#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbq h MET 3 N 0.00 1.00 -0.38 5.31 -0.00 -1.88 -0.41 114.93 118.57 2qbq h MET 3 Ca 0.00 -0.27 -0.11 0.00 -0.00 0.00 0.00 59.70 59.32 2qbq h MET 3 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 31.60 31.47 2qbq h MET 3 CO 0.00 0.94 -0.22 1.49 -0.00 0.00 0.00 176.91 179.12 2qbq h GLU 4 N 0.93 0.75 -0.08 -0.10 4.81 -1.97 0.16 114.58 119.07 2qbq h GLU 4 Ca 0.18 -0.29 -0.17 0.00 -0.13 0.00 0.00 59.36 58.95 2qbq h GLU 4 Cb 0.45 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.80 2qbq h GLU 4 CO 0.02 0.90 -0.62 0.87 -0.73 0.00 0.00 179.01 179.45 2qbq h LYS 5 N 0.65 0.56 -0.86 1.92 1.57 -1.90 -2.83 116.57 115.69 2qbq h LYS 5 Ca 0.09 -0.50 -0.02 0.00 -1.87 0.00 0.00 60.65 58.36 2qbq h LYS 5 Cb 0.72 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.10 2qbq h LYS 5 CO 0.06 1.12 0.46 1.49 -0.57 0.00 0.00 179.45 182.01 2qbq h GLU 6 N 0.17 1.20 -0.14 3.15 4.81 -0.88 -1.22 114.58 121.67 2qbq h GLU 6 Ca -0.05 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 2qbq h GLU 6 Cb 1.27 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 2qbq h GLU 6 CO 0.13 0.88 0.09 0.35 -0.73 0.00 0.00 179.01 179.73 2qbq h PHE 7 N 1.20 0.18 -0.21 0.92 3.04 -0.70 0.01 116.94 121.38 2qbq h PHE 7 Ca 0.30 0.00 -0.06 0.00 3.98 0.00 0.00 57.97 62.19 2qbq h PHE 7 Cb 0.04 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 2qbq h PHE 7 CO 0.01 0.14 -0.13 0.93 -2.02 0.00 0.00 178.31 177.24 2qbq h GLU 8 N 0.17 0.35 -0.26 1.11 5.08 -1.27 0.82 114.58 120.58 2qbq h GLU 8 Ca 0.05 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2qbq h GLU 8 Cb 0.01 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2qbq h GLU 8 CO -0.01 0.48 -0.21 0.37 -1.00 0.00 0.00 179.01 178.65 2qbq h GLN 9 N 0.33 0.60 -0.25 2.33 4.15 -0.84 -0.46 115.11 120.96 2qbq h GLN 9 Ca 0.06 -0.30 -0.15 0.00 0.77 0.00 0.00 58.65 59.04 2qbq h GLN 9 Cb 0.43 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 2qbq h GLN 9 CO 0.03 0.88 -0.47 0.82 -1.93 0.00 0.00 178.83 178.16 2qbq h ILE 10 N 0.32 1.30 -0.19 2.39 2.04 -0.76 -2.54 117.51 120.06 2qbq h ILE 10 Ca 0.05 -1.67 -0.13 0.00 1.00 0.00 0.00 64.86 64.10 2qbq h ILE 10 Cb 0.75 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 2qbq h ILE 10 CO 0.05 0.53 -0.45 -0.78 0.00 0.00 0.00 178.15 177.51 2qbq h ASP 11 N 0.52 0.51 -0.26 1.72 3.58 -0.80 -0.67 116.42 121.01 2qbq h ASP 11 Ca 0.03 -0.24 -0.15 0.00 0.42 0.00 0.00 57.03 57.09 2qbq h ASP 11 Cb 1.01 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 2qbq h ASP 11 CO 0.10 0.89 -0.39 0.07 -2.88 0.00 0.00 179.24 177.03 2qbq h LYS 12 N 0.38 0.80 -0.39 0.28 2.10 -0.99 -2.97 116.57 115.79 2qbq h LYS 12 Ca 0.03 -0.41 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 2qbq h LYS 12 Cb 0.94 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.28 2qbq h LYS 12 CO 0.08 1.04 0.00 -1.13 -2.00 0.00 0.00 179.45 177.44 2qbq n SER 13 N -4.05 2.68 -4.19 7.07 3.41 -0.97 -4.96 113.62 112.61 2qbq n SER 13 Ca -0.02 -1.92 -0.30 0.00 -0.26 0.00 0.00 58.87 56.37 2qbq n SER 13 Cb 0.53 -0.26 -0.07 0.00 -0.26 0.00 0.00 64.21 64.16 2qbq n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qbq n GLY 14 N 1.33 -0.21 1.73 5.00 0.00 -0.33 -4.88 105.19 107.82 2qbq n GLY 14 Ca 0.18 0.19 -0.18 0.00 0.00 0.00 0.00 46.02 46.20 2qbq n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qbq n SER 15 N -2.86 4.45 0.04 1.61 3.41 -0.76 -4.73 113.62 114.78 2qbq n SER 15 Ca -0.31 -3.79 -0.04 0.00 -0.26 0.00 0.00 58.87 54.48 2qbq n SER 15 Cb 0.69 -0.50 0.18 0.00 -0.26 0.00 0.00 64.21 64.32 2qbq n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2qbq h TRP 16 N 1.81 0.49 -0.29 7.33 4.06 -1.90 -1.86 115.95 125.59 2qbq h TRP 16 Ca 0.33 -0.13 -0.00 0.00 2.06 0.00 0.00 58.89 61.15 2qbq h TRP 16 Cb 1.39 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 29.42 2qbq h TRP 16 CO 0.94 0.73 0.18 0.00 -3.56 0.00 0.00 178.44 176.74 2qbq h ALA 17 N 1.26 0.37 -0.39 1.49 0.00 -1.92 0.58 119.26 120.66 2qbq h ALA 17 Ca 0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2qbq h ALA 17 Cb 0.80 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2qbq h ALA 17 CO 0.06 -0.14 0.13 0.00 0.00 0.00 0.00 179.25 179.31 2qbq h ALA 18 N 1.08 0.51 -0.65 0.00 0.00 -1.90 -0.04 119.26 118.26 2qbq h ALA 18 Ca 0.11 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2qbq h ALA 18 Cb -0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2qbq h ALA 18 CO -0.02 0.15 0.42 0.82 0.00 0.00 0.00 179.25 180.61 2qbq h ILE 19 N 0.49 1.13 -0.35 0.00 1.08 -1.08 -0.27 117.51 118.50 2qbq h ILE 19 Ca 0.13 -0.29 -0.09 0.00 -0.39 0.00 0.00 64.86 64.22 2qbq h ILE 19 Cb 0.24 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 34.19 2qbq h ILE 19 CO -0.01 0.15 -0.11 0.22 -0.69 0.00 0.00 178.15 177.71 2qbq h TYR 20 N 0.84 0.80 -0.11 1.37 3.20 -0.70 -2.85 116.97 119.52 2qbq h TYR 20 Ca 0.25 -0.18 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 2qbq h TYR 20 Cb -0.05 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2qbq h TYR 20 CO -0.04 0.87 -0.11 1.96 -1.64 0.00 0.00 178.16 179.21 2qbq h GLN 21 N 0.49 0.16 -0.60 1.82 1.08 -0.69 -1.72 115.11 115.64 2qbq h GLN 21 Ca 0.09 -0.03 -0.05 0.00 -1.45 0.00 0.00 58.65 57.20 2qbq h GLN 21 Cb 0.63 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.01 2qbq h GLN 21 CO 0.04 0.28 0.16 -0.44 -0.95 0.00 0.00 178.83 177.92 2qbq h ASP 22 N 0.16 0.86 -0.39 1.46 3.32 -0.83 -0.43 116.42 120.57 2qbq h ASP 22 Ca 0.03 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 2qbq h ASP 22 Cb 0.29 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2qbq h ASP 22 CO 0.02 0.83 0.06 0.40 -1.72 0.00 0.00 179.24 178.82 2qbq h ILE 23 N 0.89 1.24 -1.00 0.35 2.04 -1.13 -1.69 117.51 118.21 2qbq h ILE 23 Ca 0.20 -0.87 0.01 0.00 1.00 0.00 0.00 64.86 65.19 2qbq h ILE 23 Cb 0.29 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 2qbq h ILE 23 CO -0.00 0.30 0.67 0.03 0.00 0.00 0.00 178.15 179.14 2qbq h ARG 24 N 0.49 1.32 -0.65 2.37 3.08 -0.98 0.62 114.38 120.62 2qbq h ARG 24 Ca 0.12 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 2qbq h ARG 24 Cb 0.38 -0.30 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 2qbq h ARG 24 CO 0.01 0.87 0.09 1.25 -1.07 0.00 0.00 179.97 181.12 2qbq h HIS 25 N 1.36 1.16 0.00 3.04 2.76 -0.79 -3.13 115.15 119.55 2qbq h HIS 25 Ca 0.37 -0.17 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2qbq h HIS 25 Cb -0.15 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 28.50 2qbq h HIS 25 CO -0.00 0.98 -0.50 0.39 -1.30 0.00 0.00 177.93 177.50 2qbq n GLU 26 N -4.23 0.25 -1.61 5.26 1.02 -0.66 -4.96 120.64 115.71 2qbq n GLU 26 Ca 0.04 0.09 -0.42 0.00 -0.02 0.00 0.00 57.16 56.85 2qbq n GLU 26 Cb 0.30 -1.68 0.01 0.00 -0.02 0.00 0.00 31.44 30.05 2qbq n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qbq n ALA 27 N -1.77 0.17 -1.10 0.62 0.00 0.18 -4.94 120.51 113.66 2qbq n ALA 27 Ca 0.04 0.25 -0.33 0.00 0.00 0.00 0.00 53.44 53.40 2qbq n ALA 27 Cb 0.42 -2.08 0.12 0.00 0.00 0.00 0.00 19.45 17.92 2qbq n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qbq s SER 28 N -0.71 3.66 -0.09 0.00 0.01 -1.26 -5.04 113.70 110.26 2qbq s SER 28 Ca 0.62 2.31 -0.03 0.00 1.31 0.00 0.00 55.95 60.17 2qbq s SER 28 Cb -0.57 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.12 2qbq s SER 28 CO 0.57 -2.62 0.08 -0.62 0.41 0.00 0.00 173.24 171.06 2qbq s ASP 29 N -2.27 1.54 0.16 2.44 2.15 -1.26 -4.94 116.67 114.48 2qbq s ASP 29 Ca 0.72 -0.15 0.04 0.00 0.43 0.00 0.00 52.55 53.59 2qbq s ASP 29 Cb -0.27 -0.15 -0.05 0.00 -0.30 0.00 0.00 42.92 42.15 2qbq s ASP 29 CO 0.51 -0.28 -0.08 -0.36 -0.17 0.00 0.00 175.17 174.78 2qbq s PHE 30 N 2.17 1.29 0.49 -5.34 0.08 -1.26 -5.14 117.98 110.26 2qbq s PHE 30 Ca 0.04 -0.80 -0.21 0.00 0.12 0.00 0.00 56.93 56.08 2qbq s PHE 30 Cb -0.13 -0.68 -0.07 0.00 -0.57 0.00 0.00 43.02 41.57 2qbq s PHE 30 CO -0.05 0.04 1.11 -1.25 -0.10 0.00 0.00 175.22 174.97 2qbq s PRO 31 N -3.78 3.65 -0.38 0.24 0.04 -1.26 -4.90 135.00 128.61 2qbq s PRO 31 Ca 0.19 1.59 0.11 0.00 0.04 0.00 0.00 61.00 62.93 2qbq s PRO 31 Cb 0.03 -2.19 0.44 0.00 0.04 0.00 0.00 34.50 32.83 2qbq s PRO 31 CO 0.02 -0.60 1.03 0.00 0.04 0.00 0.00 177.00 177.49 2qbq h ARG 33 N 2.78 0.74 0.18 0.00 -0.00 -1.94 -2.33 114.38 113.81 2qbq h ARG 33 Ca 0.10 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.53 2qbq h ARG 33 Cb 1.05 -0.17 0.00 0.00 0.00 0.00 0.00 29.97 30.86 2qbq h ARG 33 CO 0.68 0.49 -0.08 0.28 0.00 0.00 0.00 179.97 181.33 2qbq h VAL 34 N 0.76 0.83 -0.65 2.04 2.07 -1.92 -2.24 116.25 117.13 2qbq h VAL 34 Ca 0.24 -0.01 0.14 0.00 0.82 0.00 0.00 66.70 67.89 2qbq h VAL 34 Cb -0.01 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2qbq h VAL 34 CO -0.09 0.00 0.45 0.00 0.02 0.00 0.00 177.57 177.95 2qbq h ALA 35 N 0.58 2.24 -0.03 1.67 0.00 -1.82 -1.42 119.26 120.48 2qbq h ALA 35 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qbq h ALA 35 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2qbq h ALA 35 CO 0.04 -0.41 0.00 1.63 0.00 0.00 0.00 179.25 180.51 2qbq n LYS 36 N -4.44 1.42 -2.07 0.00 4.76 -0.88 -4.62 118.16 112.32 2qbq n LYS 36 Ca 0.12 -0.61 -0.41 0.00 -2.87 0.00 0.00 58.31 54.54 2qbq n LYS 36 Cb 0.53 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.24 2qbq n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2qbq s LEU 37 N -1.92 4.40 0.29 -0.35 1.43 -0.54 -4.90 118.68 117.09 2qbq s LEU 37 Ca 0.40 2.73 0.03 0.00 -1.03 0.00 0.00 54.13 56.26 2qbq s LEU 37 Cb 0.20 -3.67 0.73 0.00 0.03 0.00 0.00 46.19 43.48 2qbq s LEU 37 CO 0.33 -0.59 1.66 -0.65 0.23 0.00 0.00 176.35 177.32 2qbq h PRO 38 N 3.29 0.25 0.00 1.29 0.11 -1.91 0.21 132.00 135.24 2qbq h PRO 38 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2qbq h PRO 38 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2qbq h PRO 38 CO 0.65 0.16 0.00 1.57 -0.21 0.00 0.00 178.00 180.17 2qbq h LYS 39 N 0.26 0.00 -0.53 1.05 2.10 -1.95 -2.51 116.57 114.98 2qbq h LYS 39 Ca 0.56 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.21 2qbq h LYS 39 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2qbq h LYS 39 CO -0.62 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 176.92 