#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbf n GLN 2 N 0.00 0.80 -1.59 1.61 3.00 -1.26 -5.12 117.38 114.82 2qbf n GLN 2 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2qbf n GLN 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2qbf n GLN 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2qbf n LYS 3 N 0.00 -4.09 -2.74 -1.09 5.02 -1.26 -4.98 118.16 109.03 2qbf n LYS 3 Ca 0.00 3.00 -0.32 0.00 -2.02 0.00 0.00 58.31 58.97 2qbf n LYS 3 Cb 0.00 -3.14 -0.05 0.00 -0.02 0.00 0.00 35.03 31.82 2qbf n LYS 3 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbf s VAL 4 N -0.73 4.56 -0.11 -0.18 0.11 -1.26 -4.97 120.40 117.82 2qbf s VAL 4 Ca 0.00 1.14 -0.29 0.00 -2.93 0.00 0.00 61.98 59.91 2qbf s VAL 4 Cb 0.00 -3.67 -0.06 0.00 -1.53 0.00 0.00 36.38 31.12 2qbf s VAL 4 CO 0.00 -0.46 2.06 -2.28 -3.33 0.00 0.00 175.10 171.09 2qbf s HIS 5 N -2.33 1.30 -0.36 1.54 2.46 -1.26 -4.83 115.29 111.80 2qbf s HIS 5 Ca 0.58 0.12 0.13 0.00 0.47 0.00 0.00 55.06 56.36 2qbf s HIS 5 Cb -0.10 -4.07 0.72 0.00 -0.13 0.00 0.00 32.58 29.01 2qbf s HIS 5 CO 0.23 -4.61 1.37 -0.35 -2.47 0.00 0.00 174.74 168.92 2qbf n PRO 6 N 8.15 0.09 -0.12 2.88 -0.04 -1.26 -1.36 135.00 143.33 2qbf n PRO 6 Ca 0.25 0.56 -0.26 0.00 -0.04 0.00 0.00 63.50 64.01 2qbf n PRO 6 Cb 0.43 -1.87 -0.11 0.00 -0.04 0.00 0.00 33.50 31.92 2qbf n PRO 6 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2qbf n ASN 7 N -1.97 1.91 0.04 3.54 5.15 -1.26 -3.87 115.26 118.80 2qbf n ASN 7 Ca -0.01 0.38 0.03 0.00 -0.60 0.00 0.00 54.58 54.37 2qbf n ASN 7 Cb 0.10 -0.89 0.39 0.00 -0.53 0.00 0.00 39.78 38.85 2qbf n ASN 7 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2qbf h GLY 8 N -0.99 0.47 2.00 8.20 0.00 -1.88 0.34 103.07 111.22 2qbf h GLY 8 Ca -0.54 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2qbf h GLY 8 CO -0.33 0.22 0.00 1.19 0.00 0.00 0.00 176.54 177.62 2qbf h ILE 9 N 0.44 0.00 -0.09 2.60 6.09 -1.41 -2.81 117.51 122.32 2qbf h ILE 9 Ca 0.11 -0.39 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 2qbf h ILE 9 Cb 0.16 1.25 0.00 0.00 0.47 0.00 0.00 36.82 38.69 2qbf h ILE 9 CO -0.01 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.61 2qbf n ARG 10 N -2.58 1.64 0.29 2.19 1.74 -0.12 -4.67 116.66 115.15 2qbf n ARG 10 Ca 0.02 -1.35 0.17 0.00 -0.77 0.00 0.00 57.85 55.92 2qbf n ARG 10 Cb 0.29 -1.10 0.88 0.00 -1.02 0.00 0.00 32.46 31.50 2qbf n ARG 10 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2qbf h LEU 11 N 0.86 0.00 0.04 0.55 3.38 -0.15 -1.27 115.31 118.72 2qbf h LEU 11 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 2qbf h LEU 11 Cb 0.44 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2qbf h LEU 11 CO 0.00 0.00 -1.86 0.61 0.09 0.00 0.00 178.44 177.28 2qbf n GLY 12 N -1.25 -0.84 3.13 0.83 0.00 -1.26 -4.55 105.19 101.25 2qbf n GLY 12 Ca -0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 2qbf n GLY 12 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qbf s ILE 13 N -2.58 0.90 0.00 -0.61 -0.00 -0.49 -4.81 121.20 113.61 2qbf s ILE 13 Ca -0.11 -1.20 0.00 0.00 -0.00 0.00 0.00 60.65 59.33 2qbf s ILE 13 Cb 0.07 -0.90 0.00 0.00 -0.00 0.00 0.00 42.46 41.64 2qbf s ILE 13 CO 0.80 -0.27 0.00 1.33 -0.00 0.00 0.00 174.94 176.80 2qbf n VAL 14 N 1.39 0.00 -3.66 8.37 0.24 -1.26 -4.68 118.33 118.73 2qbf n VAL 14 Ca -0.22 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 61.91 2qbf n VAL 14 Cb 0.54 -0.25 -0.16 0.00 -1.47 0.00 0.00 33.84 32.51 2qbf n VAL 14 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2qbf s LYS 15 N -0.50 0.03 0.60 7.34 3.01 -1.17 -4.81 119.74 124.24 2qbf s LYS 15 Ca 0.00 0.52 -0.10 0.00 -1.01 0.00 0.00 55.97 55.38 2qbf s LYS 15 Cb 0.00 -0.38 -0.03 0.00 -1.01 0.00 0.00 37.83 36.41 2qbf s LYS 15 CO 0.00 -0.33 0.99 -1.25 0.51 0.00 0.00 175.35 175.26 2qbf s PRO 16 N 2.28 3.49 0.00 -1.68 0.04 -1.26 -4.17 135.00 133.70 2qbf s PRO 16 Ca 0.03 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2qbf s PRO 16 Cb -0.12 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2qbf s PRO 16 CO -0.06 -0.55 0.00 0.91 0.04 0.00 0.00 177.00 177.34 2qbf n TRP 17 N -2.68 -2.77 -0.02 0.56 8.01 -1.26 -4.97 117.44 114.32 2qbf n TRP 17 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 2qbf n TRP 17 Cb 0.55 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.85 2qbf n TRP 17 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 2qbf n ASN 18 N -2.54 0.02 -3.10 -0.99 4.13 -1.26 -4.91 115.26 106.60 2qbf n ASN 18 Ca 0.00 -0.30 -0.19 0.00 1.68 0.00 0.00 54.58 55.77 2qbf n ASN 18 Cb 0.00 0.53 -0.04 0.00 -1.54 0.00 0.00 39.78 38.73 2qbf n ASN 18 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2qbf n SER 19 N -0.53 -1.14 -4.57 6.41 7.64 -1.26 -0.69 113.62 119.47 2qbf n SER 19 Ca 0.00 -2.75 -0.43 0.00 1.01 0.00 0.00 58.87 56.71 2qbf n SER 19 Cb 0.00 0.20 -0.05 0.00 -1.01 0.00 0.00 64.21 63.36 2qbf n SER 19 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2qbf s THR 20 N -0.16 4.66 -0.28 0.44 -1.32 -1.04 -4.97 115.64 112.97 2qbf s THR 20 Ca 0.33 0.72 -0.25 0.00 -1.21 0.00 0.00 61.69 61.28 2qbf s THR 20 Cb 0.12 -4.29 0.15 0.00 -1.51 0.00 0.00 72.50 66.97 2qbf s THR 20 CO -0.15 -0.60 1.18 -1.66 -2.21 0.00 0.00 174.62 171.17 2qbf s TRP 21 N 3.29 -0.32 0.77 9.09 1.48 -1.26 -4.09 118.94 127.89 2qbf s TRP 21 Ca 0.32 0.78 -0.11 0.00 -1.06 0.00 0.00 56.10 56.03 2qbf s TRP 21 Cb -0.12 0.41 0.05 0.00 -1.16 0.00 0.00 33.47 32.65 2qbf s TRP 21 CO 0.20 -0.16 1.09 0.12 -4.06 0.00 0.00 176.95 174.14 2qbf s PHE 22 N 0.11 2.89 -0.30 1.66 5.36 -1.26 -5.02 117.98 121.41 2qbf s PHE 22 Ca 0.05 1.23 -0.18 0.00 -0.96 0.00 0.00 56.93 57.07 2qbf s PHE 22 Cb -0.05 -3.06 0.20 0.00 -0.34 0.00 0.00 43.02 39.77 2qbf s PHE 22 CO -0.09 -1.65 1.26 0.00 -1.46 0.00 0.00 175.22 173.28 2qbf s ALA 23 N -3.11 -2.98 -0.96 11.12 0.00 -1.26 -5.02 121.76 119.54 2qbf s ALA 23 Ca 0.60 1.89 -0.15 0.00 0.00 0.00 0.00 51.96 54.30 2qbf s ALA 23 Cb -0.14 -2.14 0.19 0.00 0.00 0.00 0.00 23.12 21.02 2qbf s ALA 23 CO 0.55 -0.68 1.04 -0.80 0.00 0.00 0.00 175.76 175.86 2qbf s ASN 24 N 1.63 6.85 0.00 0.00 0.01 -1.26 -4.72 114.94 117.45 2qbf s ASN 24 Ca -0.03 -2.66 0.00 0.00 -0.71 0.00 0.00 52.86 49.45 2qbf s ASN 24 Cb -0.02 -2.30 0.00 0.00 0.41 0.00 0.00 41.25 39.34 2qbf s ASN 24 CO -0.13 -0.72 0.00 0.41 -1.51 0.00 0.00 177.10 175.15 2qbf n THR 25 N 4.37 0.00 -0.16 1.60 -1.04 -1.26 -3.77 114.28 114.02 2qbf n THR 25 Ca 0.22 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.32 2qbf n THR 25 Cb 0.46 0.00 0.17 0.00 -1.82 0.00 0.00 70.33 69.14 2qbf n THR 25 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2qbf n LYS 26 N 0.00 -0.04 0.00 -2.82 2.85 -1.26 0.69 118.16 117.59 2qbf n LYS 26 Ca 0.00 0.70 0.05 0.00 -1.05 0.00 0.00 58.31 58.01 2qbf n LYS 26 Cb 0.00 -1.14 0.01 0.00 -0.65 0.00 0.00 35.03 33.25 2qbf n LYS 26 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2qbf n GLU 27 N -4.42 1.84 -0.04 -1.58 -0.00 -1.25 -4.60 120.64 110.60 2qbf n GLU 27 Ca 0.13 -0.68 -0.10 0.00 -0.00 0.00 0.00 57.16 56.51 2qbf n GLU 27 Cb 0.42 -1.10 -0.03 0.00 -0.00 0.00 0.00 31.44 30.73 2qbf n GLU 27 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2qbf