 1qbi n GLU 368 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1qbi n ASN 369 N 0.42 -2.68 -4.93 1.62 5.03 -1.26 -4.62 115.26 108.83 1qbi n ASN 369 Ca 0.04 -0.93 -0.27 0.00 0.87 0.00 0.00 54.58 54.29 1qbi n ASN 369 Cb 0.38 -3.28 -0.03 0.00 -1.02 0.00 0.00 39.78 35.84 1qbi n ASN 369 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1qbi s THR 370 N -3.52 5.27 -0.20 3.41 -4.23 -1.09 -0.51 115.64 114.78 1qbi s THR 370 Ca 0.44 -0.66 -0.03 0.00 -1.18 0.00 0.00 61.69 60.26 1qbi s THR 370 Cb -0.23 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 69.91 1qbi s THR 370 CO 0.88 -0.05 -0.07 -0.22 -0.54 0.00 0.00 174.62 174.61 1qbi s LEU 371 N -3.09 2.80 -0.16 4.79 2.96 0.17 -1.37 118.68 124.77 1qbi s LEU 371 Ca 0.34 -0.40 -0.16 0.00 -0.22 0.00 0.00 54.13 53.69 1qbi s LEU 371 Cb -0.11 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 1qbi s LEU 371 CO 0.28 0.02 0.40 -0.76 -1.32 0.00 0.00 176.35 174.97 1qbi s LEU 372 N 1.21 4.22 -0.26 -0.68 1.43 0.12 -0.51 118.68 124.20 1qbi s LEU 372 Ca 0.02 0.62 -0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1qbi s LEU 372 Cb -0.14 -2.54 0.08 0.00 0.03 0.00 0.00 46.19 43.61 1qbi s LEU 372 CO -0.02 -0.01 0.02 -0.69 0.23 0.00 0.00 176.35 175.88 1qbi s VAL 373 N 0.89 1.15 0.35 -1.59 1.01 0.23 -0.40 120.40 122.04 1qbi s VAL 373 Ca 0.21 -1.21 -0.27 0.00 0.00 0.00 0.00 61.98 60.70 1qbi s VAL 373 Cb -0.14 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 1qbi s VAL 373 CO 0.08 -0.35 1.18 -2.16 0.00 0.00 0.00 175.10 173.85 1qbi s PRO 374 N 1.53 4.30 -0.15 2.72 0.04 -1.26 -0.31 135.00 141.88 1qbi s PRO 374 Ca 0.02 1.91 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 1qbi s PRO 374 Cb -0.18 -2.92 -0.02 0.00 0.04 0.00 0.00 34.50 31.43 1qbi s PRO 374 CO -0.13 -0.13 -0.09 0.45 0.04 0.00 0.00 177.00 177.15 1qbi s SER 375 N -0.92 4.33 -0.12 6.66 0.15 0.13 -1.25 113.70 122.68 1qbi s SER 375 Ca 0.51 -0.26 -0.28 0.00 0.70 0.00 0.00 55.95 56.62 1qbi s SER 375 Cb -0.33 -1.69 -0.25 0.00 -1.71 0.00 0.00 66.02 62.04 1qbi s SER 375 CO 0.42 0.15 0.84 -0.07 1.20 0.00 0.00 173.24 175.78 1qbi h LEU 376 N 6.84 -0.00 -0.63 3.45 3.38 -1.08 -2.80 115.31 124.46 1qbi h LEU 376 Ca -0.29 -0.92 -0.15 0.00 0.09 0.00 0.00 57.88 56.61 1qbi h LEU 376 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1qbi h LEU 376 CO 0.59 0.93 -0.64 0.50 0.09 0.00 0.00 178.44 179.91 1qbi h LYS 377 N -0.93 0.19 0.00 1.13 3.64 -1.75 -3.29 116.57 115.56 1qbi h LYS 377 Ca -0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1qbi h LYS 377 Cb 0.92 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1qbi h LYS 377 CO 0.00 0.76 -1.18 0.54 -2.27 0.00 0.00 179.45 177.30 1qbi n ARG 378 N -3.84 0.25 -3.27 1.90 5.12 -1.26 -0.50 116.66 115.06 1qbi n ARG 378 Ca -0.02 -0.04 -0.17 0.00 -1.93 0.00 0.00 57.85 55.69 1qbi n ARG 378 Cb 0.64 -1.55 0.07 0.00 -1.16 0.00 0.00 32.46 30.46 1qbi n ARG 378 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qbi n GLY 379 N 1.40 -0.24 3.14 -0.13 0.00 -1.17 -4.66 105.19 103.53 1qbi n GLY 379 Ca 0.02 0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 1qbi n GLY 379 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qbi s VAL 380 N -3.28 0.29 -0.23 1.61 -7.23 -1.25 -1.25 120.40 109.07 1qbi s VAL 380 Ca 0.23 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.45 1qbi s VAL 380 Cb -0.10 -1.84 -0.02 0.00 0.56 0.00 0.00 36.38 34.98 1qbi s VAL 380 CO 0.59 -0.69 0.00 -0.63 -0.31 0.00 0.00 175.10 174.07 1qbi s ILE 381 N -3.90 3.81 0.26 -0.62 -1.09 0.21 -0.70 121.20 119.17 1qbi s ILE 381 Ca 0.17 -0.35 -0.19 0.00 -2.23 0.00 0.00 60.65 58.05 1qbi s ILE 381 Cb 0.07 -2.75 -0.09 0.00 -1.58 0.00 0.00 42.46 38.12 1qbi s ILE 381 CO -0.03 0.39 0.75 -0.36 -1.23 0.00 0.00 174.94 174.47 1qbi s PHE 382 N 1.44 3.59 -0.20 3.97 0.40 0.58 -0.65 117.98 127.12 1qbi s PHE 382 Ca 0.05 1.40 -0.02 0.00 -0.60 0.00 0.00 56.93 57.76 1qbi s PHE 382 Cb -0.15 -2.64 -0.00 0.00 0.51 0.00 0.00 43.02 40.74 1qbi s PHE 382 CO 0.00 0.27 -0.09 0.50 0.70 0.00 0.00 175.22 176.60 1qbi s ARG 383 N -2.20 3.31 -0.23 0.44 3.52 0.12 -0.60 118.95 123.32 1qbi s ARG 383 Ca 0.46 -0.67 0.00 0.00 -0.13 0.00 0.00 55.73 55.39 1qbi s ARG 383 Cb -0.15 -2.86 0.03 0.00 -1.56 0.00 0.00 34.95 30.41 1qbi s ARG 383 CO 0.20 -0.12 -0.11 0.42 -0.81 0.00 0.00 175.30 174.88 1qbi s ILE 384 N 1.23 2.48 0.36 4.11 1.01 0.33 -0.97 121.20 129.75 1qbi s ILE 384 Ca 0.03 -1.12 -0.25 0.00 0.00 0.00 0.00 60.65 59.31 1qbi s ILE 384 Cb -0.14 -2.24 -0.10 0.00 0.01 0.00 0.00 42.46 39.99 1qbi s ILE 384 CO -0.03 0.26 0.95 -0.75 0.00 0.00 0.00 174.94 175.37 1qbi s LYS 385 N 1.27 4.46 0.29 2.79 2.20 -1.26 0.43 119.74 129.92 1qbi s LYS 385 Ca -0.00 1.29 0.06 0.00 -0.36 0.00 0.00 55.97 56.96 1qbi s LYS 385 Cb -0.16 -2.62 -0.06 0.00 -1.51 0.00 0.00 37.83 33.48 1qbi s LYS 385 CO -0.07 0.17 -0.04 -0.51 -0.36 0.00 0.00 175.35 174.54 1qbi s LEU 386 N -2.39 2.46 1.06 5.43 1.02 0.34 -0.27 118.68 126.33 1qbi s LEU 386 Ca 0.54 -1.22 -0.15 0.00 0.02 0.00 0.00 54.13 53.32 1qbi s LEU 386 Cb -0.16 -0.62 0.22 0.00 0.02 0.00 0.00 46.19 45.65 1qbi s LEU 386 CO 0.21 -0.38 1.12 1.51 0.02 0.00 0.00 176.35 178.83 1qbi s ASP 387 N -3.46 2.14 0.48 2.29 1.47 -0.44 -4.74 116.67 114.42 1qbi s ASP 387 Ca 0.30 0.89 0.33 0.00 1.18 0.00 0.00 52.55 55.26 1qbi s ASP 387 Cb 0.05 -1.36 1.61 0.00 -0.34 0.00 0.00 42.92 42.88 1qbi s ASP 387 CO 0.13 -3.40 1.99 -0.65 0.68 0.00 0.00 175.17 173.92 1qbi h PRO 388 N -2.08 0.00 -0.26 2.11 0.11 -1.93 0.14 132.00 130.09 1qbi h PRO 388 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1qbi h PRO 388 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1qbi h PRO 388 CO 0.49 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.53 