#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbn s LEU 11 N 0.00 3.51 0.41 1.20 1.43 -1.26 -4.32 118.68 119.64 2qbn s LEU 11 Ca 0.00 -0.05 -0.23 0.00 -1.03 0.00 0.00 54.13 52.82 2qbn s LEU 11 Cb 0.00 -1.87 -0.09 0.00 0.03 0.00 0.00 46.19 44.25 2qbn s LEU 11 CO 0.00 0.15 1.01 0.00 0.23 0.00 0.00 176.35 177.74 2qbn s ALA 12 N 0.50 3.06 0.30 4.21 0.00 0.28 -4.98 121.76 125.13 2qbn s ALA 12 Ca 0.00 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 52.25 2qbn s ALA 12 Cb -0.13 -3.23 -0.12 0.00 0.00 0.00 0.00 23.12 19.64 2qbn s ALA 12 CO 0.02 -0.09 1.59 -0.35 0.00 0.00 0.00 175.76 176.93 2qbn n PRO 13 N -0.24 2.71 -1.76 0.00 -0.04 -1.26 -4.82 135.00 129.59 2qbn n PRO 13 Ca 0.06 0.96 -0.42 0.00 -0.04 0.00 0.00 63.50 64.06 2qbn n PRO 13 Cb 0.51 -2.74 -0.03 0.00 -0.04 0.00 0.00 33.50 31.20 2qbn n PRO 13 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2qbn s LEU 14 N -0.54 4.39 0.56 1.53 2.96 -1.26 -4.96 118.68 121.35 2qbn s LEU 14 Ca 0.63 2.70 -0.21 0.00 -0.22 0.00 0.00 54.13 57.04 2qbn s LEU 14 Cb -0.49 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.59 2qbn s LEU 14 CO 0.49 -0.98 1.30 -2.84 -1.32 0.00 0.00 176.35 173.00 2qbn s PRO 15 N 2.72 3.10 0.55 0.98 0.02 -1.26 -4.90 135.00 136.21 2qbn s PRO 15 Ca 0.80 2.08 0.27 0.00 0.02 0.00 0.00 61.00 64.16 2qbn s PRO 15 Cb -0.45 -2.16 1.46 0.00 0.02 0.00 0.00 34.50 33.38 2qbn s PRO 15 CO 0.36 -1.17 1.99 -1.35 -0.33 0.00 0.00 177.00 176.49 2qbn h PRO 16 N 1.30 0.00 -0.01 5.54 0.11 -2.05 -2.10 132.00 134.79 2qbn h PRO 16 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2qbn h PRO 16 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2qbn h PRO 16 CO 0.57 0.00 -0.17 -2.39 -0.21 0.00 0.00 178.00 175.80 2qbn n HIS 17 N -4.14 0.00 -3.34 0.65 1.44 -1.26 -4.83 115.22 103.73 2qbn n HIS 17 Ca 0.09 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.39 2qbn n HIS 17 Cb 0.59 -0.10 -0.09 0.00 0.12 0.00 0.00 29.99 30.52 2qbn n HIS 17 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2qbn s VAL 18 N -2.37 5.12 0.32 0.61 1.01 -0.79 -4.90 120.40 119.40 2qbn s VAL 18 Ca 0.29 0.32 -0.28 0.00 0.00 0.00 0.00 61.98 62.31 2qbn s VAL 18 Cb 0.20 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.65 2qbn s VAL 18 CO 0.47 -0.06 1.13 -2.16 0.00 0.00 0.00 175.10 174.47 2qbn s PRO 19 N 2.17 4.44 0.47 2.72 0.04 -1.26 -4.84 135.00 138.73 2qbn s PRO 19 Ca 0.15 1.81 0.17 0.00 0.04 0.00 0.00 61.00 63.17 2qbn s PRO 19 Cb -0.16 -2.99 1.15 0.00 0.04 0.00 0.00 34.50 32.54 2qbn s PRO 19 CO 0.12 0.03 2.02 1.05 0.04 0.00 0.00 177.00 180.25 2qbn h GLU 20 N 3.37 0.23 0.00 4.56 4.11 -1.97 -2.15 114.58 122.73 2qbn h GLU 20 Ca -0.48 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2qbn h GLU 20 Cb 1.22 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2qbn h GLU 20 CO 0.65 0.16 0.00 -2.39 0.07 0.00 0.00 179.01 177.50 2qbn n HIS 21 N -4.46 0.00 0.50 2.06 1.44 -1.26 -2.18 115.22 111.32 2qbn n HIS 21 Ca 0.07 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.89 2qbn n HIS 21 Cb 0.36 -0.47 0.16 0.00 0.12 0.00 0.00 29.99 30.16 2qbn n HIS 21 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2qbn n LEU 22 N -1.47 3.15 -4.68 2.39 4.77 -0.81 -4.95 117.00 115.40 2qbn n LEU 22 Ca 0.04 -1.32 -0.43 0.00 -0.03 0.00 0.00 56.01 54.27 2qbn n LEU 22 Cb 0.17 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 2qbn n LEU 22 CO 0.13 0.63 0.81 -0.69 -1.33 0.00 0.00 177.39 176.95 2qbn s VAL 23 N -1.56 4.77 -0.28 4.08 1.01 -0.93 0.04 120.40 127.53 2qbn s VAL 23 Ca 0.32 2.04 -0.02 0.00 0.00 0.00 0.00 61.98 64.32 2qbn s VAL 23 Cb 0.20 -4.31 0.12 0.00 0.00 0.00 0.00 36.38 32.38 2qbn s VAL 23 CO 0.29 -0.03 0.22 0.12 0.00 0.00 0.00 175.10 175.70 2qbn s PHE 24 N 2.22 -0.13 -0.89 5.22 5.36 0.47 -4.89 117.98 125.34 2qbn s PHE 24 Ca 0.48 -0.40 -0.21 0.00 -0.96 0.00 0.00 56.93 55.84 2qbn s PHE 24 Cb -0.18 -0.62 -0.12 0.00 -0.34 0.00 0.00 43.02 41.76 2qbn s PHE 24 CO 0.16 -0.84 1.98 -0.25 -1.46 0.00 0.00 175.22 174.81 2qbn n ASP 25 N 5.29 2.75 -4.74 6.13 10.43 -1.26 -3.69 116.55 131.45 2qbn n ASP 25 Ca -0.04 -2.71 -0.39 0.00 2.57 0.00 0.00 54.79 54.22 2qbn n ASP 25 Cb 0.45 -1.21 -0.05 0.00 1.84 0.00 0.00 41.12 42.15 2qbn n ASP 25 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 2qbn s PHE 26 N 4.68 3.68 -0.43 1.24 5.36 -1.26 -4.89 117.98 126.36 2qbn s PHE 26 Ca 0.56 1.31 -0.08 0.00 -0.96 0.00 0.00 56.93 57.76 2qbn s PHE 26 Cb 0.14 -2.73 0.10 0.00 -0.34 0.00 0.00 43.02 40.19 2qbn s PHE 26 CO 0.08 0.26 0.27 0.34 -1.46 0.00 0.00 175.22 174.71 2qbn s ASP 27 N 0.09 5.56 0.46 6.13 -1.08 -1.26 -4.56 116.67 122.01 2qbn s ASP 27 Ca 0.35 -1.76 0.31 0.00 -0.52 0.00 0.00 52.55 50.93 2qbn s ASP 27 Cb -0.19 -1.95 1.63 0.00 -1.46 0.00 0.00 42.92 40.95 2qbn s ASP 27 CO 0.20 -0.59 1.95 0.00 0.52 0.00 0.00 175.17 177.24 2qbn h MET 28 N 8.34 0.00 -0.00 4.34 -0.00 -1.96 -0.58 114.93 125.07 2qbn h MET 28 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.50 2qbn h MET 28 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.67 2qbn h MET 28 CO 0.78 0.00 -0.88 0.66 -0.00 0.00 0.00 176.91 177.46 2qbn n TYR 29 N -2.61 0.00 -2.74 -0.10 4.02 -1.26 -2.88 117.16 111.59 2qbn n TYR 29 Ca -0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.80 2qbn n TYR 29 Cb 0.08 -0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.46 2qbn n TYR 29 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2qbn n ASN 30 N -1.19 -2.61 -4.77 7.72 4.05 -0.82 -4.48 115.26 113.16 2qbn n ASN 30 Ca 0.05 -3.30 -0.41 0.00 0.45 0.00 0.00 54.58 51.38 2qbn n ASN 30 Cb 0.36 1.78 -0.01 0.00 1.23 0.00 0.00 39.78 43.14 2qbn n ASN 30 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2qbn s PRO 31 N 0.52 4.20 0.25 1.20 0.04 -0.29 -4.66 135.00 136.27 2qbn s PRO 31 Ca 0.28 2.44 -0.10 0.00 0.04 0.00 0.00 61.00 63.66 2qbn s PRO 31 Cb 0.25 -3.02 0.36 0.00 0.04 0.00 0.00 34.50 32.12 2qbn s PRO 31 CO -0.18 -0.43 1.59 0.77 0.04 0.00 0.00 177.00 178.79 2qbn h SER 32 N 3.60 -0.74 -0.61 6.66 0.02 -1.90 -1.89 113.55 118.68 2qbn h SER 32 Ca -0.49 0.24 -0.26 0.00 -0.84 0.00 0.00 61.79 60.44 2qbn h SER 32 Cb 1.23 0.50 -0.16 0.00 0.14 0.00 0.00 62.40 64.11 2qbn h SER 32 CO 0.68 -0.27 0.33 0.59 -1.14 0.00 0.00 176.83 177.03 2qbn n ASN 33 N -5.52 3.73 -0.27 3.07 4.13 -1.26 -4.60 115.26 114.54 2qbn n ASN 33 Ca 0.12 -2.99 0.25 0.00 1.68 0.00 0.00 54.58 53.64 2qbn n ASN 33 Cb 0.42 -0.71 0.59 0.00 -1.54 0.00 0.00 39.78 38.54 2qbn n ASN 33 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2qbn h LEU 34 N 1.47 0.27 -2.42 3.41 5.85 -1.60 -0.10 115.31 122.21 2qbn h LEU 34 Ca 0.32 0.04 0.01 0.00 0.84 0.00 0.00 57.88 59.10 2qbn h LEU 34 Cb 2.09 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 43.12 2qbn h LEU 34 CO 0.65 0.08 0.05 0.77 -0.34 0.00 0.00 178.44 179.65 2qbn h SER 35 N 0.26 0.00 0.38 1.25 4.64 -1.86 -0.81 113.55 117.40 2qbn h SER 35 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 2qbn h SER 35 Cb 1.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 2qbn h SER 35 CO -0.16 0.00 -0.10 0.00 -0.87 0.00 0.00 176.83 175.70 2qbn n ALA 36 N -2.32 2.75 0.00 5.18 0.00 -0.05 -4.99 120.51 121.08 2qbn n ALA 36 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2qbn n ALA 36 Cb 0.14 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.24 2qbn n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbn n GLY 37 N 1.28 3.51 0.27 0.00 0.00 -0.31 -4.70 105.19 105.24 2qbn n GLY 37 Ca 0.14 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 2qbn n GLY 37 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2qbn h VAL 38 N 0.03 1.26 -0.89 1.61 3.04 -1.88 -0.25 116.25 119.17 2qbn h VAL 38 Ca 0.00 -1.06 -0.02 0.00 -1.01 0.00 0.00 66.70 64.62 2qbn h VAL 38 Cb 0.00 0.91 -0.04 0.00 -2.01 0.00 0.00 31.29 30.14 2qbn h VAL 38 CO 0.00 0.38 0.50 1.56 -1.01 0.00 0.00 177.57 178.99 2qbn h GLN 39 N 0.79 1.24 -0.35 4.17 7.50 -1.92 -1.44 115.11 125.10 2qbn h GLN 39 Ca 0.15 -0.14 -0.07 0.00 0.50 0.00 0.00 58.65 59.10 2qbn h GLN 39 Cb 0.49 -0.25 -0.02 0.00 0.05 0.00 0.00 27.48 27.76 2qbn h GLN 39 CO 0.02 0.90 -0.06 0.93 -1.50 0.00 0.00 178.83 179.12 2qbn h GLU 40 N 1.25 0.57 -0.50 1.46 3.07 -1.77 -1.02 114.58 117.64 2qbn h GLU 40 Ca 0.32 -0.15 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2qbn h GLU 40 Cb 0.01 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 2qbn h GLU 40 CO -0.05 0.64 -0.02 0.00 -1.40 0.00 0.00 179.01 178.18 2qbn h ALA 41 N 1.40 0.67 -0.07 3.43 0.00 -0.13 -2.82 119.26 121.75 2qbn h ALA 41 Ca 0.10 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2qbn h ALA 41 Cb 0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2qbn h ALA 41 CO 0.02 0.50 -0.60 -1.49 0.00 0.00 0.00 179.25 177.68 2qbn h TRP 42 N 0.75 0.28 0.00 0.00 4.06 -1.10 -3.09 115.95 116.87 2qbn h TRP 42 Ca 0.14 -0.11 0.00 0.00 2.06 0.00 0.00 58.89 60.98 2qbn h TRP 42 Cb 0.54 -0.05 0.00 0.00 -1.00 0.00 0.00 29.16 28.65 2qbn h TRP 42 CO 0.04 0.76 0.00 0.00 -3.56 0.00 0.00 178.44 175.68 2qbn h ALA 43 N 1.21 1.00 0.00 1.49 0.00 -0.92 -1.08 119.26 120.96 2qbn h ALA 43 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qbn h ALA 43 Cb 1.10 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2qbn h ALA 43 CO 0.09 0.00 -0.04 -0.39 0.00 0.00 0.00 179.25 178.91 2qbn h VAL 44 N 0.00 0.31 0.00 0.00 -1.51 -1.52 0.71 116.25 114.24 2qbn h VAL 44 Ca 0.00 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 2qbn h VAL 44 Cb 0.03 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2qbn h VAL 44 CO 0.00 0.04 0.00 0.18 -1.23 0.00 0.00 177.57 176.56 2qbn n LEU 45 N -3.44 0.13 -0.86 4.19 4.77 -0.41 -2.52 117.00 118.86 2qbn n LEU 45 Ca -0.02 0.53 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 2qbn n LEU 45 Cb 0.16 -0.51 0.24 0.00 -2.33 0.00 0.00 43.42 40.98 2qbn n LEU 45 CO 0.26 -0.30 0.70 0.00 -1.33 0.00 0.00 177.39 176.71 2qbn n GLN 46 N -1.65 2.95 -1.97 3.23 6.02 0.24 -4.81 117.38 121.39 2qbn n GLN 46 Ca 0.03 -2.70 -0.33 0.00 -0.01 0.00 0.00 57.00 54.00 2qbn n GLN 46 Cb 0.19 -1.74 0.02 0.00 1.02 0.00 0.00 30.24 29.72 2qbn n GLN 46 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2qbn s GLU 47 N -2.48 3.22 0.28 -1.09 2.02 -1.05 -4.94 118.70 114.66 2qbn s GLU 47 Ca 0.39 1.21 -0.07 0.00 0.02 0.00 0.00 54.97 56.52 2qbn s GLU 47 Cb 0.30 -2.02 0.50 0.00 0.10 0.00 0.00 34.13 33.01 2qbn s GLU 47 CO 0.10 -0.89 1.57 0.66 0.02 0.00 0.00 175.26 176.72 2qbn h SER 48 N 0.29 -0.84 -0.02 -0.19 4.64 -1.95 -1.20 113.55 114.28 2qbn h SER 48 Ca -0.47 0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2qbn h SER 48 Cb 1.22 0.59 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 2qbn h SER 48 CO 0.57 -0.33 0.00 -0.46 -0.87 0.00 0.00 176.83 175.74 2qbn n ASN 49 N -5.60 0.26 -4.68 4.97 2.04 -1.26 -4.84 115.26 106.15 2qbn n ASN 49 Ca 0.17 -1.42 -0.37 0.00 -0.44 0.00 0.00 54.58 52.51 2qbn n ASN 49 Cb 0.54 -0.01 -0.08 0.00 -2.53 0.00 0.00 39.78 37.69 2qbn n ASN 49 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 2qbn s VAL 50 N -1.97 5.26 1.00 3.53 1.01 -0.46 -5.08 120.40 123.70 2qbn s VAL 50 Ca 0.31 0.56 -0.11 0.00 0.00 0.00 0.00 61.98 62.73 2qbn s VAL 50 Cb 0.14 -3.66 0.20 0.00 0.00 0.00 0.00 36.38 33.06 2qbn s VAL 50 CO 0.24 0.31 1.11 -2.84 0.00 0.00 0.00 175.10 173.91 2qbn s PRO 51 N 1.04 0.32 0.36 2.72 0.02 -1.26 -4.83 135.00 133.37 2qbn s PRO 51 Ca 0.16 1.35 0.11 0.00 0.02 0.00 0.00 61.00 62.63 2qbn s PRO 51 Cb -0.14 -1.66 0.69 0.00 0.02 0.00 0.00 34.50 33.41 2qbn s PRO 51 CO 0.06 -3.04 1.83 -0.44 -0.33 0.00 0.00 177.00 175.08 2qbn h ASP 52 N -2.16 0.11 -3.23 2.53 3.45 -1.94 -3.41 116.42 111.76 2qbn h ASP 52 Ca -0.49 -0.03 -0.47 0.00 0.43 0.00 0.00 57.03 56.46 2qbn h ASP 52 Cb 1.29 -0.03 -0.37 0.00 -0.56 0.00 0.00 39.33 39.66 2qbn h ASP 52 CO 0.44 0.42 -0.78 -0.22 -1.57 0.00 0.00 179.24 177.53 2qbn s LEU 53 N -8.37 0.85 0.33 1.55 2.96 -1.26 -0.81 118.68 113.94 2qbn s LEU 53 Ca -0.04 -0.17 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2qbn s LEU 53 Cb 0.14 -0.60 -0.07 0.00 0.50 0.00 0.00 46.19 46.17 2qbn s LEU 53 CO 0.74 -0.16 -0.00 0.68 -1.32 0.00 0.00 176.35 176.28 2qbn s VAL 54 N 1.82 1.61 -0.11 1.68 -7.23 -0.72 -4.95 120.40 112.51 2qbn s VAL 54 Ca 0.04 -2.06 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 2qbn s VAL 54 Cb -0.12 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.10 2qbn s VAL 54 CO -0.06 -0.12 -0.22 0.86 -0.31 0.00 0.00 175.10 175.25 2qbn s TRP 55 N -3.01 2.50 -0.08 2.82 -0.11 0.11 -0.57 118.94 120.59 2qbn s TRP 55 Ca 0.33 -1.09 -0.00 0.00 1.22 0.00 0.00 56.10 56.56 2qbn s TRP 55 Cb 0.07 -1.69 -0.03 0.00 -1.50 0.00 0.00 33.47 30.32 2qbn s TRP 55 CO 0.15 -0.47 -0.05 -0.08 -4.62 0.00 0.00 176.95 171.88 2qbn s THR 56 N 0.52 3.88 -2.28 5.86 -1.32 -0.42 -0.39 115.64 121.48 2qbn s THR 56 Ca -0.15 -0.41 0.29 0.00 -1.21 0.00 0.00 61.69 60.21 2qbn s THR 56 Cb -0.17 -2.60 0.59 0.00 -1.51 0.00 0.00 72.50 68.81 2qbn s THR 56 CO 0.05 0.60 1.83 0.54 -2.21 0.00 0.00 174.62 175.43 2qbn n ARG 57 N 2.25 1.40 -1.89 7.08 1.74 -1.26 -1.64 116.66 124.33 2qbn n ARG 57 Ca -0.18 -0.69 -0.32 0.00 -0.77 0.00 0.00 57.85 55.90 2qbn n ARG 57 Cb 0.53 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 30.50 2qbn n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qbn n ASN 59 N -2.51 -3.66 0.00 0.00 4.13 -1.26 -1.37 115.26 110.59 2qbn n ASN 59 Ca 0.07 -0.88 0.00 0.00 1.68 0.00 0.00 54.58 55.45 2qbn n ASN 59 Cb 0.53 -3.42 0.00 0.00 -1.54 0.00 0.00 39.78 35.35 2qbn n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qbn n GLY 60 N -1.61 2.34 0.03 7.41 0.00 -1.26 -4.57 105.19 107.54 2qbn n GLY 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qbn n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbn n GLY 61 N -2.00 0.78 3.55 -0.02 0.00 -0.47 -4.84 105.19 102.19 2qbn n GLY 61 Ca 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 46.02 44.70 2qbn n GLY 61 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2qbn s HIS 62 N -0.10 -0.24 0.58 1.61 -3.43 -0.65 -4.74 115.29 108.31 2qbn s HIS 62 Ca 0.00 0.14 -0.10 0.00 -0.80 0.00 0.00 55.06 54.30 2qbn s HIS 62 Cb 0.00 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.64 2qbn s HIS 62 CO 0.00 -0.41 0.96 -1.58 -2.00 0.00 0.00 174.74 171.72 2qbn s TRP 63 N -2.82 3.60 -0.06 0.38 0.52 -0.31 -1.30 118.94 118.94 2qbn s TRP 63 Ca 0.07 1.18 -0.03 0.00 0.02 0.00 0.00 56.10 57.34 2qbn s TRP 63 Cb -0.01 -2.62 0.04 0.00 -1.15 0.00 0.00 33.47 29.73 2qbn s TRP 63 CO -0.07 -0.57 0.11 0.42 0.02 0.00 0.00 176.95 176.87 2qbn s ILE 64 N -3.04 -0.18 -0.05 2.03 1.01 0.26 -0.39 121.20 120.84 2qbn s ILE 64 Ca 0.53 0.38 -0.24 0.00 0.00 0.00 0.00 60.65 61.32 2qbn s ILE 64 Cb -0.11 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.10 2qbn s ILE 64 CO 0.50 0.16 0.71 0.00 0.00 0.00 0.00 174.94 176.31 2qbn s ALA 65 N 2.15 3.34 -1.05 9.38 0.00 -0.72 -1.75 121.76 133.10 2qbn s ALA 65 Ca 0.03 0.15 0.15 0.00 0.00 0.00 0.00 51.96 52.29 2qbn s ALA 65 Cb -0.12 -2.96 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 2qbn s ALA 65 CO -0.04 -0.09 0.72 0.25 0.00 0.00 0.00 175.76 176.60 2qbn n THR 66 N 3.68 0.00 -4.74 0.00 -2.24 0.01 -4.41 114.28 106.58 2qbn n THR 66 Ca -0.01 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.22 2qbn n THR 66 Cb 0.51 1.10 -0.14 0.00 -2.10 0.00 0.00 70.33 69.70 2qbn n THR 66 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qbn s ARG 67 N -2.06 1.65 0.36 -0.78 1.81 -1.26 -4.76 118.95 113.90 2qbn s ARG 67 Ca 0.09 -1.15 0.11 0.00 -1.72 0.00 0.00 55.73 53.06 2qbn s ARG 67 Cb 0.12 -1.90 0.88 0.00 -0.45 0.00 0.00 34.95 33.60 2qbn s ARG 67 CO 0.48 0.48 1.84 0.78 -0.68 0.00 0.00 175.30 178.19 2qbn h GLY 68 N 4.57 1.26 0.81 -3.53 0.00 -1.81 -1.64 103.07 102.72 2qbn h GLY 68 Ca -0.47 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 46.60 2qbn h GLY 68 CO 0.42 0.02 0.07 -1.61 0.00 0.00 0.00 176.54 175.44 2qbn h GLN 69 N 0.62 0.16 -0.20 4.80 4.15 -1.96 -0.25 115.11 122.44 2qbn h GLN 69 Ca 0.50 -0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.73 2qbn h GLN 69 Cb 0.93 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.58 2qbn h GLN 69 CO -0.25 0.11 -0.57 -0.07 -1.93 0.00 0.00 178.83 176.12 2qbn h LEU 70 N 0.17 0.71 -0.28 -2.39 4.07 -1.81 -2.00 115.31 113.77 2qbn h LEU 70 Ca 0.10 -0.39 -0.01 0.00 0.08 0.00 0.00 57.88 57.66 2qbn h LEU 70 Cb 0.07 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.59 2qbn h LEU 70 CO -0.10 1.13 0.14 0.40 -1.08 0.00 0.00 178.44 178.93 2qbn h ILE 71 N 0.48 1.14 -0.38 1.22 2.04 -1.12 -0.65 117.51 120.24 2qbn h ILE 71 Ca 0.00 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 2qbn h ILE 71 Cb 1.14 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 2qbn h ILE 71 CO 0.11 0.14 0.10 0.03 0.00 0.00 0.00 178.15 178.53 2qbn h ARG 72 N 0.33 0.60 -0.47 2.37 3.08 -1.04 -2.18 114.38 117.07 2qbn h ARG 72 Ca 0.10 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qbn h ARG 72 Cb 0.09 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2qbn h ARG 72 CO -0.01 0.63 0.30 0.93 -1.07 0.00 0.00 179.97 180.75 2qbn h GLU 73 N 0.47 0.59 -0.55 0.04 5.08 -1.15 -2.06 114.58 116.99 2qbn h GLU 73 Ca 0.12 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 2qbn h GLU 73 Cb 0.30 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2qbn h GLU 73 CO 0.00 0.39 0.02 0.00 -1.00 0.00 0.00 179.01 178.42 2qbn h ALA 74 N 1.18 0.99 0.00 3.43 0.00 -1.05 -2.20 119.26 121.61 2qbn h ALA 74 Ca 0.18 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2qbn h ALA 74 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2qbn h ALA 74 CO -0.05 0.62 -0.23 1.88 0.00 0.00 0.00 179.25 181.47 2qbn h TYR 75 N 0.87 0.00 0.00 0.00 0.05 -1.09 -2.91 116.97 113.89 2qbn h TYR 75 Ca 0.16 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.72 2qbn h TYR 75 Cb 0.49 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.19 2qbn h TYR 75 CO 0.03 0.23 -1.15 0.93 -1.05 0.00 0.00 178.16 177.15 2qbn h GLU 76 N 0.00 0.00 -4.26 4.88 5.08 -0.95 -3.40 114.58 115.93 2qbn h GLU 76 Ca -0.00 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.60 2qbn h GLU 76 Cb 0.56 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.60 2qbn h GLU 76 CO 0.03 0.89 1.08 -3.47 -1.00 0.00 0.00 179.01 176.55 2qbn n ASP 77 N -3.29 5.35 0.09 1.42 2.03 -0.87 -4.81 116.55 116.48 2qbn n ASP 77 Ca -0.03 -3.02 0.11 0.00 0.52 0.00 0.00 54.79 52.38 2qbn n ASP 77 Cb 0.96 -1.50 0.45 0.00 -0.72 0.00 0.00 41.12 40.32 2qbn n ASP 77 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qbn n TYR 78 N 4.48 0.62 -0.00 -0.67 0.18 -1.26 -1.42 117.16 119.09 2qbn n TYR 78 Ca 0.33 0.22 -0.07 0.00 1.88 0.00 0.00 57.90 60.26 2qbn n TYR 78 Cb 0.41 -0.86 0.11 0.00 -0.38 0.00 0.00 39.34 38.62 2qbn n TYR 78 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2qbn h ARG 79 N 0.00 0.54 0.00 -3.48 3.08 -1.94 -3.31 114.38 109.28 2qbn h ARG 79 Ca 0.00 -0.28 -0.37 0.00 0.07 0.00 0.00 59.98 59.40 2qbn h ARG 79 Cb 0.45 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.44 2qbn h ARG 79 CO 0.00 0.86 -2.33 0.72 -1.07 0.00 0.00 179.97 178.16 2qbn n HIS 80 N -4.02 0.15 -3.69 3.04 8.25 -1.15 -4.63 115.22 113.17 2qbn n HIS 80 Ca -0.02 0.05 -0.38 0.00 -0.26 0.00 0.00 57.72 57.11 2qbn n HIS 80 Cb 0.52 -1.03 -0.10 0.00 1.12 0.00 0.00 29.99 30.51 2qbn n HIS 80 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2qbn s PHE 81 N -2.51 3.48 0.27 4.41 0.08 -0.50 -1.69 117.98 121.52 2qbn s PHE 81 Ca -0.16 -2.48 -0.17 0.00 0.12 0.00 0.00 56.93 54.25 2qbn s PHE 81 Cb 0.07 -3.29 -0.08 0.00 -0.57 0.00 0.00 43.02 39.15 2qbn s PHE 81 CO 0.77 -0.91 0.71 0.45 -0.10 0.00 0.00 175.22 176.14 2qbn s SER 82 N 1.36 6.89 0.00 1.36 0.15 -0.14 -4.26 113.70 119.05 2qbn s SER 82 Ca 0.13 1.31 0.23 0.00 0.70 0.00 0.00 55.95 58.32 2qbn s SER 82 Cb -0.21 -2.38 0.86 0.00 -1.71 0.00 0.00 66.02 62.58 2qbn s SER 82 CO -0.04 -0.08 1.62 -1.54 1.20 0.00 0.00 173.24 174.40 2qbn n SER 83 N 0.17 1.59 -0.12 5.45 3.41 -1.26 -0.99 113.62 121.87 2qbn n SER 83 Ca 0.00 -1.63 0.12 0.00 -0.26 0.00 0.00 58.87 57.10 2qbn n SER 83 Cb 0.52 -0.07 0.47 0.00 -0.26 0.00 0.00 64.21 64.88 2qbn n SER 83 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2qbn h GLU 84 N 2.23 0.46 -2.63 4.33 4.81 -1.86 -3.21 114.58 118.71 2qbn h GLU 84 Ca 0.00 -0.03 -0.60 0.00 -0.13 0.00 0.00 59.36 58.60 2qbn h GLU 84 Cb 0.48 -0.10 -0.39 0.00 0.63 0.00 0.00 28.75 29.37 2qbn h GLU 84 CO 0.00 0.31 -0.84 0.00 -0.73 0.00 0.00 179.01 177.75 2qbn n PRO 86 N 2.78 0.20 -4.26 0.00 -0.04 -1.21 -3.81 135.00 128.66 2qbn n PRO 86 Ca 0.24 -0.10 -0.28 0.00 -0.04 0.00 0.00 63.50 63.32 2qbn n PRO 86 Cb 0.42 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.29 2qbn n PRO 86 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2qbn s PHE 87 N -2.87 2.68 -0.08 0.54 2.99 -1.26 -0.43 117.98 119.56 2qbn s PHE 87 Ca 0.16 -0.19 0.01 0.00 0.00 0.00 0.00 56.93 56.90 2qbn s PHE 87 Cb 0.18 -1.36 -0.03 0.00 0.00 0.00 0.00 43.02 41.81 2qbn s PHE 87 CO 0.62 0.46 -0.09 0.42 -0.00 0.00 0.00 175.22 176.63 2qbn s ILE 88 N -1.44 3.51 0.94 0.64 -1.09 -1.26 -2.81 121.20 119.69 2qbn s ILE 88 Ca 0.23 -0.54 -0.12 0.00 -2.23 0.00 0.00 60.65 57.99 2qbn s ILE 88 Cb -0.10 -2.43 0.16 0.00 -1.58 0.00 0.00 42.46 38.50 2qbn s ILE 88 CO 0.14 0.58 1.10 -2.16 -1.23 0.00 0.00 174.94 173.38 2qbn s PRO 89 N -0.60 0.89 0.27 2.79 0.04 -1.26 -4.86 135.00 132.26 2qbn s PRO 89 Ca 0.09 0.52 -0.00 0.00 0.04 0.00 0.00 61.00 61.65 2qbn s PRO 89 Cb -0.12 -1.79 0.55 0.00 0.04 0.00 0.00 34.50 33.18 2qbn s PRO 89 CO 0.02 -2.42 1.77 -0.09 0.04 0.00 0.00 177.00 176.32 2qbn h ARG 90 N -1.67 0.66 -0.39 4.56 2.43 -1.81 -0.28 114.38 117.88 2qbn h ARG 90 Ca -0.52 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 58.62 2qbn h ARG 90 Cb 1.32 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2qbn h ARG 90 CO 0.58 0.43 0.26 1.05 -1.51 0.00 0.00 179.97 180.79 2qbn h GLU 91 N 0.68 0.50 -0.08 0.20 9.09 -1.97 0.16 114.58 123.14 2qbn h GLU 91 Ca 0.47 -0.03 -0.08 0.00 0.05 0.00 0.00 59.36 59.78 2qbn h GLU 91 Cb 0.65 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 27.64 2qbn h GLU 91 CO -0.35 0.33 -0.25 0.00 0.05 0.00 0.00 179.01 178.79 2qbn h ALA 92 N 1.76 0.14 -0.37 1.06 0.00 -1.37 -2.39 119.26 118.10 2qbn h ALA 92 Ca 0.14 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2qbn h ALA 92 Cb -0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2qbn h ALA 92 CO -0.03 0.14 0.09 0.78 0.00 0.00 0.00 179.25 180.22 2qbn h GLY 93 N -0.16 0.58 1.08 0.00 0.00 -0.72 -0.20 103.07 103.65 2qbn h GLY 93 Ca -0.01 -0.30 -0.17 0.00 0.00 0.00 0.00 47.33 46.85 2qbn h GLY 93 CO 0.05 0.28 -0.49 0.83 0.00 0.00 0.00 176.54 177.21 2qbn h GLU 94 N 0.53 0.81 0.00 4.80 5.08 -0.70 -3.11 114.58 121.98 2qbn h GLU 94 Ca 0.12 -0.51 -0.10 0.00 -1.00 0.00 0.00 59.36 57.88 2qbn h GLU 94 Cb 0.21 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2qbn h GLU 94 CO -0.00 1.14 -0.47 0.00 -1.00 0.00 0.00 179.01 178.68 2qbn h ALA 95 N 0.66 0.98 -2.16 3.43 0.00 -1.14 -3.44 119.26 117.59 2qbn h ALA 95 Ca 0.01 -0.42 -0.56 0.00 0.00 0.00 0.00 54.91 53.94 2qbn h ALA 95 Cb 1.10 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.83 2qbn h ALA 95 CO 0.11 0.58 1.38 0.98 0.00 0.00 0.00 179.25 182.30 2qbn n TYR 96 N -3.62 2.22 -1.87 0.00 4.19 -0.11 -4.83 117.16 113.15 2qbn n TYR 96 Ca -0.00 -0.25 0.02 0.00 3.31 0.00 0.00 57.90 60.98 2qbn n TYR 96 Cb 0.55 -2.77 0.03 0.00 0.49 0.00 0.00 39.34 37.65 2qbn n TYR 96 CO 0.00 0.00 0.00 -0.40 0.91 0.00 0.00 176.86 177.37 2qbn n ASP 97 N 9.79 0.55 -4.73 2.98 3.85 -1.26 -4.88 116.55 122.86 2qbn n ASP 97 Ca 0.25 -2.24 -0.36 0.00 -0.71 0.00 0.00 54.79 51.74 2qbn n ASP 97 Cb 0.43 -0.26 0.08 0.00 -1.35 0.00 0.00 41.12 40.02 2qbn n ASP 97 CO 0.00 0.00 0.00 -0.36 -1.01 0.00 0.00 177.20 175.83 2qbn s PHE 98 N -0.59 2.06 -0.07 2.11 0.08 -1.26 -4.80 117.98 115.51 2qbn s PHE 98 Ca 0.10 1.54 0.02 0.00 0.12 0.00 0.00 56.93 58.71 2qbn s PHE 98 Cb 0.09 -3.59 -0.03 0.00 -0.57 0.00 0.00 43.02 38.93 2qbn s PHE 98 CO -0.01 -2.76 -0.12 0.42 -0.10 0.00 0.00 175.22 172.65 2qbn s ILE 99 N -1.68 3.25 -2.54 0.64 -1.09 -0.67 -1.10 121.20 118.02 2qbn s ILE 99 Ca 0.79 -0.64 0.26 0.00 -2.23 0.00 0.00 60.65 58.82 2qbn s ILE 99 Cb -0.33 -2.30 0.46 0.00 -1.58 0.00 0.00 42.46 38.70 2qbn s ILE 99 CO 0.42 0.58 1.60 -0.81 -1.23 0.00 0.00 174.94 175.50 2qbn n PRO 100 N 2.47 1.85 0.31 2.79 -0.05 -1.26 -4.19 135.00 136.92 2qbn n PRO 100 Ca -0.17 -1.24 0.20 0.00 -0.05 0.00 0.00 63.50 62.23 2qbn n PRO 100 Cb 0.52 -1.46 1.06 0.00 -0.05 0.00 0.00 33.50 33.58 2qbn n PRO 100 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 175.50 177.24 2qbn h THR 101 N 2.86 0.00 -0.51 0.52 1.35 -1.95 -1.75 112.91 113.43 2qbn h THR 101 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2qbn h THR 101 Cb 0.61 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 2qbn h THR 101 CO 0.00 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.73 2qbn n SER 102 N -2.92 3.63 -4.52 5.36 3.41 -0.26 -4.77 113.62 113.54 2qbn n SER 102 Ca -0.03 -2.00 -0.28 0.00 -0.26 0.00 0.00 58.87 56.31 2qbn n SER 102 Cb 0.12 -0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 63.63 2qbn n SER 102 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2qbn s MET 103 N -1.33 1.90 0.28 4.33 -1.94 -0.66 -3.60 119.30 118.29 2qbn s MET 103 Ca 0.43 -1.24 0.08 0.00 -1.71 0.00 0.00 55.69 53.24 2qbn s MET 103 Cb 0.24 -2.12 -0.03 0.00 2.01 0.00 0.00 34.83 34.92 2qbn s MET 103 CO 0.32 0.45 