2qbq n ASN 40 N -2.71 3.64 -0.20 7.07 3.02 0.06 -4.51 115.26 121.63 2qbq n ASN 40 Ca -0.00 -1.99 -0.01 0.00 -0.03 0.00 0.00 54.58 52.55 2qbq n ASN 40 Cb 0.17 -0.35 0.10 0.00 -0.61 0.00 0.00 39.78 39.09 2qbq n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2qbq h LYS 41 N 4.26 0.46 -0.06 3.52 3.64 -1.44 -0.70 116.57 126.26 2qbq h LYS 41 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2qbq h LYS 41 Cb 0.97 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2qbq h LYS 41 CO 0.00 0.31 0.00 0.27 -2.27 0.00 0.00 179.45 177.76 2qbq n ASN 42 N -4.94 0.17 -0.67 4.20 0.23 -1.26 -2.83 115.26 110.15 2qbq n ASN 42 Ca 0.08 -2.00 0.08 0.00 -0.53 0.00 0.00 54.58 52.21 2qbq n ASN 42 Cb 0.23 -0.03 0.08 0.00 -2.08 0.00 0.00 39.78 37.98 2qbq n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2qbq n ARG 43 N -0.41 1.38 -4.64 -3.83 1.74 -0.27 -4.92 116.66 105.70 2qbq n ARG 43 Ca 0.01 -1.53 -0.33 0.00 -0.77 0.00 0.00 57.85 55.23 2qbq n ARG 43 Cb 0.03 -1.32 -0.15 0.00 -1.02 0.00 0.00 32.46 30.00 2qbq n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2qbq s ASN 44 N -1.34 3.91 0.12 0.55 0.01 -1.13 -4.45 114.94 112.62 2qbq s ASN 44 Ca 0.20 -0.38 -0.09 0.00 -0.71 0.00 0.00 52.86 51.88 2qbq s ASN 44 Cb 0.14 -1.60 -0.10 0.00 0.41 0.00 0.00 41.25 40.09 2qbq s ASN 44 CO 0.21 0.13 1.32 -0.09 -1.51 0.00 0.00 177.10 177.16 2qbq h ARG 45 N 6.99 0.64 -4.91 -0.60 2.43 -1.89 -3.44 114.38 113.60 2qbq h ARG 45 Ca -0.29 -0.56 -0.60 0.00 -0.81 0.00 0.00 59.98 57.72 2qbq h ARG 45 Cb 1.20 0.13 -0.34 0.00 -0.42 0.00 0.00 29.97 30.55 2qbq h ARG 45 CO 0.56 1.18 -0.85 0.71 -1.51 0.00 0.00 179.97 180.06 2qbq s TYR 46 N -3.60 2.04 0.31 2.20 2.02 -1.26 -5.03 117.35 114.01 2qbq s TYR 46 Ca -0.08 -0.85 0.03 0.00 -0.37 0.00 0.00 57.07 55.80 2qbq s TYR 46 Cb 0.09 -1.42 0.62 0.00 -0.40 0.00 0.00 41.96 40.85 2qbq s TYR 46 CO 0.89 -0.39 1.86 -0.09 -1.57 0.00 0.00 175.55 176.25 2qbq h ARG 47 N 6.99 0.89 -0.06 -0.62 2.43 -1.97 -2.80 114.38 119.24 2qbq h ARG 47 Ca -0.27 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2qbq h ARG 47 Cb 1.20 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2qbq h ARG 47 CO 0.48 0.59 0.00 -0.25 -1.51 0.00 0.00 179.97 179.28 2qbq n ASP 48 N -4.58 2.13 -4.15 -3.80 8.00 -1.26 -4.78 116.55 108.11 2qbq n ASP 48 Ca 0.18 -1.72 -0.34 0.00 0.71 0.00 0.00 54.79 53.62 2qbq n ASP 48 Cb 0.36 -0.03 -0.14 0.00 -0.02 0.00 0.00 41.12 41.29 2qbq n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qbq s VAL 49 N -1.94 2.80 0.05 2.53 1.01 -1.06 -5.09 120.40 118.70 2qbq s VAL 49 Ca 0.34 -1.45 0.01 0.00 0.00 0.00 0.00 61.98 60.88 2qbq s VAL 49 Cb 0.20 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 2qbq s VAL 49 CO 0.31 -0.10 -0.06 -0.44 0.00 0.00 0.00 175.10 174.82 2qbq s SER 50 N 1.22 0.71 0.21 3.32 0.01 -1.26 -4.65 113.70 113.26 2qbq s SER 50 Ca -0.06 -0.71 -0.24 0.00 1.31 0.00 0.00 55.95 56.25 2qbq s SER 50 Cb -0.20 0.09 -0.08 0.00 0.21 0.00 0.00 66.02 66.04 2qbq s SER 50 CO -0.02 -0.35 0.81 -2.16 0.41 0.00 0.00 173.24 171.93 2qbq s PRO 51 N -2.42 4.52 0.52 12.44 0.04 -1.26 -4.54 135.00 144.29 2qbq s PRO 51 Ca -0.04 1.15 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 2qbq s PRO 51 Cb -0.04 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.35 2qbq s PRO 51 CO -0.03 0.48 1.21 -0.06 0.04 0.00 0.00 177.00 178.64 2qbq s PHE 52 N -1.32 2.62 0.23 0.56 0.08 -1.26 -4.61 117.98 114.29 2qbq s PHE 52 Ca 0.40 1.50 -0.08 0.00 0.12 0.00 0.00 56.93 58.88 2qbq s PHE 52 Cb -0.21 -3.47 0.23 0.00 -0.57 0.00 0.00 43.02 38.99 2qbq s PHE 52 CO 0.25 -1.95 1.90 -0.44 -0.10 0.00 0.00 175.22 174.88 2qbq h ASP 53 N 1.57 0.99 0.54 1.36 3.32 -1.47 -1.61 116.42 121.12 2qbq h ASP 53 Ca -0.50 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 2qbq h ASP 53 Cb 1.27 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.58 2qbq h ASP 53 CO 0.58 0.71 -0.02 1.12 -1.72 0.00 0.00 179.24 179.91 2qbq h HIS 54 N 1.17 0.00 0.00 4.55 2.07 -1.92 -3.15 115.15 117.87 2qbq h HIS 54 Ca 0.33 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.85 2qbq h HIS 54 Cb -0.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.89 2qbq h HIS 54 CO -0.01 0.02 0.00 -1.13 -3.07 0.00 0.00 177.93 173.74 2qbq n SER 55 N -3.17 1.22 -4.76 3.10 3.41 -1.13 -5.07 113.62 107.23 2qbq n SER 55 Ca -0.01 -1.46 -0.35 0.00 -0.26 0.00 0.00 58.87 56.79 2qbq n SER 55 Cb 0.21 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.19 2qbq n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qbq s ARG 56 N -0.46 3.06 -0.10 4.33 1.70 -0.62 -0.86 118.95 125.99 2qbq s ARG 56 Ca 0.00 1.69 -0.24 0.00 -0.47 0.00 0.00 55.73 56.71 2qbq s ARG 56 Cb 0.00 -1.96 -0.03 0.00 -0.57 0.00 0.00 34.95 32.40 2qbq s ARG 56 CO 0.00 -1.11 0.77 0.42 -1.08 0.00 0.00 175.30 174.30 2qbq s ILE 57 N -1.76 4.97 -0.21 4.99 -1.09 -0.50 -4.79 121.20 122.80 2qbq s ILE 57 Ca 0.74 1.55 -0.11 0.00 -2.23 0.00 0.00 60.65 60.60 2qbq s ILE 57 Cb -0.27 -4.09 -0.05 0.00 -1.58 0.00 0.00 42.46 36.47 2qbq s ILE 57 CO 0.32 0.16 0.20 -0.54 -1.23 0.00 0.00 174.94 173.84 2qbq s LYS 58 N 1.36 4.15 0.32 2.79 1.02 -1.26 -4.09 119.74 124.03 2qbq s LYS 58 Ca 0.38 -0.15 -0.28 0.00 0.02 0.00 0.00 55.97 55.94 2qbq s LYS 58 Cb -0.17 -3.49 -0.09 0.00 -0.52 0.00 0.00 37.83 33.56 2qbq s LYS 58 CO 0.17 0.15 1.10 -0.51 -0.92 0.00 0.00 175.35 175.33 2qbq s LEU 59 N 0.79 4.43 -1.43 3.17 1.43 -0.06 -4.92 118.68 122.09 2qbq s LEU 59 Ca 0.10 2.24 -0.12 0.00 -1.03 0.00 0.00 54.13 55.32 2qbq s LEU 59 Cb -0.13 -3.78 0.06 0.00 0.03 0.00 0.00 46.19 42.37 2qbq s LEU 59 CO 0.03 -0.28 2.24 1.41 0.23 0.00 0.00 176.35 179.98 2qbq n HIS 60 N 0.81 3.18 -3.76 0.29 8.25 -1.26 -4.54 115.22 118.19 2qbq n HIS 60 Ca 0.01 -2.94 -0.13 0.00 -0.26 0.00 0.00 57.72 54.40 2qbq n HIS 60 Cb 0.46 -2.35 -0.10 0.00 1.12 0.00 0.00 29.99 29.12 2qbq n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2qbq s GLN 61 N 2.10 0.49 0.16 -0.41 -2.07 -1.26 -5.07 119.66 113.60 2qbq s GLN 61 Ca 0.48 0.20 -0.06 0.00 -1.82 0.00 0.00 55.36 54.16 2qbq s GLN 61 Cb 0.14 0.23 0.01 0.00 -1.09 0.00 0.00 33.01 32.29 2qbq s GLN 61 CO -0.06 -0.10 1.42 0.93 -1.32 0.00 0.00 175.29 176.16 2qbq h GLU 62 N 4.95 0.60 0.00 9.60 5.08 -2.02 -3.34 114.58 129.44 2qbq h GLU 62 Ca -0.28 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.65 2qbq h GLU 62 Cb 1.18 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2qbq h GLU 62 CO 0.34 1.06 0.00 -3.47 -1.00 0.00 0.00 179.01 175.94 2qbq n ASP 63 N -3.92 0.00 -3.45 1.42 2.03 -1.26 -4.71 116.55 106.67 2qbq n ASP 63 Ca -0.05 0.98 -0.11 0.00 0.52 0.00 0.00 54.79 56.14 2qbq n ASP 63 Cb 0.68 -0.48 -0.09 0.00 -0.72 0.00 0.00 41.12 40.50 2qbq n ASP 63 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2qbq s ASN 64 N -2.42 0.35 0.00 1.67 3.84 -1.26 -5.03 114.94 112.09 2qbq s ASN 64 Ca 0.00 0.31 0.10 0.00 0.21 0.00 0.00 52.86 53.48 2qbq s ASN 64 Cb 0.00 1.00 0.33 0.00 -0.55 0.00 0.00 41.25 42.04 2qbq s ASN 64 CO 0.00 -0.29 1.26 -0.90 -2.79 0.00 0.00 177.10 174.38 2qbq n ASP 65 N 5.36 1.37 -4.71 -4.21 5.68 -1.25 -4.84 116.55 113.95 2qbq n ASP 65 Ca -0.05 -1.94 -0.40 0.00 -0.50 0.00 0.00 54.79 51.90 2qbq n ASP 65 Cb 0.50 -0.16 -0.05 0.00 -1.14 0.00 0.00 41.12 40.28 2qbq n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2qbq s TYR 66 N -1.68 3.55 0.04 2.11 5.04 -1.26 -0.89 117.35 124.26 2qbq s TYR 66 Ca 0.20 1.26 0.02 0.00 -2.44 0.00 0.00 57.07 56.11 2qbq s TYR 66 Cb 0.10 -2.86 -0.02 0.00 0.35 0.00 0.00 41.96 39.53 2qbq s TYR 66 CO 0.14 0.01 -0.07 -1.50 -1.34 0.00 0.00 175.55 172.79 2qbq s ILE 67 N 1.09 0.50 -1.17 3.14 2.07 -1.26 -4.92 121.20 120.65 2qbq s ILE 67 Ca 0.38 -1.07 -0.21 0.00 -1.41 0.00 0.00 60.65 58.35 2qbq s ILE 67 Cb -0.18 -0.58 0.03 0.00 0.13 0.00 0.00 42.46 41.87 2qbq s ILE 67 CO 0.17 -0.40 1.70 0.21 -1.91 0.00 0.00 174.94 174.71 2qbq s ASN 68 N -1.58 6.35 -0.14 4.50 3.84 -1.26 -4.61 114.94 122.04 2qbq s ASN 68 Ca -0.10 -1.89 -0.25 0.00 0.21 0.00 0.00 52.86 50.82 2qbq s ASN 68 Cb -0.10 -2.58 0.06 0.00 -0.55 0.00 0.00 41.25 38.09 2qbq s ASN 68 CO 0.00 -1.66 0.63 0.00 -2.79 0.00 0.00 177.10 173.28 2qbq s ALA 69 N 5.87 -1.60 0.04 1.71 0.00 -1.26 -2.99 121.76 123.54 2qbq s ALA 69 Ca 0.55 1.47 0.07 0.00 0.00 0.00 0.00 51.96 54.05 2qbq s ALA 69 Cb 0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 2qbq s ALA 69 CO 0.03 -0.33 -0.20 -1.12 0.00 0.00 0.00 175.76 174.14 2qbq s SER 70 N -0.45 2.36 -0.41 0.00 0.01 0.30 -1.41 113.70 114.09 2qbq s SER 70 Ca -0.06 -0.52 -0.17 0.00 1.31 0.00 0.00 55.95 56.51 2qbq s SER 70 Cb -0.03 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 66.03 2qbq s SER 70 CO 0.05 0.14 0.43 -0.22 0.41 0.00 0.00 173.24 174.05 2qbq s LEU 71 N -1.19 4.82 -0.67 2.44 1.98 -0.04 -1.11 118.68 124.90 2qbq s LEU 71 Ca 0.07 -0.62 -0.19 0.00 -2.89 0.00 0.00 54.13 50.50 2qbq s LEU 71 Cb -0.09 -2.39 0.12 0.00 0.66 0.00 0.00 46.19 44.49 2qbq s LEU 71 CO 0.02 -0.56 0.80 -0.63 -1.89 0.00 0.00 176.35 174.09 2qbq s ILE 72 N 2.13 4.85 -0.52 6.68 1.09 0.12 -4.89 121.20 130.66 2qbq s ILE 72 Ca 0.12 -1.19 -0.16 0.00 -1.10 0.00 0.00 60.65 58.32 2qbq s ILE 72 Cb -0.17 -4.55 0.11 0.00 -1.06 0.00 0.00 42.46 36.79 2qbq s ILE 72 CO 0.13 -1.20 0.48 -0.75 -0.10 0.00 0.00 174.94 173.50 2qbq s LYS 73 N 2.53 2.99 -0.83 2.79 2.20 -1.26 -1.47 119.74 126.70 2qbq s LYS 73 Ca 0.16 -1.55 -0.22 0.00 -0.36 0.00 0.00 55.97 54.01 2qbq s LYS 73 Cb -0.19 -4.24 0.09 0.00 -1.51 0.00 0.00 37.83 31.98 2qbq s LYS 73 CO 0.03 -1.23 1.14 -1.64 -0.36 0.00 0.00 175.35 173.28 2qbq s MET 74 N 1.69 3.38 0.14 4.03 -1.94 -0.86 -4.91 119.30 120.82 2qbq s MET 74 Ca 0.04 -1.17 -0.25 0.00 -1.71 0.00 0.00 55.69 52.61 2qbq s MET 74 Cb -0.28 -4.67 -0.02 0.00 2.01 0.00 0.00 34.83 31.88 2qbq s MET 74 CO 0.05 -1.90 1.62 1.49 -0.01 0.00 0.00 175.02 176.27 2qbq h GLU 75 N 9.38 -0.34 -0.33 2.03 4.81 -1.95 0.17 114.58 128.36 2qbq h GLU 75 Ca -0.04 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2qbq h GLU 75 Cb 1.04 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 2qbq h GLU 75 CO 1.21 -0.23 0.16 1.49 -0.73 0.00 0.00 179.01 180.90 2qbq h GLU 76 N -0.35 0.47 0.00 1.92 4.81 -1.97 -2.72 114.58 116.74 2qbq h GLU 76 Ca 0.10 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 