1qbi n THR 389 N -2.73 0.33 -3.86 -1.15 -2.24 -1.26 -4.95 114.28 98.41 1qbi n THR 389 Ca -0.01 -0.59 -0.27 0.00 -2.27 0.00 0.00 64.05 60.91 1qbi n THR 389 Cb 0.15 0.92 0.02 0.00 -2.10 0.00 0.00 70.33 69.31 1qbi n THR 389 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1qbi n TYR 390 N 1.16 -2.04 -0.05 4.78 4.02 0.48 -4.87 117.16 120.64 1qbi n TYR 390 Ca 0.18 0.86 -0.01 0.00 -0.01 0.00 0.00 57.90 58.91 1qbi n TYR 390 Cb 0.54 -4.05 -0.14 0.00 -0.02 0.00 0.00 39.34 35.67 1qbi n TYR 390 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1qbi n SER 391 N -2.93 0.78 -3.82 7.72 7.64 -1.26 -4.97 113.62 116.78 1qbi n SER 391 Ca -0.13 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.64 1qbi n SER 391 Cb 0.60 1.31 -0.09 0.00 -1.01 0.00 0.00 64.21 65.02 1qbi n SER 391 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1qbi s THR 392 N -2.78 0.09 0.51 0.44 -1.32 -1.26 -5.03 115.64 106.28 1qbi s THR 392 Ca -0.08 -0.73 -0.17 0.00 -1.21 0.00 0.00 61.69 59.50 1qbi s THR 392 Cb 0.08 -0.76 -0.08 0.00 -1.51 0.00 0.00 72.50 70.23 1qbi s THR 392 CO 0.73 -0.40 0.98 0.42 -2.21 0.00 0.00 174.62 174.14 1qbi s THR 393 N -2.07 4.52 -0.11 5.08 -4.23 -1.26 -1.32 115.64 116.25 1qbi s THR 393 Ca -0.09 1.24 -0.01 0.00 -1.18 0.00 0.00 61.69 61.65 1qbi s THR 393 Cb -0.03 -3.71 -0.03 0.00 1.34 0.00 0.00 72.50 70.07 1qbi s THR 393 CO -0.01 -0.65 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.03 1qbi s TYR 394 N -2.58 2.93 0.00 3.99 2.02 0.63 -4.74 117.35 119.59 1qbi s TYR 394 Ca 0.59 -0.24 0.00 0.00 -0.37 0.00 0.00 57.07 57.05 1qbi s TYR 394 Cb -0.10 -1.82 0.00 0.00 -0.40 0.00 0.00 41.96 39.64 1qbi s TYR 394 CO 0.30 0.08 0.00 -0.25 -1.57 0.00 0.00 175.55 174.11 1qbi n ASP 395 N 2.96 0.00 -4.88 2.29 8.00 -1.26 -4.07 116.55 119.59 1qbi n ASP 395 Ca -0.18 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.04 1qbi n ASP 395 Cb 0.53 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.61 1qbi n ASP 395 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1qbi s ASP 396 N -4.00 4.49 -0.34 -2.24 1.01 -1.26 -4.96 116.67 109.37 1qbi s ASP 396 Ca 0.00 -1.41 -0.24 0.00 0.71 0.00 0.00 52.55 51.62 1qbi s ASP 396 Cb 0.00 0.59 0.01 0.00 1.01 0.00 0.00 42.92 44.53 1qbi s ASP 396 CO 0.00 -1.11 0.80 0.00 0.21 0.00 0.00 175.17 175.07 1qbi s ALA 397 N -2.83 3.47 -0.26 5.23 0.00 -1.26 -4.49 121.76 121.61 1qbi s ALA 397 Ca 0.24 -0.53 -0.15 0.00 0.00 0.00 0.00 51.96 51.52 1qbi s ALA 397 Cb -0.02 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1qbi s ALA 397 CO 0.15 -1.37 0.36 0.08 0.00 0.00 0.00 175.76 174.98 1qbi s VAL 398 N 3.08 5.19 0.40 0.00 1.01 -0.14 -4.85 120.40 125.08 1qbi s VAL 398 Ca 0.32 0.54 -0.23 0.00 0.00 0.00 0.00 61.98 62.61 1qbi s VAL 398 Cb -0.13 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 1qbi s VAL 398 CO 