h PHE 28 N 1.26 0.18 -0.51 -1.84 3.57 0.01 0.36 116.94 119.97 2qbf h PHE 28 Ca 0.00 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.59 2qbf h PHE 28 Cb 0.36 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.98 2qbf h PHE 28 CO 0.00 0.10 0.14 0.00 -2.23 0.00 0.00 178.31 176.32 2qbf h ALA 29 N 1.09 0.60 -0.21 2.41 0.00 -1.80 -2.11 119.26 119.24 2qbf h ALA 29 Ca 0.07 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2qbf h ALA 29 Cb 0.01 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2qbf h ALA 29 CO -0.05 -0.27 -0.19 -0.44 0.00 0.00 0.00 179.25 178.30 2qbf h ASP 30 N 0.29 0.53 -0.95 0.00 5.19 -1.74 -3.14 116.42 116.59 2qbf h ASP 30 Ca 0.25 -0.47 0.20 0.00 -0.62 0.00 0.00 57.03 56.39 2qbf h ASP 30 Cb 0.32 -0.15 -0.08 0.00 0.18 0.00 0.00 39.33 39.60 2qbf h ASP 30 CO -0.30 0.89 0.61 0.78 -3.12 0.00 0.00 179.24 178.10 2qbf h ASN 31 N 0.17 0.57 -0.24 6.45 2.35 0.17 -0.71 115.58 124.34 2qbf h ASN 31 Ca 0.03 0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 55.73 2qbf h ASN 31 Cb 0.73 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 39.06 2qbf h ASN 31 CO 0.05 0.22 -0.30 -0.07 -1.65 0.00 0.00 177.43 175.68 2qbf h LEU 32 N 0.57 0.68 -0.19 1.61 3.38 -1.38 -2.41 115.31 117.56 2qbf h LEU 32 Ca 0.52 -0.50 0.05 0.00 0.09 0.00 0.00 57.88 58.05 2qbf h LEU 32 Cb 1.06 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.56 2qbf h LEU 32 CO -0.26 1.04 -0.22 -0.78 0.09 0.00 0.00 178.44 178.32 2qbf h ASP 33 N 0.34 -0.68 -0.09 -0.43 -0.00 -1.10 0.93 116.42 115.39 2qbf h ASP 33 Ca 0.03 0.12 0.03 0.00 -0.00 0.00 0.00 57.03 57.21 2qbf h ASP 33 Cb 0.87 0.32 -0.03 0.00 -0.00 0.00 0.00 39.33 40.49 2qbf h ASP 33 CO 0.07 -0.26 -0.08 0.77 -0.00 0.00 0.00 179.24 179.74 2qbf h SER 34 N -0.24 -0.26 -0.98 2.28 4.64 -1.43 0.34 113.55 117.90 2qbf h SER 34 Ca 0.12 0.05 0.25 0.00 -0.47 0.00 0.00 61.79 61.74 2qbf h SER 34 Cb 0.42 0.13 -0.13 0.00 -0.31 0.00 0.00 62.40 62.52 2qbf h SER 34 CO -0.33 -0.12 0.55 0.44 -0.87 0.00 0.00 176.83 176.51 2qbf h ASP 35 N -0.10 0.60 0.20 4.97 5.19 -0.82 0.21 116.42 126.66 2qbf h ASP 35 Ca 0.06 0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.61 2qbf h ASP 35 Cb 0.20 0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2qbf h ASP 35 CO -0.15 0.06 -0.10 0.15 -3.12 0.00 0.00 179.24 176.08 2qbf h PHE 36 N 0.52 -0.25 -0.21 4.55 3.57 0.10 -2.86 116.94 122.37 2qbf h PHE 36 Ca 0.64 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 62.19 2qbf h PHE 36 Cb 1.24 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 40.01 2qbf h PHE 36 CO -0.03 0.13 -0.17 0.87 -2.23 0.00 0.00 178.31 176.88 2qbf h LYS 37 N -0.71 -0.17 -0.34 1.11 1.57 0.11 -2.00 116.57 116.14 2qbf h LYS 37 Ca -0.03 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2qbf h LYS 37 Cb 0.49 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2qbf h LYS 37 CO 0.05 -0.12 0.11 -0.39 -0.57 0.00 0.00 179.45 178.53 2qbf h VAL 38 N -0.18 1.15 0.07 0.50 -1.51 -1.13 -2.90 116.25 112.25 2qbf h VAL 38 Ca 0.12 -0.50 -0.00 0.00 -1.23 0.00 0.00 66.70 65.09 2qbf h VAL 38 Cb 0.36 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.30 2qbf h VAL 38 CO -0.31 0.18 -0.03 0.03 -1.23 0.00 0.00 177.57 176.21 2qbf h ARG 39 N 0.48 -0.09 -0.56 5.19 3.08 -1.12 -1.21 114.38 120.15 2qbf h ARG 39 Ca 0.12 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 2qbf h ARG 39 Cb 0.15 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 2qbf h ARG 39 CO -0.01 0.10 0.28 -0.56 -1.07 0.00 0.00 179.97 178.72 2qbf h GLN 40 N -0.27 0.79 0.25 0.04 3.07 -1.39 0.24 115.11 117.84 2qbf h GLN 40 Ca -0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 58.65 58.61 2qbf h GLN 40 Cb 0.23 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 27.65 2qbf h GLN 40 CO 0.02 0.63 -0.12 1.88 0.09 0.00 0.00 178.83 181.32 2qbf h TYR 41 N 0.75 -0.32 -0.33 0.06 0.05 -1.50 -0.28 116.97 115.40 2qbf h TYR 41 Ca 0.19 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 59.00 2qbf h TYR 41 Cb 0.09 0.10 -0.04 0.00 1.01 0.00 0.00 36.73 37.90 2qbf h TYR 41 CO -0.01 -0.20 0.11 -0.07 -1.05 0.00 0.00 178.16 176.95 2qbf h LEU 42 N -0.34 0.12 -0.83 3.88 -0.00 -1.03 0.47 115.31 117.58 2qbf h LEU 42 Ca -0.03 0.04 0.09 0.00 -0.00 0.00 0.00 57.88 57.97 2qbf h LEU 42 Cb 0.26 0.02 -0.07 0.00 -0.00 0.00 0.00 40.66 40.88 2qbf h LEU 42 CO 0.06 0.10 0.48 0.74 -0.00 0.00 0.00 178.44 179.82 2qbf h THR 43 N 0.25 0.94 0.12 0.22 2.02 -0.27 0.65 112.91 116.84 2qbf h THR 43 Ca 0.15 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2qbf h THR 43 Cb 0.12 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 2qbf h THR 43 CO -0.15 0.15 -0.06 0.50 0.37 0.00 0.00 175.52 176.33 2qbf h LYS 44 N 0.83 -0.15 -0.35 6.66 3.64 -0.44 -2.16 116.57 124.59 2qbf h LYS 44 Ca 0.39 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.88 2qbf h LYS 44 Cb 0.31 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2qbf h LYS 44 CO -0.23 0.30 0.43 0.93 -2.27 0.00 0.00 179.45 178.62 2qbf h GLU 45 N -0.91 0.00 -1.07 1.90 5.08 0.05 -0.76 114.58 118.87 2qbf h GLU 45 Ca -0.02 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.84 2qbf h GLU 45 Cb 0.52 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 29.35 2qbf h GLU 45 CO 0.03 0.00 -0.87 1.28 -1.00 0.00 0.00 179.01 178.45 2qbf n LEU 46 N -3.59 4.00 0.05 1.33 7.99 0.21 -4.91 117.00 122.07 2qbf n LEU 46 Ca 0.06 -4.62 -0.02 0.00 -0.01 0.00 0.00 56.01 51.42 2qbf n LEU 46 Cb 0.59 -0.20 -0.01 0.00 -0.11 0.00 0.00 43.42 43.69 2qbf n LEU 46 CO 0.25 1.97 0.50 0.00 -1.51 0.00 0.00 177.39 178.61 2qbf h ALA 47 N 2.50 -0.93 0.00 -1.18 0.00 -0.44 -2.73 119.26 116.48 2qbf h ALA 47 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2qbf h ALA 47 Cb 1.20 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2qbf h ALA 47 CO 0.70 -0.93 0.00 0.36 0.00 0.00 0.00 179.25 179.38 2qbf n LYS 48 N -2.51 0.79 0.02 0.00 0.00 -1.26 -3.23 118.16 111.98 2qbf n LYS 48 Ca -0.02 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.41 2qbf n LYS 48 Cb 0.06 -1.29 0.18 0.00 -0.00 0.00 0.00 35.03 33.98 2qbf n LYS 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qbf n ALA 49 N 0.29 3.35 -2.97 0.58 0.00 -1.03 -4.98 120.51 115.75 2qbf n ALA 49 Ca 0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 53.44 52.99 2qbf n ALA 49 Cb 0.27 -1.10 0.06 0.00 0.00 0.00 0.00 19.45 18.68 2qbf n ALA 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qbf n SER 50 N -1.77 -2.14 -4.74 0.00 7.64 -1.20 -3.10 113.62 108.30 2qbf n SER 50 Ca 0.04 -0.43 -0.39 0.00 1.01 0.00 0.00 58.87 59.10 2qbf n SER 50 Cb 0.39 -3.68 -0.05 0.00 -1.01 0.00 0.00 64.21 59.85 2qbf n SER 50 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2qbf s VAL 51 N -3.25 4.87 -0.02 0.44 0.11 -1.26 0.62 120.40 121.91 2qbf s VAL 51 Ca 0.01 1.45 -0.02 0.00 -2.93 0.00 0.00 61.98 60.50 2qbf s VAL 51 Cb -0.00 -4.03 -0.01 0.00 -1.53 0.00 0.00 36.38 30.81 2qbf s VAL 51 CO 0.50 0.36 -0.03 -1.54 -3.33 0.00 0.00 175.10 171.06 2qbf n SER 52 N 3.00 0.19 -1.52 3.54 3.41 -0.96 -4.76 113.62 116.52 2qbf n SER 52 Ca -0.04 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2qbf n SER 52 Cb 0.51 