0.19 -0.51 -0.01 0.00 0.00 175.02 175.47 2qbn s ASP 104 N -2.50 5.27 0.71 3.03 1.01 -1.26 -4.71 116.67 118.21 2qbn s ASP 104 Ca 0.22 -0.41 -0.13 0.00 0.71 0.00 0.00 52.55 52.93 2qbn s ASP 104 Cb -0.10 -1.16 0.02 0.00 1.01 0.00 0.00 42.92 42.70 2qbn s ASP 104 CO 0.13 -0.14 1.11 -2.84 0.21 0.00 0.00 175.17 173.64 2qbn s PRO 105 N -3.86 2.54 0.16 8.23 0.02 -1.26 -1.43 135.00 139.41 2qbn s PRO 105 Ca 0.35 1.35 0.08 0.00 0.02 0.00 0.00 61.00 62.80 2qbn s PRO 105 Cb -0.07 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.48 2qbn s PRO 105 CO 0.25 -1.45 1.37 -1.00 -0.33 0.00 0.00 177.00 175.84 2qbn h PRO 106 N -0.40 0.00 -0.82 5.54 0.13 -2.02 -3.45 132.00 130.98 2qbn h PRO 106 Ca -0.46 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 64.86 2qbn h PRO 106 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.32 2qbn h PRO 106 CO 0.53 0.89 0.55 0.93 -0.23 0.00 0.00 178.00 180.67 2qbn h GLU 107 N 0.00 0.33 -0.69 0.86 3.07 -1.94 -2.72 114.58 113.49 2qbn h GLU 107 Ca -0.01 -0.02 0.01 0.00 -0.50 0.00 0.00 59.36 58.84 2qbn h GLU 107 Cb 1.58 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 29.38 2qbn h GLU 107 CO 0.12 0.22 0.45 0.37 -1.40 0.00 0.00 179.01 178.77 2qbn h GLN 108 N 0.34 0.89 -0.87 2.33 4.15 -1.52 -3.30 115.11 117.13 2qbn h GLN 108 Ca 0.42 -0.05 0.16 0.00 0.77 0.00 0.00 58.65 59.94 2qbn h GLN 108 Cb 1.10 -0.20 -0.10 0.00 0.21 0.00 0.00 27.48 28.49 2qbn h GLN 108 CO -0.13 0.59 0.45 0.00 -1.93 0.00 0.00 178.83 177.81 2qbn h ARG 109 N 0.92 0.59 -0.49 1.69 3.08 -1.77 -2.17 114.38 116.22 2qbn h ARG 109 Ca 0.26 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.27 2qbn h ARG 109 Cb -0.07 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2qbn h ARG 109 CO -0.07 0.39 0.28 -0.56 -1.07 0.00 0.00 179.97 178.94 2qbn h GLN 110 N 0.60 0.66 0.05 0.04 3.07 -1.76 -2.29 115.11 115.49 2qbn h GLN 110 Ca 0.49 -0.06 -0.23 0.00 0.09 0.00 0.00 58.65 58.94 2qbn h GLN 110 Cb 0.74 -0.14 -0.01 0.00 0.08 0.00 0.00 27.48 28.15 2qbn h GLN 110 CO -0.39 0.47 -1.06 0.74 0.09 0.00 0.00 178.83 178.68 2qbn h PHE 111 N 0.67 0.24 -0.80 0.06 -1.00 -1.60 -3.23 116.94 111.29 2qbn h PHE 111 Ca 0.18 -0.17 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 2qbn h PHE 111 Cb -0.01 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 39.50 2qbn h PHE 111 CO 0.00 1.10 0.43 -0.09 -1.61 0.00 0.00 178.31 178.14 2qbn h ARG 112 N 0.05 1.12 -0.86 1.51 2.43 -1.02 -1.38 114.38 116.22 2qbn h ARG 112 Ca -0.06 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 58.99 2qbn h ARG 112 Cb 1.79 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 31.07 2qbn h ARG 112 CO 0.16 0.83 0.57 0.00 -1.51 0.00 0.00 179.97 180.01 2qbn h ALA 113 N 1.35 1.11 -0.20 2.80 0.00 -1.44 -0.63 119.26 122.24 2qbn h ALA 113 Ca 0.28 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 2qbn h ALA 113 Cb 0.04 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2qbn h ALA 113 CO -0.04 0.47 -0.58 1.25 0.00 0.00 0.00 179.25 180.34 2qbn h LEU 114 N 1.14 0.73 -0.45 0.00 5.85 -1.49 -3.00 115.31 118.09 2qbn h LEU 114 Ca 0.33 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 2qbn h LEU 114 Cb -0.09 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.71 2qbn h LEU 114 CO -0.08 1.15 0.12 0.00 -0.34 0.00 0.00 178.44 179.29 2qbn h ALA 115 N 0.86 0.59 -0.08 1.25 0.00 -0.85 -1.98 119.26 119.05 2qbn h ALA 115 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2qbn h ALA 115 Cb 1.15 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2qbn h ALA 115 CO 0.11 0.27 0.07 -0.97 0.00 0.00 0.00 179.25 178.73 2qbn h ASN 116 N 0.60 0.00 0.26 0.00 -1.24 -1.11 -1.10 115.58 112.99 2qbn h ASN 116 Ca 0.14 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.09 2qbn h ASN 116 Cb 0.30 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.34 2qbn h ASN 116 CO -0.00 0.00 -0.28 -0.61 -1.29 0.00 0.00 177.43 175.25 2qbn h GLN 117 N 0.00 0.03 -0.01 6.67 4.15 -1.21 0.25 115.11 125.00 2qbn h GLN 117 Ca 0.04 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2qbn h GLN 117 Cb 0.18 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.87 2qbn h GLN 117 CO -0.00 0.32 -0.62 1.33 -1.93 0.00 0.00 178.83 177.93 2qbn n VAL 118 N -4.19 0.00 -0.47 2.39 0.24 -0.45 -4.55 118.33 111.30 2qbn n VAL 118 Ca -0.02 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 2qbn n VAL 118 Cb 0.34 1.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 2qbn n VAL 118 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 2qbn n VAL 119 N -0.74 0.00 -0.96 3.34 0.24 -1.01 -4.93 118.33 114.26 2qbn n VAL 119 Ca 0.06 -0.20 -0.30 0.00 -2.04 0.00 0.00 64.34 61.86 2qbn n VAL 119 Cb 0.34 1.47 0.25 0.00 -1.47 0.00 0.00 33.84 34.44 2qbn n VAL 119 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2qbn s GLY 120 N -0.09 1.56 0.21 7.63 0.00 0.89 -4.62 107.32 112.91 2qbn s GLY 120 Ca 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 44.72 43.61 2qbn s GLY 120 CO 0.00 -0.06 1.67 1.98 0.00 0.00 0.00 173.10 176.69 2qbn h MET 121 N -2.80 0.15 -0.83 2.90 1.85 -1.86 -0.61 114.93 113.74 2qbn h MET 121 Ca -0.43 -0.01 0.20 0.00 -0.61 0.00 0.00 59.70 58.85 2qbn h MET 121 Cb 1.29 -0.03 -0.05 0.00 0.43 0.00 0.00 31.60 33.24 2qbn h MET 121 CO 0.30 0.10 0.56 -1.35 -0.40 0.00 0.00 176.91 176.13 2qbn h PRO 122 N 0.16 0.27 -0.09 0.39 0.11 -1.92 0.13 132.00 131.05 2qbn h PRO 122 Ca 0.32 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 66.21 2qbn h PRO 122 Cb 0.52 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2qbn h PRO 122 CO -0.49 0.18 -0.78 0.28 -0.21 0.00 0.00 178.00 176.98 2qbn h VAL 123 N 0.28 1.35 -0.46 3.15 2.07 -1.43 -3.12 116.25 118.09 2qbn h VAL 123 Ca 0.42 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.81 2qbn h VAL 123 Cb 1.20 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 33.06 2qbn h VAL 123 CO -0.11 0.65 0.30 0.58 0.02 0.00 0.00 177.57 179.01 2qbn h VAL 124 N 0.36 1.12 -0.82 2.57 2.07 -0.42 -2.22 116.25 118.91 2qbn h VAL 124 Ca -0.05 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.37 2qbn h VAL 124 Cb 1.38 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 31.52 2qbn h VAL 124 CO 0.14 0.11 0.44 0.44 0.02 0.00 0.00 177.57 178.73 2qbn h ASP 125 N 0.62 0.58 0.98 0.57 3.45 -1.28 0.23 116.42 121.57 2qbn h ASP 125 Ca 0.17 0.07 -0.01 0.00 0.43 0.00 0.00 57.03 57.69 2qbn h ASP 125 Cb -0.07 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 38.66 2qbn h ASP 125 CO -0.04 0.30 -0.04 0.11 -1.57 0.00 0.00 179.24 178.01 2qbn h LYS 126 N 0.70 0.00 0.00 3.56 1.57 -1.36 -2.91 116.57 118.12 2qbn h LYS 126 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 2qbn h LYS 126 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2qbn h LYS 126 CO -0.30 0.04 -1.06 1.28 -0.57 0.00 0.00 179.45 178.84 2qbn n LEU 127 N -3.16 0.92 -0.40 2.94 4.77 0.06 -4.67 117.00 117.47 2qbn n LEU 127 Ca 0.00 -0.45 -0.07 0.00 -0.03 0.00 0.00 56.01 55.46 2qbn n LEU 127 Cb 0.32 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 2qbn n LEU 127 CO 0.28 0.23 0.52 -0.08 -1.33 0.00 0.00 177.39 177.01 2qbn h GLU 128 N 0.00 -0.01 -0.57 3.23 4.57 -0.44 0.19 114.58 121.54 2qbn h GLU 128 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2qbn h GLU 128 Cb 0.54 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.10 2qbn h GLU 128 CO 0.00 -0.01 0.38 -0.91 -1.18 0.00 0.00 179.01 177.29 2qbn h ASN 129 N -0.01 0.66 -0.57 1.04 -0.26 -1.83 -0.98 115.58 113.63 2qbn h ASN 129 Ca 0.23 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.94 2qbn h ASN 129 Cb 0.49 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.56 2qbn h ASN 129 CO -0.95 0.48 0.33 -0.09 -1.06 0.00 0.00 177.43 176.14 2qbn h ARG 130 N 0.78 0.79 -0.17 0.81 9.65 -1.44 0.30 114.38 125.08 2qbn h ARG 130 Ca 0.21 -0.08 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2qbn h ARG 130 Cb -0.08 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.33 2qbn h ARG 130 CO -0.04 0.59 0.09 0.82 2.80 0.00 0.00 179.97 184.23 2qbn h ILE 131 N 0.77 1.11 -0.06 1.20 2.04 -0.40 -1.21 117.51 120.97 2qbn h ILE 131 Ca 0.20 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.76 2qbn h ILE 131 Cb 0.02 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2qbn h ILE 131 CO -0.03 0.11 -0.03 -0.61 0.00 0.00 0.00 178.15 177.59 2qbn h GLN 132 N 0.17 -0.02 -0.54 2.37 5.75 -0.94 -2.31 115.11 119.59 2qbn h GLN 132 Ca 0.06 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.59 2qbn h GLN 132 Cb 0.09 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.61 2qbn h GLN 132 CO -0.01 -0.01 0.33 1.49 -2.65 0.00 0.00 178.83 177.97 2qbn h GLU 133 N -0.02 0.63 -0.41 1.69 4.81 -0.80 -2.46 114.58 118.01 2qbn h GLU 133 Ca 0.03 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 2qbn h GLU 133 Cb 0.07 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2qbn h GLU 133 CO -0.07 0.42 0.06 1.25 -0.73 0.00 0.00 179.01 179.93 2qbn h LEU 134 N 0.65 0.66 -0.07 1.64 5.85 -1.09 -0.97 115.31 121.98 2qbn h LEU 134 Ca 0.22 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2qbn h LEU 134 Cb 0.02 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2qbn h LEU 134 CO -0.09 0.76 -0.04 0.00 -0.34 0.00 0.00 178.44 178.73 2qbn h ALA 135 N 0.92 0.03 -0.74 1.25 0.00 -1.29 0.04 119.26 119.47 2qbn h ALA 135 Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qbn h ALA 135 Cb 0.39 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2qbn h ALA 135 CO 0.01 -0.51 0.42 0.00 0.00 0.00 0.00 179.25 179.18 2qbn h SER 137 N 1.02 0.38 -0.24 0.00 0.87 -0.84 -0.01 113.55 114.72 2qbn h SER 137 Ca 0.26 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2qbn h SER 137 Cb 0.01 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2qbn h SER 137 CO -0.05 0.45 0.10 -0.07 -0.53 0.00 0.00 176.83 176.74 2qbn h LEU 138 N 0.28 0.33 -0.51 2.23 3.38 -0.84 -2.25 115.31 117.94 2qbn h LEU 138 Ca 0.09 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2qbn h LEU 138 Cb 0.19 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2qbn h LEU 138 CO -0.01 0.39 -0.03 0.40 0.09 0.00 0.00 178.44 179.29 2qbn h ILE 139 N 0.24 1.27 -0.78 1.22 2.04 -1.20 -2.67 117.51 117.63 2qbn h ILE 139 Ca 0.08 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 2qbn h ILE 139 Cb 0.16 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2qbn h ILE 139 CO -0.01 0.40 0.40 -0.08 0.00 0.00 0.00 178.15 178.86 2qbn h GLU 140 N 0.78 1.10 -0.37 2.37 4.57 -0.94 0.97 114.58 123.06 2qbn h GLU 140 Ca 0.14 -0.14 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 2qbn h GLU 140 Cb 0.56 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2qbn h GLU 140 CO 0.03 0.83 0.00 1.03 -1.18 0.00 0.00 179.01 179.72 2qbn h SER 141 N 1.10 0.56 0.47 1.04 0.87 -1.23 -3.13 113.55 113.23 2qbn h SER 141 Ca 0.27 -0.11 -0.30 0.00 -1.23 0.00 0.00 61.79 60.42 2qbn h SER 141 Cb 0.07 -0.15 0.01 0.00 -0.44 0.00 0.00 62.40 61.89 2qbn h SER 141 CO -0.04 0.63 -1.43 -0.07 -0.53 0.00 0.00 176.83 175.38 2qbn h LEU 142 N 0.56 0.50 -0.85 2.23 3.38 -1.05 -3.40 115.31 116.68 2qbn h LEU 142 Ca 0.12 -0.60 0.13 0.00 0.09 0.00 0.00 57.88 57.62 2qbn h LEU 142 Cb 0.36 -0.16 -0.14 0.00 0.09 0.00 0.00 40.66 40.81 2qbn h LEU 142 CO 0.01 1.48 -0.34 -1.14 0.09 0.00 0.00 178.44 178.54 2qbn n ARG 143 N -3.54 -0.21 0.16 1.13 0.63 0.27 -0.62 116.66 114.49 2qbn n ARG 143 Ca -0.14 1.31 0.13 0.00 -0.92 0.00 0.00 57.85 58.23 2qbn n ARG 143 Cb 1.05 -1.94 0.54 0.00 0.45 0.00 0.00 32.46 32.55 2qbn n ARG 143 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2qbn h PRO 144 N 0.00 0.00 0.00 -0.14 0.13 -1.77 -3.16 132.00 127.06 2qbn h PRO 144 Ca 0.29 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.30 2qbn h PRO 144 Cb 0.50 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.62 2qbn h PRO 144 CO -0.84 0.00 -0.55 1.96 -0.23 0.00 0.00 178.00 178.34 2qbn h GLN 145 N 0.00 0.00 -0.06 0.86 4.20 -1.12 -3.46 115.11 115.53 2qbn h GLN 145 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2qbn h GLN 145 Cb 0.38 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2qbn h GLN 145 CO 0.00 0.55 -0.02 0.41 -0.67 0.00 0.00 178.83 179.09 2qbn n GLY 146 N 0.25 0.48 3.59 3.46 0.00 -1.19 -4.96 105.19 106.82 2qbn n GLY 146 Ca -0.01 -0.23 -0.04 0.00 0.00 0.00 0.00 46.02 45.74 2qbn n GLY 146 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2qbn s GLN 147 N -0.97 0.42 -0.02 1.61 -2.07 -1.26 -0.96 119.66 116.41 2qbn s GLN 147 Ca 0.00 -0.17 -0.30 0.00 -1.82 0.00 0.00 55.36 53.07 2qbn s GLN 147 Cb 0.00 0.18 0.11 0.00 -1.09 0.00 0.00 33.01 32.21 2qbn s GLN 147 CO 0.00 -0.18 1.09 0.00 -1.32 0.00 0.00 175.29 174.88 2qbn s ASN 149 N -2.64 5.87 0.30 0.00 0.02 -1.26 -0.85 114.94 116.38 2qbn s ASN 149 Ca 0.10 -2.70 0.07 0.00 -1.02 0.00 0.00 52.86 