0.15 0.18 1.00 -2.16 0.00 0.00 0.00 175.10 174.27 1qbi s PRO 399 N 1.95 4.24 0.07 2.72 0.04 -1.26 0.16 135.00 142.92 1qbi s PRO 399 Ca 0.15 1.37 -0.05 0.00 0.04 0.00 0.00 61.00 62.51 1qbi s PRO 399 Cb -0.16 -2.48 -0.02 0.00 0.04 0.00 0.00 34.50 31.88 1qbi s PRO 399 CO 0.10 -0.05 0.08 -1.64 0.04 0.00 0.00 177.00 175.53 1qbi s MET 400 N -2.61 0.71 -1.41 4.56 -1.94 0.17 -4.80 119.30 113.99 1qbi s MET 400 Ca 0.58 -1.05 -0.10 0.00 -1.71 0.00 0.00 55.69 53.41 1qbi s MET 400 Cb -0.18 0.27 0.04 0.00 2.01 0.00 0.00 34.83 36.97 1qbi s MET 400 CO 0.23 -0.18 1.07 1.19 -0.01 0.00 0.00 175.02 177.31 1qbi n PHE 401 N 0.11 -2.56 -1.67 -0.03 3.01 -0.93 -0.62 117.46 114.77 1qbi n PHE 401 Ca -0.15 0.96 -0.48 0.00 1.01 0.00 0.00 57.45 58.79 1qbi n PHE 401 Cb 0.61 -4.61 -0.05 0.00 -0.01 0.00 0.00 39.48 35.43 1qbi n PHE 401 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1qbi n LYS 402 N -4.79 2.01 -3.72 -1.08 3.00 0.14 -4.58 118.16 109.15 1qbi n LYS 402 Ca -0.02 0.73 -0.09 0.00 -0.00 0.00 0.00 58.31 58.93 1qbi n LYS 402 Cb 0.56 -2.50 -0.02 0.00 0.00 0.00 0.00 35.03 33.07 1qbi n LYS 402 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1qbi s SER 403 N 1.90 -0.35 -1.43 3.14 1.04 -0.38 -4.79 113.70 112.83 1qbi s SER 403 Ca 0.84 -0.42 -0.09 0.00 0.48 0.00 0.00 55.95 56.76 1qbi s SER 403 Cb -0.73 0.67 0.06 0.00 0.10 0.00 0.00 66.02 66.11 1qbi s SER 403 CO 0.44 -1.19 2.40 0.59 0.98 0.00 0.00 173.24 176.46 1qbi n ASN 404 N -0.42 6.70 -4.07 7.02 3.02 -1.26 -4.33 115.26 121.93 1qbi n ASN 404 Ca -0.09 -2.91 -0.13 0.00 -0.03 0.00 0.00 54.58 51.42 1qbi n ASN 404 Cb 0.61 -1.51 -0.11 0.00 -0.61 0.00 0.00 39.78 38.16 1qbi n ASN 404 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1qbi s ASN 405 N 1.57 0.92 -0.56 6.41 0.01 -1.26 -0.48 114.94 121.55 1qbi s ASN 405 Ca 0.54 -0.56 -0.17 0.00 -0.71 0.00 0.00 52.86 51.95 1qbi s ASN 405 Cb 0.15 0.03 0.12 0.00 0.41 0.00 0.00 41.25 41.96 1qbi s ASN 405 CO -0.06 -0.20 0.59 -0.13 -1.51 0.00 0.00 177.10 175.80 1qbi s ARG 406 N -1.62 3.02 -0.09 -0.60 0.52 -1.26 -3.40 118.95 115.52 1qbi s ARG 406 Ca -0.09 -1.52 -0.30 0.00 -0.52 0.00 0.00 55.73 53.30 1qbi s ARG 406 Cb -0.10 -4.28 -0.02 0.00 0.52 0.00 0.00 34.95 31.07 1qbi s ARG 406 CO 0.00 -1.42 1.16 0.71 0.02 0.00 0.00 175.30 175.77 1qbi s TYR 407 N 2.11 3.23 -0.19 -0.53 4.12 -1.07 -0.95 117.35 124.07 1qbi s TYR 407 Ca 0.07 1.29 0.11 0.00 0.02 0.00 0.00 57.07 58.56 1qbi s TYR 407 Cb -0.27 -3.37 -0.19 0.00 -1.52 0.00 0.00 41.96 36.60 1qbi s TYR 407 CO 0.05 -1.07 -0.03 -2.13 0.02 0.00 0.00 175.55 172.38 1qbi n ARG 408 N 5.38 0.91 -3.45 -0.62 3.00 0.60 -3.77 116.66 118.72 1qbi n ARG 408 Ca 0.11 0.04 -0.12 0.00 -0.00 0.00 0.00 57.85 57.88 1qbi n ARG 408 Cb 0.47 -1.45 -0.02 0.00 0.00 0.00 0.00 32.46 31.45 1qbi n ARG 408 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1qbi