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2qbf n SER 52 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2qbf n ARG 53 N -2.64 1.68 -2.66 4.33 0.63 -1.26 -4.86 116.66 111.88 2qbf n ARG 53 Ca -0.01 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.88 2qbf n ARG 53 Cb 0.05 0.00 0.10 0.00 0.45 0.00 0.00 32.46 33.05 2qbf n ARG 53 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 2qbf n ILE 54 N -0.61 0.00 -1.39 5.15 3.06 -1.26 -3.57 119.36 120.74 2qbf n ILE 54 Ca 0.00 -0.65 -0.37 0.00 -2.50 0.00 0.00 62.75 59.23 2qbf n ILE 54 Cb 0.00 1.08 0.06 0.00 0.54 0.00 0.00 39.64 41.31 2qbf n ILE 54 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 2qbf n VAL 55 N 0.96 2.33 -3.66 9.51 0.31 -1.18 -4.73 118.33 121.88 2qbf n VAL 55 Ca -0.02 -0.45 -0.18 0.00 -0.01 0.00 0.00 64.34 63.68 2qbf n VAL 55 Cb 0.73 -0.80 -0.16 0.00 -0.91 0.00 0.00 33.84 32.70 2qbf n VAL 55 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2qbf s ILE 56 N -1.78 -0.21 0.02 2.52 1.01 0.13 -1.45 121.20 121.44 2qbf s ILE 56 Ca 0.69 0.35 0.07 0.00 0.00 0.00 0.00 60.65 61.76 2qbf s ILE 56 Cb -0.39 -0.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.78 2qbf s ILE 56 CO 0.54 0.13 -0.19 -1.61 0.00 0.00 0.00 174.94 173.81 2qbf s GLU 57 N 2.25 2.10 -0.49 2.79 2.02 -1.26 -2.49 118.70 123.63 2qbf s GLU 57 Ca 0.04 -0.95 0.03 0.00 0.02 0.00 0.00 54.97 54.11 2qbf s GLU 57 Cb -0.12 -2.17 0.16 0.00 0.10 0.00 0.00 34.13 32.09 2qbf s GLU 57 CO -0.05 0.55 0.34 1.03 0.02 0.00 0.00 175.26 177.15 2qbf s ARG 58 N -1.23 1.36 0.00 1.61 0.52 -1.26 0.93 118.95 120.89 2qbf s ARG 58 Ca 0.13 -2.32 0.00 0.00 -0.52 0.00 0.00 55.73 53.02 2qbf s ARG 58 Cb -0.10 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 33.22 2qbf s ARG 58 CO 0.03 -1.29 0.00 -0.35 0.02 0.00 0.00 175.30 173.72 2qbf n PRO 59 N 2.91 2.34 -1.52 3.54 -0.04 -1.12 -4.73 135.00 136.39 2qbf n PRO 59 Ca 0.20 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.27 2qbf n PRO 59 Cb 0.40 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.79 2qbf n PRO 59 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qbf n ALA 60 N -3.00 0.65 -3.51 0.55 0.00 -1.26 -3.36 120.51 110.58 2qbf n ALA 60 Ca 0.00 -0.63 -0.24 0.00 0.00 0.00 0.00 53.44 52.58 2qbf n ALA 60 Cb 0.00 -2.82 0.01 0.00 0.00 0.00 0.00 19.45 16.63 2qbf n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbf n LYS 61 N 8.76 -1.38 0.00 0.00 4.76 -1.26 -4.95 118.16 124.08 2qbf n LYS 61 Ca 0.47 0.75 0.00 0.00 -2.87 0.00 0.00 58.31 56.66 2qbf n LYS 61 Cb 0.34 -1.84 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 2qbf n LYS 61 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2qbf n SER 62 N -1.72 0.00 -4.87 4.39 3.41 -1.21 -4.26 113.62 109.35 2qbf n SER 62 Ca -0.24 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.04 2qbf n SER 62 Cb 0.59 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.49 2qbf n SER 62 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2qbf s ILE 63 N -1.80 5.26 -0.01 -1.33 1.01 -1.24 -2.78 121.20 120.31 2qbf s ILE 63 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.45 2qbf s ILE 63 Cb 0.00 -3.43 -0.00 0.00 0.01 0.00 0.00 42.46 39.04 2qbf s ILE 63 CO 0.00 0.36 -0.02 -1.14 0.00 0.00 0.00 174.94 174.14 2qbf n ARG 64 N 1.11 0.04 -1.66 2.79 3.00 0.26 -0.67 116.66 121.53 2qbf n ARG 64 Ca -0.12 0.14 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 2qbf n ARG 64 Cb 0.53 -0.69 0.00 0.00 0.00 0.00 0.00 32.46 32.30 2qbf n ARG 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2qbf n VAL 65 N -2.53 -9.28 -3.65 5.15 0.31 -1.26 -2.58 118.33 104.49 2qbf n VAL 65 Ca -0.01 2.09 -0.29 0.00 -0.01 0.00 0.00 64.34 66.12 2qbf n VAL 65 Cb 0.03 -4.59 -0.13 0.00 -0.91 0.00 0.00 33.84 28.24 2qbf n VAL 65 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2qbf s THR 66 N -0.35 1.10 0.05 2.52 2.01 -0.53 -1.63 115.64 118.82 2qbf s THR 66 Ca 0.00 -2.34 -0.31 0.00 0.31 0.00 0.00 61.69 59.36 2qbf s THR 66 Cb 0.00 -1.78 -0.07 0.00 0.01 0.00 0.00 72.50 70.66 2qbf s THR 66 CO 0.00 -0.91 1.56 -0.63 -0.69 0.00 0.00 174.62 173.95 2qbf s ILE 67 N 0.54 3.25 -0.97 1.82 1.01 -0.81 -3.10 121.20 122.95 2qbf s ILE 67 Ca 0.18 0.70 -0.01 0.00 0.00 0.00 0.00 60.65 61.52 2qbf s ILE 67 Cb -0.24 -3.45 0.33 0.00 0.01 0.00 0.00 42.46 39.11 2qbf s ILE 67 CO 0.00 0.00 1.80 1.41 0.00 0.00 0.00 174.94 178.15 2qbf n HIS 68 N 5.41 2.89 -2.54 3.97 8.25 -1.23 -0.78 115.22 131.19 2qbf n HIS 68 Ca 0.15 -2.62 -0.35 0.00 -0.26 0.00 0.00 57.72 54.63 2qbf n HIS 68 Cb 0.42 -1.14 -0.04 0.00 1.12 0.00 0.00 29.99 30.35 2qbf n HIS 68 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2qbf s THR 69 N -4.48 3.74 -0.01 1.59 -1.32 -1.20 -2.27 115.64 111.69 2qbf s THR 69 Ca 0.42 1.22 0.15 0.00 -1.21 0.00 0.00 61.69 62.27 2qbf s THR 69 Cb 0.24 -3.58 0.05 0.00 -1.51 0.00 0.00 72.50 67.70 2qbf s THR 69 CO -0.18 -0.10 1.52 0.00 -2.21 0.00 0.00 174.62 173.65 2qbf h ALA 70 N 2.09 0.74 -3.11 11.08 0.00 0.07 -3.37 119.26 126.76 2qbf h ALA 70 Ca -0.49 -0.48 -0.62 0.00 0.00 0.00 0.00 54.91 53.32 2qbf h ALA 70 Cb 1.22 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.52 2qbf h ALA 70 CO 0.61 0.66 -0.70 1.03 0.00 0.00 0.00 179.25 180.85 2qbf s ARG 71 N -3.15 1.59 0.11 0.00 0.52 -1.18 -4.72 118.95 112.12 2qbf s ARG 71 Ca 0.02 -2.31 -0.17 0.00 -0.52 0.00 0.00 55.73 52.75 2qbf s ARG 71 Cb 0.09 -2.72 -0.05 0.00 0.52 0.00 0.00 34.95 32.79 2qbf s ARG 71 CO 0.74 -1.16 1.59 -1.00 0.02 0.00 0.00 175.30 175.49 2qbf h PRO 72 N 6.53 0.52 -0.73 3.54 0.13 -1.87 -3.20 132.00 136.91 2qbf h PRO 72 Ca -0.01 -0.13 0.14 0.00 -0.87 0.00 0.00 66.00 65.13 2qbf h PRO 72 Cb 0.90 -0.06 -0.14 0.00 0.13 0.00 0.00 31.00 31.83 2qbf h PRO 72 CO 0.57 0.60 -0.20 0.78 -0.23 0.00 0.00 178.00 179.51 2qbf h GLY 73 N 0.35 0.46 2.00 1.56 0.00 -1.97 0.92 103.07 106.38 2qbf h GLY 73 Ca 0.10 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2qbf h GLY 73 CO 0.00 -0.27 0.00 1.19 0.00 0.00 0.00 176.54 177.46 2qbf h ILE 74 N -0.02 0.00 0.00 2.60 6.09 -1.95 -1.72 117.51 122.52 2qbf h ILE 74 Ca 0.34 -0.27 -0.06 0.00 -1.37 0.00 0.00 64.86 63.50 2qbf h ILE 74 Cb 0.54 1.