2qbq h GLU 76 Cb 0.50 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2qbq h GLU 76 CO -0.32 0.44 -0.21 0.00 -0.73 0.00 0.00 179.01 178.19 2qbq h ALA 77 N 1.01 1.09 -4.86 2.92 0.00 -1.91 -3.47 119.26 114.04 2qbq h ALA 77 Ca 0.11 -0.19 -0.31 0.00 0.00 0.00 0.00 54.91 54.53 2qbq h ALA 77 Cb 0.12 -0.03 0.12 0.00 0.00 0.00 0.00 17.79 18.00 2qbq h ALA 77 CO -0.01 0.26 -0.55 1.04 0.00 0.00 0.00 179.25 179.98 2qbq n GLN 78 N -3.47 -6.14 -3.83 0.00 6.02 0.59 -4.87 117.38 105.67 2qbq n GLN 78 Ca -0.00 0.66 -0.12 0.00 -0.01 0.00 0.00 57.00 57.52 2qbq n GLN 78 Cb 0.38 -5.19 -0.13 0.00 1.02 0.00 0.00 30.24 26.32 2qbq n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2qbq s ARG 79 N -5.85 0.12 0.12 -1.09 3.52 -1.16 -4.96 118.95 109.65 2qbq s ARG 79 Ca 0.37 0.15 0.10 0.00 -0.13 0.00 0.00 55.73 56.23 2qbq s ARG 79 Cb -0.16 0.05 -0.04 0.00 -1.56 0.00 0.00 34.95 33.24 2qbq s ARG 79 CO 0.58 -0.02 -0.24 -1.12 -0.81 0.00 0.00 175.30 173.69 2qbq s SER 80 N 0.09 3.50 0.03 -2.12 0.01 -1.26 -2.04 113.70 111.91 2qbq s SER 80 Ca -0.00 -0.67 0.03 0.00 1.31 0.00 0.00 55.95 56.61 2qbq s SER 80 Cb -0.01 -0.34 -0.02 0.00 0.21 0.00 0.00 66.02 65.87 2qbq s SER 80 CO -0.00 0.19 -0.09 -0.31 0.41 0.00 0.00 173.24 173.43 2qbq s TYR 81 N -1.07 0.82 -0.32 2.43 1.51 -0.54 -3.99 117.35 116.19 2qbq s TYR 81 Ca 0.15 -0.34 -0.12 0.00 -1.01 0.00 0.00 57.07 55.75 2qbq s TYR 81 Cb -0.10 -0.49 -0.02 0.00 -0.11 0.00 0.00 41.96 41.23 2qbq s TYR 81 CO 0.07 -0.02 0.20 0.42 -1.11 0.00 0.00 175.55 175.11 2qbq s ILE 82 N -0.87 5.11 -0.19 2.71 1.01 -0.31 0.12 121.20 128.78 2qbq s ILE 82 Ca -0.03 -0.17 -0.07 0.00 0.00 0.00 0.00 60.65 60.38 2qbq s ILE 82 Cb -0.07 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2qbq s ILE 82 CO 0.01 0.08 0.06 -0.76 0.00 0.00 0.00 174.94 174.33 2qbq s LEU 83 N 1.70 3.81 0.17 2.97 1.02 -0.27 0.18 118.68 128.25 2qbq s LEU 83 Ca 0.06 0.07 -0.01 0.00 0.02 0.00 0.00 54.13 54.27 2qbq s LEU 83 Cb -0.17 -1.96 -0.04 0.00 0.02 0.00 0.00 46.19 44.04 2qbq s LEU 83 CO 0.09 0.17 0.08 0.28 0.02 0.00 0.00 176.35 176.99 2qbq s THR 84 N 0.42 0.11 0.72 5.49 -1.32 -0.55 -0.54 115.64 119.97 2qbq s THR 84 Ca 0.03 -1.95 -0.11 0.00 -1.21 0.00 0.00 61.69 58.45 2qbq s THR 84 Cb -0.12 -2.25 0.02 0.00 -1.51 0.00 0.00 72.50 68.64 2qbq s THR 84 CO 0.00 -0.26 1.07 0.00 -2.21 0.00 0.00 174.62 173.22 2qbq s GLN 85 N -4.09 2.71 -0.23 7.08 -2.07 -1.16 -3.88 119.66 118.03 2qbq s GLN 85 Ca 0.31 0.87 -0.37 0.00 -1.82 0.00 0.00 55.36 54.35 2qbq s GLN 85 Cb 0.07 -1.97 -0.13 0.00 -1.09 0.00 0.00 33.01 29.89 2qbq s GLN 85 CO 0.06 -1.24 1.90 0.41 -1.32 0.00 0.00 175.29 175.11 2qbq n GLY 86 N -2.02 0.99 3.63 2.60 0.00 -0.19 -4.90 105.19 105.30 2qbq n GLY 86 Ca 0.07 0.91 -0.42 0.00 0.00 0.00 0.00 46.02 46.59 2qbq n GLY 86 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qbq n PRO 87 N 6.51 1.51 -3.03 1.61 -0.02 -1.26 -4.69 135.00 135.62 2qbq n PRO 87 Ca 0.29 0.54 -0.22 0.00 -2.02 0.00 0.00 63.50 62.09 2qbq n PRO 87 Cb 0.21 -2.10 0.01 0.00 -0.02 0.00 0.00 33.50 31.60 2qbq n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qbq s LEU 88 N -0.66 3.65 0.55 2.45 1.43 -1.26 -0.99 118.68 123.84 2qbq s LEU 88 Ca 0.62 0.12 0.28 0.00 -1.03 0.00 0.00 54.13 54.12 2qbq s LEU 88 Cb -0.56 -3.02 1.45 0.00 0.03 0.00 0.00 46.19 44.09 2qbq s LEU 88 CO 0.58 -0.72 1.95 -0.65 0.23 0.00 0.00 176.35 177.73 2qbq h PRO 89 N 0.45 0.00 -0.01 1.29 0.11 -1.96 -0.60 132.00 131.27 2qbq h PRO 89 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qbq h PRO 89 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2qbq h PRO 89 CO 0.55 0.00 -0.48 0.27 -0.21 0.00 0.00 178.00 178.13 2qbq n ASN 90 N -4.16 1.89 -0.38 -2.05 6.94 -1.26 -4.38 115.26 111.85 2qbq n ASN 90 Ca 0.12 -1.43 0.06 0.00 -0.02 0.00 0.00 54.58 53.30 2qbq n ASN 90 Cb 0.72 0.47 0.13 0.00 -2.36 0.00 0.00 39.78 38.74 2qbq n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2qbq n THR 91 N -0.15 1.49 -0.09 5.53 -2.24 -0.25 -4.64 114.28 113.92 2qbq n THR 91 Ca 0.09 -1.49 -0.09 0.00 -2.27 0.00 0.00 64.05 60.29 2qbq n THR 91 Cb 0.45 0.16 0.05 0.00 -2.10 0.00 0.00 70.33 68.90 2qbq n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qbq h GLY 93 N 0.93 0.84 0.79 0.00 0.00 -1.90 -2.28 103.07 101.44 2qbq h GLY 93 Ca 0.08 -0.47 0.03 0.00 0.00 0.00 0.00 47.33 46.97 2qbq h GLY 93 CO 0.07 0.44 0.18 0.45 0.00 0.00 0.00 176.54 177.68 2qbq h HIS 94 N 0.70 0.33 -0.12 5.60 -0.00 -1.79 -0.15 115.15 119.72 2qbq h HIS 94 Ca 0.17 0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.60 2qbq h HIS 94 Cb 0.22 -0.09 -0.05 0.00 -0.00 0.00 0.00 27.41 27.48 2qbq h HIS 94 CO 0.01 0.17 -0.20 0.35 -0.00 0.00 0.00 177.93 178.26 2qbq h PHE 95 N 0.37 -0.52 0.00 2.45 3.57 -0.76 0.12 116.94 122.17 2qbq h PHE 95 Ca 0.16 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 2qbq h PHE 95 Cb 0.08 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2qbq h PHE 95 CO -0.11 -0.28 -0.31 -1.49 -2.23 0.00 0.00 178.31 173.89 2qbq h TRP 96 N -0.25 0.00 -0.55 0.41 4.06 -1.20 -1.73 115.95 116.68 2qbq h TRP 96 Ca 0.10 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.94 2qbq h TRP 96 Cb 0.40 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.54 2qbq h TRP 96 CO -0.30 0.31 -0.09 1.49 -3.56 0.00 0.00 178.44 176.29 2qbq h GLU 97 N 0.00 1.02 -0.19 0.49 4.81 -0.15 -0.93 114.58 119.63 2qbq h GLU 97 Ca -0.00 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 58.85 2qbq h GLU 97 Cb 0.73 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 2qbq h GLU 97 CO 0.04 1.05 0.07 1.98 -0.73 0.00 0.00 179.01 181.42 2qbq h MET 98 N 0.91 0.28 -0.70 1.92 4.05 -0.50 0.18 114.93 121.08 2qbq h MET 98 Ca 0.15 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 59.56 2qbq h MET 98 Cb 0.65 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.36 2qbq h MET 98 CO 0.05 0.37 0.41 0.28 0.23 0.00 0.00 176.91 178.25 2qbq h VAL 99 N 0.14 1.03 0.49 -5.77 2.07 -1.15 0.87 116.25 113.92 2qbq h VAL 99 Ca 0.06 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2qbq h VAL 99 Cb 0.20 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2qbq h VAL 99 CO -0.00 0.14 -0.24 -0.25 0.02 0.00 0.00 177.57 177.24 2qbq h TRP 100 N 0.78 -0.61 -0.60 1.57 2.91 -0.94 -2.00 115.95 117.05 2qbq h TRP 100 Ca 0.30 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.32 2qbq h TRP 100 Cb 0.12 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.94 2qbq h TRP 100 CO -0.06 -0.29 0.40 0.93 -1.03 0.00 0.00 178.44 178.40 2qbq h GLU 101 N -0.98 0.75 -0.00 2.65 5.08 -0.88 -1.43 114.58 119.78 2qbq h GLU 101 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2qbq h GLU 101 Cb 0.60 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2qbq h GLU 101 CO 0.11 0.50 -0.09 1.04 -1.00 0.00 0.00 179.01 179.57 2qbq n GLN 102 N -4.45 0.68 -2.49 2.33 1.13 0.29 -4.93 117.38 109.93 2qbq n GLN 102 Ca 0.06 -0.20 -0.19 0.00 -1.94 0.00 0.00 57.00 54.73 2qbq n GLN 102 Cb 0.08 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.93 2qbq n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2qbq n LYS 103 N -0.98 -2.15 -2.16 -1.09 5.02 -0.54 -4.09 118.16 112.16 2qbq n LYS 103 Ca 0.15 0.86 -0.37 0.00 -2.02 0.00 0.00 58.31 56.93 2qbq n LYS 103 Cb 0.27 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 29.87 2qbq n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qbq s SER 104 N -2.31 5.94 -0.06 4.39 0.01 -0.82 -0.53 113.70 120.32 2qbq s SER 104 Ca 0.06 2.38 0.13 0.00 1.31 0.00 0.00 55.95 59.83 2qbq s SER 104 Cb -0.03 -2.61 -0.19 0.00 0.21 0.00 0.00 66.02 63.41 2qbq s SER 104 CO 0.08 -1.08 0.19 -1.14 0.41 0.00 0.00 173.24 171.70 2qbq n ARG 105 N -0.68 1.06 -4.13 12.44 0.00 -1.26 -4.85 116.66 119.24 2qbq n ARG 105 Ca 0.08 -0.07 -0.15 0.00 -0.00 0.00 0.00 57.85 57.71 2qbq n ARG 105 Cb 0.48 -1.32 -0.11 0.00 0.00 0.00 0.00 32.46 31.50 2qbq n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2qbq s GLY 106 N -3.99 0.72 -0.12 5.14 0.00 -1.26 -1.35 107.32 106.46 2qbq s GLY 106 Ca -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.72 2qbq s GLY 106 CO 0.55 -0.99 -0.10 0.14 0.00 0.00 0.00 173.10 172.70 2qbq s VAL 107 N -1.57 1.17 -0.26 1.40 1.01 0.06 -1.62 120.40 120.60 2qbq s VAL 107 Ca -0.04 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 2qbq s VAL 107 Cb -0.08 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 2qbq s VAL 107 CO 0.01 0.39 0.09 -0.69 0.00 0.00 0.00 175.10 174.90 2qbq s VAL 108 N 1.54 4.43 -0.22 2.92 1.01 0.14 -1.00 120.40 129.22 2qbq s VAL 108 Ca 0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 2qbq s VAL 108 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2qbq s VAL 108 CO -0.07 0.30 -0.04 -0.32 0.00 0.00 0.00 175.10 174.96 2qbq s MET 109 N 1.63 3.39 0.00 2.72 0.00 0.19 -1.19 119.30 126.03 2qbq s MET 109 Ca 0.06 -0.62 0.17 0.00 0.00 0.00 0.00 55.69 55.31 2qbq s MET 109 Cb -0.15 -3.01 0.44 0.00 0.00 0.00 0.00 34.83 32.11 2qbq s MET 109 CO 0.05 -0.18 1.36 1.28 0.00 0.00 0.00 175.02 177.52 2qbq n LEU 110 N 4.75 3.33 -4.36 4.11 4.77 -0.56 0.44 117.00 129.48 2qbq n LEU 110 Ca -0.18 -1.83 -0.18 0.00 -0.03 0.00 0.00 56.01 53.79 2qbq n LEU 110 Cb 0.51 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.18 2qbq n LEU 110 CO 0.29 0.80 -0.31 0.54 -1.33 0.00 0.00 177.39 177.38 2qbq s ASN 111 N -1.09 1.94 0.16 -1.43 2.20 -1.21 -4.52 114.94 110.98 2qbq s ASN 111 Ca 0.35 -1.27 0.03 0.00 -0.94 0.00 0.00 52.86 51.02 2qbq s ASN 111 Cb 0.19 -0.00 -0.04 0.00 -2.00 0.00 0.00 41.25 39.40 2qbq s ASN 111 CO 0.25 -0.55 0.27 -0.13 -2.94 0.00 0.00 177.10 174.00 2qbq s ARG 112 N -3.88 3.37 0.18 3.55 0.52 -1.26 -4.83 118.95 116.60 2qbq s ARG 112 Ca 0.32 -0.65 -0.13 0.00 -0.52 0.00 0.00 55.73 54.75 2qbq s ARG 112 Cb 0.07 -2.92 0.17 0.00 0.52 0.00 0.00 34.95 32.79 2qbq s ARG 112 CO 0.11 0.51 1.75 0.28 0.02 0.00 0.00 175.30 177.97 2qbq h VAL 113 N 1.65 0.85 -3.32 3.52 2.07 -1.95 -3.40 116.25 115.67 2qbq h VAL 113 Ca -0.49 -0.13 -0.65 0.00 0.82 0.00 0.00 66.70 66.25 2qbq h VAL 113 Cb 1.20 0.43 -0.26 0.00 -1.52 0.00 0.00 31.29 31.14 2qbq h VAL 113 CO 0.67 0.07 -0.75 -0.32 0.02 0.00 0.00 177.57 177.26 2qbq s MET 114 N -6.13 3.42 -0.02 1.57 -2.45 -1.26 0.42 119.30 114.84 2qbq s MET 114 Ca -0.13 -0.66 0.01 0.00 -1.25 0.00 0.00 55.69 53.65 2qbq s MET 114 Cb 0.15 -2.68 0.02 0.00 1.25 0.00 0.00 34.83 33.56 2qbq s MET 114 CO 0.73 0.20 -0.01 -1.21 1.05 0.00 0.00 175.02 175.78 2qbq s GLU 115 N 0.41 0.34 -1.47 4.11 2.02 0.50 -4.86 118.70 119.75 2qbq s GLU 115 Ca -0.09 0.02 -0.03 0.00 0.02 0.00 0.00 54.97 54.88 2qbq s GLU 115 Cb -0.16 -0.46 0.03 0.00 0.10 0.00 0.00 34.13 33.64 2qbq s GLU 115 CO 0.05 -0.08 0.44 1.63 0.02 0.00 0.00 175.26 177.32 2qbq n LYS 116 N 3.87 -3.08 -0.51 1.61 5.02 -1.26 -1.34 118.16 122.47 2qbq n LYS 116 Ca -0.24 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 2qbq n LYS 116 Cb 0.52 -4.54 0.00 0.00 -0.02 0.00 0.00 35.03 30.99 2qbq n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qbq n GLY 117 N -1.95 1.46 3.25 0.72 0.00 -1.26 -4.98 105.19 102.45 2qbq n GLY 117 Ca -0.25 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 2qbq n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qbq s SER 118 N -3.23 2.07 -0.51 1.61 1.04 -0.45 -5.11 113.70 109.13 2qbq s SER 118 Ca 0.00 -0.83 -0.16 0.00 0.48 0.00 0.00 55.95 55.43 2qbq s SER 118 Cb 0.00 -0.08 0.09 0.00 0.10 0.00 0.00 66.02 66.13 2qbq s SER 118 CO 0.00 -0.15 0.48 -0.76 0.98 0.00 0.00 173.24 173.80 2qbq s LEU 119 N -2.55 5.70 0.01 2.42 1.43 -1.26 -0.37 118.68 124.06 2qbq s LEU 119 Ca 0.11 -1.43 0.25 0.00 -1.03 0.00 0.00 54.13 52.03 2qbq s LEU 119 Cb -0.04 -2.23 0.51 0.00 0.03 0.00 0.00 46.19 44.45 2qbq s LEU 119 CO 0.03 -0.78 1.41 0.29 0.23 0.00 0.00 176.35 177.53 2qbq n LYS 120 N 5.44 0.02 -3.60 1.70 4.76 0.17 -4.89 118.16 121.76 2qbq n LYS 120 Ca -0.12 0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.20 2qbq n LYS 120 Cb 0.43 -1.51 -0.06 0.00 -1.84 0.00 0.00 35.03 32.04 2qbq n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qbq s ALA 122 N -0.31 2.52 -1.13 0.00 0.00 -0.17 -4.77 121.76 117.91 2qbq s ALA 122 Ca -0.01 0.25 -0.20 0.00 0.00 0.00 0.00 51.96 51.99 2qbq s ALA 122 Cb -0.03 -3.23 0.08 0.00 0.00 0.00 0.00 23.12 19.93 2qbq s ALA 122 CO 0.00 -1.35 1.52 -1.14 0.00 0.00 0.00 175.76 174.79 2qbq s GLN 123 N -4.74 3.78 0.00 0.00 2.00 -1.26 -4.79 119.66 114.65 2qbq s GLN 123 Ca 0.61 -1.64 0.22 0.00 -2.00 0.00 0.00 55.36 52.55 2qbq s GLN 123 Cb -0.16 -5.35 0.20 0.00 0.80 0.00 0.00 33.01 28.50 2qbq s GLN 123 CO 0.51 -2.14 1.22 2.48 -0.50 0.00 0.00 175.29 176.86 2qbq n TYR 124 N 8.17 0.05 -4.26 1.67 0.18 -1.26 -4.84 117.16 116.87 2qbq n TYR 124 Ca 0.38 -0.03 -0.21 0.00 1.88 0.00 0.00 57.90 59.92 2qbq n TYR 124 Cb 0.48 -0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.32 2qbq n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2qbq s TRP 125 N -1.80 1.59 0.26 -3.48 -2.14 -1.26 -5.05 118.94 107.05 2qbq s TRP 125 Ca 0.27 -0.46 -0.30 0.00 2.66 0.00 0.00 56.10 58.27 2qbq s TRP 125 Cb 0.19 -0.85 -0.10 0.00 -3.10 0.00 0.00 33.47 29.61 2qbq s TRP 125 CO 0.28 0.18 1.37 -1.25 -2.66 0.00 0.00 176.95 174.87 2qbq s PRO 126 N -2.16 4.32 0.03 3.25 0.04 -1.26 -4.94 135.00 134.28 2qbq s PRO 126 Ca 0.06 2.21 0.23 0.00 0.04 0.00 0.00 61.00 63.55 2qbq s PRO 126 Cb -0.08 -3.12 0.08 0.00 0.04 0.00 0.00 34.50 31.42 2qbq s PRO 126 CO 0.04 -0.32 1.07 1.04 0.04 0.00 0.00 177.00 178.87 2qbq n GLN 127 N 2.04 0.20 -4.09 4.56 6.02 -1.26 -4.68 117.38 120.17 2qbq n GLN 127 Ca 0.05 -0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.87 2qbq n GLN 127 Cb 0.41 -1.56 -0.15 0.00 1.02 0.00 0.00 30.24 29.96 2qbq n GLN 127 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2qbq s LYS 128 N -3.14 0.45 0.26 -1.09 1.02 -1.26 -5.05 119.74 110.93 2qbq s LYS 128 Ca 0.05 -0.09 -0.02 0.00 0.02 0.00 0.00 55.97 55.93 2qbq s LYS 128 Cb 0.15 -0.49 0.54 0.00 -0.52 0.00 0.00 37.83 37.51 2qbq s LYS 128 CO 0.80 0.00 1.68 0.93 -0.92 0.00 0.00 175.35 177.84 2qbq h GLU 129 N 6.58 0.29 0.00 1.68 3.07 -1.91 -1.45 114.58 122.84 2qbq h GLU 129 Ca -0.34 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 2qbq h GLU 129 Cb 1.17 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 2qbq h GLU 129 CO 0.49 0.19 0.00 0.93 -1.40 0.00 0.00 179.01 179.22 2qbq h GLU 130 N 0.30 0.00 -3.21 2.33 3.07 -1.97 -3.37 114.58 111.73 2qbq h GLU 130 Ca 0.46 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.68 2qbq h GLU 130 Cb 0.82 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 28.33 2qbq h GLU 130 CO -0.53 0.00 -0.50 0.15 -1.40 0.00 0.00 179.01 176.73 2qbq s LYS 131 N -3.64 2.50 0.66 2.33 1.02 -0.55 -5.08 119.74 116.98 2qbq s LYS 131 Ca 0.01 -3.14 -0.11 0.00 0.02 0.00 0.00 55.97 52.75 2qbq s LYS 131 Cb 0.09 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2qbq s LYS 131 CO 0.47 -1.24 1.05 -1.83 -0.92 0.00 0.00 175.35 172.88 2qbq s GLU 132 N -1.11 3.27 -0.09 1.68 1.03 -1.26 -4.57 118.70 117.65 2qbq s GLU 132 Ca 0.23 0.86 -0.01 0.00 0.03 0.00 0.00 54.97 56.08 2qbq s GLU 132 Cb -0.10 -2.03 -0.03 0.00 -0.80 0.00 0.00 34.13 31.16 2qbq s GLU 132 CO -0.12 -0.84 -0.04 -1.64 -1.33 0.00 0.00 175.26 171.30 2qbq s MET 133 N -5.10 2.95 -0.16 -4.83 -1.94 0.21 -4.96 119.30 105.48 2qbq s MET 133 Ca 0.57 -0.49 0.02 0.00 -1.71 0.00 0.00 55.69 54.07 2qbq s MET 133 Cb -0.13 -2.70 0.02 0.00 2.01 0.00 0.00 34.83 34.03 2qbq s MET 133 CO 0.54 0.63 -0.20 0.42 -0.01 0.00 0.00 175.02 176.40 2qbq s ILE 134 N -0.69 1.97 -0.71 2.53 1.01 -1.26 -0.08 121.20 123.96 2qbq s ILE 134 Ca 0.11 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.71 2qbq s ILE 134 Cb -0.11 -1.77 0.18 0.00 0.01 0.00 0.00 42.46 40.77 2qbq s ILE 134 CO 0.02 0.53 0.66 -0.36 0.00 0.00 0.00 174.94 175.79 2qbq s PHE 135 N 1.10 3.56 0.22 3.97 0.08 -0.03 -4.93 117.98 121.94 2qbq s PHE 135 Ca -0.01 -1.72 -0.08 0.00 0.12 0.00 0.00 56.93 55.24 2qbq s PHE 135 Cb -0.14 -3.81 0.29 0.00 -0.57 0.00 0.00 43.02 38.79 2qbq s PHE 135 CO -0.07 -1.00 1.82 0.93 -0.10 0.00 0.00 175.22 176.80 2qbq h GLU 136 N 8.21 0.77 -0.77 0.44 5.08 -1.96 0.19 114.58 126.53 2qbq h GLU 136 Ca -0.05 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.32 2qbq h GLU 136 Cb 1.06 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 30.09 2qbq h GLU 136 CO 0.86 0.51 0.51 0.38 -1.00 0.00 0.00 179.01 180.27 2qbq h ASP 137 N 0.79 0.75 -0.05 1.42 2.03 -1.97 -2.70 116.42 116.69 2qbq h ASP 137 Ca 0.33 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.63 2qbq h ASP 137 Cb 0.20 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 2qbq h ASP 137 CO -0.18 0.49 0.00 0.35 -1.03 0.00 0.00 179.24 178.87 2qbq n THR 138 N -4.48 0.06 -3.50 1.15 -2.24 -1.05 -5.01 114.28 99.22 2qbq n THR 138 Ca 0.11 -0.53 -0.19 0.00 -2.27 0.00 0.00 64.05 61.17 2qbq n THR 138 Cb 0.20 1.27 0.06 0.00 -2.10 0.00 0.00 70.33 69.76 2qbq n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2qbq n ASN 139 N 0.88 -2.97 -4.11 3.42 5.15 0.64 -4.93 115.26 113.34 2qbq n ASN 139 Ca 0.10 -0.74 -0.18 0.00 -0.60 0.00 0.00 54.58 53.16 2qbq n ASN 139 Cb 0.40 -4.65 -0.13 0.00 -0.53 0.00 0.00 39.78 34.86 2qbq n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2qbq s LEU 140 N -6.27 2.17 -0.06 1.20 1.02 -1.02 -1.92 118.68 113.80 2qbq s LEU 140 Ca 0.13 -0.43 0.04 0.00 0.02 0.00 0.00 54.13 53.89 2qbq s LEU 140 Cb -0.03 -0.49 -0.02 0.00 0.02 0.00 0.00 46.19 45.67 2qbq s LEU 140 CO 0.77 -0.00 -0.17 -0.75 0.02 0.00 0.00 176.35 176.21 2qbq s LYS 141 N -1.10 2.63 -0.11 1.70 2.20 -0.27 -0.86 119.74 123.94 2qbq s LYS 141 Ca -0.00 -0.76 0.01 0.00 -0.36 0.00 0.00 55.97 54.86 2qbq s LYS 141 Cb -0.08 -2.35 0.02 0.00 -1.51 0.00 0.00 37.83 33.91 2qbq s LYS 141 CO 0.01 0.50 -0.14 -1.17 -0.36 0.00 0.00 175.35 174.19 2qbq s LEU 142 N -0.42 1.63 -0.04 5.43 2.96 0.88 -0.39 118.68 128.73 2qbq s LEU 142 Ca 0.04 -0.40 0.04 0.00 -0.22 0.00 0.00 54.13 53.60 2qbq s LEU 142 Cb -0.12 -1.03 -0.00 0.00 0.50 0.00 0.00 46.19 45.54 2qbq s LEU 142 CO 0.02 -0.01 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.98 2qbq s THR 143 N 1.10 1.40 -0.23 3.68 2.01 -0.61 -0.62 115.64 122.38 2qbq s THR 143 Ca -0.05 -0.70 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 2qbq s THR 143 Cb -0.14 -1.21 0.01 0.00 0.01 0.00 0.00 72.50 71.16 2qbq s THR 143 CO -0.03 0.41 1.06 -0.22 -0.69 0.00 0.00 174.62 175.15 2qbq s LEU 144 N 0.07 4.11 -0.17 4.42 2.96 -1.26 -1.03 118.68 127.78 2qbq s LEU 144 Ca -0.04 1.40 -0.01 0.00 -0.22 0.00 0.00 54.13 55.26 2qbq s LEU 144 Cb -0.12 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.81 2qbq s LEU 144 CO 0.02 -0.68 0.15 -0.38 -1.32 0.00 0.00 176.35 174.14 2qbq n ILE 145 N 5.33 1.64 -3.67 6.68 2.08 0.14 -4.33 119.36 127.25 2qbq n ILE 145 Ca 0.12 -0.64 -0.01 0.00 0.56 0.00 0.00 62.75 62.77 2qbq n ILE 145 Cb 0.46 -1.51 -0.01 0.00 -0.75 0.00 0.00 39.64 37.83 2qbq n ILE 145 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 2qbq s SER 146 N -6.71 -0.13 -0.22 4.38 1.04 -1.14 -4.99 113.70 105.94 2qbq s SER 146 Ca -0.25 -0.23 -0.18 0.00 0.48 0.00 0.00 55.95 55.77 2qbq s SER 146 Cb 0.08 0.31 0.06 0.00 0.10 0.00 0.00 66.02 66.56 2qbq s SER 146 CO 0.71 -0.56 0.57 -1.83 0.98 0.00 0.00 173.24 173.11 2qbq s GLU 147 N -2.82 0.64 -0.40 4.02 -1.05 -1.26 -0.25 118.70 117.58 2qbq s GLU 147 Ca 0.13 0.86 -0.06 0.00 -0.15 0.00 0.00 54.97 55.74 2qbq s GLU 147 Cb 0.02 0.26 0.08 0.00 -0.44 0.00 0.00 34.13 34.05 2qbq s GLU 147 CO -0.02 -0.10 0.21 0.34 0.95 0.00 0.00 175.26 176.65 2qbq s ASP 148 N 0.62 5.43 -0.19 0.83 2.15 0.92 -4.97 116.67 121.46 2qbq s ASP 148 Ca -0.03 -1.64 -0.20 0.00 0.43 0.00 0.00 52.55 51.12 2qbq s ASP 148 Cb -0.05 -1.91 -0.03 0.00 -0.30 0.00 0.00 42.92 40.64 2qbq s ASP 148 CO -0.04 -0.51 0.59 -0.63 -0.17 0.00 0.00 175.17 174.41 2qbq s ILE 149 N 1.32 5.06 0.51 4.11 1.01 -1.26 -1.32 121.20 130.63 2qbq s ILE 149 Ca 0.03 1.10 0.05 0.00 0.00 0.00 0.00 60.65 61.84 2qbq s ILE 149 Cb -0.23 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.35 2qbq s ILE 149 CO -0.00 0.15 0.31 -0.54 0.00 0.00 0.00 174.94 174.86 2qbq s LYS 150 N 1.70 2.26 0.22 2.79 -0.14 0.15 -5.01 119.74 121.71 2qbq s LYS 150 Ca 0.27 -2.02 -0.09 0.00 -1.36 0.00 0.00 55.97 52.78 2qbq s LYS 150 Cb -0.16 -2.02 0.20 0.00 -1.68 0.00 0.00 37.83 34.18 2qbq s LYS 150 CO 0.10 -0.48 1.89 0.66 -0.76 0.00 0.00 175.35 176.76 2qbq h SER 151 N 0.95 0.94 0.00 2.83 4.64 -1.05 -3.32 113.55 118.55 2qbq h SER 151 Ca -0.39 