49.31 2qbn s ASN 149 Cb 0.00 -2.01 0.80 0.00 0.02 0.00 0.00 41.25 40.07 2qbn s ASN 149 CO -0.04 -0.48 1.72 0.15 0.02 0.00 0.00 177.10 178.47 2qbn h PHE 150 N 7.46 0.89 -0.15 2.20 3.57 -1.62 0.11 116.94 129.39 2qbn h PHE 150 Ca 0.01 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2qbn h PHE 150 Cb 1.00 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2qbn h PHE 150 CO 0.83 0.05 0.10 1.79 -2.23 0.00 0.00 178.31 178.84 2qbn h THR 151 N 0.54 1.05 0.00 4.41 1.35 -1.94 -0.07 112.91 118.25 2qbn h THR 151 Ca 0.60 -0.10 -0.03 0.00 -0.55 0.00 0.00 66.41 66.33 2qbn h THR 151 Cb 1.11 0.84 -0.00 0.00 -1.73 0.00 0.00 68.15 68.37 2qbn h THR 151 CO -0.48 0.05 -0.99 1.05 -0.25 0.00 0.00 175.52 174.89 2qbn h GLU 152 N 0.20 0.00 0.00 4.72 4.11 -1.87 -1.03 114.58 120.72 2qbn h GLU 152 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.49 2qbn h GLU 152 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2qbn h GLU 152 CO -0.01 0.06 -0.81 -0.25 0.07 0.00 0.00 179.01 178.07 2qbn n ASP 153 N -2.75 0.72 0.09 3.06 8.00 0.34 -4.42 116.55 121.59 2qbn n ASP 153 Ca -0.01 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.59 2qbn n ASP 153 Cb 0.60 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 42.07 2qbn n ASP 153 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qbn n TYR 154 N -2.22 -2.13 -0.35 1.24 9.36 -0.62 -4.80 117.16 117.64 2qbn n TYR 154 Ca 0.02 0.44 0.16 0.00 3.32 0.00 0.00 57.90 61.84 2qbn n TYR 154 Cb 0.47 1.18 0.37 0.00 -0.63 0.00 0.00 39.34 40.73 2qbn n TYR 154 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qbn h ALA 155 N 0.00 1.79 0.00 2.98 0.00 -1.09 -1.53 119.26 121.41 2qbn h ALA 155 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2qbn h ALA 155 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2qbn h ALA 155 CO 0.00 -0.22 -0.28 0.93 0.00 0.00 0.00 179.25 179.68 2qbn h GLU 156 N 0.63 0.00 -0.90 0.00 5.08 -1.40 -3.38 114.58 114.61 2qbn h GLU 156 Ca 0.62 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 59.07 2qbn h GLU 156 Cb 1.13 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.31 2qbn h GLU 156 CO -0.42 0.10 0.58 -1.00 -1.00 0.00 0.00 179.01 177.27 2qbn h PRO 157 N -1.00 0.89 0.62 2.33 0.13 -1.75 -1.73 132.00 131.48 2qbn h PRO 157 Ca -0.02 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 2qbn h PRO 157 Cb 0.34 -0.20 0.01 0.00 0.13 0.00 0.00 31.00 31.27 2qbn h PRO 157 CO -0.01 0.59 -0.30 0.35 -0.23 0.00 0.00 178.00 178.40 2qbn h PHE 158 N 0.92 -0.77 -0.62 1.56 3.57 -1.50 -0.67 116.94 119.44 2qbn h PHE 158 Ca 0.41 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.83 2qbn h PHE 158 Cb 0.38 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2qbn h PHE 158 CO -0.00 -0.48 0.13 -1.35 -2.23 0.00 0.00 178.31 174.38 2qbn h PRO 159 N -0.87 1.00 -0.41 6.41 0.11 -1.73 -2.99 132.00 133.52 2qbn h PRO 159 Ca -0.08 -0.25 -0.08 0.00 0.11 0.00 0.00 66.00 65.70 2qbn h PRO 159 Cb 0.63 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2qbn h PRO 159 CO 0.14 0.92 -0.05 0.82 -0.21 0.00 0.00 178.00 179.63 2qbn h ILE 160 N 0.91 1.27 -0.38 4.15 2.04 -1.37 -1.51 117.51 122.62 2qbn h ILE 160 Ca 0.19 -1.10 -0.07 0.00 1.00 0.00 0.00 64.86 64.88 2qbn h ILE 160 Cb 0.39 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2qbn h ILE 160 CO 0.01 0.37 -0.06 0.03 0.00 0.00 0.00 178.15 178.50 2qbn h ARG 161 N 0.57 0.63 -0.44 2.37 3.08 -1.15 0.11 114.38 119.56 2qbn h ARG 161 Ca 0.11 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2qbn h ARG 161 Cb 0.55 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 2qbn h ARG 161 CO 0.03 0.69 0.10 0.82 -1.07 0.00 0.00 179.97 180.55 2qbn h ILE 162 N 0.59 1.23 -0.39 2.04 2.04 -1.41 -1.18 117.51 120.43 2qbn h ILE 162 Ca 0.11 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 2qbn h ILE 162 Cb 0.46 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 2qbn h ILE 162 CO 0.02 0.29 0.12 0.15 0.00 0.00 0.00 178.15 178.73 2qbn h PHE 163 N 0.57 0.62 0.00 1.37 3.57 -0.66 -1.96 116.94 120.45 2qbn h PHE 163 Ca 0.14 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2qbn h PHE 163 Cb 0.32 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2qbn h PHE 163 CO 0.02 0.58 -0.17 0.52 -2.23 0.00 0.00 178.31 177.03 2qbn h MET 164 N 0.48 0.00 0.11 1.11 2.86 -0.67 0.27 114.93 119.09 2qbn h MET 164 Ca 0.13 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2qbn h MET 164 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2qbn h MET 164 CO -0.00 0.17 -0.05 1.25 1.06 0.00 0.00 176.91 179.34 2qbn h LEU 165 N 0.00 -0.13 -1.26 1.22 5.85 -0.77 -0.10 115.31 120.12 2qbn h LEU 165 Ca -0.00 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.39 2qbn h LEU 165 Cb 0.33 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2qbn h LEU 165 CO 0.02 0.19 -0.36 0.17 -0.34 0.00 0.00 178.44 178.13 2qbn h LEU 166 N -0.46 0.02 -0.22 2.25 8.10 -0.89 -2.40 115.31 121.72 2qbn h LEU 166 Ca -0.02 -0.01 0.00 0.00 0.11 0.00 0.00 57.88 57.97 2qbn h LEU 166 Cb 0.37 -0.01 0.00 0.00 -0.44 0.00 0.00 40.66 40.59 2qbn h LEU 166 CO 0.03 0.38 -0.17 0.00 -4.11 0.00 0.00 178.44 174.56 2qbn n ALA 167 N -2.47 2.86 -3.31 0.17 0.00 0.04 -0.34 120.51 117.45 2qbn n ALA 167 Ca -0.02 -0.28 -0.21 0.00 0.00 0.00 0.00 53.44 52.93 2qbn n ALA 167 Cb 0.40 -1.29 0.06 0.00 0.00 0.00 0.00 19.45 18.62 2qbn n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbn n GLY 168 N 1.34 -0.39 3.50 0.00 0.00 -0.22 -4.31 105.19 105.11 2qbn n GLY 168 Ca 0.12 0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 2qbn n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbn s LEU 169 N -6.46 2.80 0.30 0.99 1.43 -0.25 -5.05 118.68 112.45 2qbn s LEU 169 Ca 0.45 -0.25 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 2qbn s LEU 169 Cb -0.20 -1.60 -0.10 0.00 0.03 0.00 0.00 46.19 44.32 2qbn s LEU 169 CO 0.55 0.31 1.39 -2.16 0.23 0.00 0.00 176.35 176.67 2qbn s PRO 170 N -1.08 4.28 0.62 1.29 0.04 -1.26 -4.59 135.00 134.31 2qbn s PRO 170 Ca 0.14 2.30 0.39 0.00 0.04 0.00 0.00 61.00 63.87 2qbn s PRO 170 Cb -0.11 -3.07 2.05 0.00 0.04 0.00 0.00 34.50 33.41 2qbn s PRO 170 CO 0.03 -0.34 2.25 0.93 0.04 0.00 0.00 177.00 179.92 2qbn h GLU 171 N 4.01 0.00 0.00 4.56 5.08 -1.98 -1.54 114.58 124.71 2qbn h GLU 171 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2qbn h GLU 171 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2qbn h GLU 171 CO 0.70 0.02 0.00 -0.85 -1.00 0.00 0.00 179.01 177.88 2qbn n GLU 172 N -3.25 0.14 0.00 2.33 0.28 -1.26 -2.18 120.64 116.70 2qbn n GLU 172 Ca -0.02 0.33 0.13 0.00 -0.16 0.00 0.00 57.16 57.44 2qbn n GLU 172 Cb 0.14 -1.74 0.49 0.00 1.43 0.00 0.00 31.44 31.76 2qbn n GLU 172 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2qbn n ASP 173 N -1.99 0.58 0.08 -1.84 10.43 -0.58 -4.38 116.55 118.85 2qbn n ASP 173 Ca 0.03 -0.51 -0.12 0.00 2.57 0.00 0.00 54.79 56.77 2qbn n ASP 173 Cb 0.24 -0.01 -0.05 0.00 1.84 0.00 0.00 41.12 43.14 2qbn n ASP 173 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 2qbn h ILE 174 N 0.59 0.51 -0.59 0.53 1.08 -1.59 -2.31 117.51 115.73 2qbn h ILE 174 Ca 0.00 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.59 2qbn h ILE 174 Cb 0.43 0.51 -0.11 0.00 -3.07 0.00 0.00 36.82 34.58 2qbn h ILE 174 CO 0.00 0.00 -0.08 -0.65 -0.69 0.00 0.00 178.15 176.73 2qbn h PRO 175 N -0.37 0.05 0.00 2.37 0.11 -1.82 0.29 132.00 132.62 2qbn h PRO 175 Ca 0.05 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 2qbn h PRO 175 Cb 0.42 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.52 2qbn h PRO 175 CO -0.16 0.03 -0.00 1.25 -0.21 0.00 0.00 178.00 178.91 2qbn h HIS 176 N 0.05 -0.00 -0.77 0.65 -0.00 -1.84 -2.08 115.15 111.16 2qbn h HIS 176 Ca 0.29 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.61 2qbn h HIS 176 Cb 0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.84 2qbn h HIS 176 CO -0.43 0.25 0.28 -0.07 -0.00 0.00 0.00 177.93 177.97 2qbn h LEU 177 N -0.26 1.08 -0.68 0.26 3.38 -0.99 -1.95 115.31 116.16 2qbn h LEU 177 Ca -0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 2qbn h LEU 177 Cb 0.26 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2qbn h LEU 177 CO 0.00 0.98 0.21 0.50 0.09 0.00 0.00 178.44 180.22 2qbn h LYS 178 N 1.13 1.05 -0.26 1.13 1.63 -0.44 -1.14 116.57 119.66 2qbn h LYS 178 Ca 0.25 -0.23 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 2qbn h LYS 178 Cb 0.26 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 2qbn h LYS 178 CO -0.02 0.91 0.14 -0.92 -3.45 0.00 0.00 179.45 176.12 2qbn h TYR 179 N 0.99 0.36 -0.23 1.91 3.20 -1.02 -1.65 116.97 120.53 2qbn h TYR 179 Ca 0.22 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 2qbn h TYR 179 Cb 0.30 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2qbn h TYR 179 CO 0.02 0.31 0.13 -0.07 -1.64 0.00 0.00 178.16 176.91 2qbn h LEU 180 N 0.31 0.28 -1.12 2.82 3.38 -1.08 -2.41 115.31 117.48 2qbn h LEU 180 Ca 0.09 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2qbn h LEU 180 Cb 0.07 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2qbn h LEU 180 CO -0.01 0.27 0.37 0.71 0.09 0.00 0.00 178.44 179.86 2qbn h THR 181 N 0.26 1.22 0.00 0.22 1.35 -1.13 -1.93 112.91 112.89 2qbn h THR 181 Ca 0.08 -0.56 -0.04 0.00 -0.55 0.00 0.00 66.41 65.34 2qbn h THR 181 Cb 0.05 0.28 -0.01 0.00 -1.73 0.00 0.00 68.15 66.74 2qbn h THR 181 CO -0.01 0.25 -0.20 0.44 -0.25 0.00 0.00 175.52 175.75 2qbn h ASP 182 N 0.99 0.00 1.29 5.36 3.45 -1.03 -1.96 116.42 124.51 2qbn h ASP 182 Ca 0.25 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.71 2qbn h ASP 182 Cb 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 2qbn h ASP 182 CO -0.04 0.20 0.00 1.56 -1.57 0.00 0.00 179.24 179.39 2qbn h GLN 183 N 0.00 0.00 0.00 3.56 1.08 -0.86 0.27 115.11 119.17 2qbn h GLN 183 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2qbn h GLN 183 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2qbn h GLN 183 CO 0.03 0.00 -0.62 0.52 -0.95 0.00 0.00 178.83 177.81 2qbn h MET 184 N 0.00 0.00 0.00 1.46 2.86 -1.28 -3.25 114.93 114.72 2qbn h MET 184 Ca 0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 2qbn h MET 184 Cb 0.64 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.28 2qbn h MET 184 CO 0.00 0.00 -1.53 0.25 1.06 0.00 0.00 176.91 176.69 2qbn n THR 185 N -2.68 0.53 -3.15 2.22 -2.24 -1.08 -4.85 114.28 103.04 2qbn n THR 185 Ca 0.02 -0.25 -0.20 0.00 -2.27 0.00 0.00 64.05 61.35 2qbn n THR 185 Cb 0.52 -0.82 -0.04 0.00 -2.10 0.00 0.00 70.33 67.89 2qbn n THR 185 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2qbn n ARG 186 N -2.58 0.86 -1.65 -0.78 1.74 0.95 -1.48 116.66 113.71 2qbn n ARG 186 Ca -0.15 -3.19 -0.45 0.00 -0.77 0.00 0.00 57.85 53.29 2qbn n ARG 186 Cb 0.71 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.66 2qbn n ARG 186 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2qbn n PRO 187 N 0.81 1.86 0.00 5.56 -0.04 -1.19 -4.60 135.00 137.40 2qbn n PRO 187 Ca 0.22 0.66 0.13 0.00 -0.04 0.00 0.00 63.50 64.47 2qbn n PRO 187 Cb 0.61 -2.28 0.36 0.00 -0.04 0.00 0.00 33.50 32.15 2qbn n PRO 187 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2qbn n ASP 188 N 2.03 1.04 0.00 3.54 5.68 -1.26 -4.94 116.55 122.64 2qbn n ASP 188 Ca 0.12 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.52 2qbn n ASP 188 Cb 0.30 0.15 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 2qbn n ASP 188 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qbn n GLY 189 N 1.35 1.14 0.16 6.12 0.00 -1.26 -4.95 105.19 107.75 2qbn n GLY 189 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.18 2qbn n GLY 189 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qbn h SER 190 N 0.00 0.00 -3.89 1.61 4.64 -2.00 -3.45 113.55 110.46 2qbn h SER 190 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 2qbn h SER 190 Cb 0.00 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 61.80 2qbn h SER 190 CO 0.00 0.43 -0.76 -0.04 -0.87 0.00 0.00 176.83 175.59 2qbn s MET 191 N -3.21 0.52 0.78 4.77 -1.94 -1.26 -5.11 119.30 113.85 2qbn s MET 191 Ca 0.03 -0.20 -0.12 0.00 -1.71 0.00 0.00 55.69 53.69 2qbn s MET 191 Cb 0.09 -0.51 0.06 0.00 2.01 0.00 0.00 34.83 36.48 2qbn s MET 191 CO 0.72 0.11 1.14 0.95 -0.01 0.00 0.00 175.02 177.92 2qbn s THR 192 N -0.03 2.64 0.17 2.05 -4.23 -1.26 -4.84 115.64 110.14 2qbn s THR 192 Ca 0.01 0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.58 2qbn s THR 192 Cb -0.04 -3.17 0.06 0.00 1.34 0.00 0.00 72.50 70.69 2qbn s THR 192 CO -0.00 -0.27 1.83 0.15 -0.54 0.00 0.00 174.62 175.79 2qbn h PHE 193 N -0.94 0.66 -0.78 3.99 3.57 -1.92 -1.88 116.94 119.64 2qbn h PHE 193 Ca -0.46 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.12 2qbn h PHE 193 Cb 1.30 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.76 