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.87 2qbf h ILE 74 CO -0.76 0.00 -0.50 0.58 -3.07 0.00 0.00 178.15 174.40 2qbf h VAL 75 N 0.00 0.48 -0.75 2.19 2.07 0.62 -3.38 116.25 117.48 2qbf h VAL 75 Ca 0.00 -1.48 0.05 0.00 0.82 0.00 0.00 66.70 66.10 2qbf h VAL 75 Cb 0.38 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 2qbf h VAL 75 CO 0.00 0.16 0.45 0.40 0.02 0.00 0.00 177.57 178.60 2qbf h ILE 76 N -1.00 1.02 0.00 4.57 1.08 -0.30 -1.92 117.51 120.96 2qbf h ILE 76 Ca -0.09 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.10 2qbf h ILE 76 Cb 0.65 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.51 2qbf h ILE 76 CO -0.05 0.15 0.00 0.61 -0.69 0.00 0.00 178.15 178.17 2qbf n GLY 77 N -1.31 -1.69 3.47 5.37 0.00 -0.65 -0.90 105.19 109.49 2qbf n GLY 77 Ca 0.10 -1.53 -0.49 0.00 0.00 0.00 0.00 46.02 44.10 2qbf n GLY 77 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qbf n LYS 78 N -2.09 1.20 -2.91 1.61 2.85 -1.26 -1.02 118.16 116.54 2qbf n LYS 78 Ca 0.00 0.31 -0.22 0.00 -1.05 0.00 0.00 58.31 57.36 2qbf n LYS 78 Cb 0.00 -2.60 0.03 0.00 -0.65 0.00 0.00 35.03 31.81 2qbf n LYS 78 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2qbf n LYS 79 N 8.33 -4.35 -1.94 -1.58 5.02 -1.26 -2.16 118.16 120.21 2qbf n LYS 79 Ca 0.40 0.91 -0.10 0.00 -2.02 0.00 0.00 58.31 57.50 2qbf n LYS 79 Cb 0.27 -5.70 -0.01 0.00 -0.02 0.00 0.00 35.03 29.57 2qbf n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qbf n GLY 80 N -1.44 0.28 0.08 0.72 0.00 -0.19 -4.95 105.19 99.70 2qbf n GLY 80 Ca -0.13 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 2qbf n GLY 80 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2qbf h GLU 81 N 0.00 0.11 0.10 1.61 -0.00 -0.89 -2.98 114.58 112.53 2qbf h GLU 81 Ca -0.23 -0.13 -0.01 0.00 -0.00 0.00 0.00 59.36 59.00 2qbf h GLU 81 Cb 1.03 0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.82 2qbf h GLU 81 CO 0.28 0.94 -0.05 -0.44 -0.00 0.00 0.00 179.01 179.74 2qbf h ASP 82 N -0.67 -0.12 -0.99 3.06 3.32 -1.41 -2.77 116.42 116.83 2qbf h ASP 82 Ca -0.03 -0.14 0.13 0.00 0.02 0.00 0.00 57.03 57.01 2qbf h ASP 82 Cb 1.02 0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.51 2qbf h ASP 82 CO 0.04 0.07 0.63 1.62 -1.72 0.00 0.00 179.24 179.87 2qbf h VAL 83 N -0.30 0.90 -0.59 -1.35 3.04 -0.18 -1.27 116.25 116.50 2qbf h VAL 83 Ca -0.01 -0.33 0.07 0.00 -1.01 0.00 0.00 66.70 65.42 2qbf h VAL 83 Cb 0.25 -0.14 -0.06 0.00 -2.01 0.00 0.00 31.29 29.33 2qbf h VAL 83 CO 0.02 0.17 0.27 -0.08 -1.01 0.00 0.00 177.57 176.95 2qbf h GLU 84 N 0.96 0.49 0.08 4.17 4.22 -1.33 -2.49 114.58 120.66 2qbf h GLU 84 Ca 0.50 -0.03 0.02 0.00 0.08 0.00 0.00 59.36 59.93 2qbf h GLU 84 Cb 0.53 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 2qbf h GLU 84 CO -0.27 0.32 -0.34 -0.22 -2.18 0.00 0.00 179.01 176.33 2qbf h LYS 85 N 0.50 -0.52 -0.42 1.92 3.64 -0.99 -2.76 116.57 117.94 2qbf h LYS 85 Ca 0.28 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.78 2qbf h LYS 85 Cb 0.26 0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 32.10 2qbf h LYS 85 CO -0.23 -0.35 -0.20 -0.07 -2.27 0.00 0.00 179.45 176.34 2qbf h LEU 86 N -0.54 -0.67 -0.60 5.20 3.38 -1.36 -2.36 115.31 118.36 2qbf h LEU 86 Ca 0.04 0.16 0.12 0.00 0.09 0.00 0.00 57.88 58.29 2qbf h LEU 86 Cb 0.59 0.37 -0.11 0.00 0.09 0.00 0.00 40.66 41.60 2qbf h LEU 86 CO -0.23 -0.23 -0.04 -0.09 0.09 0.00 0.00 178.44 177.94 2qbf h ARG 87 N -0.12 0.08 0.07 1.13 2.43 -1.18 -0.84 114.38 115.95 2qbf h ARG 87 Ca 0.20 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 2qbf h ARG 87 Cb 0.43 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 2qbf h ARG 87 CO -0.49 0.05 -0.34 -0.22 -1.51 0.00 0.00 179.97 177.46 2qbf h LYS 88 N 0.08 -0.51 -0.04 0.20 3.11 -1.18 -0.35 116.57 117.87 2qbf h LYS 88 Ca 0.31 0.04 0.03 0.00 -2.81 0.00 0.00 60.65 58.21 2qbf h LYS 88 Cb 0.49 0.12 -0.04 0.00 -1.00 0.00 0.00 32.23 31.80 2qbf h LYS 88 CO -0.55 -0.34 -0.16 0.28 -2.81 0.00 0.00 179.45 175.87 2qbf h VAL 89 N -0.53 0.60 -0.05 2.00 2.07 -1.31 0.26 116.25 119.28 2qbf h VAL 89 Ca 0.04 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.58 2qbf h VAL 89 Cb 0.59 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2qbf h VAL 89 CO -0.23 0.00 -0.40 0.58 0.02 0.00 0.00 177.57 177.54 2qbf h VAL 90 N -0.24 0.00 -0.37 2.57 2.07 -0.83 1.01 116.25 120.46 2qbf h VAL 90 Ca 0.06 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.69 2qbf h VAL 90 Cb 0.33 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2qbf h VAL 90 CO -0.18 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.71 2qbf h ALA 91 N -0.64 2.22 0.10 1.67 0.00 -0.94 0.31 119.26 121.98 2qbf h ALA 91 Ca 0.02 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 2qbf h ALA 91 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2qbf h ALA 91 CO -0.30 -0.49 -1.18 0.22 0.00 0.00 0.00 179.25 177.51 2qbf h ASP 92 N 0.00 0.46 0.32 0.00 1.82 0.13 0.26 116.42 119.40 2qbf h ASP 92 Ca 0.17 -0.46 -0.02 0.00 -0.39 0.00 0.00 57.03 56.34 2qbf h ASP 92 Cb 0.77 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 40.64 2qbf h ASP 92 CO -0.00 1.33 -0.16 0.40 -1.61 0.00 0.00 179.24 179.20 2qbf h ILE 93 N 0.11 0.67 -0.12 2.25 2.04 0.31 -2.70 117.51 120.07 2qbf h ILE 93 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2qbf h ILE 93 Cb 1.88 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 2qbf h ILE 93 CO 0.20 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.35 2qbf n ALA 94 N -2.29 2.53 -3.51 1.87 0.00 -1.00 -4.97 120.51 113.14 2qbf n ALA 94 Ca -0.10 -0.54 -0.24 0.00 0.00 0.00 0.00 53.44 52.56 2qbf n ALA 94 Cb 0.20 -1.08 0.05 0.00 0.00 0.00 0.00 19.45 18.61 2qbf n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbf n GLY 95 N 1.19 -1.08 3.52 0.00 0.00 -0.31 -5.02 105.19 103.49 2qbf n GLY 95 Ca 0.17 0.50 -0.12 0.00 0.00 0.00 0.00 46.02 46.57 2qbf n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbf s VAL 96 N -3.38 0.00 -0.83 1.61 -7.23 0.77 -5.01 120.40 106.33 2qbf s VAL 96 Ca 0.41 0.00 -0.26 0.00 -1.81 0.00 0.00 61.98 60.33 2qbf s VAL 96 Cb -0.12 -1.00 -0.11 0.00 0.56 0.00 0.00 36.38 35.71 2qbf s VAL 96 CO 0.82 0.00 2.26 -2.16 -0.31 0.00 0.00 175.10 175.71 2qbf s PRO 97 N -1.97 1.88 0.11 4.82 0.04 -1.26 -4.37 135.00 134.24 2qbf s PRO 97 Ca -0.02 0.23 -0.04 0.00 0.04 0.00 0.00 61.00 61.20 2qbf s PRO 97 Cb -0.01 -4.87 -0.05 0.00 0.04 0.00 0.00 34.50 29.61 2qbf s PRO 97 CO -0.00 -4.15 0.33 0.00 0.04 0.00 0.00 177.00 173.21 2qbf s ALA 98 N 13.43 3.84 0.00 8.56 0.00 -1.26 -3.61 121.76 142.72 2qbf s ALA 98 Ca 0.86 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2qbf s ALA 98 Cb -0.11 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.95 2qbf s ALA 98 CO 0.05 0.70 0.00 1.04 0.00 0.00 0.00 175.76 177.55 2qbf n GLN 99 N 0.29 3.72 0.00 0.00 3.00 0.15 -4.75 117.38 119.79 2qbf n GLN 99 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2qbf n GLN 99 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.76 2qbf n GLN 99 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57 2qbf n ILE 100 N 0.00 0.00 -3.71 5.09 3.06 -1.06 -4.55 119.36 118.19 2qbf n ILE 100 Ca 0.00 0.00 -0.36 0.00 -2.50 0.00 0.00 62.75 59.89 2qbf n ILE 100 Cb 0.00 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 40.09 2qbf n ILE 100 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 2qbf s ASN 101 N 0.00 6.13 -0.26 9.51 0.01 -0.65 -4.98 114.94 124.71 2qbf s ASN 101 Ca 0.00 0.16 -0.14 0.00 -0.71 0.00 0.00 52.86 52.17 2qbf s ASN 101 Cb 0.00 -2.09 -0.04 0.00 0.41 0.00 0.00 41.25 39.53 2qbf s ASN 101 CO 0.00 0.12 0.33 -0.63 -1.51 0.00 0.00 177.10 175.41 2qbf s ILE 102 N 0.72 5.21 -0.07 0.60 1.09 -1.26 -1.92 121.20 125.57 2qbf s ILE 102 Ca 0.08 0.50 -0.04 0.00 -1.10 0.00 0.00 60.65 60.09 2qbf s ILE 102 Cb -0.12 -3.66 -0.04 0.00 -1.06 0.00 0.00 42.46 37.58 2qbf s ILE 102 CO 0.01 0.20 0.11 0.00 -0.10 0.00 0.00 174.94 175.16 2qbf s ALA 103 N 1.81 3.71 0.17 9.38 0.00 0.04 -4.99 121.76 131.87 2qbf s ALA 103 Ca 0.14 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.35 2qbf s ALA 103 Cb -0.15 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.20 2qbf s ALA 103 CO 0.09 0.65 0.00 -1.91 0.00 0.00 0.00 175.76 174.59 