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2qbq h SER 151 Cb 1.30 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2qbq h SER 151 CO 0.62 0.67 0.00 0.00 -0.87 0.00 0.00 176.83 177.25 2qbq n TYR 152 N -4.52 0.00 -3.60 4.77 4.11 -1.26 -5.01 117.16 111.65 2qbq n TYR 152 Ca 0.09 -0.05 -0.13 0.00 -0.00 0.00 0.00 57.90 57.80 2qbq n TYR 152 Cb 0.03 -0.01 -0.05 0.00 -0.00 0.00 0.00 39.34 39.31 2qbq n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 2qbq s TYR 153 N -0.11 -0.35 -0.02 -3.48 1.13 -1.25 -1.67 117.35 111.60 2qbq s TYR 153 Ca 0.00 0.32 0.03 0.00 -1.41 0.00 0.00 57.07 56.01 2qbq s TYR 153 Cb 0.00 0.30 -0.00 0.00 -1.10 0.00 0.00 41.96 41.16 2qbq s TYR 153 CO 0.00 -0.64 -0.11 0.99 -2.51 0.00 0.00 175.55 173.28 2qbq s THR 154 N -2.69 0.94 -0.16 -3.49 2.01 -0.47 -0.68 115.64 111.10 2qbq s THR 154 Ca -0.04 -0.47 -0.03 0.00 0.31 0.00 0.00 61.69 61.47 2qbq s THR 154 Cb -0.00 -0.81 -0.02 0.00 0.01 0.00 0.00 72.50 71.68 2qbq s THR 154 CO -0.04 0.28 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.41 2qbq s VAL 155 N -0.00 3.53 -0.06 3.82 1.01 -0.44 -0.49 120.40 127.78 2qbq s VAL 155 Ca -0.00 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.55 2qbq s VAL 155 Cb -0.08 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 2qbq s VAL 155 CO 0.00 0.49 -0.22 -0.13 0.00 0.00 0.00 175.10 175.24 2qbq s ARG 156 N 0.58 2.59 -0.36 2.72 0.52 0.11 -0.05 118.95 125.05 2qbq s ARG 156 Ca -0.04 -0.85 -0.17 0.00 -0.52 0.00 0.00 55.73 54.14 2qbq s ARG 156 Cb -0.15 -2.23 -0.00 0.00 0.52 0.00 0.00 34.95 33.09 2qbq s ARG 156 CO 0.03 0.42 0.47 -1.14 0.02 0.00 0.00 175.30 175.09 2qbq s GLN 157 N -0.24 3.52 0.19 3.54 0.74 0.65 -0.63 119.66 127.43 2qbq s GLN 157 Ca -0.01 -0.32 0.07 0.00 0.05 0.00 0.00 55.36 55.15 2qbq s GLN 157 Cb -0.13 -3.84 -0.04 0.00 1.10 0.00 0.00 33.01 30.10 2qbq s GLN 157 CO 0.03 -0.66 0.05 -0.51 -0.55 0.00 0.00 175.29 173.66 2qbq s LEU 158 N 2.28 3.48 -0.17 3.68 1.02 0.27 0.28 118.68 129.52 2qbq s LEU 158 Ca 0.16 -0.34 0.01 0.00 0.02 0.00 0.00 54.13 53.98 2qbq s LEU 158 Cb -0.16 -2.09 0.03 0.00 0.02 0.00 0.00 46.19 43.99 2qbq s LEU 158 CO 0.13 0.06 -0.15 -0.70 0.02 0.00 0.00 176.35 175.71 2qbq s GLU 159 N -3.14 2.50 -0.21 1.70 2.12 -0.20 -0.95 118.70 120.52 2qbq s GLU 159 Ca 0.29 -0.74 -0.07 0.00 0.36 0.00 0.00 54.97 54.81 2qbq s GLU 159 Cb -0.09 -2.36 -0.03 0.00 0.26 0.00 0.00 34.13 31.91 2qbq s GLU 159 CO 0.21 -0.27 0.06 -1.17 -0.54 0.00 0.00 175.26 173.54 2qbq s LEU 160 N 1.38 3.60 -0.17 2.70 0.20 0.37 -1.57 118.68 125.19 2qbq s LEU 160 Ca 0.03 -0.07 -0.02 0.00 0.69 0.00 0.00 54.13 54.77 2qbq s LEU 160 Cb -0.14 -1.93 -0.01 0.00 -0.43 0.00 0.00 46.19 43.68 2qbq s LEU 160 CO -0.11 0.07 -0.10 -0.70 -0.29 0.00 0.00 176.35 175.22 2qbq s GLU 161 N 0.96 3.34 -0.63 1.98 2.12 0.47 -1.09 118.70 125.85 2qbq s GLU 161 Ca 0.04 -0.67 -0.27 0.00 0.36 0.00 0.00 54.97 54.42 2qbq s GLU 161 Cb -0.14 -2.78 -0.00 0.00 0.26 0.00 0.00 34.13 31.46 2qbq s GLU 161 CO 0.03 -0.00 1.67 1.21 -0.54 0.00 0.00 175.26 177.63 2qbq s ASN 162 N 0.92 5.58 0.54 -1.70 3.84 -0.49 -1.12 114.94 122.51 2qbq s ASN 162 Ca -0.02 0.15 0.21 0.00 0.21 0.00 0.00 52.86 53.41 2qbq s ASN 162 Cb -0.15 -2.54 1.44 0.00 -0.55 0.00 0.00 41.25 39.45 2qbq s ASN 162 CO -0.00 -2.17 2.16 -0.07 -2.79 0.00 0.00 177.10 174.23 2qbq h LEU 163 N 15.21 0.00 -0.64 3.21 4.07 -1.69 1.02 115.31 136.50 2qbq h LEU 163 Ca -0.27 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.57 2qbq h LEU 163 Cb 1.13 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.86 2qbq h LEU 163 CO 1.23 0.03 -0.27 0.74 -1.08 0.00 0.00 178.44 179.08 2qbq h THR 164 N 0.00 1.28 -0.00 0.22 2.02 -1.90 -3.30 112.91 111.22 2qbq h THR 164 Ca -0.00 -1.40 0.00 0.00 0.77 0.00 0.00 66.41 65.78 2qbq h THR 164 Cb 0.06 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2qbq h THR 164 CO 0.00 0.47 -0.35 0.35 0.37 0.00 0.00 175.52 176.35 2qbq n THR 165 N -4.09 0.00 -1.08 3.16 -2.24 -0.80 -4.99 114.28 104.24 2qbq n THR 165 Ca -0.00 -0.32 -0.03 0.00 -2.27 0.00 0.00 64.05 61.43 2qbq n THR 165 Cb 0.46 1.01 -0.01 0.00 -2.10 0.00 0.00 70.33 69.69 2qbq n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qbq n GLN 166 N -1.06 -1.08 -2.42 -0.78 6.02 0.35 -4.98 117.38 113.42 2qbq n GLN 166 Ca 0.02 0.43 -0.39 0.00 -0.01 0.00 0.00 57.00 57.05 2qbq n GLN 166 Cb 0.13 -4.32 -0.03 0.00 1.02 0.00 0.00 30.24 27.04 2qbq n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2qbq s GLU 167 N -1.56 4.35 0.02 -1.09 2.12 -1.20 -4.85 118.70 116.50 2qbq s GLU 167 Ca 0.00 1.77 0.07 0.00 0.36 0.00 0.00 54.97 57.17 2qbq s GLU 167 Cb 0.00 -2.89 -0.02 0.00 0.26 0.00 0.00 34.13 31.48 2qbq s GLU 167 CO 0.00 -0.04 -0.22 0.99 -0.54 0.00 0.00 175.26 175.45 2qbq s THR 168 N -1.35 1.75 0.01 -1.70 2.01 -1.26 -1.40 115.64 113.70 2qbq s THR 168 Ca 0.51 -1.12 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2qbq s THR 168 Cb -0.30 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 70.71 2qbq s THR 168 CO 0.38 0.34 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.49 2qbq s ARG 169 N -0.92 0.24 -0.14 4.92 0.52 -0.25 -4.99 118.95 118.34 2qbq s ARG 169 Ca 0.08 -0.41 -0.17 0.00 -0.52 0.00 0.00 55.73 54.71 2qbq s ARG 169 Cb -0.09 0.01 -0.04 0.00 0.52 0.00 0.00 34.95 35.35 2qbq s ARG 169 CO 0.01 -0.02 0.45 -2.00 0.02 0.00 0.00 175.30 173.76 2qbq s GLU 170 N -0.94 4.31 -0.12 3.54 2.12 -1.26 -0.48 118.70 125.87 2qbq s GLU 170 Ca -0.09 0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.63 2qbq s GLU 170 Cb -0.06 -3.45 -0.00 0.00 0.26 0.00 0.00 34.13 30.87 2qbq s GLU 170 CO -0.01 0.13 -0.19 0.42 -0.54 0.00 0.00 175.26 175.07 2qbq s ILE 171 N 0.73 2.45 -0.17 -3.70 -1.09 -0.12 -4.85 121.20 114.45 2qbq s ILE 171 Ca 0.24 -0.87 -0.14 0.00 -2.23 0.00 0.00 60.65 57.65 2qbq s ILE 171 Cb -0.15 -1.99 -0.04 0.00 -1.58 0.00 0.00 42.46 38.70 2qbq s ILE 171 CO 0.09 0.54 0.31 -0.76 -1.23 0.00 0.00 174.94 173.90 2qbq s LEU 172 N 0.43 4.22 -0.24 2.97 1.02 -0.45 -0.56 118.68 126.07 2qbq s LEU 172 Ca -0.14 0.50 -0.04 0.00 0.02 0.00 0.00 54.13 54.47 2qbq s LEU 172 Cb -0.17 -2.40 -0.00 0.00 0.02 0.00 0.00 46.19 43.64 2qbq s LEU 172 CO 0.06 0.06 -0.02 -2.28 0.02 0.00 0.00 176.35 174.19 2qbq s HIS 173 N 0.65 3.01 -0.38 0.29 2.46 0.20 -0.76 115.29 120.75 2qbq s HIS 173 Ca 0.17 -1.00 -0.07 0.00 0.47 0.00 0.00 55.06 54.63 2qbq s HIS 173 Cb -0.13 -2.13 0.07 0.00 -0.13 0.00 0.00 32.58 30.26 2qbq s HIS 173 CO 0.05 -0.57 0.19 -0.06 -2.47 0.00 0.00 174.74 171.88 2qbq s PHE 174 N 1.47 3.35 -0.47 3.88 0.08 -0.17 0.10 117.98 126.22 2qbq s PHE 174 Ca 0.05 -1.66 -0.12 0.00 0.12 0.00 0.00 56.93 55.32 2qbq s PHE 174 Cb -0.15 -2.73 0.09 0.00 -0.57 0.00 0.00 43.02 39.66 2qbq s PHE 174 CO -0.02 -0.83 0.36 -1.58 -0.10 0.00 0.00 175.22 173.05 2qbq s HIS 175 N 1.36 3.32 -0.22 0.36 2.46 0.36 -0.64 115.29 122.29 2qbq s HIS 175 Ca 0.02 -1.39 -0.28 0.00 0.47 0.00 0.00 55.06 53.88 2qbq s HIS 175 Cb -0.22 -3.27 0.00 0.00 -0.13 0.00 0.00 32.58 28.96 2qbq s HIS 175 CO 0.01 -0.89 0.98 -0.47 -2.47 0.00 0.00 174.74 171.89 2qbq s TYR 176 N 1.50 3.35 -0.27 3.88 6.14 0.17 -1.36 117.35 130.76 2qbq s TYR 176 Ca 0.04 1.39 0.04 0.00 0.64 0.00 0.00 57.07 59.17 2qbq s TYR 176 Cb -0.25 -3.20 -0.01 0.00 0.42 0.00 0.00 41.96 38.92 2qbq s TYR 176 CO 0.03 -0.43 0.30 0.25 0.64 0.00 0.00 175.55 176.35 2qbq n THR 177 N 5.21 0.00 -1.41 4.34 -2.24 -0.67 -3.36 114.28 116.14 2qbq n THR 177 Ca 0.10 -0.45 0.07 0.00 -2.27 0.00 0.00 64.05 61.51 2qbq n THR 177 Cb 0.47 1.03 0.15 0.00 -2.10 0.00 0.00 70.33 69.88 2qbq n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2qbq n THR 178 N -0.64 1.80 -3.35 4.28 -2.24 -1.22 -4.82 114.28 108.09 2qbq n THR 178 Ca 0.01 -2.45 -0.44 0.00 -2.27 0.00 0.00 64.05 58.91 2qbq n THR 178 Cb 0.07 -0.13 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 2qbq n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2qbq s TRP 179 N -2.69 3.20 0.26 4.78 -0.11 -1.26 -4.66 118.94 118.46 2qbq s TRP 179 Ca 0.32 -0.76 -0.31 0.00 1.22 0.00 0.00 56.10 56.58 2qbq s TRP 179 Cb 0.30 -3.14 -0.12 0.00 -1.50 0.00 0.00 33.47 29.02 2qbq s TRP 179 CO -0.02 -0.81 1.61 -2.30 -4.62 0.00 0.00 176.95 170.81 2qbq n PRO 180 N 5.42 2.63 -1.65 5.86 -0.02 -1.26 -4.82 135.00 141.16 2qbq n PRO 180 Ca -0.11 0.94 -0.46 0.00 -2.02 0.00 0.00 63.50 61.85 2qbq n PRO 180 Cb 0.45 -2.72 -0.03 0.00 -0.02 0.00 0.00 33.50 31.17 2qbq n PRO 180 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2qbq n ASP 181 N 2.65 2.40 -0.61 2.55 5.75 -1.26 -0.45 116.55 127.58 2qbq n ASP 181 Ca 0.11 1.14 -0.08 0.00 -0.01 0.00 0.00 54.79 55.95 2qbq n ASP 181 Cb 0.35 -1.37 -0.03 0.00 -1.03 0.00 0.00 41.12 39.04 2qbq n ASP 181 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2qbq n PHE 182 N 1.89 0.00 -3.82 2.11 3.72 -1.26 -4.94 117.46 115.16 2qbq n PHE 182 Ca 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2qbq n PHE 182 Cb 0.29 -2.25 0.00 0.00 -0.94 0.00 0.00 39.48 36.59 2qbq n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qbq n GLY 183 N -0.26 4.76 3.35 1.37 0.00 0.41 -4.94 105.19 109.88 2qbq n GLY 183 Ca -0.08 -2.08 -0.18 0.00 0.00 0.00 0.00 46.02 43.67 2qbq n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbq s VAL 184 N -0.84 1.51 0.93 1.61 -7.23 -1.26 -4.78 120.40 110.34 2qbq s VAL 184 Ca 0.00 -2.13 -0.10 0.00 -1.81 0.00 0.00 61.98 57.94 2qbq s VAL 184 Cb 0.00 -2.19 0.15 0.00 0.56 0.00 0.00 36.38 34.90 2qbq s VAL 184 CO 0.00 -0.48 1.14 -2.84 -0.31 0.00 0.00 175.10 172.61 2qbq s PRO 185 N -3.72 0.90 0.49 4.82 0.02 -1.26 -4.41 135.00 131.84 2qbq s PRO 185 Ca 0.25 1.54 0.18 0.00 0.02 0.00 0.00 61.00 62.99 2qbq s PRO 185 Cb 0.02 -1.71 1.23 0.00 0.02 0.00 0.00 34.50 34.06 2qbq s PRO 185 CO 0.08 -2.71 2.07 1.05 -0.33 0.00 0.00 177.00 177.16 2qbq h GLU 186 N -1.93 0.00 -2.75 5.54 4.11 -1.98 -3.45 114.58 114.12 2qbq h GLU 186 Ca -0.44 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.01 2qbq h GLU 186 Cb 1.27 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.39 2qbq h GLU 186 CO 0.41 0.11 0.30 -1.54 0.07 0.00 0.00 179.01 178.36 2qbq s SER 187 N -6.80 -0.51 0.38 3.06 1.04 -1.26 -5.02 113.70 104.60 2qbq s SER 187 Ca -0.04 0.01 0.05 0.00 0.48 0.00 0.00 55.95 56.45 2qbq s SER 187 Cb 0.16 0.53 