2qbn h PHE 193 CO 0.39 0.42 0.47 0.00 -2.23 0.00 0.00 178.31 177.36 2qbn h ALA 194 N 1.19 1.06 -0.58 2.41 0.00 -1.92 0.89 119.26 122.31 2qbn h ALA 194 Ca 0.19 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2qbn h ALA 194 Cb -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2qbn h ALA 194 CO -0.04 0.18 0.03 0.93 0.00 0.00 0.00 179.25 180.35 2qbn h GLU 195 N 0.85 1.00 -0.59 0.00 5.08 -1.83 -1.43 114.58 117.66 2qbn h GLU 195 Ca 0.34 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 2qbn h GLU 195 Cb 0.18 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2qbn h GLU 195 CO -0.18 0.98 0.01 0.00 -1.00 0.00 0.00 179.01 178.82 2qbn h ALA 196 N 0.99 0.89 -0.13 3.43 0.00 -0.70 -2.16 119.26 121.57 2qbn h ALA 196 Ca 0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2qbn h ALA 196 Cb 0.51 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2qbn h ALA 196 CO 0.02 0.66 0.07 -0.22 0.00 0.00 0.00 179.25 179.77 2qbn h LYS 197 N 0.94 0.19 -0.18 0.00 3.64 -0.60 -1.34 116.57 119.22 2qbn h LYS 197 Ca 0.17 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 2qbn h LYS 197 Cb 0.54 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2qbn h LYS 197 CO 0.03 0.23 -0.08 0.93 -2.27 0.00 0.00 179.45 178.29 2qbn h GLU 198 N 0.09 0.27 -0.31 1.90 4.39 -1.17 0.40 114.58 120.15 2qbn h GLU 198 Ca 0.05 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 2qbn h GLU 198 Cb 0.11 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2qbn h GLU 198 CO -0.01 0.37 -0.40 0.00 -1.16 0.00 0.00 179.01 177.81 2qbn h ALA 199 N 1.66 0.71 -0.44 3.43 0.00 -1.12 0.15 119.26 123.65 2qbn h ALA 199 Ca 0.06 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 2qbn h ALA 199 Cb 0.32 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2qbn h ALA 199 CO 0.02 0.66 -0.04 1.25 0.00 0.00 0.00 179.25 181.14 2qbn h LEU 200 N 0.62 0.80 -0.80 0.00 5.85 -0.49 -2.49 115.31 118.80 2qbn h LEU 200 Ca 0.05 -0.33 -0.13 0.00 0.84 0.00 0.00 57.88 58.31 2qbn h LEU 200 Cb 0.95 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2qbn h LEU 200 CO 0.09 0.94 -0.51 1.88 -0.34 0.00 0.00 178.44 180.50 2qbn h TYR 201 N 0.65 0.28 -0.73 1.25 0.05 -0.80 -1.68 116.97 115.99 2qbn h TYR 201 Ca 0.12 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2qbn h TYR 201 Cb 0.56 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.20 2qbn h TYR 201 CO 0.04 0.70 0.48 0.22 -1.05 0.00 0.00 178.16 178.55 2qbn h ASP 202 N 0.18 0.85 -0.12 3.88 -0.00 -0.47 -0.28 116.42 120.47 2qbn h ASP 202 Ca 0.01 -0.03 -0.10 0.00 -0.00 0.00 0.00 57.03 56.91 2qbn h ASP 202 Cb 0.96 -0.21 0.00 0.00 -0.00 0.00 0.00 39.33 40.08 2qbn h ASP 202 CO 0.08 0.62 -0.30 0.22 -0.00 0.00 0.00 179.24 179.86 2qbn h TYR 203 N 1.00 0.53 -0.07 0.28 3.20 -1.10 -3.38 116.97 117.42 2qbn h TYR 203 Ca 0.27 -0.20 -0.14 0.00 3.14 0.00 0.00 58.73 61.79 2qbn h TYR 203 Cb -0.10 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 38.08 2qbn h TYR 203 CO 0.00 0.92 -0.52 -0.07 -1.64 0.00 0.00 178.16 176.85 2qbn h LEU 204 N -0.01 0.58 -0.78 2.82 3.38 -0.89 -3.37 115.31 117.03 2qbn h LEU 204 Ca -0.00 -0.68 0.13 0.00 0.09 0.00 0.00 57.88 57.42 2qbn h LEU 204 Cb 0.91 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.35 2qbn h LEU 204 CO 0.06 1.17 -0.33 0.40 0.09 0.00 0.00 178.44 179.83 2qbn h ILE 205 N 0.04 0.11 -0.11 1.22 2.04 -1.24 -0.41 117.51 119.16 2qbn h ILE 205 Ca -0.05 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.74 2qbn h ILE 205 Cb 1.18 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 2qbn h ILE 205 CO 0.11 0.00 -0.27 1.55 0.00 0.00 0.00 178.15 179.53 2qbn h PRO 206 N -0.07 0.19 -0.40 2.37 0.13 -1.79 -2.30 132.00 130.12 2qbn h PRO 206 Ca 0.30 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 65.22 2qbn h PRO 206 Cb 0.58 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 2qbn h PRO 206 CO -0.83 0.46 -0.32 0.82 -0.23 0.00 0.00 178.00 177.90 2qbn h ILE 207 N 0.17 1.27 -0.31 -3.56 2.04 -1.32 -0.80 117.51 115.00 2qbn h ILE 207 Ca 0.03 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 64.38 2qbn h ILE 207 Cb 0.58 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2qbn h ILE 207 CO 0.04 0.50 0.14 0.40 0.00 0.00 0.00 178.15 179.24 2qbn h ILE 208 N 0.75 1.16 -0.70 -0.67 2.04 -0.91 0.01 117.51 119.19 2qbn h ILE 208 Ca 0.07 -0.47 -0.06 0.00 1.00 0.00 0.00 64.86 65.40 2qbn h ILE 208 Cb 0.91 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 2qbn h ILE 208 CO 0.08 0.17 0.22 -0.08 0.00 0.00 0.00 178.15 178.54 2qbn h GLU 209 N 0.36 1.09 -0.79 2.37 4.57 -1.35 -0.24 114.58 120.59 2qbn h GLU 209 Ca 0.11 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.05 2qbn h GLU 209 Cb 0.14 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 2qbn h GLU 209 CO -0.01 0.94 0.49 0.37 -1.18 0.00 0.00 179.01 179.62 2qbn h GLN 210 N 1.03 1.06 -0.00 1.92 4.15 -0.82 -1.58 115.11 120.87 2qbn h GLN 210 Ca 0.23 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.56 2qbn h GLN 210 Cb 0.31 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.77 2qbn h GLN 210 CO -0.01 0.74 -0.32 0.54 -1.93 0.00 0.00 178.83 177.85 2qbn n ARG 211 N -4.39 0.28 0.03 1.69 1.74 -0.04 -1.67 116.66 114.30 2qbn n ARG 211 Ca 0.09 -0.14 -0.04 0.00 -0.77 0.00 0.00 57.85 56.99 2qbn n ARG 211 Cb 0.06 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.90 2qbn n ARG 211 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qbn h ARG 212 N 0.33 0.00 0.10 5.56 3.08 -0.42 -2.70 114.38 120.34 2qbn h ARG 212 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2qbn h ARG 212 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.55 2qbn h ARG 212 CO 0.00 0.52 -0.65 1.96 -1.07 0.00 0.00 179.97 180.72 2qbn h GLN 213 N 0.00 0.26 -2.81 0.04 1.08 -1.27 -3.41 115.11 109.00 2qbn h GLN 213 Ca -0.16 -0.42 -0.61 0.00 -1.45 0.00 0.00 58.65 56.01 2qbn h GLN 213 Cb 1.75 0.15 -0.40 0.00 -0.05 0.00 0.00 27.48 28.93 2qbn h GLN 213 CO 0.08 1.18 -0.75 0.15 -0.95 0.00 0.00 178.83 178.54 2qbn s LYS 214 N -2.51 1.67 0.31 1.46 1.02 -0.67 -5.12 119.74 115.90 2qbn s LYS 214 Ca -0.14 -2.64 -0.29 0.00 0.02 0.00 0.00 55.97 52.92 2qbn s LYS 214 Cb 0.01 -2.49 -0.12 0.00 -0.52 0.00 0.00 37.83 34.70 2qbn s LYS 214 CO 0.81 -1.30 1.38 -2.30 -0.92 0.00 0.00 175.35 173.02 2qbn n PRO 215 N 2.60 2.23 -1.19 -1.68 -0.02 -1.02 -4.50 135.00 131.42 2qbn n PRO 215 Ca 0.21 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2qbn n PRO 215 Cb 0.39 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2qbn n PRO 215 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qbn n GLY 216 N 1.32 4.34 0.78 -1.23 0.00 -1.26 -5.04 105.19 104.09 2qbn n GLY 216 Ca 0.07 -2.14 0.09 0.00 0.00 0.00 0.00 46.02 44.03 2qbn n GLY 216 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qbn n THR 217 N -0.20 0.29 -1.51 2.61 -2.24 -1.26 -4.58 114.28 107.38 2qbn n THR 217 Ca 0.00 -0.64 -0.30 0.00 -2.27 0.00 0.00 64.05 60.84 2qbn n THR 217 Cb 0.00 1.11 0.09 0.00 -2.10 0.00 0.00 70.33 69.44 2qbn n THR 217 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2qbn s ASP 218 N -1.31 4.47 0.31 3.42 1.47 -1.26 -4.84 116.67 118.93 2qbn s ASP 218 Ca 0.25 1.36 0.01 0.00 1.18 0.00 0.00 52.55 55.35 2qbn s ASP 218 Cb 0.16 -2.10 0.54 0.00 -0.34 0.00 0.00 42.92 41.17 2qbn s ASP 218 CO 0.22 -1.99 1.94 0.00 0.68 0.00 0.00 175.17 176.02 2qbn h ALA 219 N -1.10 1.51 -0.48 2.11 0.00 -0.92 -1.74 119.26 118.63 2qbn h ALA 219 Ca -0.47 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 2qbn h ALA 219 Cb 1.26 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2qbn h ALA 219 CO 0.58 0.39 0.08 0.82 0.00 0.00 0.00 179.25 181.12 2qbn h ILE 220 N 1.01 1.25 -0.43 0.00 1.08 -1.81 -1.57 117.51 117.05 2qbn h ILE 220 Ca 0.35 -0.92 -0.01 0.00 -0.39 0.00 0.00 64.86 63.89 2qbn h ILE 220 Cb 0.10 0.91 -0.02 0.00 -3.07 0.00 0.00 36.82 34.73 2qbn h ILE 220 CO -0.11 0.33 0.23 0.28 -0.69 0.00 0.00 178.15 178.19 2qbn h SER 221 N 0.68 0.53 -0.51 1.72 0.02 -1.73 0.17 113.55 114.42 2qbn h SER 221 Ca 0.15 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2qbn h SER 221 Cb 0.39 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2qbn h SER 221 CO 0.01 0.47 0.32 0.40 -1.14 0.00 0.00 176.83 176.89 2qbn h ILE 222 N 0.56 1.14 -0.02 3.27 2.04 -1.18 -0.83 117.51 122.50 2qbn h ILE 222 Ca 0.15 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 2qbn h ILE 222 Cb 0.05 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2qbn h ILE 222 CO -0.02 0.14 -0.00 0.58 0.00 0.00 0.00 178.15 178.85 2qbn h VAL 223 N 0.68 1.25 -0.76 1.67 2.07 -1.07 -1.51 116.25 118.59 2qbn h VAL 223 Ca 0.18 -0.76 0.09 0.00 0.82 0.00 0.00 66.70 67.04 2qbn h VAL 223 Cb -0.04 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 2qbn h VAL 223 CO -0.04 0.20 0.50 0.00 0.02 0.00 0.00 177.57 178.25 2qbn h ALA 224 N 0.69 1.79 -0.44 1.67 0.00 -0.45 -1.61 119.26 120.91 2qbn h ALA 224 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qbn h ALA 224 Cb 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2qbn h ALA 224 CO 0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 2qbn n ASN 225 N -4.50 4.26 -4.43 0.00 4.13 -0.33 -4.85 115.26 109.54 2qbn n ASN 225 Ca 0.12 -2.65 -0.29 0.00 1.68 0.00 0.00 54.58 53.44 2qbn n ASN 225 Cb 0.32 -0.52 0.16 0.00 -1.54 0.00 0.00 39.78 38.20 2qbn n ASN 225 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2qbn s GLY 226 N -1.29 1.66 0.07 7.41 0.00 -0.57 -4.92 107.32 109.68 2qbn s GLY 226 Ca 0.43 -0.87 0.09 0.00 0.00 0.00 0.00 44.72 44.37 2qbn s GLY 226 CO 0.16 -0.21 -0.25 1.20 0.00 0.00 0.00 173.10 174.00 2qbn s GLN 227 N -5.61 1.59 -0.34 2.90 -0.21 -1.26 -2.19 119.66 114.54 2qbn s GLN 227 Ca 0.68 -1.15 -0.00 0.00 0.02 0.00 0.00 55.36 54.91 2qbn s GLN 227 Cb -0.09 -1.85 0.08 0.00 1.00 0.00 0.00 33.01 32.15 2qbn s GLN 227 CO 0.53 0.46 0.08 0.08 -2.12 0.00 0.00 175.29 174.32 2qbn s VAL 228 N -0.89 2.87 -1.31 1.09 1.01 0.16 -4.73 120.40 118.60 2qbn s VAL 228 Ca 0.11 -1.86 -0.09 0.00 0.00 0.00 0.00 61.98 60.14 2qbn s VAL 228 Cb -0.10 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.41 2qbn s VAL 228 CO 0.03 -0.42 0.56 0.59 0.00 0.00 0.00 175.10 175.86 2qbn n ASN 229 N 4.51 -2.15 0.00 3.32 5.03 -1.26 -2.43 115.26 122.28 2qbn n ASN 229 Ca -0.05 -1.02 0.00 0.00 0.87 0.00 0.00 54.58 54.37 2qbn n ASN 229 Cb 0.42 -3.09 0.00 0.00 -1.02 0.00 0.00 39.78 36.09 2qbn n ASN 229 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qbn n GLY 230 N -1.89 1.53 3.30 7.41 0.00 -1.26 -5.04 105.19 109.25 2qbn n GLY 230 Ca -0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 2qbn n GLY 230 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qbn s ARG 231 N -0.37 1.20 0.30 1.61 1.04 -1.02 -5.09 118.95 116.62 2qbn s ARG 231 Ca 0.00 -1.37 -0.30 0.00 -1.04 0.00 0.00 55.73 53.02 2qbn s ARG 231 Cb 0.00 -1.17 -0.11 0.00 -2.04 0.00 0.00 34.95 31.62 2qbn s ARG 231 CO 0.00 0.23 1.61 -2.14 -0.04 0.00 0.00 175.30 174.96 2qbn s PRO 232 N -2.84 4.11 0.48 3.89 0.02 -1.26 0.37 135.00 139.77 2qbn s PRO 232 Ca 0.14 2.61 -0.21 0.00 0.02 0.00 0.00 61.00 63.56 2qbn s PRO 232 Cb -0.05 -3.01 -0.08 0.00 0.02 0.00 0.00 34.50 31.38 2qbn s PRO 232 CO 0.05 -0.66 1.07 -1.50 -0.33 0.00 0.00 177.00 175.64 2qbn s ILE 233 N -0.00 3.57 0.56 2.83 2.07 -0.93 -4.73 121.20 124.56 2qbn s ILE 233 Ca 0.64 1.04 -0.06 0.00 -1.41 0.00 0.00 60.65 60.85 2qbn s ILE 233 Cb -0.48 -3.46 -0.01 0.00 0.13 0.00 0.00 42.46 38.64 2qbn s ILE 233 CO 0.48 -0.15 0.88 0.42 -1.91 0.00 0.00 174.94 174.67 2qbn s THR 234 N -1.82 4.06 0.25 4.00 -4.23 -1.26 -4.91 115.64 111.73 2qbn s THR 234 Ca 0.66 0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 61.24 2qbn s THR 234 Cb -0.20 -3.59 0.23 0.00 1.34 0.00 0.00 72.50 70.27 2qbn s THR 234 CO 0.24 -0.62 1.89 0.28 -0.54 0.00 0.00 174.62 175.88 2qbn h SER 235 N -0.08 1.07 0.17 3.99 0.02 -1.95 -0.39 113.55 116.38 2qbn h SER 235 Ca -0.46 -0.07 -0.18 0.00 -0.84 0.00 0.00 61.79 60.24 2qbn h SER 235 Cb 1.24 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 2qbn h SER 235 CO 0.61 0.84 -0.68 -2.24 -1.14 0.00 0.00 176.83 174.22 2qbn h ASP 236 N 1.22 0.54 -0.52 3.07 3.04 -1.99 -1.39 116.42 120.39 2qbn h ASP 236 Ca 0.32 -0.33 -0.06 0.00 -3.24 0.00 0.00 57.03 53.71 2qbn h ASP 236 Cb -0.03 -0.16 -0.02 0.00 -1.04 0.00 0.00 39.33 38.09 2qbn h ASP 236 CO -0.06 1.07 0.11 -0.33 -2.04 0.00 0.00 179.24 177.99 2qbn h GLU 237 N 0.33 0.85 -0.80 4.15 5.08 -1.85 -0.40 114.58 121.94 2qbn h GLU 237 Ca -0.02 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.10 2qbn h GLU 237 Cb 1.25 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.36 2qbn h GLU 237 CO 0.12 0.82 0.40 0.00 -1.00 0.00 0.00 179.01 179.36 2qbn h ALA 238 N 0.99 1.03 -0.48 3.43 0.00 -0.96 -1.48 119.26 121.79 2qbn h ALA 238 