2qbf n GLU 104 N 1.65 3.19 -3.65 0.00 2.13 -1.26 -3.25 120.64 119.44 2qbf n GLU 104 Ca -0.17 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.60 2qbf n GLU 104 Cb 0.54 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.18 2qbf n GLU 104 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2qbf s VAL 105 N 0.00 -0.51 -1.03 6.31 -7.23 -1.26 -4.28 120.40 112.40 2qbf s VAL 105 Ca 0.00 0.03 -0.17 0.00 -1.81 0.00 0.00 61.98 60.03 2qbf s VAL 105 Cb 0.00 -0.91 -0.09 0.00 0.56 0.00 0.00 36.38 35.94 2qbf s VAL 105 CO 0.00 0.01 2.09 -2.11 -0.31 0.00 0.00 175.10 174.78 2qbf n ARG 106 N 4.93 2.07 -1.81 4.82 0.00 -1.26 -4.61 116.66 120.80 2qbf n ARG 106 Ca -0.15 -2.03 0.00 0.00 -0.00 0.00 0.00 57.85 55.67 2qbf n ARG 106 Cb 0.53 -2.96 0.00 0.00 -0.00 0.00 0.00 32.46 30.04 2qbf n ARG 106 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2qbf n LYS 107 N 6.21 -3.69 0.24 2.89 5.02 -1.26 -4.63 118.16 122.93 2qbf n LYS 107 Ca 0.51 2.81 0.09 0.00 -2.02 0.00 0.00 58.31 59.70 2qbf n LYS 107 Cb 0.36 -3.26 0.62 0.00 -0.02 0.00 0.00 35.03 32.72 2qbf n LYS 107 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2qbf h PRO 108 N 2.96 0.00 0.00 1.97 0.13 -1.96 -2.46 132.00 132.64 2qbf h PRO 108 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2qbf h PRO 108 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2qbf h PRO 108 CO 0.00 0.15 0.03 0.93 -0.23 0.00 0.00 178.00 178.88 2qbf h GLU 109 N 0.00 0.00 -0.29 0.86 3.07 -1.97 -1.97 114.58 114.28 2qbf h GLU 109 Ca -0.00 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.71 2qbf h GLU 109 Cb 0.32 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.14 2qbf h GLU 109 CO 0.02 0.00 -0.14 1.28 -1.40 0.00 0.00 179.01 178.77 2qbf n LEU 110 N -2.80 3.89 -4.06 1.33 4.77 -0.93 -4.06 117.00 115.14 2qbf n LEU 110 Ca -0.02 -3.76 -0.32 0.00 -0.03 0.00 0.00 56.01 51.87 2qbf n LEU 110 Cb 0.09 -0.61 -0.15 0.00 -2.33 0.00 0.00 43.42 40.41 2qbf n LEU 110 CO 0.16 1.26 -0.44 -0.62 -1.33 0.00 0.00 177.39 176.42 2qbf s ASP 111 N -2.63 4.47 0.00 -1.43 2.15 -0.74 -5.00 116.67 113.50 2qbf s ASP 111 Ca 0.43 -1.49 0.00 0.00 0.43 0.00 0.00 52.55 51.92 2qbf s ASP 111 Cb 0.40 -1.55 0.00 0.00 -0.30 0.00 0.00 42.92 41.47 2qbf s ASP 111 CO -0.01 -0.22 0.72 0.00 -0.17 0.00 0.00 175.17 175.49 2qbf n ALA 112 N 4.41 0.00 -0.13 3.66 0.00 -1.26 0.43 120.51 127.62 2qbf n ALA 112 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.23 2qbf n ALA 112 Cb 0.42 0.36 -0.07 0.00 0.00 0.00 0.00 19.45 20.16 2qbf n ALA 112 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2qbf h LYS 113 N 0.00 -0.23 -0.63 0.00 1.63 -1.88 0.63 116.57 116.08 2qbf h LYS 113 Ca 0.00 0.02 0.13 0.00 -0.85 0.00 0.00 60.65 59.94 2qbf h LYS 113 Cb 0.00 0.05 -0.10 0.00 -0.60 0.00 0.00 32.23 31.58 2qbf h LYS 113 CO 0.00 -0.16 0.06 -0.07 -3.45 0.00 0.00 179.45 175.83 2qbf h LEU 114 N -0.24 -0.16 -0.47 5.20 3.38 -1.58 1.17 115.31 122.61 2qbf h LEU 114 Ca 0.06 0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2qbf h LEU 114 Cb 0.40 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2qbf h LEU 114 CO -0.46 -0.07 0.11 0.58 0.09 0.00 0.00 178.44 178.69 2qbf h VAL 115 N 0.17 1.24 -0.01 1.22 2.07 0.94 -1.26 116.25 120.62 2qbf h VAL 115 Ca 0.33 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 2qbf h VAL 115 Cb 0.54 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2qbf h VAL 115 CO -0.49 0.30 -0.01 0.00 0.02 0.00 0.00 177.57 177.39 2qbf h ALA 116 N 0.98 0.01 -0.58 1.67 0.00 0.15 -2.49 119.26 119.00 2qbf h ALA 116 Ca 0.15 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.97 2qbf h ALA 116 Cb 0.33 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2qbf h ALA 116 CO 0.00 -0.27 0.40 -0.44 0.00 0.00 0.00 179.25 178.94 2qbf h ASP 117 N -0.40 0.20 0.23 0.00 3.45 0.14 -2.29 116.42 117.75 2qbf h ASP 117 Ca 0.00 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.46 2qbf h ASP 117 Cb 0.44 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 2qbf h ASP 117 CO 0.00 0.11 -0.11 -1.28 -1.57 0.00 0.00 179.24 176.39 2qbf h SER 118 N 0.22 -0.26 -0.99 6.45 0.87 -1.01 -2.45 113.55 116.37 2qbf h SER 118 Ca 0.27 0.01 0.28 0.00 -1.23 0.00 0.00 61.79 61.12 2qbf h SER 118 Cb 0.78 0.07 -0.14 0.00 -0.44 0.00 0.00 62.40 62.67 2qbf h SER 118 CO -0.05 -0.15 0.55 -0.29 -0.53 0.00 0.00 176.83 176.36 2qbf h ILE 119 N -0.39 0.41 -0.23 2.23 6.09 -1.23 0.74 117.51 125.15 2qbf h ILE 119 Ca -0.03 -0.15 -0.01 0.00 -1.37 0.00 0.00 64.86 63.30 2qbf h ILE 119 Cb 0.24 -0.06 -0.01 0.00 0.47 0.00 0.00 36.82 37.46 2qbf h ILE 119 CO 0.05 0.08 0.09 0.71 -3.07 0.00 0.00 178.15 176.01 2qbf h THR 120 N 0.43 1.16 -1.00 2.19 1.35 -1.46 -2.22 112.91 113.37 2qbf h THR 120 Ca 0.68 -0.50 0.09 0.00 -0.55 0.00 0.00 66.41 66.13 2qbf h THR 120 Cb 1.41 1.07 -0.08 0.00 -1.73 0.00 0.00 68.15 68.83 2qbf h THR 120 CO -0.55 0.16 0.64 0.28 -0.25 0.00 0.00 175.52 175.81 2qbf h SER 121 N 0.22 0.99 -0.25 5.36 0.02 -0.37 -2.10 113.55 117.41 2qbf h SER 121 Ca 0.08 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2qbf h SER 121 Cb 0.17 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2qbf h SER 121 CO -0.01 0.58 0.07 1.56 -1.14 0.00 0.00 176.83 177.90 2qbf h GLN 122 N 1.09 0.39 -0.87 3.45 4.20 -1.09 -2.40 115.11 119.88 2qbf h GLN 122 Ca 0.46 -0.09 0.11 0.00 0.06 0.00 0.00 58.65 59.20 2qbf h GLN 122 Cb 0.32 -0.05 -0.08 0.00 0.30 0.00 0.00 27.48 27.96 2qbf h GLN 122 CO -0.21 0.48 0.50 -0.07 -0.67 0.00 0.00 178.83 178.85 2qbf h LEU 123 N 0.23 0.69 -1.24 1.46 3.38 -0.78 0.12 115.31 119.18 2qbf h LEU 123 Ca 0.08 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2qbf h LEU 123 Cb 0.25 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2qbf h LEU 123 CO -0.00 0.36 0.07 -0.33 0.09 0.00 0.00 178.44 178.64 2qbf h GLU 124 N 0.79 0.60 -0.15 1.13 5.08 -1.20 -1.13 114.58 119.70 2qbf h GLU 124 Ca 0.44 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2qbf h GLU 124 Cb 0.47 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2qbf h GLU 124 CO -0.28 0.57 0.00 0.54 -1.00 0.00 0.00 179.01 178.83 2qbf n ARG 125 N -4.31 1.15 -2.69 2.33 1.74 0.37 -4.92 116.66 110.33 2qbf n ARG 125 Ca 0.02 -0.21 -0.07 0.00 -0.77 0.00 0.00 57.85 56.82 2qbf n ARG 125 Cb 0.21 -1.10 0.01 0.00 -1.02 0.00 0.00 32.46 30.56 2qbf n ARG 125 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qbf n ARG 126 N -0.29 -2.17 -4.15 5.56 5.12 -0.43 -5.05 116.66 115.25 2qbf n ARG 126 Ca 0.02 1.98 -0.16 0.00 -1.93 0.00 0.00 57.85 57.76 2qbf n ARG 126 Cb 0.08 -5.20 -0.14 0.00 -1.16 0.00 0.00 32.46 26.03 2qbf n ARG 126 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2qbf s VAL 127 N -2.38 0.40 -0.56 1.55 -7.23 -1.19 -5.00 120.40 105.99 2qbf s VAL 127 Ca 0.21 -0.23 -0.34 0.00 -1.81 0.00 0.00 61.98 59.82 2qbf s VAL 127 Cb -0.06 -0.34 -0.14 0.00 0.56 0.00 0.00 36.38 36.40 2qbf s VAL 127 CO 0.68 0.10 2.35 0.23 -0.31 0.00 0.00 175.10 178.16 2qbf n MET 128 N 2.93 0.66 -0.19 4.82 2.81 -1.26 -4.67 117.12 122.22 2qbf n MET 128 Ca -0.13 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2qbf n MET 128 Cb 0.58 -2.28 0.09 0.00 -0.71 0.00 0.00 33.22 30.90 2qbf n MET 128 