s ASP 409 N -5.54 -0.55 -0.18 6.15 -1.08 -1.22 -4.33 116.67 109.92 1qbi s ASP 409 Ca -0.17 -0.03 -0.17 0.00 -0.52 0.00 0.00 52.55 51.66 1qbi s ASP 409 Cb 0.06 0.60 0.05 0.00 -1.46 0.00 0.00 42.92 42.17 1qbi s ASP 409 CO 0.65 -0.98 0.49 0.54 0.52 0.00 0.00 175.17 176.39 1qbi s VAL 410 N -3.74 -0.00 0.24 1.11 0.11 -1.26 -1.58 120.40 115.28 1qbi s VAL 410 Ca 0.02 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.07 1qbi s VAL 410 Cb -0.01 -0.68 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 1qbi s VAL 410 CO -0.12 0.00 0.20 0.27 -3.33 0.00 0.00 175.10 172.12 1qbi s ILE 411 N 0.27 0.00 0.17 7.04 -4.36 -0.41 -4.73 121.20 119.18 1qbi s ILE 411 Ca -0.00 -1.94 0.08 0.00 -0.26 0.00 0.00 60.65 58.53 1qbi s ILE 411 Cb -0.03 -2.49 -0.04 0.00 1.25 0.00 0.00 42.46 41.15 1qbi s ILE 411 CO 0.00 0.00 -0.17 0.00 0.24 0.00 0.00 174.94 175.01 1qbi s ALA 412 N -3.96 2.00 0.83 2.27 0.00 -1.26 -0.68 121.76 120.95 1qbi s ALA 412 Ca 0.38 -1.52 -0.11 0.00 0.00 0.00 0.00 51.96 50.71 1qbi s ALA 412 Cb 0.05 -0.16 0.09 0.00 0.00 0.00 0.00 23.12 23.10 1qbi s ALA 412 CO 0.15 0.20 1.09 -1.54 0.00 0.00 0.00 175.76 175.67 1qbi s SER 413 N -2.78 4.08 0.37 0.00 1.04 0.20 -4.91 113.70 111.69 1qbi s SER 413 Ca 0.17 1.60 0.09 0.00 0.48 0.00 0.00 55.95 58.29 1qbi s SER 413 Cb -0.05 -2.30 0.83 0.00 0.10 0.00 0.00 66.02 64.60 1qbi s SER 413 CO 0.07 -2.27 1.89 -0.65 0.98 0.00 0.00 173.24 173.26 1qbi h PRO 414 N -1.29 0.65 0.00 4.02 0.11 -1.91 -0.87 132.00 132.71 1qbi h PRO 414 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1qbi h PRO 414 Cb 1.26 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1qbi h PRO 414 CO 0.54 0.43 -0.12 -0.44 -0.21 0.00 0.00 178.00 178.20 1qbi h ASP 415 N 0.67 0.00 0.00 -2.05 3.32 -1.92 -3.38 116.42 113.06 1qbi h ASP 415 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1qbi h ASP 415 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1qbi h ASP 415 CO -0.17 0.12 0.00 0.61 -1.72 0.00 0.00 179.24 178.08 1qbi n GLY 416 N 0.56 0.68 0.14 2.75 0.00 -0.33 -0.19 105.19 108.80 1qbi n GLY 416 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1qbi n GLY 416 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1qbi n ASN 417 N 0.00 0.87 -4.24 1.61 6.94 -1.19 -4.01 115.26 115.24 1qbi n ASN 417 Ca 0.00 -0.67 -0.32 0.00 -0.02 0.00 0.00 54.58 53.57 1qbi n ASN 417 Cb 0.00 0.27 -0.17 0.00 -2.36 0.00 0.00 39.78 37.52 1qbi n ASN 417 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1qbi s VAL 418 N -2.75 2.04 -0.09 3.53 1.01 -1.26 -4.30 120.40 118.58 1qbi s VAL 418 Ca 0.17 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1qbi s VAL 418 Cb 0.18 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1qbi s VAL 418 CO 0.62 0.56 -0.05 -0.76 0.00 0.00 0.00 175.10 175.48 1qbi s LEU 419 N 0.14 3.25 -0.14 3.92 1.43 0.70 -0.63 118.68 