0.74 0.00 0.10 0.00 0.00 66.02 67.54 2qbq s SER 187 CO 0.66 -0.85 2.02 -0.65 0.98 0.00 0.00 173.24 175.39 2qbq h PRO 188 N 2.02 0.66 0.01 4.02 0.11 -1.93 -2.34 132.00 134.55 2qbq h PRO 188 Ca -0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2qbq h PRO 188 Cb 1.28 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2qbq h PRO 188 CO 0.36 0.46 -0.02 0.00 -0.21 0.00 0.00 178.00 178.59 2qbq h ALA 189 N 1.65 -0.03 -0.38 -0.75 0.00 -1.95 0.55 119.26 118.36 2qbq h ALA 189 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2qbq h ALA 189 Cb -0.03 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2qbq h ALA 189 CO -0.03 -0.52 -0.02 0.66 0.00 0.00 0.00 179.25 179.33 2qbq h SER 190 N -0.05 0.58 -0.15 0.00 4.64 -1.74 0.24 113.55 117.08 2qbq h SER 190 Ca 0.01 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 2qbq h SER 190 Cb 0.05 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2qbq h SER 190 CO -0.02 0.67 -0.07 0.15 -0.87 0.00 0.00 176.83 176.69 2qbq h PHE 191 N 0.58 0.35 -0.66 4.77 3.57 -1.15 -2.64 116.94 121.77 2qbq h PHE 191 Ca 0.12 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 2qbq h PHE 191 Cb 0.40 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2qbq h PHE 191 CO 0.02 0.64 0.15 -0.07 -2.23 0.00 0.00 178.31 176.81 2qbq h LEU 192 N -0.03 1.00 -0.68 0.59 3.38 -0.70 -0.03 115.31 118.83 2qbq h LEU 192 Ca 0.03 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.81 2qbq h LEU 192 Cb 0.54 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2qbq h LEU 192 CO 0.02 0.97 0.44 -1.13 0.09 0.00 0.00 178.44 178.83 2qbq h ASN 193 N 1.00 0.74 -0.21 -0.43 -1.24 -0.95 0.40 115.58 114.88 2qbq h ASN 193 Ca 0.21 -0.01 -0.05 0.00 0.71 0.00 0.00 56.30 57.16 2qbq h ASN 193 Cb 0.37 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.24 2qbq h ASN 193 CO 0.00 0.52 -0.05 0.15 -1.29 0.00 0.00 177.43 176.76 2qbq h PHE 194 N 0.87 0.46 -0.64 0.67 3.57 -1.06 -2.27 116.94 118.55 2qbq h PHE 194 Ca 0.26 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2qbq h PHE 194 Cb -0.04 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2qbq h PHE 194 CO -0.04 0.65 0.42 1.25 -2.23 0.00 0.00 178.31 178.36 2qbq h LEU 195 N 0.14 0.74 -1.67 0.59 5.85 -0.71 -1.30 115.31 118.94 2qbq h LEU 195 Ca 0.05 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2qbq h LEU 195 Cb 0.50 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 2qbq h LEU 195 CO 0.02 0.55 -0.19 -0.26 -0.34 0.00 0.00 178.44 178.23 2qbq h PHE 196 N 0.87 0.00 -0.25 1.25 -1.00 -0.90 0.69 116.94 117.61 2qbq h PHE 196 Ca 0.23 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.99 2qbq h PHE 196 Cb -0.08 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 2qbq h PHE 196 CO -0.03 0.19 0.05 0.87 -1.61 0.00 0.00 178.31 177.78 2qbq h LYS 197 N 0.00 0.41 -0.06 1.51 1.79 -0.64 0.11 116.57 119.68 2qbq h LYS 197 Ca -0.00 -0.10 -0.00 0.00 -2.18 0.00 0.00 60.65 58.36 2qbq h LYS 197 Cb 0.43 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.03 2qbq h LYS 197 CO 0.02 0.52 0.03 0.28 -1.08 0.00 0.00 179.45 179.23 2qbq h VAL 198 N 0.23 1.09 -0.20 0.50 2.07 -0.73 -2.69 116.25 116.51 2qbq h VAL 198 Ca 0.08 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.37 2qbq h VAL 198 Cb 0.30 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2qbq h VAL 198 CO 0.00 0.08 -0.06 0.03 0.02 0.00 0.00 177.57 177.64 2qbq h ARG 199 N -0.00 -0.01 0.00 1.57 3.08 -0.77 -2.47 114.38 115.78 2qbq h ARG 199 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2qbq h ARG 199 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2qbq h ARG 199 CO -0.00 -0.01 0.00 0.39 -1.07 0.00 0.00 179.97 179.28 2qbq n GLU 200 N -5.21 0.00 0.16 0.04 1.02 0.38 -2.19 120.64 114.84 2qbq n GLU 200 Ca -0.02 0.29 0.13 0.00 -0.02 0.00 0.00 57.16 57.53 2qbq n GLU 200 Cb 0.14 -1.51 0.30 0.00 -0.02 0.00 0.00 31.44 30.34 2qbq n GLU 200 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2qbq h SER 201 N 0.00 0.00 0.00 1.62 4.64 -1.10 -3.47 113.55 115.24 2qbq h SER 201 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qbq h SER 201 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2qbq h SER 201 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2qbq n GLY 202 N 1.22 0.89 0.30 -0.77 0.00 -0.93 -4.94 105.19 100.96 2qbq n GLY 202 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2qbq n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2qbq h SER 203 N 0.00 0.00 -0.13 1.61 0.02 -1.78 -2.15 113.55 111.12 2qbq h SER 203 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qbq h SER 203 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2qbq h SER 203 CO 0.00 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.87 2qbq n LEU 204 N -4.15 1.98 -4.75 5.07 4.77 -1.26 -4.48 117.00 114.18 2qbq n LEU 204 Ca -0.01 -0.76 -0.38 0.00 -0.03 0.00 0.00 56.01 54.82 2qbq n LEU 204 Cb 0.17 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2qbq n LEU 204 CO 0.31 0.38 0.96 -0.55 -1.33 0.00 0.00 177.39 177.16 2qbq s SER 205 N -1.74 5.47 0.13 -1.43 0.15 -0.81 -4.89 113.70 110.58 2qbq s SER 205 Ca 0.34 2.69 0.19 0.00 0.70 0.00 0.00 55.95 59.88 2qbq s SER 205 Cb 0.20 -2.63 0.79 0.00 -1.71 0.00 0.00 66.02 62.66 2qbq s SER 205 CO 0.30 -1.43 1.57 -0.81 1.20 0.00 0.00 173.24 174.07 2qbq n PRO 206 N -0.88 0.10 0.08 5.44 -0.04 -1.26 -2.16 135.00 136.28 2qbq n PRO 206 Ca 0.09 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 64.03 2qbq n PRO 206 Cb 0.45 -1.69 0.45 0.00 -0.04 0.00 0.00 33.50 32.67 2qbq n PRO 206 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2qbq n GLU 207 N -1.88 0.15 -3.89 0.54 0.28 -1.26 -4.77 120.64 109.81 2qbq n GLU 207 Ca 0.03 0.27 -0.24 0.00 -0.16 0.00 0.00 57.16 57.05 2qbq n GLU 207 Cb 0.19 -1.73 -0.03 0.00 1.43 0.00 0.00 31.44 31.29 2qbq n GLU 207 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 2qbq s HIS 208 N -3.15 2.22 0.99 -1.84 3.76 -0.92 -5.13 115.29 111.23 2qbq s HIS 208 Ca 0.08 -0.67 -0.15 0.00 -0.15 0.00 0.00 55.06 54.17 2qbq s HIS 208 Cb 0.12 -1.99 0.18 0.00 1.11 0.00 0.00 32.58 32.00 2qbq s HIS 208 CO 0.45 -0.16 1.17 0.20 -0.85 0.00 0.00 174.74 175.55 2qbq s GLY 209 N -4.12 1.62 0.36 -2.22 0.00 0.31 -4.93 107.32 98.34 2qbq s GLY 209 Ca 0.39 -0.76 -0.28 0.00 0.00 0.00 0.00 44.72 44.07 2qbq s GLY 209 CO 0.23 -0.09 1.40 2.56 0.00 0.00 0.00 173.10 177.21 2qbq s PRO 210 N -5.44 4.22 0.45 2.90 0.04 -1.26 -4.41 135.00 131.50 2qbq s PRO 210 Ca 0.68 2.41 -0.25 0.00 0.04 0.00 0.00 61.00 63.88 2qbq s PRO 210 Cb -0.11 -3.01 -0.08 0.00 0.04 0.00 0.00 34.50 31.33 2qbq s PRO 210 CO 0.54 -0.37 1.32 0.54 0.04 0.00 0.00 177.00 179.06 2qbq s VAL 211 N -1.13 2.48 -0.19 -0.36 0.11 -1.26 -4.44 120.40 115.62 2qbq s VAL 211 Ca 0.51 0.41 -0.14 0.00 -2.93 0.00 0.00 61.98 59.83 2qbq s VAL 211 Cb -0.43 -3.23 -0.05 0.00 -1.53 0.00 0.00 36.38 31.14 2qbq s VAL 211 CO 0.58 0.04 0.29 -0.69 -3.33 0.00 0.00 175.10 171.99 2qbq s VAL 212 N -1.29 5.30 -0.06 2.04 1.01 -0.64 -1.17 120.40 125.58 2qbq s VAL 212 Ca 0.61 0.50 0.04 0.00 0.00 0.00 0.00 61.98 63.14 2qbq s VAL 212 Cb -0.38 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.37 2qbq s VAL 212 CO 0.48 0.35 -0.19 -0.69 0.00 0.00 0.00 175.10 175.06 2qbq s VAL 213 N 0.75 1.62 -0.18 2.92 1.01 0.13 0.28 120.40 126.93 2qbq s VAL 213 Ca 0.15 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 2qbq s VAL 213 Cb -0.13 -1.40 0.05 0.00 0.00 0.00 0.00 36.38 34.90 2qbq s VAL 213 CO 0.04 0.46 0.46 -1.38 0.00 0.00 0.00 175.10 174.68 2qbq s HIS 214 N 0.21 -0.54 0.00 5.22 -3.43 -0.33 -1.48 115.29 114.93 2qbq s HIS 214 Ca -0.10 1.28 0.00 0.00 -0.80 0.00 0.00 55.06 55.44 2qbq s HIS 214 Cb -0.14 0.21 0.00 0.00 -1.43 0.00 0.00 32.58 31.21 2qbq s HIS 214 CO 0.04 -0.27 0.00 0.00 -2.00 0.00 0.00 174.74 172.51 2qbq n SER 216 N 0.00 1.13 0.10 0.00 2.88 -1.26 -2.33 113.62 114.14 2qbq n SER 216 Ca 0.00 0.43 0.12 0.00 -1.33 0.00 0.00 58.87 58.09 2qbq n SER 216 Cb 0.00 -0.71 0.16 0.00 -0.75 0.00 0.00 64.21 62.91 2qbq n SER 216 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qbq h ALA 217 N -1.38 0.68 -0.17 -1.46 0.00 -1.88 -0.49 119.26 114.56 2qbq h ALA 217 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2qbq h ALA 217 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2qbq h ALA 217 CO 0.00 0.00 -0.04 0.41 0.00 0.00 0.00 179.25 179.62 2qbq n GLY 218 N 1.26 0.39 0.00 0.00 0.00 -1.25 -4.30 105.19 101.28 2qbq n GLY 218 Ca 0.03 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2qbq n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qbq n ILE 219 N -3.54 0.00 0.00 -0.61 -5.35 -1.26 -4.54 119.36 104.06 2qbq n ILE 219 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 2qbq n ILE 219 Cb 0.31 -0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.12 2qbq n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qbq n GLY 220 N 1.36 0.22 0.32 3.28 0.00 -1.26 0.07 105.19 109.17 2qbq n GLY 220 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2qbq n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qbq h ARG 221 N 0.00 1.11 -0.55 1.61 3.08 -1.95 -1.62 114.38 116.05 2qbq h ARG 221 Ca 0.00 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2qbq h ARG 221 Cb 0.00 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 2qbq h ARG 221 CO 0.00 0.81 0.31 0.77 -1.07 0.00 0.00 179.97 180.80 2qbq h SER 222 N 1.10 0.68 -0.66 7.04 0.02 -1.87 -1.03 113.55 118.84 2qbq h SER 222 Ca 0.28 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2qbq h SER 222 Cb 0.02 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 2qbq h SER 222 CO -0.05 0.57 0.43 1.23 -1.14 0.00 0.00 176.83 177.87 2qbq h GLY 223 N 0.74 0.93 0.97 -3.77 0.00 -1.00 -1.33 103.07 99.62 2qbq h GLY 223 Ca 0.20 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 2qbq h GLY 223 CO -0.03 0.34 0.19 -0.84 0.00 0.00 0.00 176.54 176.20 2qbq h THR 224 N 0.89 1.12 0.12 4.70 2.02 -0.96 -0.44 112.91 120.36 2qbq h THR 224 Ca 0.24 -0.28 0.01 0.00 0.77 0.00 0.00 66.41 67.14 2qbq h THR 224 Cb -0.09 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 2qbq h THR 224 CO -0.05 0.12 -0.15 0.15 0.37 0.00 0.00 175.52 175.96 2qbq h PHE 225 N 0.42 -0.38 -0.59 3.16 3.04 -0.88 -2.43 116.94 119.29 2qbq h PHE 225 Ca 0.12 