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2qbf h PHE 129 N 13.20 -0.00 -0.63 2.03 -0.00 -1.97 -1.37 116.94 128.20 2qbf h PHE 129 Ca -0.19 0.04 0.13 0.00 -0.00 0.00 0.00 57.97 57.96 2qbf h PHE 129 Cb 1.32 0.09 -0.11 0.00 -0.00 0.00 0.00 35.95 37.26 2qbf h PHE 129 CO 0.99 -0.13 0.01 -0.09 -0.00 0.00 0.00 178.31 179.09 2qbf h ARG 130 N 0.14 0.12 -0.03 6.09 9.65 -1.99 0.37 114.38 128.72 2qbf h ARG 130 Ca 0.30 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 59.17 2qbf h ARG 130 Cb 0.47 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.03 2qbf h ARG 130 CO -0.48 0.08 -0.02 0.00 2.80 0.00 0.00 179.97 182.36 2qbf h ARG 131 N 0.12 0.06 -0.68 0.20 3.08 -1.66 -2.18 114.38 113.32 2qbf h ARG 131 Ca 0.33 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.33 2qbf h ARG 131 Cb 0.54 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 2qbf h ARG 131 CO -0.53 0.47 0.31 0.00 -1.07 0.00 0.00 179.97 179.15 2qbf h ALA 132 N 0.59 1.27 0.87 0.04 0.00 -0.89 -0.63 119.26 120.51 2qbf h ALA 132 Ca 0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2qbf h ALA 132 Cb 0.45 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2qbf h ALA 132 CO 0.00 0.56 -0.42 1.98 0.00 0.00 0.00 179.25 181.38 2qbf h MET 133 N 0.97 -1.12 -0.56 0.00 -1.53 -0.27 -2.69 114.93 109.72 2qbf h MET 133 Ca 0.24 0.08 0.07 0.00 -3.44 0.00 0.00 59.70 56.64 2qbf h MET 133 Cb 0.12 0.25 -0.03 0.00 -0.55 0.00 0.00 31.60 31.39 2qbf h MET 133 CO -0.03 -0.74 0.38 -0.22 0.14 0.00 0.00 176.91 176.43 2qbf h LYS 134 N -1.20 0.49 -0.02 0.39 3.64 -1.26 -2.80 116.57 115.80 2qbf h LYS 134 Ca -0.12 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2qbf h LYS 134 Cb 0.90 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.61 2qbf h LYS 134 CO 0.20 0.32 0.01 -0.09 -2.27 0.00 0.00 179.45 177.62 2qbf h ARG 135 N 0.50 0.03 -0.89 1.90 2.43 -0.92 -2.38 114.38 115.06 2qbf h ARG 135 Ca 0.25 -0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.52 2qbf h ARG 135 Cb 0.33 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.81 2qbf h ARG 135 CO -0.07 0.06 0.57 0.00 -1.51 0.00 0.00 179.97 179.02 2qbf h ALA 136 N 0.97 1.68 0.81 2.80 0.00 -1.21 -2.38 119.26 121.94 2qbf h ALA 136 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2qbf h ALA 136 Cb 0.04 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.65 2qbf h ALA 136 CO -0.00 0.12 -0.39 0.28 0.00 0.00 0.00 179.25 179.26 2qbf h VAL 137 N 0.83 0.00 -0.73 0.00 2.07 -1.46 -2.49 116.25 114.48 2qbf h VAL 137 Ca 0.42 -0.07 0.11 0.00 0.82 0.00 0.00 66.70 67.98 2qbf h VAL 137 Cb 0.48 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.12 2qbf h VAL 137 CO -0.18 0.00 -0.39 1.56 0.02 0.00 0.00 177.57 178.57 2qbf h GLN 138 N -1.16 -0.12 0.13 1.57 7.50 -1.11 -0.35 115.11 121.56 2qbf h GLN 138 Ca -0.11 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.05 2qbf h GLN 138 Cb 0.83 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 28.38 2qbf h GLN 138 CO 0.18 -0.08 -0.23 -0.91 -1.50 0.00 0.00 178.83 176.29 2qbf h ASN 139 N -0.12 -0.68 -0.94 1.46 -0.26 -1.44 -0.52 115.58 113.08 2qbf h ASN 139 Ca 0.25 0.06 0.20 0.00 -0.56 0.00 0.00 56.30 56.25 2qbf h ASN 139 Cb 0.56 0.24 -0.11 0.00 -1.06 0.00 0.00 38.32 37.95 2qbf h ASN 139 CO -0.79 -0.27 0.52 0.00 -1.06 0.00 0.00 177.43 175.83 2qbf h ALA 140 N -1.22 1.54 -0.03 -0.83 0.00 -1.14 0.32 119.26 117.90 2qbf h ALA 140 Ca -0.01 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2qbf h ALA 140 Cb 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2qbf h ALA 140 CO -0.09 -0.17 -0.21 1.98 0.00 0.00 0.00 179.25 180.77 2qbf h MET 141 N 0.61 0.04 -0.06 0.00 -1.53 -0.74 -3.04 114.93 110.21 2qbf h MET 141 Ca 0.56 -0.01 -0.09 0.00 -3.44 0.00 0.00 59.70 56.72 2qbf h MET 141 Cb 0.94 -0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.98 2qbf h MET 141 CO -0.43 0.25 -0.29 -0.09 0.14 0.00 0.00 176.91 176.49 2qbf h ARG 142 N 0.04 0.31 -1.02 0.39 2.43 0.13 -3.20 114.38 113.46 2qbf h ARG 142 Ca 0.01 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 58.92 2qbf h ARG 142 Cb 0.40 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2qbf h ARG 142 CO 0.03 0.89 0.01 1.28 -1.51 0.00 0.00 179.97 180.67 2qbf n LEU 143 N -4.45 3.09 0.00 3.80 7.99 -0.80 -4.93 117.00 121.70 2qbf n LEU 143 Ca -0.08 -1.55 0.00 0.00 -0.01 0.00 0.00 56.01 54.37 2qbf n LEU 143 Cb 0.49 -0.52 0.00 0.00 -0.11 0.00 0.00 43.42 43.28 2qbf n LEU 143 CO 0.41 0.52 0.00 0.61 -1.51 0.00 0.00 177.39 177.42 2qbf n GLY 144 N 0.49 0.57 2.66 -0.72 0.00 -1.21 -5.02 105.19 101.97 2qbf n GLY 144 Ca 0.01 -1.29 -0.03 0.00 0.00 0.00 0.00 46.02 44.71 2qbf n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbf n ALA 145 N 0.63 -2.61 0.21 4.61 0.00 -1.25 -4.27 120.51 117.83 2qbf n ALA 145 Ca 0.00 1.42 0.08 0.00 0.00 0.00 0.00 53.44 54.94 2qbf n ALA 145 Cb 0.00 -3.01 0.40 0.00 0.00 0.00 0.00 19.45 16.84 2qbf n ALA 145 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbf n LYS 146 N 1.98 0.10 -3.58 0.00 5.02 0.21 -4.72 118.16 117.17 2qbf n LYS 146 Ca -0.24 0.52 -0.08 0.00 -2.02 0.00 0.00 58.31 56.50 2qbf n LYS 146 Cb 0.37 -1.79 -0.04 0.00 -0.02 0.00 0.00 35.03 33.55 2qbf n LYS 146 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2qbf s GLY 147 N -3.37 -0.22 0.02 0.72 0.00 -0.54 -2.27 107.32 101.67 2qbf s GLY 147 Ca 0.00 2.03 -0.14 0.00 0.00 0.00 0.00 44.72 46.62 2qbf s GLY 147 CO 0.20 0.90 0.29 -1.50 0.00 0.00 0.00 173.10 173.00 2qbf s ILE 148 N -1.48 0.08 -0.28 0.90 2.07 0.85 0.13 121.20 123.47 2qbf s ILE 148 Ca 0.03 -0.63 -0.01 0.00 -1.41 0.00 0.00 60.65 58.62 2qbf s ILE 148 Cb -0.01 -0.82 0.17 0.00 0.13 0.00 0.00 42.46 41.93 2qbf s ILE 148 CO -0.02 -0.35 0.50 -0.75 -1.91 0.00 0.00 174.94 172.41 2qbf s LYS 149 N -2.13 0.47 -0.09 3.50 2.20 0.16 -1.61 119.74 122.24 2qbf s LYS 149 Ca -0.08 0.75 -0.04 0.00 -0.36 0.00 0.00 55.97 56.24 2qbf s LYS 149 Cb -0.02 0.07 -0.04 0.00 -1.51 0.00 0.00 37.83 36.33 2qbf s LYS 149 CO -0.01 -0.67 0.09 0.08 -0.36 0.00 0.00 175.35 174.49 2qbf s VAL 150 N 2.71 5.02 -0.06 4.02 1.01 -1.16 0.48 120.40 132.42 2qbf s VAL 150 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 2qbf s VAL 150 Cb -0.15 -3.19 0.04 0.00 0.00 0.00 0.00 36.38 33.08 2qbf s VAL 150 CO -0.19 0.57 0.11 -0.70 0.00 0.00 0.00 175.10 174.88 2qbf s GLU 151 N -1.11 -0.02 -0.07 2.72 2.12 0.21 -4.37 118.70 118.18 2qbf s GLU 151 Ca 0.16 0.46 -0.10 0.00 0.36 0.00 0.00 54.97 55.84 2qbf s GLU 151 Cb -0.12 -0.39 -0.05 0.00 0.26 0.00 0.00 34.13 33.84 2qbf s GLU 151 CO 0.05 -0.31 0.25 0.08 -0.54 0.00 0.00 175.26 174.80 2qbf s VAL 152 N 2.17 5.31 0.00 3.70 1.01 -1.24 -0.82 120.40 130.52 2qbf s VAL 152 Ca 0.03 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.49 2qbf s VAL 152 Cb -0.12 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2qbf s VAL 152 CO -0.04 0.60 0.00 -1.54 0.00 0.00 0.00 175.10 174.11 2qbf n SER 153 N 1.95 0.00 -3.86 3.32 3.41 0.34 -1.61 113.62 117.17 2qbf n SER 153 Ca -0.17 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.30 2qbf n SER 153 Cb 0.54 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.54 2qbf n SER 153 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qbf n GLY 154 N 