127.35 1qbi s LEU 419 Ca -0.13 -0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1qbi s LEU 419 Cb -0.16 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 1qbi s LEU 419 CO 0.07 0.32 -0.13 -0.31 0.23 0.00 0.00 176.35 176.53 1qbi s TYR 420 N -0.56 2.81 0.06 0.29 1.51 0.14 -0.64 117.35 120.96 1qbi s TYR 420 Ca 0.09 -0.73 0.06 0.00 -1.01 0.00 0.00 57.07 55.48 1qbi s TYR 420 Cb -0.12 -1.86 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 1qbi s TYR 420 CO 0.02 -0.27 -0.18 0.08 -1.11 0.00 0.00 175.55 174.09 1qbi s VAL 421 N 0.46 1.43 -0.01 0.71 1.01 0.76 -1.29 120.40 123.47 1qbi s VAL 421 Ca -0.10 -1.25 -0.01 0.00 0.00 0.00 0.00 61.98 60.62 1qbi s VAL 421 Cb -0.16 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1qbi s VAL 421 CO 0.05 0.00 0.08 -0.76 0.00 0.00 0.00 175.10 174.47 1qbi s LEU 422 N -1.46 3.88 0.09 3.92 1.43 -0.61 -0.43 118.68 125.50 1qbi s LEU 422 Ca 0.04 0.15 0.09 0.00 -1.03 0.00 0.00 54.13 53.38 1qbi s LEU 422 Cb -0.09 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 1qbi s LEU 422 CO 0.02 0.28 -0.23 0.42 0.23 0.00 0.00 176.35 177.07 1qbi s THR 423 N -1.16 1.92 0.81 5.49 -4.23 -0.31 -0.29 115.64 117.86 1qbi s THR 423 Ca 0.22 -1.49 -0.11 0.00 -1.18 0.00 0.00 61.69 59.12 1qbi s THR 423 Cb -0.12 -1.70 0.08 0.00 1.34 0.00 0.00 72.50 72.11 1qbi s THR 423 CO 0.13 0.11 1.13 -1.81 -0.54 0.00 0.00 174.62 173.64 1qbi s ASP 424 N -1.66 3.93 0.08 3.99 1.01 -0.12 -3.11 116.67 120.78 1qbi s ASP 424 Ca 0.10 2.05 -0.13 0.00 0.71 0.00 0.00 52.55 55.28 1qbi s ASP 424 Cb -0.10 -2.55 -0.22 0.00 1.01 0.00 0.00 42.92 41.06 1qbi s ASP 424 CO 0.04 -2.42 1.19 0.74 0.21 0.00 0.00 175.17 174.93 1qbi h THR 425 N -1.18 1.30 -3.60 -1.27 2.02 -1.88 0.83 112.91 109.12 1qbi h THR 425 Ca -0.44 -2.31 -0.06 0.00 0.77 0.00 0.00 66.41 64.36 1qbi h THR 425 Cb 1.25 2.44 -0.11 0.00 -1.74 0.00 0.00 68.15 69.99 1qbi h THR 425 CO 0.48 0.71 -0.14 0.00 0.37 0.00 0.00 175.52 176.93 1qbi s ALA 426 N -3.25 -0.44 0.00 6.16 0.00 -1.26 -4.31 121.76 118.65 1qbi s ALA 426 Ca -0.09 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1qbi s ALA 426 Cb 0.07 0.87 0.00 0.00 0.00 0.00 0.00 23.12 24.06 1qbi s ALA 426 CO 0.92 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 176.35 1qbi n GLY 427 N -0.29 0.87 3.91 0.00 0.00 -1.26 -5.04 105.19 103.38 1qbi n GLY 427 Ca -0.08 -2.04 -0.29 0.00 0.00 0.00 0.00 46.02 43.61 1qbi n GLY 427 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qbi s ASN 428 N -2.15 6.24 -0.03 1.61 0.01 -1.26 -4.29 114.94 115.07 1qbi s ASN 428 Ca 0.00 0.19 -0.17 0.00 -0.71 0.00 0.00 52.86 52.17 1qbi s ASN 428 Cb 0.00 -1.87 0.03 0.00 0.41 0.00 0.00 41.25 39.82 1qbi s ASN 428 CO 0.00 0.12 0.37 0.54 -1.51 0.00 0.00 177.10 176.62 1qbi s VAL 429 N -1.61 0.04 0.02 1.60 0.11 0.08 -4.66 120.40 115.99 1qbi s VAL 429 Ca 0.34 -0.37 -0.30 0.00 -2.93 0.00 0.00 61.98 58.73 1qbi s VAL 429 Cb -0.12 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1qbi s VAL 429 CO 0.27 -0.20 0.96 -1.58 -3.33 0.00 0.00 175.10 171.22 1qbi s GLN 430 N -1.18 4.58 0.88 1.54 0.74 0.34 -0.82 119.66 125.74 1qbi s GLN 430 Ca -0.12 1.39 -0.12 0.00 0.05 0.00 0.00 55.36 56.56 1qbi s GLN 430 Cb -0.04 -3.44 0.16 0.00 1.10 0.00 0.00 33.01 30.79 1qbi s GLN 430 CO 0.05 0.02 1.22 0.15 -0.55 0.00 0.00 175.29 176.18 1qbi s LYS 431 N 0.75 1.09 0.40 1.67 1.02 0.12 -4.73 119.74 120.06 1qbi s LYS 431 Ca 0.50 -0.48 0.12 0.00 0.02 0.00 0.00 55.97 56.13 1qbi s LYS 431 Cb -0.21 -1.98 0.95 0.00 -0.52 0.00 0.00 37.83 36.07 1qbi s LYS 431 CO 0.28 -2.06 1.93 -0.44 -0.92 0.00 0.00 175.35 174.14 1qbi h ASP 432 N -1.29 0.49 -0.22 2.83 3.32 -1.90 -0.81 116.42 118.83 1qbi h ASP 432 Ca -0.43 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1qbi h ASP 432 Cb 1.26 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1qbi h ASP 432 CO 0.43 0.27 0.00 -0.90 -1.72 0.00 0.00 179.24 177.32 1qbi n ASP 433 N -4.49 1.37 0.00 6.45 3.85 -1.26 -4.45 116.55 118.01 1qbi n ASP 433 Ca 0.13 -1.89 0.00 0.00 -0.71 0.00 0.00 54.79 52.32 1qbi n ASP 433 Cb 0.43 -0.15 0.00 0.00 -1.35 0.00 0.00 41.12 40.05 1qbi n ASP 433 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1qbi n GLY 434 N 0.96 2.48 3.88 6.12 0.00 -0.31 -5.01 105.19 113.31 1qbi n GLY 434 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1qbi n GLY 434 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qbi s SER 435 N -1.79 5.57 0.03 1.61 1.04 -1.26 -4.63 113.70 114.27 1qbi s SER 435 Ca 0.00 1.18 -0.06 0.00 0.48 0.00 0.00 55.95 57.55 1qbi s SER 435 Cb 0.00 -2.02 -0.05 0.00 0.10 0.00 0.00 66.02 64.05 1qbi s SER 435 CO 0.00 -1.26 0.28 0.54 0.98 0.00 0.00 173.24 173.77 1qbi s VAL 436 N -3.33 5.29 0.03 5.02 0.11 -1.26 0.15 120.40 126.41 1qbi s VAL 436 Ca 0.58 0.11 0.03 0.00 -2.93 0.00 0.00 61.98 59.76 1qbi s VAL 436 Cb -0.11 -3.58 -0.02 0.00 -1.53 0.00 0.00 36.38 31.14 1qbi s VAL 436 CO 0.52 0.30 -0.08 0.28 -3.33 0.00 0.00 175.10 172.79 1qbi s THR 437 N -1.36 0.61 -1.06 5.04 -1.32 0.00 -4.89 115.64 112.66 1qbi s THR 437 Ca 0.30 -0.83 0.14 0.00 -1.21 0.00 0.00 61.69 60.09 1qbi s THR 437 Cb -0.13 -0.61 0.43 0.00 -1.51 0.00 0.00 72.50 70.68 1qbi s THR 437 CO 0.18 -0.18 1.36 -0.46 -2.21 0.00 0.00 174.62 173.31 1qbi n ASN 438 N 1.95 3.37 -4.43 8.08 0.23 -1.26 -0.74 115.26 122.46 1qbi n ASN 438 Ca -0.19 -2.14 -0.44 0.00 -0.53 0.00 0.00 54.58 51.28 1qbi n ASN 438 Cb 0.56 -0.34 -0.04 0.00 -2.08 0.00 0.00 39.78 37.88 1qbi n ASN 438 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1qbi s THR 439 N -1.26 4.59 -0.04 5.53 2.01 -1.26 -4.61 115.64 120.60 1qbi s THR 439 Ca 0.32 -0.87 -0.21 0.00 0.31 0.00 0.00 61.69 61.24 1qbi s THR 439 Cb 0.19 -4.