Ca 0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2qbn h ALA 238 Cb 0.37 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2qbn h ALA 238 CO 0.01 0.58 0.19 -0.22 0.00 0.00 0.00 179.25 179.80 2qbn h LYS 239 N 1.13 0.71 0.00 0.00 3.64 -0.89 -0.07 116.57 121.09 2qbn h LYS 239 Ca 0.28 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 2qbn h LYS 239 Cb 0.09 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2qbn h LYS 239 CO -0.04 0.64 -0.27 0.00 -2.27 0.00 0.00 179.45 177.51 2qbn h ARG 240 N 0.63 0.00 0.14 1.90 3.08 -0.69 -1.09 114.38 118.35 2qbn h ARG 240 Ca 0.16 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.01 2qbn h ARG 240 Cb 0.19 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.26 2qbn h ARG 240 CO -0.01 0.27 -0.92 1.98 -1.07 0.00 0.00 179.97 180.22 2qbn h MET 241 N 0.00 0.30 0.00 0.04 4.05 -0.91 -1.77 114.93 116.63 2qbn h MET 241 Ca -0.00 -0.51 -0.03 0.00 -0.28 0.00 0.00 59.70 58.88 2qbn h MET 241 Cb 0.57 0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 31.56 2qbn h MET 241 CO 0.04 1.24 -0.13 0.00 0.23 0.00 0.00 176.91 178.29 2qbn h GLY 243 N 0.48 0.43 1.00 0.00 0.00 -1.25 -1.85 103.07 101.87 2qbn h GLY 243 Ca -0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 2qbn h GLY 243 CO 0.02 0.19 0.36 -2.00 0.00 0.00 0.00 176.54 175.11 2qbn h LEU 244 N 0.34 0.73 -0.77 3.11 5.85 -1.34 -2.60 115.31 120.63 2qbn h LEU 244 Ca 0.10 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.83 2qbn h LEU 244 Cb 0.07 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 2qbn h LEU 244 CO -0.02 0.57 0.45 -0.07 -0.34 0.00 0.00 178.44 179.04 2qbn h LEU 245 N 0.82 0.69 -0.38 2.25 3.38 -1.00 -0.56 115.31 120.50 2qbn h LEU 245 Ca 0.22 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2qbn h LEU 245 Cb -0.02 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2qbn h LEU 245 CO -0.04 0.43 0.15 -0.07 0.09 0.00 0.00 178.44 179.01 2qbn h LEU 246 N 0.82 0.52 -0.34 1.67 4.07 -1.05 0.24 115.31 121.23 2qbn h LEU 246 Ca 0.35 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 2qbn h LEU 246 Cb 0.21 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.80 2qbn h LEU 246 CO -0.19 0.54 0.17 0.58 -1.08 0.00 0.00 178.44 178.46 2qbn h VAL 247 N 0.46 1.16 0.00 1.22 2.07 -1.06 -1.40 116.25 118.70 2qbn h VAL 247 Ca 0.13 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 2qbn h VAL 247 Cb 0.18 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 2qbn h VAL 247 CO -0.01 0.16 -0.52 1.62 0.02 0.00 0.00 177.57 178.84 2qbn h VAL 248 N 0.42 1.24 0.00 2.57 3.04 -1.03 -1.39 116.25 121.10 2qbn h VAL 248 Ca 0.12 -1.88 -0.09 0.00 -1.01 0.00 0.00 66.70 63.84 2qbn h VAL 248 Cb 0.10 2.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.42 2qbn h VAL 248 CO -0.02 0.51 -0.43 1.23 -1.01 0.00 0.00 177.57 177.85 2qbn h GLY 249 N 1.90 0.00 -0.07 3.17 0.00 -0.74 -3.33 103.07 104.00 2qbn h GLY 249 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2qbn h GLY 249 CO 0.07 0.00 -0.72 1.04 0.00 0.00 0.00 176.54 176.93 2qbn n LEU 250 N -3.19 0.83 -2.00 3.11 4.32 -0.54 -4.44 117.00 115.09 2qbn n LEU 250 Ca 0.02 -0.52 0.02 0.00 -0.02 0.00 0.00 56.01 55.51 2qbn n LEU 250 Cb 0.70 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.53 2qbn n LEU 250 CO 0.39 0.20 0.05 -0.67 -1.22 0.00 0.00 177.39 176.14 2qbn n ASP 251 N -1.27 1.11 0.00 -1.43 4.64 -0.53 -4.82 116.55 114.24 2qbn n ASP 251 Ca 0.03 -2.01 0.00 0.00 -1.38 0.00 0.00 54.79 51.43 2qbn n ASP 251 Cb 0.26 -0.33 0.00 0.00 -1.04 0.00 0.00 41.12 40.01 2qbn n ASP 251 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 2qbn n THR 252 N 0.05 0.00 -0.19 5.18 -2.24 -1.25 -4.73 114.28 111.09 2qbn n THR 252 Ca 0.05 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.91 2qbn n THR 252 Cb 1.00 -0.50 0.37 0.00 -2.10 0.00 0.00 70.33 69.10 2qbn n THR 252 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2qbn h VAL 253 N 0.00 0.99 -0.72 2.28 2.07 -1.90 -1.90 116.25 117.06 2qbn h VAL 253 Ca 0.00 -0.25 0.15 0.00 0.82 0.00 0.00 66.70 67.42 2qbn h VAL 253 Cb 0.00 0.20 -0.10 0.00 -1.52 0.00 0.00 31.29 29.87 2qbn h VAL 253 CO 0.00 0.13 0.21 0.58 0.02 0.00 0.00 177.57 178.51 2qbn h VAL 254 N 0.72 0.57 -0.02 2.57 2.07 -1.88 -0.38 116.25 119.90 2qbn h VAL 254 Ca 0.33 -0.11 -0.22 0.00 0.82 0.00 0.00 66.70 67.52 2qbn h VAL 254 Cb 0.35 0.22 0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2qbn h VAL 254 CO -0.11 0.06 -0.85 0.78 0.02 0.00 0.00 177.57 177.47 2qbn h ASN 255 N 0.32 0.78 -0.89 0.57 2.35 -1.65 -3.31 115.58 113.75 2qbn h ASN 255 Ca 0.40 -0.73 -0.02 0.00 -0.55 0.00 0.00 56.30 55.40 2qbn h ASN 255 Cb 0.66 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.75 2qbn h ASN 255 CO -0.46 1.40 0.48 0.15 -1.65 0.00 0.00 177.43 177.35 2qbn h PHE 256 N 0.23 1.23 -0.98 1.19 3.04 -0.99 -2.46 116.94 118.20 2qbn h PHE 256 Ca -0.10 -0.03 0.07 0.00 3.98 0.00 0.00 57.97 61.88 2qbn h PHE 256 Cb 1.52 -0.39 -0.07 0.00 2.56 0.00 0.00 35.95 39.57 2qbn h PHE 256 CO 0.12 0.85 0.64 -0.07 -2.02 0.00 0.00 178.31 177.83 2qbn h LEU 257 N 1.25 1.00 -0.73 0.59 3.38 -1.18 -1.60 115.31 118.02 2qbn h LEU 257 Ca 0.31 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.17 2qbn h LEU 257 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2qbn h LEU 257 CO -0.05 0.63 -0.29 0.28 0.09 0.00 0.00 178.44 179.10 2qbn h SER 258 N 1.13 0.67 -0.40 -0.43 0.02 -1.53 -0.75 113.55 112.26 2qbn h SER 258 Ca 0.43 -0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 2qbn h SER 258 Cb 0.20 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 2qbn h SER 258 CO -0.17 0.92 0.10 -0.26 -1.14 0.00 0.00 176.83 176.28 2qbn h PHE 259 N 0.56 0.67 -0.37 3.45 0.04 -1.14 -1.05 116.94 119.10 2qbn h PHE 259 Ca 0.07 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.74 2qbn h PHE 259 Cb 0.78 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.73 2qbn h PHE 259 CO 0.03 0.64 0.14 0.77 -0.60 0.00 0.00 178.31 179.29 2qbn h SER 260 N 0.51 0.51 0.36 2.17 0.02 -1.15 -2.28 113.55 113.69 2qbn h SER 260 Ca 0.13 -0.17 -0.12 0.00 -0.84 0.00 0.00 61.79 60.79 2qbn h SER 260 Cb 0.30 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 2qbn h SER 260 CO 0.00 0.55 -0.50 -0.03 -1.14 0.00 0.00 176.83 175.71 2qbn h MET 261 N 0.45 0.16 -0.23 3.45 1.85 -1.09 -1.72 114.93 117.79 2qbn h MET 261 Ca 0.12 -0.09 -0.02 0.00 -0.61 0.00 0.00 59.70 59.11 2qbn h MET 261 Cb 0.20 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.22 2qbn h MET 261 CO -0.01 0.62 0.08 1.49 -0.40 0.00 0.00 176.91 178.70 2qbn h GLU 262 N 0.13 0.35 -0.37 0.39 4.81 -1.04 0.24 114.58 119.07 2qbn h GLU 262 Ca 0.00 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2qbn h GLU 262 Cb 0.93 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.23 2qbn h GLU 262 CO 0.07 0.41 0.23 0.35 -0.73 0.00 0.00 179.01 179.34 2qbn h PHE 263 N 0.21 0.43 -0.34 0.92 3.04 -1.18 -2.06 116.94 117.96 2qbn h PHE 263 Ca 0.08 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.96 2qbn h PHE 263 Cb 0.20 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 38.55 2qbn h PHE 263 CO -0.01 0.25 -0.10 -0.07 -2.02 0.00 0.00 178.31 176.37 2qbn h LEU 264 N 0.46 0.56 -1.54 0.59 3.38 -1.10 -1.74 115.31 115.92 2qbn h LEU 264 Ca 0.15 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2qbn h LEU 264 Cb -0.01 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2qbn h LEU 264 CO -0.06 0.70 -0.23 0.00 0.09 0.00 0.00 178.44 178.94 2qbn h ALA 265 N 1.36 1.33 -0.01 1.53 0.00 -0.52 -2.73 119.26 120.22 2qbn h ALA 265 Ca 0.10 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qbn h ALA 265 Cb 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qbn h ALA 265 CO 0.03 0.29 -0.43 1.63 0.00 0.00 0.00 179.25 180.77 2qbn n LYS 266 N -3.84 0.83 -3.62 0.00 5.02 -0.81 -4.29 118.16 111.44 2qbn n LYS 266 Ca -0.02 -0.59 -0.29 0.00 -2.02 0.00 0.00 58.31 55.39 2qbn n LYS 266 Cb 0.33 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.73 2qbn n LYS 266 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qbn s SER 267 N -2.58 3.17 0.44 4.39 0.15 -0.71 -4.97 113.70 113.58 2qbn s SER 267 Ca 0.19 -2.85 0.14 0.00 0.70 0.00 0.00 55.95 54.13 2qbn s SER 267 Cb 0.18 -0.88 1.04 0.00 -1.71 0.00 0.00 66.02 64.66 2qbn s SER 267 CO 0.59 -0.22 1.98 -0.65 1.20 0.00 0.00 173.24 176.13 2qbn h PRO 268 N 6.30 0.39 -0.28 5.44 0.11 -1.85 -2.19 132.00 139.92 2qbn h PRO 268 Ca 0.09 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.21 2qbn h PRO 268 Cb 0.90 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.90 2qbn h PRO 268 CO 0.46 0.26 0.10 0.93 -0.21 0.00 0.00 178.00 179.53 2qbn h GLU 269 N 0.40 0.22 -0.18 1.05 3.07 -1.93 0.38 114.58 117.59 2qbn h GLU 269 Ca 0.28 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 59.01 2qbn h GLU 269 Cb 0.57 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 2qbn h GLU 269 CO -0.08 0.14 -0.39 0.45 -1.40 0.00 0.00 179.01 177.74 2qbn h HIS 270 N 0.23 0.47 -0.38 4.33 3.86 -1.78 -1.29 115.15 120.59 2qbn h HIS 270 Ca 0.13 -0.13 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 2qbn h HIS 270 Cb 0.09 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 2qbn h HIS 270 CO -0.13 0.74 0.12 0.00 0.86 0.00 0.00 177.93 179.51 2qbn h ARG 271 N 0.34 0.59 -0.87 2.45 3.08 -1.08 -2.55 114.38 116.35 2qbn h ARG 271 Ca 0.03 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2qbn h ARG 271 Cb 0.84 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 2qbn h ARG 271 CO 0.07 0.60 0.52 0.37 -1.07 0.00 0.00 179.97 180.46 2qbn h GLN 272 N 0.47 1.18 -0.89 0.04 5.75 -0.68 -1.24 115.11 119.73 2qbn h GLN 272 Ca 0.12 -0.11 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 2qbn h GLN 272 Cb 0.26 -0.25 -0.05 0.00 1.07 0.00 0.00 27.48 28.51 2qbn h GLN 272 CO -0.00 0.84 0.58 1.49 -2.65 0.00 0.00 178.83 179.09 2qbn h GLU 273 N 1.20 1.12 0.00 1.69 4.81 -0.97 -0.19 114.58 122.24 2qbn h GLU 273 Ca 0.31 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.37 2qbn h GLU 273 Cb -0.04 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 2qbn h GLU 273 CO -0.06 0.74 -0.51 -0.07 -0.73 0.00 0.00 179.01 178.39 2qbn h LEU 274 N 1.16 0.00 -0.07 1.64 3.38 -1.08 -1.43 115.31 118.91 2qbn h LEU 274 Ca 0.35 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.07 2qbn h LEU 274 Cb -0.05 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.71 2qbn h LEU 274 CO -0.10 0.51 -0.93 0.40 0.09 0.00 0.00 178.44 178.41 2qbn h ILE 275 N 0.00 1.28 0.00 1.22 2.04 -0.64 -2.77 117.51 118.64 2qbn h ILE 275 Ca -0.01 -2.13 -0.19 0.00 1.00 0.00 0.00 64.86 63.54 2qbn h ILE 275 Cb 1.26 2.20 -0.03 0.00 -0.74 0.00 0.00 36.82 39.52 2qbn h ILE 275 CO 0.07 0.67 -0.90 -0.33 0.00 0.00 0.00 178.15 177.65 2qbn h GLU 276 N 0.46 0.00 -2.40 2.37 5.08 -1.06 -3.39 114.58 115.64 2qbn h GLU 276 Ca -0.10 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.67 2qbn h GLU 276 Cb 1.57 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.43 2qbn h GLU 276 CO 0.19 0.90 -0.88 0.54 -1.00 0.00 0.00 179.01 178.76 2qbn n ARG 277 N -3.45 0.98 0.16 2.33 1.74 -0.54 -4.96 116.66 112.92 2qbn n ARG 277 Ca -0.00 -3.66 0.18 0.00 -0.77 0.00 0.00 57.85 53.59 2qbn n ARG 277 Cb 0.86 -1.76 0.79 0.00 -1.02 0.00 0.00 32.46 31.33 2qbn n ARG 277 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2qbn h PRO 278 N 4.97 0.00 0.00 5.56 0.11 -1.69 -1.26 132.00 139.68 2qbn h PRO 278 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2qbn h PRO 278 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2qbn h PRO 278 CO 0.53 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.47 2qbn n GLU 279 N -3.91 0.09 0.00 1.05 0.00 -1.26 -1.66 120.64 114.95 2qbn n GLU 279 Ca 0.03 0.46 0.13 0.00 0.00 0.00 0.00 57.16 57.79 2qbn n GLU 279 Cb 0.39 -1.73 0.44 0.00 0.00 0.00 0.00 31.44 30.54 2qbn n GLU 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2qbn n ARG 280 N -1.91 1.12 -0.02 3.44 1.74 -0.48 -4.36 116.66 116.19 2qbn n ARG 280 Ca 0.01 -0.65 -0.09 0.00 -0.77 0.00 0.00 57.85 56.35 2qbn n ARG 280 Cb 0.11 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2qbn n ARG 280 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2qbn h ILE 281 N 1.58 0.64 -0.48 0.55 1.08 -1.50 0.40 117.51 119.78 2qbn h ILE 281 Ca 0.00 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 2qbn h ILE 281 Cb 0.50 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 34.82 2qbn h ILE 281 CO 0.00 0.00 0.11 -0.65 -0.69 0.00 0.00 178.15 176.92 2qbn h PRO 282 N -0.14 0.25 -0.68 2.37 0.11 -1.82 0.21 132.00 132.30 2qbn h PRO 282 Ca 0.10 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.15 2qbn h PRO 282 Cb 0.29 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 2qbn h PRO 282 CO -0.25 0.16 0.24 0.00 -0.21 0.00 0.00 