1.02 1.60 2.44 5.00 0.00 -1.19 -3.40 105.19 110.66 2qbf n GLY 154 Ca 0.00 -2.14 -0.16 0.00 0.00 0.00 0.00 46.02 43.72 2qbf n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qbf n ARG 155 N -1.94 -1.15 -1.61 1.61 5.12 -1.25 -4.69 116.66 112.75 2qbf n ARG 155 Ca 0.11 1.02 -0.42 0.00 -1.93 0.00 0.00 57.85 56.64 2qbf n ARG 155 Cb 0.39 -5.24 0.01 0.00 -1.16 0.00 0.00 32.46 26.46 2qbf n ARG 155 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2qbf n LEU 156 N -1.91 2.62 0.00 0.55 4.77 -1.26 -0.13 117.00 121.65 2qbf n LEU 156 Ca -0.17 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 2qbf n LEU 156 Cb 0.55 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2qbf n LEU 156 CO 0.24 -1.43 0.00 0.61 -1.33 0.00 0.00 177.39 175.49 2qbf n GLY 157 N 1.16 0.07 2.28 -0.72 0.00 -1.26 -2.19 105.19 104.53 2qbf n GLY 157 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 2qbf n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbf n GLY 158 N -1.12 0.71 3.55 -0.02 0.00 0.82 -5.00 105.19 104.12 2qbf n GLY 158 Ca 0.00 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 2qbf n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbf s ALA 159 N -2.48 0.26 -0.06 4.61 0.00 -0.93 -4.98 121.76 118.18 2qbf s ALA 159 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 51.96 51.05 2qbf s ALA 159 Cb 0.00 -3.01 -0.22 0.00 0.00 0.00 0.00 23.12 19.89 2qbf s ALA 159 CO 0.00 -3.62 1.08 0.93 0.00 0.00 0.00 175.76 174.15 2qbf h GLU 160 N -2.56 -0.01 -5.35 0.00 5.08 -1.94 -3.42 114.58 106.37 2qbf h GLU 160 Ca -0.50 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.22 2qbf h GLU 160 Cb 1.32 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.43 2qbf h GLU 160 CO 0.43 0.65 0.03 0.42 -1.00 0.00 0.00 179.01 179.54 2qbf s ILE 161 N -3.52 4.97 0.71 3.13 1.01 -1.26 -5.00 121.20 121.23 2qbf s ILE 161 Ca -0.17 0.49 -0.16 0.00 0.00 0.00 0.00 60.65 60.82 2qbf s ILE 161 Cb -0.00 -4.00 0.03 0.00 0.01 0.00 0.00 42.46 38.50 2qbf s ILE 161 CO 0.67 -0.23 1.22 0.00 0.00 0.00 0.00 174.94 176.60 2qbf s ALA 162 N 2.52 2.18 0.06 9.38 0.00 -1.26 -4.68 121.76 129.95 2qbf s ALA 162 Ca 0.21 0.94 -0.22 0.00 0.00 0.00 0.00 51.96 52.89 2qbf s ALA 162 Cb -0.15 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.54 2qbf s ALA 162 CO 0.13 -1.79 0.52 -0.98 0.00 0.00 0.00 175.76 173.64 2qbf s ARG 163 N -3.80 1.05 0.05 0.00 1.70 -1.26 -4.66 118.95 112.04 2qbf s ARG 163 Ca 0.76 -0.28 0.01 0.00 -0.47 0.00 0.00 55.73 55.75 2qbf s ARG 163 Cb -0.30 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.52 2qbf s ARG 163 CO 0.44 -0.39 0.13 0.99 -1.08 0.00 0.00 175.30 175.39 2qbf s THR 164 N -2.62 4.91 0.20 4.99 2.01 -1.22 -3.16 115.64 120.76 2qbf s THR 164 Ca -0.04 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 61.49 2qbf s THR 164 Cb -0.00 -3.35 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 2qbf s THR 164 CO -0.03 0.18 0.06 -0.70 -0.69 0.00 0.00 174.62 173.45 2qbf s GLU 165 N -2.28 2.59 0.00 4.92 2.56 -0.63 -5.00 118.70 120.85 2qbf s GLU 165 Ca 0.30 -1.09 0.00 0.00 0.00 0.00 0.00 54.97 54.17 2qbf s GLU 165 Cb -0.12 -2.43 0.00 0.00 2.00 0.00 0.00 34.13 33.58 2qbf s GLU 165 CO 0.22 0.44 0.00 1.87 -0.56 0.00 0.00 175.26 177.23 2qbf n TRP 166 N -0.48 0.00 -0.53 5.30 -0.00 -1.26 -3.68 117.44 116.79 2qbf n TRP 166 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.41 2qbf n TRP 166 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.87 2qbf n TRP 166 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 2qbf n TYR 167 N 0.00 -0.44 -3.43 5.87 9.36 -1.26 -4.49 117.16 122.77 2qbf n TYR 167 Ca 0.00 0.26 0.01 0.00 3.32 0.00 0.00 57.90 61.49 2qbf n TYR 167 Cb 0.00 -2.04 -0.03 0.00 -0.63 0.00 0.00 39.34 36.63 2qbf n TYR 167 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2qbf s ARG 168 N -3.04 0.46 0.24 2.98 3.00 -1.26 -3.00 118.95 118.34 2qbf s ARG 168 Ca 0.00 1.06 0.03 0.00 -1.00 0.00 0.00 55.73 55.82 2qbf s ARG 168 Cb 0.00 0.63 -0.03 0.00 0.00 0.00 0.00 34.95 35.55 2qbf s ARG 168 CO 0.00 -0.26 0.39 -1.21 0.00 0.00 0.00 175.30 174.23 2qbf s GLU 169 N 2.77 3.46 0.90 5.12 2.02 -0.63 -4.95 118.70 127.39 2qbf s GLU 169 Ca 0.01 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.43 2qbf s GLU 169 Cb -0.11 -2.84 0.00 0.00 0.10 0.00 0.00 34.13 31.28 2qbf s GLU 169 CO -0.18 0.38 0.00 0.41 0.02 0.00 0.00 175.26 175.89 2qbf n GLY 170 N -1.23 -1.78 3.75 -1.39 0.00 -1.26 -0.10 105.19 103.18 2qbf n GLY 170 Ca -0.07 -1.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 2qbf n GLY 170 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qbf s ARG 171 N -0.73 3.09 -0.44 1.61 1.70 -0.96 -4.61 118.95 118.61 2qbf s ARG 171 Ca 0.00 -0.38 0.03 0.00 -0.47 0.00 0.00 55.73 54.92 2qbf s ARG 171 Cb 0.00 -2.89 0.16 0.00 -0.57 0.00 0.00 34.95 31.65 2qbf s ARG 171 CO 0.00 0.70 0.33 0.08 -1.08 0.00 0.00 175.30 175.33 2qbf s VAL 172 N -1.01 0.66 -1.27 4.99 1.01 -1.26 -3.55 120.40 119.98 2qbf s VAL 172 Ca 0.17 -2.69 -0.19 0.00 0.00 0.00 0.00 61.98 59.26 2qbf s VAL 172 Cb -0.12 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.82 2qbf s VAL 172 CO 0.06 -1.16 1.81 -0.81 0.00 0.00 0.00 175.10 175.01 2qbf n PRO 173 N 2.96 2.73 0.24 2.72 -0.04 -1.26 -4.77 135.00 137.58 2qbf n PRO 173 Ca 0.25 -3.01 0.17 0.00 -0.04 0.00 0.00 63.50 60.86 2qbf n PRO 173 Cb 0.44 -3.55 0.83 0.00 -0.04 0.00 0.00 33.50 31.19 2qbf n PRO 173 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2qbf h LEU 174 N 13.89 0.00 -0.24 1.53 4.07 -2.01 -1.81 115.31 130.74 2qbf h LEU 174 Ca 0.39 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 58.14 2qbf h LEU 174 Cb 0.88 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 2qbf h LEU 174 CO 1.42 0.00 -0.90 0.45 -1.08 0.00 0.00 178.44 178.34 2qbf h HIS 175 N 0.00 0.46 -2.31 1.13 3.86 -2.01 -3.43 115.15 112.85 2qbf h HIS 175 Ca 0.00 -0.25 -0.54 0.00 -1.16 0.00 0.00 60.37 58.42 2qbf h HIS 175 Cb 0.11 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 2qbf h HIS 175 CO 0.00 1.06 1.36 0.99 0.86 0.00 0.00 177.93 182.20 2qbf s THR 176 N -3.27 3.35 0.16 2.45 2.01 -0.68 -4.84 115.64 114.81 2qbf s THR 176 Ca -0.04 0.31 -0.18 0.00 0.31 0.00 0.00 61.69 62.09 2qbf s THR 176 Cb 0.10 -3.59 0.05 0.00 0.01 0.00 0.00 72.50 69.07 2qbf s THR 176 CO 0.85 -0.46 1.69 -0.07 -0.69 0.00 0.00 174.62 175.93 2qbf h LEU 177 N 15.19 -0.26 -6.90 4.42 3.38 -1.86 -2.94 115.31 126.34 2qbf h LEU 177 Ca -0.31 0.10 -0.73 0.00 0.09 0.00 0.00 57.88 57.03 2qbf h LEU 177 Cb 1.18 0.19 -0.12 0.00 0.09 0.00 0.00 40.66 42.01 2qbf h LEU 177 CO 1.09 -0.09 2.17 -1.14 0.09 0.00 0.00 178.44 180.56 2qbf n ARG 178 N -5.25 3.30 0.00 1.13 0.63 -1.26 -4.23 116.66 110.98 2qbf n ARG 178 Ca 0.01 -3.34 0.00 0.00 -0.92 0.00 0.00 57.85 53.60 2qbf n ARG 178 Cb 0.19 -3.14 0.00 0.00 0.45 0.00 0.00 32.46 29.96 2qbf n ARG 178 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qbf n ALA 179 N 5.65 0.81 -2.78 5.13 0.00 -1.06 -4.13 120.51 124.12 2qbf n ALA 179 Ca 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.87 2qbf n ALA 179 Cb 0.40 0.02 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 2qbf n ALA 179 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qbf