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.00 1qbi s THR 439 CO 0.19 -1.37 0.59 -0.76 -0.69 0.00 0.00 174.62 172.58 1qbi s LEU 440 N 3.26 4.37 0.20 4.42 1.43 -1.26 -4.91 118.68 126.20 1qbi s LEU 440 Ca 0.21 1.10 -0.11 0.00 -1.03 0.00 0.00 54.13 54.30 1qbi s LEU 440 Cb -0.16 -2.91 0.13 0.00 0.03 0.00 0.00 46.19 43.28 1qbi s LEU 440 CO 0.04 0.05 1.86 -0.08 0.23 0.00 0.00 176.35 178.44 1qbi h GLU 441 N 6.03 0.94 -2.52 1.70 4.81 -1.18 -3.34 114.58 121.03 1qbi h GLU 441 Ca -0.44 -0.07 -0.60 0.00 -0.13 0.00 0.00 59.36 58.13 1qbi h GLU 441 Cb 1.20 -0.20 -0.40 0.00 0.63 0.00 0.00 28.75 29.97 1qbi h GLU 441 CO 0.72 0.64 -0.78 0.09 -0.73 0.00 0.00 179.01 178.95 1qbi n ASN 442 N -4.57 1.73 -4.72 1.04 4.13 -1.26 -5.10 115.26 106.50 1qbi n ASN 442 Ca 0.06 -2.94 -0.43 0.00 1.68 0.00 0.00 54.58 52.95 1qbi n ASN 442 Cb 0.03 -0.66 -0.02 0.00 -1.54 0.00 0.00 39.78 37.59 1qbi n ASN 442 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1qbi n PRO 443 N 1.88 2.49 -3.73 3.52 -0.02 -1.26 -3.62 135.00 134.27 1qbi n PRO 443 Ca 0.25 0.89 -0.26 0.00 -2.02 0.00 0.00 63.50 62.35 1qbi n PRO 443 Cb 0.43 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 1qbi n PRO 443 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qbi n GLY 444 N 2.16 -1.02 3.36 -1.23 0.00 0.28 -4.70 105.19 104.04 1qbi n GLY 444 Ca 0.10 0.46 -0.19 0.00 0.00 0.00 0.00 46.02 46.39 1qbi n GLY 444 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qbi s SER 445 N -3.08 2.42 -0.29 1.61 0.01 -1.18 -0.99 113.70 112.19 1qbi s SER 445 Ca 0.11 -1.11 -0.02 0.00 1.31 0.00 0.00 55.95 56.24 1qbi s SER 445 Cb -0.06 -0.11 0.04 0.00 0.21 0.00 0.00 66.02 66.10 1qbi s SER 445 CO 0.79 -0.30 0.00 -0.22 0.41 0.00 0.00 173.24 173.92 1qbi s LEU 446 N -3.34 3.79 0.14 2.44 2.96 0.32 -1.17 118.68 123.82 1qbi s LEU 446 Ca 0.25 -1.14 0.10 0.00 -0.22 0.00 0.00 54.13 53.12 1qbi s LEU 446 Cb 0.02 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 1qbi s LEU 446 CO 0.08 -0.23 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.05 1qbi s ILE 447 N 1.30 2.70 0.08 6.68 1.01 0.43 -0.28 121.20 133.10 1qbi s ILE 447 Ca -0.03 -1.64 0.08 0.00 0.00 0.00 0.00 60.65 59.06 1qbi s ILE 447 Cb -0.19 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1qbi s ILE 447 CO -0.01 0.05 -0.23 -1.59 0.00 0.00 0.00 174.94 173.16 1qbi s LYS 448 N -2.27 1.38 -0.17 2.79 -2.85 0.88 -0.17 119.74 119.32 1qbi s LYS 448 Ca 0.18 -1.10 0.01 0.00 -1.00 0.00 0.00 55.97 54.06 1qbi s LYS 448 Cb -0.10 -1.61 0.02 0.00 -2.06 0.00 0.00 37.83 34.09 1qbi s LYS 448 CO 0.10 0.40 -0.16 -0.06 0.10 0.00 0.00 175.35 175.72 1qbi s PHE 449 N -0.95 2.51 -1.62 1.78 0.40 0.19 -0.66 117.98 119.63 1qbi s PHE 449 Ca 0.09 -1.49 0.13 0.00 -0.60 0.00 0.00 56.93 55.06 1qbi s PHE 449 Cb -0.10 -1.76 0.10 0.00 0.51 0.00 0.00 43.02 41.78 1qbi s PHE 449 CO 0.03 -0.75 0.91 2.41 0.70 0.00 0.00 175.22 178.52