178.00 177.95 2qbn h ALA 283 N 1.36 1.14 -0.77 -0.75 0.00 -1.76 -2.17 119.26 116.31 2qbn h ALA 283 Ca 0.24 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2qbn h ALA 283 Cb 0.30 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2qbn h ALA 283 CO -0.29 0.61 0.27 0.00 0.00 0.00 0.00 179.25 179.84 2qbn h ALA 284 N 1.26 1.03 -0.79 0.00 0.00 0.21 -1.58 119.26 119.39 2qbn h ALA 284 Ca 0.23 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2qbn h ALA 284 Cb 0.24 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2qbn h ALA 284 CO -0.01 0.67 0.49 0.00 0.00 0.00 0.00 179.25 180.40 2qbn h GLU 286 N 0.94 0.99 -0.20 0.00 4.57 -0.90 -0.77 114.58 119.21 2qbn h GLU 286 Ca 0.33 -0.44 -0.10 0.00 -1.18 0.00 0.00 59.36 57.97 2qbn h GLU 286 Cb 0.08 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2qbn h GLU 286 CO -0.14 1.12 -0.31 1.49 -1.18 0.00 0.00 179.01 179.99 2qbn h GLU 287 N 0.85 0.40 -0.10 1.92 4.57 -0.78 -2.01 114.58 119.44 2qbn h GLU 287 Ca 0.10 -0.17 -0.17 0.00 -1.18 0.00 0.00 59.36 57.94 2qbn h GLU 287 Cb 0.83 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 2qbn h GLU 287 CO 0.07 0.68 -0.68 -0.07 -1.18 0.00 0.00 179.01 177.83 2qbn h LEU 288 N 0.35 0.48 -1.46 1.64 3.38 -0.84 -1.34 115.31 117.51 2qbn h LEU 288 Ca 0.05 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 2qbn h LEU 288 Cb 0.72 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2qbn h LEU 288 CO 0.06 1.02 -0.08 -0.07 0.09 0.00 0.00 178.44 179.46 2qbn h LEU 289 N 0.29 0.24 0.19 1.67 3.38 -0.78 0.12 115.31 120.41 2qbn h LEU 289 Ca -0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2qbn h LEU 289 Cb 1.24 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2qbn h LEU 289 CO 0.12 0.35 -0.09 -0.09 0.09 0.00 0.00 178.44 178.82 2qbn h ARG 290 N 0.25 -0.24 -0.56 1.13 2.43 -1.12 -2.90 114.38 113.37 2qbn h ARG 290 Ca 0.05 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 2qbn h ARG 290 Cb 0.30 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 2qbn h ARG 290 CO 0.01 0.08 0.24 -0.09 -1.51 0.00 0.00 179.97 178.70 2qbn h ARG 291 N -0.98 0.79 -0.65 0.20 9.65 -1.17 -3.07 114.38 119.16 2qbn h ARG 291 Ca -0.03 -0.11 -0.43 0.00 -1.10 0.00 0.00 59.98 58.31 2qbn h ARG 291 Cb 0.43 -0.15 -0.27 0.00 -1.39 0.00 0.00 29.97 28.59 2qbn h ARG 291 CO 0.04 0.64 -0.15 1.19 2.80 0.00 0.00 179.97 184.49 2qbn n PHE 292 N -4.35 2.19 -1.64 2.20 3.01 0.40 -4.96 117.46 114.32 2qbn n PHE 292 Ca 0.05 -2.15 -0.38 0.00 1.01 0.00 0.00 57.45 55.97 2qbn n PHE 292 Cb 0.15 -0.65 0.05 0.00 -0.01 0.00 0.00 39.48 39.02 2qbn n PHE 292 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2qbn n SER 293 N -0.93 1.11 0.00 4.37 2.88 -1.09 -4.91 113.62 115.05 2qbn n SER 293 Ca 0.44 0.84 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 2qbn n SER 293 Cb 0.94 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.97 2qbn n SER 293 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qbn n LEU 294 N -0.81 0.00 -4.76 2.46 -0.00 -1.26 -4.86 117.00 107.76 2qbn n LEU 294 Ca 0.13 -0.02 -0.33 0.00 -0.00 0.00 0.00 56.01 55.80 2qbn n LEU 294 Cb 0.47 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.81 2qbn n LEU 294 CO 0.50 0.03 -0.26 -0.69 -0.00 0.00 0.00 177.39 176.96 2qbn s VAL 295 N 0.00 4.64 -0.32 1.47 1.01 -1.26 -1.14 120.40 124.80 2qbn s VAL 295 Ca 0.00 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.61 2qbn s VAL 295 Cb 0.00 -3.10 0.16 0.00 0.00 0.00 0.00 36.38 33.44 2qbn s VAL 295 CO 0.00 0.38 0.43 0.00 0.00 0.00 0.00 175.10 175.91 2qbn s ALA 296 N -1.15 -1.21 0.00 5.51 0.00 0.41 -1.36 121.76 123.96 2qbn s ALA 296 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2qbn s ALA 296 Cb -0.12 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.84 2qbn s ALA 296 CO 0.12 -1.88 0.00 -0.40 0.00 0.00 0.00 175.76 173.60 2qbn n ASP 297 N 5.04 1.61 0.00 0.00 5.75 -1.26 -4.46 116.55 123.23 2qbn n ASP 297 Ca 0.04 -0.43 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 2qbn n ASP 297 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 2qbn n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qbn n GLY 298 N 4.03 3.25 3.31 6.12 0.00 0.43 -1.52 105.19 120.81 2qbn n GLY 298 Ca 0.00 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 2qbn n GLY 298 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qbn s ARG 299 N 1.69 1.54 -0.02 1.61 1.81 -0.39 -4.30 118.95 120.89 2qbn s ARG 299 Ca 0.00 -1.75 0.05 0.00 -1.72 0.00 0.00 55.73 52.31 2qbn s ARG 299 Cb 0.00 0.34 -0.01 0.00 -0.45 0.00 0.00 34.95 34.83 2qbn s ARG 299 CO 0.00 -0.57 -0.18 -1.50 -0.68 0.00 0.00 175.30 172.37 2qbn s ILE 300 N -3.72 1.47 0.04 1.52 2.07 -0.16 -1.11 121.20 121.32 2qbn s ILE 300 Ca 0.37 -0.78 -0.31 0.00 -1.41 0.00 0.00 60.65 58.52 2qbn s ILE 300 Cb 0.03 -1.23 -0.06 0.00 0.13 0.00 0.00 42.46 41.33 2qbn s ILE 300 CO 0.19 0.42 1.36 -0.76 -1.91 0.00 0.00 174.94 174.24 2qbn s LEU 301 N -0.29 4.34 0.18 8.50 2.01 -0.40 -0.97 118.68 132.05 2qbn s LEU 301 Ca 0.04 2.15 0.26 0.00 0.01 0.00 0.00 54.13 56.58 2qbn s LEU 301 Cb -0.09 -3.57 0.71 0.00 0.01 0.00 0.00 46.19 43.25 2qbn s LEU 301 CO 0.00 -0.66 1.67 0.35 1.01 0.00 0.00 176.35 178.72 2qbn n THR 302 N 4.36 0.52 -3.75 5.49 -2.24 -0.68 -0.83 114.28 117.15 2qbn n THR 302 Ca 0.12 -0.28 -0.03 0.00 -2.27 0.00 0.00 64.05 61.59 2qbn n THR 302 Cb 0.44 -0.47 -0.01 0.00 -2.10 0.00 0.00 70.33 68.19 2qbn n THR 302 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qbn s SER 303 N -4.42 -0.17 0.41 3.42 1.04 -1.26 -4.84 113.70 107.89 2qbn s SER 303 Ca 0.10 -0.40 -0.26 0.00 0.48 0.00 0.00 55.95 55.86 2qbn s SER 303 Cb 0.13 0.47 -0.09 0.00 0.10 0.00 0.00 66.02 66.63 2qbn s SER 303 CO 0.63 -0.88 1.41 -1.81 0.98 0.00 0.00 173.24 173.56 2qbn s ASP 304 N -2.96 6.16 -0.27 7.02 1.01 -1.26 -3.77 116.67 122.59 2qbn s ASP 304 Ca 0.13 2.88 -0.20 0.00 0.71 0.00 0.00 52.55 56.07 2qbn s ASP 304 Cb -0.01 -2.65 0.08 0.00 1.01 0.00 0.00 42.92 41.34 2qbn s ASP 304 CO 0.02 -0.98 0.70 -0.47 0.21 0.00 0.00 175.17 174.65 2qbn s TYR 305 N -1.19 -0.93 -0.28 4.23 5.04 0.13 -4.90 117.35 119.44 2qbn s TYR 305 Ca 0.57 2.03 -0.19 0.00 -2.44 0.00 0.00 57.07 57.04 2qbn s TYR 305 Cb -0.43 0.46 -0.02 0.00 0.35 0.00 0.00 41.96 42.33 2qbn s TYR 305 CO 0.56 -0.46 0.58 -1.21 -1.34 0.00 0.00 175.55 173.69 2qbn s GLU 306 N 1.05 3.98 -0.18 4.97 2.02 -1.26 -0.55 118.70 128.73 2qbn s GLU 306 Ca -0.05 0.33 0.00 0.00 0.02 0.00 0.00 54.97 55.27 2qbn s GLU 306 Cb -0.05 -3.69 0.04 0.00 0.10 0.00 0.00 34.13 30.53 2qbn s GLU 306 CO -0.10 -0.47 -0.09 0.12 0.02 0.00 0.00 175.26 174.74 2qbn s PHE 307 N 2.47 2.13 -1.45 1.61 5.36 -0.06 -4.78 117.98 123.26 2qbn s PHE 307 Ca 0.24 -1.36 -0.05 0.00 -0.96 0.00 0.00 56.93 54.79 2qbn s PHE 307 Cb -0.15 -1.52 0.04 0.00 -0.34 0.00 0.00 43.02 41.05 2qbn s PHE 307 CO 0.10 -0.69 0.62 0.72 -1.46 0.00 0.00 175.22 174.52 2qbn n HIS 308 N 4.76 -1.82 -0.94 10.12 8.25 -1.26 -1.27 115.22 133.06 2qbn n HIS 308 Ca -0.14 0.80 0.00 0.00 -0.26 0.00 0.00 57.72 58.12 2qbn n HIS 308 Cb 0.47 -3.79 0.00 0.00 1.12 0.00 0.00 29.99 27.79 2qbn n HIS 308 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qbn n GLY 309 N -1.76 0.70 3.45 -1.41 0.00 -1.26 -5.01 105.19 99.90 2qbn n GLY 309 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 2qbn n GLY 309 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbn s VAL 310 N -2.98 3.39 -0.41 1.61 1.01 -0.40 -5.08 120.40 117.54 2qbn s VAL 310 Ca 0.00 -0.56 -0.26 0.00 0.00 0.00 0.00 61.98 61.17 2qbn s VAL 310 Cb 0.00 -2.43 0.02 0.00 0.00 0.00 0.00 36.38 33.97 2qbn s VAL 310 CO 0.00 0.54 0.92 -1.58 0.00 0.00 0.00 175.10 174.98 2qbn s GLN 311 N 0.02 3.70 -0.10 2.72 2.00 -1.26 -0.88 119.66 125.86 2qbn s GLN 311 Ca -0.02 0.38 -0.06 0.00 -2.00 0.00 0.00 55.36 53.66 2qbn s GLN 311 Cb -0.14 -3.86 -0.04 0.00 0.80 0.00 0.00 33.01 29.77 2qbn s GLN 311 CO 0.04 -1.08 0.13 -0.51 -0.50 0.00 0.00 175.29 173.37 2qbn s LEU 312 N 3.61 4.29 0.03 3.68 1.43 0.29 -4.92 118.68 127.09 2qbn s LEU 312 Ca 0.38 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.90 2qbn s LEU 312 Cb -0.11 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 2qbn s LEU 312 CO 0.22 0.39 0.10 -0.75 0.23 0.00 0.00 176.35 176.55 2qbn s LYS 313 N -1.10 3.09 0.19 1.70 2.20 -1.26 -0.69 119.74 123.87 2qbn s LYS 313 Ca 0.16 -0.52 -0.33 0.00 -0.36 0.00 0.00 55.97 54.92 2qbn s LYS 313 Cb -0.12 -2.86 -0.14 0.00 -1.51 0.00 0.00 37.83 33.19 2qbn s LYS 313 CO 0.05 0.62 1.44 1.17 -0.36 0.00 0.00 175.35 178.28 2qbn n LYS 314 N 0.85 1.92 0.00 4.03 4.81 -1.25 -0.95 118.16 127.57 2qbn n LYS 314 Ca -0.11 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2qbn n LYS 314 Cb 0.52 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.20 2qbn n LYS 314 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qbn n GLY 315 N 2.63 2.56 3.76 3.14 0.00 -0.01 -4.94 105.19 112.33 2qbn n GLY 315 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2qbn n GLY 315 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qbn s ASP 316 N -1.53 5.85 -0.01 1.61 -0.00 -0.12 -4.66 116.67 117.80 2qbn s ASP 316 Ca 0.00 2.73 -0.07 0.00 -0.00 0.00 0.00 52.55 55.21 2qbn s ASP 316 Cb 0.00 -2.64 -0.05 0.00 -0.00 0.00 0.00 42.92 40.24 2qbn s ASP 316 CO 0.00 -1.18 0.25 -1.10 -0.00 0.00 0.00 175.17 173.14 2qbn s GLN 317 N -2.56 3.57 -0.07 8.23 -0.21 -1.26 -1.28 119.66 126.08 2qbn s GLN 317 Ca 0.63 -0.07 -0.00 0.00 0.02 0.00 0.00 55.36 55.94 2qbn s GLN 317 Cb -0.39 -3.11 0.03 0.00 1.00 0.00 0.00 33.01 30.53 2qbn s GLN 317 CO 0.49 0.67 -0.03 -1.50 -2.12 0.00 0.00 175.29 172.81 2qbn s ILE 318 N -1.24 0.53 -0.04 1.08 2.07 -0.26 -1.17 121.20 122.17 2qbn s ILE 318 Ca 0.25 -0.02 -0.25 0.00 -1.41 0.00 0.00 60.65 59.22 2qbn s ILE 318 Cb -0.13 -0.62 -0.04 0.00 0.13 0.00 0.00 42.46 41.80 2qbn s ILE 318 CO 0.14 0.26 0.78 -0.22 -1.91 0.00 0.00 174.94 174.00 2qbn s LEU 319 N 1.56 4.34 -0.64 8.50 2.96 0.47 -1.26 118.68 134.62 2qbn s LEU 319 Ca -0.01 1.34 0.05 0.00 -0.22 0.00 0.00 54.13 55.29 2qbn s LEU 319 Cb -0.13 -3.23 0.17 0.00 0.50 0.00 0.00 46.19 43.50 2qbn s LEU 319 CO -0.04 -0.14 0.46 -0.76 -1.32 0.00 0.00 176.35 174.55 2qbn s LEU 320 N 0.78 4.06 -0.47 -0.68 1.43 -0.57 -1.76 118.68 121.46 2qbn s LEU 320 Ca 0.41 -3.67 -0.30 0.00 -1.03 0.00 0.00 54.13 49.55 2qbn s LEU 320 Cb -0.19 -1.37 -0.10 0.00 0.03 0.00 0.00 46.19 44.56 2qbn s LEU 320 CO 0.21 -0.11 2.36 -2.65 0.23 0.00 0.00 176.35 176.39 2qbn n PRO 321 N 2.18 1.07 0.05 1.29 -0.02 -1.26 -4.29 135.00 134.04 2qbn n PRO 321 Ca 0.22 0.18 0.10 0.00 -2.02 0.00 0.00 63.50 61.98 2qbn n PRO 321 Cb 0.38 -2.85 0.56 0.00 -0.02 0.00 0.00 33.50 31.57 2qbn n PRO 321 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2qbn h GLN 322 N 15.61 0.24 -0.75 -0.52 7.50 -1.70 -1.85 115.11 133.64 2qbn h GLN 322 Ca -0.25 -0.01 0.03 0.00 0.50 0.00 0.00 58.65 58.91 2qbn h GLN 322 Cb 1.29 -0.05 -0.04 0.00 0.05 0.00 0.00 27.48 28.72 2qbn h GLN 322 CO 1.11 0.16 0.49 1.98 -1.50 0.00 0.00 178.83 181.08 2qbn h MET 323 N 0.25 0.91 0.00 1.46 4.05 -1.49 -3.24 114.93 116.87 2qbn h MET 323 Ca 0.16 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.39 2qbn h MET 323 Cb 0.32 -0.21 -0.02 0.00 -0.80 0.00 0.00 31.60 30.90 2qbn h MET 323 CO -0.03 0.60 -0.62 -0.07 0.23 0.00 0.00 176.91 177.02 2qbn h LEU 324 N 0.94 0.00 -0.43 3.39 3.38 -1.64 -3.34 115.31 117.61 2qbn h LEU 324 Ca 0.29 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.35 2qbn h LEU 324 Cb 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.67 2qbn h LEU 324 CO -0.08 0.62 -0.10 0.28 0.09 0.00 0.00 178.44 179.25 2qbn h SER 325 N 0.00 -0.39 1.26 -0.43 0.02 -1.66 -1.56 113.55 110.79 2qbn h SER 325 Ca -0.01 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2qbn h SER 325 Cb 1.10 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.90 2qbn h SER 325 CO 0.08 -0.14 0.00 1.23 -1.14 0.00 0.00 176.83 176.86 2qbn h GLY 326 N 0.00 0.00 0.28 -3.77 0.00 -1.74 -2.92 103.07 94.92 2qbn h GLY 326 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2qbn h GLY 326 CO -0.44 0.00 -0.40 1.04 0.00 0.00 0.00 176.54 176.75 2qbn n LEU 327 N -2.68 1.00 -4.64 3.11 4.77 -0.71 -4.62 117.00 113.24 2qbn n LEU 327 Ca 0.03 -0.27 -0.43 0.00 -0.03 0.00 0.00 56.01 55.31 2qbn n LEU 327 Cb 0.36 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2qbn n LEU 327 CO 0.27 0.20 1.27 -0.62 -1.33 0.00 0.00 177.39 177.19 2qbn s ASP 328 N -2.66 6.55 0.65 -1.43 3.68 -0.67 -4.73 116.67 118.06 2qbn s ASP 328 Ca 0.19 1.57 0.36 0.00 2.13 0.00 0.00 52.55 56.80 2qbn s ASP 328 Cb 0.18 -2.53 1.97 0.00 -1.45 0.00 0.00 42.92 41.09 2qbn s ASP 328 CO 0.60 -1.12 2.15 1.05 0.13 0.00 0.00 175.17 177.98 2qbn h GLU 329 N 9.93 0.00 0.00 4.34 4.11 -1.89 0.35 114.58 131.42 2qbn h GLU 329 