0.00 -0.08 0.00 3.98 0.00 0.00 57.97 62.00 2qbq h PHE 225 Cb 0.02 0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.66 2qbq h PHE 225 CO -0.04 -0.22 0.06 0.00 -2.02 0.00 0.00 178.31 176.10 2qbq h LEU 227 N 0.90 0.45 -0.37 0.00 5.85 -0.97 -0.39 115.31 120.78 2qbq h LEU 227 Ca 0.18 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2qbq h LEU 227 Cb 0.44 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2qbq h LEU 227 CO 0.02 0.40 0.22 0.00 -0.34 0.00 0.00 178.44 178.74 2qbq h ALA 228 N 1.07 0.47 -0.34 1.25 0.00 -1.31 -1.25 119.26 119.13 2qbq h ALA 228 Ca 0.13 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2qbq h ALA 228 Cb 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2qbq h ALA 228 CO -0.02 -0.03 0.15 0.22 0.00 0.00 0.00 179.25 179.57 2qbq h ASP 229 N 0.48 0.47 -0.45 0.00 3.58 -1.19 -2.25 116.42 117.06 2qbq h ASP 229 Ca 0.13 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 2qbq h ASP 229 Cb 0.01 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 2qbq h ASP 229 CO -0.02 0.50 0.25 0.74 -2.88 0.00 0.00 179.24 177.82 2qbq h THR 230 N 0.41 1.16 -0.70 2.25 2.02 -0.95 -1.57 112.91 115.53 2qbq h THR 230 Ca 0.12 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 2qbq h THR 230 Cb 0.17 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 2qbq h THR 230 CO -0.01 0.17 0.40 0.00 0.37 0.00 0.00 175.52 176.45 2qbq h LEU 232 N 0.96 0.86 -0.15 0.00 3.38 -1.25 -1.71 115.31 117.41 2qbq h LEU 232 Ca 0.25 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2qbq h LEU 232 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2qbq h LEU 232 CO -0.04 0.85 -0.01 0.25 0.09 0.00 0.00 178.44 179.58 2qbq h LEU 233 N 0.87 0.27 -0.45 1.67 6.46 -0.59 0.65 115.31 124.18 2qbq h LEU 233 Ca 0.18 -0.33 0.06 0.00 -0.12 0.00 0.00 57.88 57.67 2qbq h LEU 233 Cb 0.35 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 40.16 2qbq h LEU 233 CO 0.00 0.53 0.17 -0.07 -0.62 0.00 0.00 178.44 178.46 2qbq h LEU 234 N -0.01 0.18 -0.94 2.25 -0.00 -0.78 -0.47 115.31 115.54 2qbq h LEU 234 Ca 0.04 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2qbq h LEU 234 Cb 0.41 0.03 -0.05 0.00 -0.00 0.00 0.00 40.66 41.05 2qbq h LEU 234 CO 0.01 0.14 0.60 -0.03 -0.00 0.00 0.00 178.44 179.16 2qbq h MET 235 N 0.34 1.25 -0.19 1.13 4.05 -1.20 -2.95 114.93 117.36 2qbq h MET 235 Ca 0.21 -0.09 -0.03 0.00 -0.28 0.00 0.00 59.70 59.52 2qbq h MET 235 Cb 0.20 -0.27 -0.01 0.00 -0.80 0.00 0.00 31.60 30.72 2qbq h MET 235 CO -0.21 0.84 0.02 0.22 0.23 0.00 0.00 176.91 178.01 2qbq h ASP 236 N 1.28 0.32 0.12 1.39 3.58 0.08 0.35 116.42 123.54 2qbq h ASP 236 Ca 0.34 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.48 2qbq h ASP 236 Cb -0.11 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 40.85 2qbq h ASP 236 CO -0.07 0.52 -0.11 0.50 -2.88 0.00 0.00 179.24 177.20 2qbq h LYS 237 N 0.10 0.00 0.00 0.28 3.11 -1.04 -2.64 116.57 116.39 2qbq h LYS 237 Ca 0.06 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 2qbq h LYS 237 Cb 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.58 2qbq h LYS 237 CO 0.01 0.11 -0.93 0.54 -2.81 0.00 0.00 179.45 176.37 2qbq n ARG 238 N -4.35 0.96 -3.98 1.90 1.74 -1.12 -4.98 116.66 106.82 2qbq n ARG 238 Ca -0.03 -0.01 -0.27 0.00 -0.77 0.00 0.00 57.85 56.77 2qbq n ARG 238 Cb 0.19 -1.37 -0.01 0.00 -1.02 0.00 0.00 32.46 30.25 2qbq n ARG 238 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2qbq n LYS 239 N -1.48 -3.57 -3.29 5.56 4.76 0.12 -4.95 118.16 115.32 2qbq n LYS 239 Ca 0.03 0.43 -0.08 0.00 -2.87 0.00 0.00 58.31 55.82 2qbq n LYS 239 Cb 0.30 -4.75 -0.05 0.00 -1.84 0.00 0.00 35.03 28.69 2qbq n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2qbq s ASP 240 N -4.10 0.03 0.36 4.39 2.15 -0.96 -5.03 116.67 113.52 2qbq s ASP 240 Ca 0.18 -0.86 0.07 0.00 0.43 0.00 0.00 52.55 52.38 2qbq s ASP 240 Cb -0.10 1.20 0.77 0.00 -0.30 0.00 0.00 42.92 44.50 2qbq s ASP 240 CO 0.89 -0.27 1.94 -0.65 -0.17 0.00 0.00 175.17 176.90 2qbq h PRO 241 N 7.48 0.70 0.00 4.34 0.11 -1.92 -2.43 132.00 140.28 2qbq h PRO 241 Ca 0.00 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 2qbq h PRO 241 Cb 1.12 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2qbq h PRO 241 CO 0.19 0.47 -0.01 0.77 -0.21 0.00 0.00 178.00 179.21 2qbq h SER 242 N 0.72 0.00 -0.01 -2.05 0.02 -1.97 -2.87 113.55 107.39 2qbq h SER 242 Ca 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 2qbq h SER 242 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2qbq h SER 242 CO -0.13 0.01 0.00 -1.54 -1.14 0.00 0.00 176.83 174.03 2qbq n SER 243 N -3.13 0.26 -4.58 3.07 3.41 -0.91 -4.71 113.62 107.03 2qbq n SER 243 Ca -0.01 -1.16 -0.37 0.00 -0.26 0.00 0.00 58.87 57.07 2qbq n SER 243 Cb 0.20 -0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.03 2qbq n SER 243 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qbq s VAL 244 N -1.99 5.11 -0.61 -3.33 0.11 -1.08 -5.03 120.40 113.57 2qbq s VAL 244 Ca 0.43 0.10 -0.12 0.00 -2.93 0.00 0.00 61.98 59.45 2qbq s VAL 244 Cb 0.20 -3.41 0.15 0.00 -1.53 0.00 0.00 36.38 31.80 2qbq s VAL 244 CO 0.34 0.29 0.53 -0.62 -3.33 0.00 0.00 175.10 172.31 2qbq s ASP 245 N 1.54 6.13 0.16 3.54 -1.08 -1.26 -4.61 116.67 121.09 2qbq s ASP 245 Ca 0.07 -2.17 -0.17 0.00 -0.52 0.00 0.00 52.55 49.76 2qbq s ASP 245 Cb -0.15 -2.12 0.08 0.00 -1.46 0.00 0.00 42.92 39.27 2qbq s ASP 245 CO 0.08 -0.69 1.69 0.40 0.52 0.00 0.00 175.17 177.16 2qbq h ILE 246 N 5.60 0.67 -0.68 4.11 2.04 -1.99 -0.34 117.51 126.92 2qbq h ILE 246 Ca -0.14 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.73 2qbq h ILE 246 Cb 1.06 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 2qbq h ILE 246 CO 0.88 0.01 0.43 0.11 0.00 0.00 0.00 178.15 179.59 2qbq h LYS 247 N 0.05 0.83 -0.84 2.37 1.57 -1.99 0.01 116.57 118.57 2qbq h LYS 247 Ca 0.18 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2qbq h LYS 247 Cb 0.26 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 2qbq h LYS 247 CO -0.34 0.55 0.43 -0.22 -0.57 0.00 0.00 179.45 179.30 2qbq h LYS 248 N 0.86 1.19 -0.49 3.15 3.64 -1.79 -1.58 116.57 121.55 2qbq h LYS 248 Ca 0.27 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2qbq h LYS 248 Cb -0.01 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 2qbq h LYS 248 CO -0.09 0.90 0.19 0.28 -2.27 0.00 0.00 179.45 178.46 2qbq h VAL 249 N 1.18 1.21 -0.81 2.00 2.07 -0.35 -1.54 116.25 120.01 2qbq h VAL 249 Ca 0.29 -0.66 0.04 0.00 0.82 0.00 0.00 66.70 67.19 2qbq h VAL 249 Cb 0.08 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 2qbq h VAL 249 CO -0.04 0.25 0.51 0.25 0.02 0.00 0.00 177.57 178.56 2qbq h LEU 250 N 0.65 0.84 -0.60 2.57 5.85 -0.61 -0.89 115.31 123.12 2qbq h LEU 250 Ca 0.16 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.76 2qbq h LEU 250 Cb 0.20 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2qbq h LEU 250 CO -0.01 0.57 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.34 2qbq h LEU 251 N 0.99 0.86 -0.35 2.25 3.38 -1.07 -0.91 115.31 120.46 2qbq h LEU 251 Ca 0.33 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2qbq h LEU 251 Cb 0.05 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2qbq h LEU 251 CO -0.13 1.07 0.12 -0.08 0.09 0.00 0.00 178.44 179.52 2qbq h GLU 252 N 0.72 0.27 -0.75 1.13 4.57 -0.85 -2.55 114.58 117.12 2qbq h GLU 252 Ca 0.09 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.31 2qbq h GLU 252 Cb 0.79 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.26 2qbq h GLU 252 CO 0.07 0.18 0.45 0.52 -1.18 0.00 0.00 179.01 179.04 2qbq h MET 253 N 0.27 0.81 0.00 1.92 2.86 -0.77 -2.28 114.93 117.74 2qbq h MET 253 Ca 0.16 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2qbq h MET 253 Cb 0.13 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2qbq h MET 253 CO -0.16 0.53 0.00 0.54 1.06 0.00 0.00 176.91 178.89 2qbq n ARG 254 N -4.70 0.03 0.25 1.72 1.74 -0.38 -1.11 116.66 114.22 2qbq n ARG 254 Ca 0.10 0.32 0.15 0.00 -0.77 0.00 0.00 57.85 57.65 2qbq n ARG 254 Cb 0.16 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.57 2qbq n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2qbq h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.28 -3.30 116.57 119.13 2qbq h LYS 255 Ca 0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2qbq h LYS 255 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2qbq h LYS 255 CO 0.00 0.00 -2.02 1.19 -0.57 0.00 0.00 179.45 178.05 2qbq n PHE 256 N -3.10 0.00 -3.66 -1.35 3.72 -0.26 -4.97 117.46 107.84 2qbq n PHE 256 Ca 0.02 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.31 2qbq n PHE 256 Cb 0.40 -0.60 -0.08 0.00 -0.94 0.00 0.00 39.48 38.25 2qbq n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2qbq s ARG 257 N -3.07 0.64 0.56 -1.08 3.52 -1.19 -4.50 118.95 113.83 2qbq s ARG 257 Ca -0.08 0.96 -0.19 0.00 -0.13 0.00 0.00 55.73 56.29 2qbq s ARG 257 Cb 0.10 0.20 -0.05 0.00 -1.56 0.00 0.00 34.95 33.64 2qbq s ARG 257 CO 0.80 -0.12 1.15 0.00 -0.81 0.00 0.00 175.30 176.32 2qbq s MET 258 N 1.00 3.22 0.00 5.12 0.23 -1.26 -4.29 119.30 123.32 2qbq s MET 258 Ca -0.05 1.66 0.00 0.00 -1.03 0.00 0.00 55.69 56.27 2qbq s MET 258 Cb -0.05 -1.98 0.00 0.00 -1.53 0.00 0.00 34.83 31.27 2qbq s MET 258 CO -0.09 -0.97 0.00 0.41 -2.03 0.00 0.00 175.02 172.34 2qbq n GLY 259 N 0.23 0.53 3.61 3.16 0.00 -1.26 -4.87 105.19 106.59 2qbq n GLY 259 Ca 0.12 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 2qbq n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbq s LEU 260 N 0.00 3.67 0.00 0.99 1.43 -1.26 -4.24 118.68 119.27 2qbq s LEU 260 Ca 0.00 1.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.38 2qbq s LEU 260 Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2qbq s LEU 260 CO 0.00 -1.45 0.00 -0.38 0.23 0.00 0.00 176.35 174.75 2qbq n ILE 261 N 6.93 -1.49 0.03 -0.59 5.41 0.11 -4.89 119.36 124.88 2qbq n ILE 261 Ca 0.19 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.80 2qbq n ILE 261 Cb 0.47 -2.01 -0.14 0.00 -0.71 0.00 0.00 39.64 37.24 2qbq n ILE 261 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2qbq h GLN 262 N 0.00 0.16 -5.28 0.38 -0.00 -1.76 -3.47 115.11 105.15 2qbq h GLN 262 Ca 0.00 -0.27 -0.41 0.00 -0.00 0.00 0.00 58.65 57.96 2qbq h GLN 262 Cb 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 27.48 27.44 2qbq h GLN 262 CO 0.00 0.95 -0.69 0.95 0.00 0.00 0.00 178.83 180.04 2qbq s THR 263 N -2.61 1.35 0.30 2.39 -4.23 -1.26 -5.04 115.64 106.54 2qbq s THR 263 Ca -0.09 -2.10 0.10 0.00 -1.18 0.00 0.00 61.69 58.42 2qbq s THR 263 Cb 0.07 -2.21 0.02 0.00 1.34 0.00 0.00 72.50 71.72 2qbq s THR 263 CO 0.83 -0.46 1.69 0.00 -0.54 0.00 0.00 174.62 176.15 2qbq h ALA 264 N 2.50 1.12 -0.04 3.99 0.00 -1.93 -2.72 119.26 122.19 2qbq h ALA 264 Ca -0.38 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 53.91 2qbq h ALA 264 Cb 1.