n ASP 180 N -0.49 -6.78 -3.96 0.00 4.64 -1.25 -3.69 116.55 105.01 2qbf n ASP 180 Ca 0.00 1.27 -0.30 0.00 -1.38 0.00 0.00 54.79 54.39 2qbf n ASP 180 Cb 0.03 -4.72 -0.16 0.00 -1.04 0.00 0.00 41.12 35.24 2qbf n ASP 180 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2qbf s ILE 181 N -1.37 1.47 -0.50 5.18 1.09 -1.26 -2.94 121.20 122.86 2qbf s ILE 181 Ca -0.04 -0.90 -0.28 0.00 -1.10 0.00 0.00 60.65 58.34 2qbf s ILE 181 Cb 0.00 -1.58 -0.00 0.00 -1.06 0.00 0.00 42.46 39.82 2qbf s ILE 181 CO 0.66 0.15 1.62 -0.62 -0.10 0.00 0.00 174.94 176.65 2qbf s ASP 182 N 1.47 5.88 -0.04 3.58 3.68 0.44 -4.82 116.67 126.87 2qbf s ASP 182 Ca -0.01 0.62 0.06 0.00 2.13 0.00 0.00 52.55 55.36 2qbf s ASP 182 Cb -0.16 -2.54 -0.01 0.00 -1.45 0.00 0.00 42.92 38.76 2qbf s ASP 182 CO -0.08 -1.84 -0.23 -0.47 0.13 0.00 0.00 175.17 172.68 2qbf s TYR 183 N 6.94 2.20 0.28 -5.34 5.04 -1.26 -2.02 117.35 123.18 2qbf s TYR 183 Ca 0.64 -0.57 -0.21 0.00 -2.44 0.00 0.00 57.07 54.49 2qbf s TYR 183 Cb -0.14 -1.44 0.02 0.00 0.35 0.00 0.00 41.96 40.75 2qbf s TYR 183 CO 0.27 -0.15 0.74 1.21 -1.34 0.00 0.00 175.55 176.28 2qbf s ASN 184 N -0.26 -0.25 0.28 4.32 3.04 -1.16 -4.85 114.94 116.06 2qbf s ASN 184 Ca 0.01 -0.62 0.02 0.00 0.04 0.00 0.00 52.86 52.31 2qbf s ASN 184 Cb -0.12 0.72 -0.04 0.00 -1.54 0.00 0.00 41.25 40.27 2qbf s ASN 184 CO 0.02 -1.33 0.16 0.42 -3.04 0.00 0.00 177.10 173.32 2qbf s THR 185 N -3.82 0.25 -0.28 -5.21 -4.23 -1.26 -1.60 115.64 99.49 2qbf s THR 185 Ca 0.11 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.41 2qbf s THR 185 Cb -0.06 -2.53 0.11 0.00 1.34 0.00 0.00 72.50 71.37 2qbf s THR 185 CO 0.07 0.00 0.89 -0.94 -0.54 0.00 0.00 174.62 174.10 2qbf s SER 186 N -3.32 -0.63 -0.09 3.99 1.04 -0.50 -4.76 113.70 109.43 2qbf s SER 186 Ca 0.37 1.10 -0.15 0.00 0.48 0.00 0.00 55.95 57.75 2qbf s SER 186 Cb 0.06 1.18 -0.05 0.00 0.10 0.00 0.00 66.02 67.31 2qbf s SER 186 CO 0.17 -0.18 0.38 -1.61 0.98 0.00 0.00 173.24 172.98 2qbf s GLU 187 N 0.84 4.13 -0.45 4.02 2.02 -1.26 -1.55 118.70 126.46 2qbf s GLU 187 Ca -0.03 0.30 -0.02 0.00 0.02 0.00 0.00 54.97 55.23 2qbf s GLU 187 Cb -0.05 -3.35 0.12 0.00 0.10 0.00 0.00 34.13 30.95 2qbf s GLU 187 CO -0.10 0.39 0.24 0.00 0.02 0.00 0.00 175.26 175.81 2qbf s ALA 188 N -0.08 3.23 -0.25 5.21 0.00 -1.02 -4.90 121.76 123.96 2qbf s ALA 188 Ca 0.22 -2.68 -0.29 0.00 0.00 0.00 0.00 51.96 49.20 2qbf s ALA 188 Cb -0.15 -2.44 -0.01 0.00 0.00 0.00 0.00 23.12 20.53 2qbf s ALA 188 CO 0.09 -1.86 1.33 -1.01 0.00 0.00 0.00 175.76 174.31 2qbf s HIS 189 N 0.89 2.66 0.00 0.00 0.09 -1.26 -1.01 115.29 116.66 2qbf s HIS 189 Ca 0.10 0.87 0.00 0.00 -0.00 0.00 0.00 55.06 56.03 2qbf s HIS 189 Cb -0.22 -3.79 0.00 0.00 -0.00 0.00 0.00 32.58 28.57 2qbf s HIS 189 CO -0.04 -1.87 0.00 0.25 -0.00 0.00 0.00 174.74 173.08 2qbf n THR 190 N 5.96 0.00 0.36 1.30 -2.24 -0.04 -4.78 114.28 114.84 2qbf n THR 190 Ca 0.15 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.99 2qbf n THR 190 Cb 0.46 -0.77 0.28 0.00 -2.10 0.00 0.00 70.33 68.20 2qbf n THR 190 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2qbf n THR 191 N -0.62 1.20 -2.98 4.28 -2.24 -1.26 -4.05 114.28 108.61 2qbf n THR 191 Ca 0.00 0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.98 2qbf n THR 191 Cb 0.00 -1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 67.04 2qbf n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qbf n TYR 192 N -1.63 -2.81 -0.01 4.78 0.18 -1.26 -5.14 117.16 111.26 2qbf n TYR 192 Ca 0.02 -2.05 0.00 0.00 1.88 0.00 0.00 57.90 57.75 2qbf n TYR 192 Cb 0.13 1.06 0.00 0.00 -0.38 0.00 0.00 39.34 40.15 2qbf n TYR 192 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2qbf n GLY 193 N 2.86 -4.20 3.80 -7.48 0.00 -1.26 -5.02 105.19 93.89 2qbf n GLY 193 Ca 0.22 -2.08 -0.27 0.00 0.00 0.00 0.00 46.02 43.89 2qbf n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbf s VAL 194 N -0.97 4.52 -0.45 1.61 1.01 -1.26 -0.86 120.40 123.98 2qbf s VAL 194 Ca 0.00 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.99 2qbf s VAL 194 Cb 0.00 -3.28 0.14 0.00 0.00 0.00 0.00 36.38 33.24 2qbf s VAL 194 CO 0.00 -0.07 0.28 -0.63 0.00 0.00 0.00 175.10 174.68 2qbf s ILE 195 N -1.69 1.30 0.74 2.22 1.01 -0.18 -4.76 121.20 119.83 2qbf s ILE 195 Ca 0.31 -2.66 -0.15 0.00 0.00 0.00 0.00 60.65 58.14 2qbf s ILE 195 Cb -0.10 -1.90 0.02 0.00 0.01 0.00 0.00 42.46 40.49 2qbf s ILE 195 CO 0.23 -0.96 1.00 0.61 0.00 0.00 0.00 174.94 175.82 2qbf n GLY 196 N 3.34 -0.37 3.06 6.18 0.00 -1.26 -2.42 105.19 113.71 2qbf n GLY 196 Ca 0.13 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 2qbf n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbf s VAL 197 N -1.86 -0.05 0.00 1.61 1.01 -0.59 0.13 120.40 120.65 2qbf s VAL 197 Ca 0.73 0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.93 2qbf s VAL 197 Cb -0.33 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 2qbf s VAL 197 CO 0.50 0.06 -0.23 -0.54 0.00 0.00 0.00 175.10 174.90 2qbf s LYS 198 N 1.29 1.73 -0.06 2.72 1.02 -0.00 -1.40 119.74 125.03 2qbf s LYS 198 Ca -0.09 -0.87 0.04 0.00 0.02 0.00 0.00 55.97 55.07 2qbf s LYS 198 Cb -0.10 -1.74 -0.00 0.00 -0.52 0.00 0.00 37.83 35.47 2qbf s LYS 198 CO -0.09 0.47 -0.19 0.14 -0.92 0.00 0.00 175.35 174.76 2qbf s VAL 199 N -0.62 1.59 -0.34 3.17 -7.23 -0.63 -0.62 120.40 115.73 2qbf s VAL 199 Ca 0.09 -0.78 0.03 0.00 -1.81 0.00 0.00 61.98 59.51 2qbf s VAL 199 Cb -0.09 -1.38 0.10 0.00 0.56 0.00 0.00 36.38 35.57 2qbf s VAL 199 CO 0.00 0.45 0.06 0.26 -0.31 0.00 0.00 175.10 175.56 2qbf s TRP 200 N 0.19 3.72 -0.34 2.82 0.51 0.18 -2.99 118.94 123.04 2qbf s TRP 200 Ca -0.09 -2.90 -0.06 0.00 -2.12 0.00 0.00 56.10 50.92 2qbf s TRP 200 Cb -0.14 -2.91 0.04 0.00 -0.81 0.00 0.00 33.47 29.65 2qbf s TRP 200 CO 0.04 -0.95 0.10 0.42 -0.51 0.00 0.00 176.95 176.05 2qbf s ILE 201 N 0.94 3.76 -0.27 2.03 1.01 -0.85 0.36 121.20 128.17 2qbf s ILE 201 Ca 0.10 -1.14 -0.16 0.00 0.00 0.00 0.00 60.65 59.45 2qbf s ILE 201 Cb -0.19 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 2qbf s ILE 201 CO -0.07 -0.18 0.43 0.12 0.00 0.00 0.00 174.94 175.24 2qbf s PHE 202 N 1.40 3.26 0.00 3.97 5.36 0.12 -0.42 117.98 131.66 2qbf s PHE 202 Ca -0.02 0.51 0.00 0.00 -0.96 0.00 0.00 56.93 56.46 2qbf s PHE 202 Cb -0.20 -2.63 0.00 0.00 -0.34 0.00 0.00 43.02 39.85 2qbf s PHE 202 CO 0.03 -0.25 0.00 1.63 -1.46 0.00 0.00 175.22 175.17 2qbf n LYS 203 N 5.41 0.00 -4.18 10.12 5.02 -1.15 -0.62 118.16 132.76 2qbf n LYS 203 Ca -0.07 0.02 -0.17 0.00 -2.02 0.00 0.00 58.31 56.08 2qbf n LYS 203 Cb 0.50 -0.37 -0.15 0.00 -0.02 0.00 0.00 35.03 34.99 2qbf n LYS 203 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2qbf s GLY 204 N -2.36 0.29 0.00 0.72 0.00 -1.25 -3.70 107.32 101.02 2qbf s GLY 204 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.50 2qbf s GLY 204 CO 0.00 -0.13 0.42 1.18 0.00 0.00 0.00 173.10 174.57 2qbf n GLU 205 N 3.06 0.00 0.00 2.90 -0.58 -1.24 -3.89 120.64 120.89 2qbf n GLU 205 Ca -0.14 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2qbf n GLU 205 Cb 0.57 -0.92 0.00 0.00 -0.57 0.00 0.00 31.44 30.52 2qbf n GLU 205 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16