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2qbq h ALA 264 CO 0.65 0.63 -0.71 0.22 0.00 0.00 0.00 179.25 180.04 2qbq h ASP 265 N 0.07 0.24 -0.68 0.00 3.58 -1.96 0.08 116.42 117.75 2qbq h ASP 265 Ca 0.00 -0.16 -0.08 0.00 0.42 0.00 0.00 57.03 57.21 2qbq h ASP 265 Cb 0.89 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.85 2qbq h ASP 265 CO 0.07 0.87 0.12 1.56 -2.88 0.00 0.00 179.24 178.98 2qbq h GLN 266 N 0.14 1.11 -0.19 0.28 4.20 -1.83 0.21 115.11 119.03 2qbq h GLN 266 Ca -0.02 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 2qbq h GLN 266 Cb 1.26 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 2qbq h GLN 266 CO 0.11 1.01 0.07 1.25 -0.67 0.00 0.00 178.83 180.59 2qbq h LEU 267 N 1.05 0.28 -0.78 1.46 5.85 -1.25 -1.11 115.31 120.81 2qbq h LEU 267 Ca 0.21 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.78 2qbq h LEU 267 Cb 0.43 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 2qbq h LEU 267 CO 0.01 0.39 0.49 -0.09 -0.34 0.00 0.00 178.44 178.90 2qbq h ARG 268 N 0.15 0.91 -0.45 1.25 2.43 -0.65 -1.28 114.38 116.73 2qbq h ARG 268 Ca 0.06 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2qbq h ARG 268 Cb 0.21 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2qbq h ARG 268 CO -0.00 0.60 0.14 0.35 -1.51 0.00 0.00 179.97 179.55 2qbq h PHE 269 N 0.94 0.66 -0.63 2.20 3.04 -0.29 -2.31 116.94 120.54 2qbq h PHE 269 Ca 0.32 -0.04 0.06 0.00 3.98 0.00 0.00 57.97 62.29 2qbq h PHE 269 Cb 0.05 -0.20 -0.05 0.00 2.56 0.00 0.00 35.95 38.31 2qbq h PHE 269 CO -0.04 0.54 0.34 0.77 -2.02 0.00 0.00 178.31 177.91 2qbq h SER 270 N 0.64 0.50 -0.23 0.41 0.02 -0.00 0.69 113.55 115.58 2qbq h SER 270 Ca 0.15 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2qbq h SER 270 Cb 0.20 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2qbq h SER 270 CO -0.01 0.33 0.14 1.88 -1.14 0.00 0.00 176.83 178.03 2qbq h TYR 271 N 0.64 0.30 -0.39 3.45 -1.99 -1.17 -1.22 116.97 116.60 2qbq h TYR 271 Ca 0.28 0.00 0.07 0.00 2.00 0.00 0.00 58.73 61.08 2qbq h TYR 271 Cb 0.18 -0.10 -0.06 0.00 2.00 0.00 0.00 36.73 38.76 2qbq h TYR 271 CO -0.09 0.22 0.04 -0.07 -0.00 0.00 0.00 178.16 178.26 2qbq h LEU 272 N 0.29 -0.08 -0.25 3.88 4.07 -0.87 0.45 115.31 122.80 2qbq h LEU 272 Ca 0.08 0.08 -0.02 0.00 0.08 0.00 0.00 57.88 58.10 2qbq h LEU 272 Cb 0.01 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 2qbq h LEU 272 CO -0.02 -0.01 0.06 0.00 -1.08 0.00 0.00 178.44 177.40 2qbq h ALA 273 N 1.32 0.32 -0.30 1.53 0.00 -0.72 -2.00 119.26 119.41 2qbq h ALA 273 Ca 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2qbq h ALA 273 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2qbq h ALA 273 CO -0.28 -0.03 0.10 0.28 0.00 0.00 0.00 179.25 179.32 2qbq h VAL 274 N 0.22 1.20 -0.45 0.00 2.07 -0.95 0.19 116.25 118.53 2qbq h VAL 274 Ca 0.08 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 67.01 2qbq h VAL 274 Cb 0.27 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2qbq h VAL 274 CO 0.00 0.21 0.24 0.40 0.02 0.00 0.00 177.57 178.44 2qbq h ILE 275 N 0.32 1.00 -0.26 4.57 2.04 -0.90 0.83 117.51 125.10 2qbq h ILE 275 Ca 0.10 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 2qbq h ILE 275 Cb 0.23 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2qbq h ILE 275 CO -0.00 0.09 -0.08 -0.08 0.00 0.00 0.00 178.15 178.08 2qbq h GLU 276 N 0.49 0.52 0.00 2.37 4.57 -1.22 -2.95 114.58 118.36 2qbq h GLU 276 Ca 0.19 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 2qbq h GLU 276 Cb 0.07 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2qbq h GLU 276 CO -0.12 0.74 -0.05 0.78 -1.18 0.00 0.00 179.01 179.18 2qbq h GLY 277 N 0.26 0.00 0.97 1.92 0.00 -0.26 -2.27 103.07 103.69 2qbq h GLY 277 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.53 2qbq h GLY 277 CO 0.03 0.00 0.38 0.00 0.00 0.00 0.00 176.54 176.95 2qbq h ALA 278 N 1.95 2.36 -0.48 3.60 0.00 -0.65 -1.47 119.26 124.57 2qbq h ALA 278 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2qbq h ALA 278 Cb 0.09 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2qbq h ALA 278 CO 0.01 -0.51 0.27 0.87 0.00 0.00 0.00 179.25 179.89 2qbq h LYS 279 N 0.11 0.53 0.05 0.00 1.57 -1.52 -1.77 116.57 115.53 2qbq h LYS 279 Ca 0.26 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2qbq h LYS 279 Cb 0.88 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.07 2qbq h LYS 279 CO -0.03 0.35 -0.02 0.35 -0.57 0.00 0.00 179.45 179.53 2qbq h PHE 280 N 0.55 -0.06 -1.02 -1.35 3.57 -1.45 -1.42 116.94 115.76 2qbq h PHE 280 Ca 0.20 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.94 2qbq h PHE 280 Cb 0.05 0.02 -0.11 0.00 2.79 0.00 0.00 35.95 38.70 2qbq h PHE 280 CO -0.08 0.13 0.63 0.82 -2.23 0.00 0.00 178.31 177.58 2qbq h ILE 281 N -0.24 0.56 -0.59 1.41 1.08 -1.17 -1.07 117.51 117.48 2qbq h ILE 281 Ca -0.01 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 2qbq h ILE 281 Cb 0.21 -0.02 0.00 0.00 -3.07 0.00 0.00 36.82 33.95 2qbq h ILE 281 CO 0.01 0.10 0.00 0.23 -0.69 0.00 0.00 178.15 177.80 2qbq n MET 282 N -4.76 2.56 0.00 2.37 2.81 -0.69 -4.89 117.12 114.52 2qbq n MET 282 Ca 0.26 -2.41 0.00 0.00 -1.81 0.00 0.00 57.70 53.74 2qbq n MET 282 Cb 0.78 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.76 2qbq n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qbq n GLY 283 N 1.57 1.57 3.62 3.03 0.00 -0.41 -5.06 105.19 109.52 2qbq n GLY 283 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 2qbq n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qbq s ASP 284 N -2.00 6.66 0.00 1.61 -1.08 -0.56 -4.92 116.67 116.38 2qbq s ASP 284 Ca 0.00 1.08 0.18 0.00 -0.52 0.00 0.00 52.55 53.29 2qbq s ASP 284 Cb 0.00 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.46 2qbq s ASP 284 CO 0.00 -1.12 1.43 -1.54 0.52 0.00 0.00 175.17 174.46 2qbq n SER 285 N 7.70 2.29 -0.04 -0.34 3.41 -1.26 -4.27 113.62 121.11 2qbq n SER 285 Ca 0.14 -1.89 -0.02 0.00 -0.26 0.00 0.00 58.87 56.85 2qbq n SER 285 Cb 0.47 -0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 64.13 2qbq n SER 285 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qbq n SER 286 N 0.74 2.60 -0.24 4.04 3.41 -1.26 -4.67 113.62 118.23 2qbq n SER 286 Ca 0.16 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.85 2qbq n SER 286 Cb 0.40 0.93 0.34 0.00 -0.26 0.00 0.00 64.21 65.62 2qbq n SER 286 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2qbq h VAL 287 N 0.00 0.96 -0.23 -3.33 -1.51 -1.97 -1.81 116.25 108.36 2qbq h VAL 287 Ca -0.20 -0.27 0.05 0.00 -1.23 0.00 0.00 66.70 65.05 2qbq h VAL 287 Cb 1.31 0.10 -0.05 0.00 -2.13 0.00 0.00 31.29 30.52 2qbq h VAL 287 CO 0.01 0.14 -0.07 -0.61 -1.23 0.00 0.00 177.57 175.81 2qbq h GLN 288 N 0.79 -0.02 -0.29 5.19 4.15 -1.84 0.30 115.11 123.39 2qbq h GLN 288 Ca 0.38 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.72 2qbq h GLN 288 Cb 0.42 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2qbq h GLN 288 CO -0.15 -0.02 -0.16 -0.44 -1.93 0.00 0.00 178.83 176.13 2qbq h ASP 289 N -0.02 0.51 0.02 -0.69 3.32 -1.76 -2.13 116.42 115.67 2qbq h ASP 289 Ca 0.11 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2qbq h ASP 289 Cb 0.20 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 2qbq h ASP 289 CO -0.25 0.69 -0.03 1.56 -1.72 0.00 0.00 179.24 179.50 2qbq h GLN 290 N 0.47 -0.06 -0.75 3.56 4.20 -0.33 -1.37 115.11 120.84 2qbq h GLN 290 Ca 0.08 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.83 2qbq h GLN 290 Cb 0.56 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 2qbq h GLN 290 CO 0.04 -0.04 0.47 -1.49 -0.67 0.00 0.00 178.83 177.14 2qbq h TRP 291 N -0.06 0.87 -0.47 2.96 6.55 -0.24 0.52 115.95 126.08 2qbq h TRP 291 Ca 0.00 0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.91 2qbq h TRP 291 Cb 0.06 -0.29 -0.04 0.00 -0.86 0.00 0.00 29.16 28.03 2qbq h TRP 291 CO -0.09 0.49 0.24 -0.22 -1.05 0.00 0.00 178.44 177.81 2qbq h LYS 292 N 0.90 0.46 0.42 0.49 3.64 -1.08 0.15 116.57 121.55 2qbq h LYS 292 Ca 0.31 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 2qbq h LYS 292 Cb 0.05 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2qbq h LYS 292 CO -0.12 0.31 -0.20 0.93 -2.27 0.00 0.00 179.45 178.09 2qbq h GLU 293 N 0.48 -0.54 0.00 1.90 4.39 -0.49 -3.00 114.58 117.31 2qbq h GLU 293 Ca 0.20 0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.94 2qbq h GLU 293 Cb 0.10 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2qbq h GLU 293 CO -0.14 -0.30 -0.01 -0.07 -1.16 0.00 0.00 179.01 177.33 2qbq h LEU 294 N -0.68 0.00 -0.96 1.33 4.07 -0.71 -2.27 115.31 116.08 2qbq h LEU 294 Ca -0.06 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 2qbq h LEU 294 Cb 0.49 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 2qbq h LEU 294 CO 0.09 0.01 -0.29 0.77 -1.08 0.00 0.00 178.44 177.94 2qbq h SER 295 N 0.00 0.00 -5.68 -0.43 4.64 -0.55 -3.46 113.55 108.07 2qbq h SER 295 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 2qbq h SER 295 Cb 0.02 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 62.26 2qbq h SER 295 CO 0.00 0.29 -0.70 1.41 -0.87 0.00 0.00 176.83 176.96 2qbq n HIS 296 N -3.42 -2.59 0.43 4.77 8.25 -0.86 -4.89 115.22 116.91 2qbq n HIS 296 Ca 0.00 0.97 0.10 0.00 -0.26 0.00 0.00 57.72 58.53 2qbq n HIS 296 Cb 0.48 -4.99 0.42 0.00 1.12 0.00 0.00 29.99 27.02 2qbq n HIS 296 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2qbq n GLU 297 N -4.61 0.12 0.00 -0.41 0.28 -1.26 -4.57 120.64 110.18 2qbq n GLU 297 Ca -0.10 0.36 0.13 0.00 -0.16 0.00 0.00 57.16 57.39 2qbq n GLU 297 Cb 0.60 -1.72 0.31 0.00 1.43 0.00 0.00 31.44 32.06 2qbq n GLU 297 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72