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2qbn h GLU 329 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2qbn h GLU 329 CO 1.00 0.00 0.00 0.00 0.07 0.00 0.00 179.01 180.08 2qbn h ARG 330 N 0.00 0.00 0.00 1.06 3.08 -1.93 -3.23 114.38 113.36 2qbn h ARG 330 Ca 0.02 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.75 2qbn h ARG 330 Cb 0.35 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 2qbn h ARG 330 CO -0.00 0.00 -2.20 0.39 -1.07 0.00 0.00 179.97 177.09 2qbn n GLU 331 N -3.04 0.97 -3.68 0.04 1.02 0.11 -4.95 120.64 111.11 2qbn n GLU 331 Ca 0.02 0.04 -0.18 0.00 -0.02 0.00 0.00 57.16 57.02 2qbn n GLU 331 Cb 0.36 -1.44 -0.16 0.00 -0.02 0.00 0.00 31.44 30.18 2qbn n GLU 331 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2qbn s ASN 332 N -5.47 0.82 0.48 1.62 0.01 -0.40 -4.70 114.94 107.30 2qbn s ASN 332 Ca -0.16 0.23 -0.23 0.00 -0.71 0.00 0.00 52.86 52.00 2qbn s ASN 332 Cb 0.06 0.11 -0.07 0.00 0.41 0.00 0.00 41.25 41.77 2qbn s ASN 332 CO 0.63 -0.24 1.23 0.00 -1.51 0.00 0.00 177.10 177.21 2qbn s ALA 333 N 2.15 2.93 -1.32 0.60 0.00 -1.25 -3.07 121.76 121.80 2qbn s ALA 333 Ca 0.03 1.06 -0.10 0.00 0.00 0.00 0.00 51.96 52.95 2qbn s ALA 333 Cb -0.12 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2qbn s ALA 333 CO -0.05 -0.88 0.51 0.00 0.00 0.00 0.00 175.76 175.35 2qbn h PRO 335 N -1.95 0.34 0.00 0.00 0.13 -1.83 -1.22 132.00 127.47 2qbn h PRO 335 Ca -0.65 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2qbn h PRO 335 Cb 1.38 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2qbn h PRO 335 CO 0.58 0.22 0.00 -1.33 -0.23 0.00 0.00 178.00 177.24 2qbn n MET 336 N -4.53 0.15 -2.90 0.86 2.81 -1.26 -4.76 117.12 107.49 2qbn n MET 336 Ca 0.23 0.21 -0.40 0.00 -1.81 0.00 0.00 57.70 55.93 2qbn n MET 336 Cb 0.85 -1.71 -0.05 0.00 -0.71 0.00 0.00 33.22 31.60 2qbn n MET 336 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 2qbn s HIS 337 N -3.11 3.78 -0.29 2.03 3.76 -0.46 -5.03 115.29 115.96 2qbn s HIS 337 Ca 0.10 1.60 -0.14 0.00 -0.15 0.00 0.00 55.06 56.46 2qbn s HIS 337 Cb 0.13 -2.89 -0.03 0.00 1.11 0.00 0.00 32.58 30.90 2qbn s HIS 337 CO 0.50 0.28 0.32 0.08 -0.85 0.00 0.00 174.74 175.06 2qbn s VAL 338 N -0.16 5.21 -0.25 -0.90 1.01 -1.26 -5.03 120.40 119.02 2qbn s VAL 338 Ca 0.41 0.30 -0.02 0.00 0.00 0.00 0.00 61.98 62.67 2qbn s VAL 338 Cb -0.22 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.56 2qbn s VAL 338 CO 0.26 0.11 0.06 -0.62 0.00 0.00 0.00 175.10 174.91 2qbn s ASP 339 N 1.70 3.45 0.30 3.32 2.15 -1.26 -5.00 116.67 121.33 2qbn s ASP 339 Ca 0.12 -1.19 0.22 0.00 0.43 0.00 0.00 52.55 52.13 2qbn s ASP 339 Cb -0.16 -0.73 1.10 0.00 -0.30 0.00 0.00 42.92 42.83 2qbn s ASP 339 CO 0.11 -0.35 1.66 0.49 -0.17 0.00 0.00 175.17 176.91 2qbn n PHE 340 N 4.96 0.74 0.22 -5.34 3.72 -1.26 -1.07 117.46 119.43 2qbn n PHE 340 Ca -0.06 0.36 0.12 0.00 -0.05 0.00 0.00 57.45 57.81 2qbn n PHE 340 Cb 0.45 -1.08 0.26 0.00 -0.94 0.00 0.00 39.48 38.17 2qbn n PHE 340 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2qbn n SER 341 N -2.24 3.40 -4.64 4.37 7.64 -1.26 -4.58 113.62 116.32 2qbn n SER 341 Ca -0.00 -1.98 -0.53 0.00 1.01 0.00 0.00 58.87 57.37 2qbn n SER 341 Cb 0.09 -0.31 -0.06 0.00 -1.01 0.00 0.00 64.21 62.92 2qbn n SER 341 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2qbn n ARG 342 N 1.41 1.30 0.21 1.43 0.63 -0.23 -4.91 116.66 116.50 2qbn n ARG 342 Ca 0.20 0.47 -0.09 0.00 -0.92 0.00 0.00 57.85 57.51 2qbn n ARG 342 Cb 0.58 -2.15 -0.05 0.00 0.45 0.00 0.00 32.46 31.29 2qbn n ARG 342 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2qbn h GLN 343 N 5.70 -0.56 -3.35 -0.14 1.08 -1.93 -3.38 115.11 112.52 2qbn h GLN 343 Ca -0.47 0.04 -0.67 0.00 -1.45 0.00 0.00 58.65 56.10 2qbn h GLN 343 Cb 1.32 0.13 -0.38 0.00 -0.05 0.00 0.00 27.48 28.50 2qbn h GLN 343 CO 0.85 -0.37 -0.40 0.21 -0.95 0.00 0.00 178.83 178.17 2qbn s LYS 344 N -4.37 2.60 -0.43 1.46 2.47 -1.26 -5.05 119.74 115.16 2qbn s LYS 344 Ca -0.09 -2.93 -0.28 0.00 -1.56 0.00 0.00 55.97 51.11 2qbn s LYS 344 Cb 0.01 -3.63 -0.00 0.00 -1.46 0.00 0.00 37.83 32.75 2qbn s LYS 344 CO 0.28 -1.21 1.60 0.08 0.16 0.00 0.00 175.35 176.26 2qbn s VAL 345 N -0.76 3.67 -0.11 4.02 1.01 -1.26 -4.94 120.40 122.03 2qbn s VAL 345 Ca 0.21 0.64 -0.02 0.00 0.00 0.00 0.00 61.98 62.81 2qbn s VAL 345 Cb -0.15 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2qbn s VAL 345 CO -0.08 -0.72 -0.02 -0.55 0.00 0.00 0.00 175.10 173.74 2qbn s SER 346 N 5.27 5.04 0.07 3.32 0.15 -1.26 -5.09 113.70 121.19 2qbn s SER 346 Ca 0.67 0.04 -0.27 0.00 0.70 0.00 0.00 55.95 57.08 2qbn s SER 346 Cb -0.16 -1.53 0.09 0.00 -1.71 0.00 0.00 66.02 62.70 2qbn s SER 346 CO 0.30 0.31 1.07 -1.38 1.20 0.00 0.00 173.24 174.74 2qbn s HIS 347 N -0.45 -0.12 -0.21 3.44 -3.43 -1.26 -4.25 115.29 109.00 2qbn s HIS 347 Ca 0.08 -0.09 0.19 0.00 -0.80 0.00 0.00 55.06 54.43 2qbn s HIS 347 Cb -0.12 0.60 0.47 0.00 -1.43 0.00 0.00 32.58 32.10 2qbn s HIS 347 CO 0.02 -0.60 1.15 0.25 -2.00 0.00 0.00 174.74 173.56 2qbn n THR 348 N -0.44 1.37 -0.27 -5.38 -2.24 -1.26 -4.89 114.28 101.17 2qbn n THR 348 Ca -0.07 -2.84 0.07 0.00 -2.27 0.00 0.00 64.05 58.94 2qbn n THR 348 Cb 0.61 0.57 0.31 0.00 -2.10 0.00 0.00 70.33 69.73 2qbn n THR 348 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2qbn h THR 349 N 4.73 0.97 -0.48 4.28 2.02 -1.87 0.01 112.91 122.56 2qbn h THR 349 Ca -0.03 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.85 2qbn h THR 349 Cb 1.43 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2qbn h THR 349 CO 0.27 0.16 0.00 0.49 0.37 0.00 0.00 175.52 176.81 2qbn n PHE 350 N -4.52 1.58 -0.99 3.16 3.72 -1.26 -4.76 117.46 114.38 2qbn n PHE 350 Ca 0.15 -0.56 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 2qbn n PHE 350 Cb 0.31 -0.38 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2qbn n PHE 350 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qbn n GLY 351 N 0.63 -2.34 3.51 1.37 0.00 -0.01 -1.12 105.19 107.24 2qbn n GLY 351 Ca 0.22 -1.87 -0.18 0.00 0.00 0.00 0.00 46.02 44.20 2qbn n GLY 351 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qbn s HIS 352 N -0.28 -0.65 0.00 1.61 2.46 -1.26 -4.71 115.29 112.46 2qbn s HIS 352 Ca 0.00 1.11 0.00 0.00 0.47 0.00 0.00 55.06 56.64 2qbn s HIS 352 Cb 0.00 0.40 0.00 0.00 -0.13 0.00 0.00 32.58 32.85 2qbn s HIS 352 CO 0.00 -0.60 0.00 0.41 -2.47 0.00 0.00 174.74 172.08 2qbn n GLY 353 N 0.96 -1.80 0.34 1.59 0.00 -1.26 -4.30 105.19 100.71 2qbn n GLY 353 Ca -0.19 -1.60 0.19 0.00 0.00 0.00 0.00 46.02 44.42 2qbn n GLY 353 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qbn h SER 354 N 0.00 0.00 -0.59 1.61 4.64 -1.92 -2.00 113.55 115.28 2qbn h SER 354 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qbn h SER 354 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qbn h SER 354 CO 0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 2qbn n HIS 355 N -3.23 1.14 -1.53 4.77 -0.00 -1.26 -5.00 115.22 110.11 2qbn n HIS 355 Ca -0.01 -0.49 -0.57 0.00 -0.00 0.00 0.00 57.72 56.65 2qbn n HIS 355 Cb 0.24 -0.14 -0.07 0.00 -0.00 0.00 0.00 29.99 30.01 2qbn n HIS 355 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2qbn n LEU 356 N 1.11 0.50 -4.56 2.41 7.94 -0.76 -4.72 117.00 118.92 2qbn n LEU 356 Ca 0.22 1.15 -0.58 0.00 -1.11 0.00 0.00 56.01 55.69 2qbn n LEU 356 Cb 0.70 -1.00 -0.08 0.00 0.53 0.00 0.00 43.42 43.58 2qbn n LEU 356 CO 0.19 -1.63 0.75 0.00 -1.11 0.00 0.00 177.39 175.59 2qbn h LEU 358 N 3.83 0.00 -3.05 0.00 3.38 -1.91 -3.36 115.31 114.21 2qbn h LEU 358 Ca -0.49 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2qbn h LEU 358 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2qbn h LEU 358 CO 0.73 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.87 2qbn n GLY 359 N 1.18 2.68 0.30 0.83 0.00 -1.26 -4.42 105.19 104.50 2qbn n GLY 359 Ca 0.00 -0.85 0.16 0.00 0.00 0.00 0.00 46.02 45.33 2qbn n GLY 359 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2qbn h GLN 360 N 4.24 0.00 -0.12 1.61 3.07 -1.91 -0.45 115.11 121.55 2qbn h GLN 360 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 58.65 58.53 2qbn h GLN 360 Cb 1.36 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.93 2qbn h GLN 360 CO 0.18 0.04 -0.76 0.45 0.09 0.00 0.00 178.83 178.83 2qbn h HIS 361 N 0.00 1.00 -0.40 0.06 3.86 -1.91 -0.73 115.15 117.03 2qbn h HIS 361 Ca -0.00 -0.46 -0.10 0.00 -1.16 0.00 0.00 60.37 58.65 2qbn h HIS 361 Cb 0.13 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 2qbn h HIS 361 CO 0.00 1.28 -0.15 1.25 0.86 0.00 0.00 177.93 181.18 2qbn h LEU 362 N 0.44 0.83 -0.06 2.43 5.85 -1.64 -2.05 115.31 121.11 2qbn h LEU 362 Ca -0.06 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.29 2qbn h LEU 362 Cb 1.40 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 2qbn h LEU 362 CO 0.16 1.03 -0.02 0.00 -0.34 0.00 0.00 178.44 179.26 2qbn h ALA 363 N 0.83 0.04 -0.81 1.25 0.00 -1.04 -1.04 119.26 118.48 2qbn h ALA 363 Ca 0.09 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2qbn h ALA 363 Cb 0.69 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 2qbn h ALA 363 CO 0.05 -0.50 0.44 0.00 0.00 0.00 0.00 179.25 179.25 2qbn h ARG 364 N -0.01 1.12 -0.41 0.00 3.08 -1.10 -0.76 114.38 116.30 2qbn h ARG 364 Ca 0.03 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2qbn h ARG 364 Cb 0.05 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 2qbn h ARG 364 CO -0.07 0.82 0.19 -0.09 -1.07 0.00 0.00 179.97 179.75 2qbn h ARG 365 N 1.12 0.60 -0.47 0.04 9.65 -1.00 0.45 114.38 124.78 2qbn h ARG 365 Ca 0.28 -0.10 -0.07 0.00 -1.10 0.00 0.00 59.98 59.00 2qbn h ARG 365 Cb 0.02 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 2qbn h ARG 365 CO -0.05 0.54 -0.00 0.93 2.80 0.00 0.00 179.97 184.19 2qbn h GLU 366 N 0.52 0.77 -0.03 0.20 5.08 -0.75 -0.49 114.58 119.89 2qbn h GLU 366 Ca 0.14 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2qbn h GLU 366 Cb 0.15 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2qbn h GLU 366 CO -0.02 0.78 -0.02 0.82 -1.00 0.00 0.00 179.01 179.57 2qbn h ILE 367 N 0.72 1.35 -0.58 3.13 2.04 -0.86 -2.06 117.51 121.25 2qbn h ILE 367 Ca 0.14 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 2qbn h ILE 367 Cb 0.44 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 2qbn h ILE 367 CO 0.02 0.29 0.29 0.40 0.00 0.00 0.00 178.15 179.14 2qbn h ILE 368 N -0.37 1.21 -0.71 -0.67 1.08 -0.81 -0.75 117.51 116.48 2qbn h ILE 368 Ca 0.01 -0.57 -0.01 0.00 -0.39 0.00 0.00 64.86 63.89 2qbn h ILE 368 Cb 0.48 0.51 -0.03 0.00 -3.07 0.00 0.00 36.82 34.70 2qbn h ILE 368 CO 0.00 0.23 0.40 0.58 -0.69 0.00 0.00 178.15 178.67 2qbn h VAL 369 N 0.79 1.21 -0.11 1.67 2.07 -1.13 -1.50 116.25 119.25 2qbn h VAL 369 Ca 0.20 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 2qbn h VAL 369 Cb 0.11 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2qbn h VAL 369 CO -0.03 0.23 0.06 0.74 0.02 0.00 0.00 177.57 178.60 2qbn h THR 370 N 0.97 1.09 -0.19 2.57 2.02 -0.93 -0.65 112.91 117.80 2qbn h THR 370 Ca 0.25 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 67.19 2qbn h THR 370 Cb 0.02 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2qbn h THR 370 CO -0.04 0.08 0.06 -0.07 0.37 0.00 0.00 175.52 175.92 2qbn h LEU 371 N 0.08 0.06 0.32 2.58 3.38 -0.93 -0.73 115.31 120.06 2qbn h LEU 371 Ca 0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qbn h LEU 371 Cb 0.08 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qbn h LEU 371 CO -0.01 0.06 -0.15 0.50 0.09 0.00 0.00 178.44 178.93 2qbn h LYS 372 N 0.15 -0.41 0.00 1.13 3.11 -1.20 -2.57 116.57 116.77 2qbn h LYS 372 Ca 0.08 0.03 -0.09 0.00 -2.81 0.00 0.00 60.65 57.86 2qbn h LYS 372 Cb 0.06 0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 2qbn h LYS 372 CO -0.09 -0.15 -0.44 0.93 -2.81 0.00 0.00 179.45 176.89 2qbn h GLU 373 N -0.64 0.00 0.00 1.90 4.39 -1.12 -2.24 114.58 116.87 2qbn h GLU 373 Ca -0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 2qbn h GLU 373 Cb 0.46 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2qbn h GLU 373 CO 0.07 0.44 -0.00 2.35 -1.16 0.00 0.00 179.01 180.71 2qbn h TRP 374 N 0.00 -0.00 0.00 4.33 2.91 -1.17 -3.10 115.95 118.92 2qbn h TRP 374 Ca -0.00 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.00 2qbn h TRP 374 Cb 0.82 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.47 2qbn h TRP 374 CO 0.00 0.69 -0.07 -0.07 -1.03 0.00 0.00 178.44 177.96 2qbn h LEU 375 N -0.71 0.00 -0.34 0.65 3.38 -1.47 0.62 115.31 117.43 2qbn h LEU 375 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 2qbn h LEU 375 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2qbn h LEU 375 CO 0.00 0.07 -0.75 0.74 0.09 0.00 0.00 178.44 178.59 2qbn h THR 376 N 0.00 1.36 0.03 0.22 2.02 -1.43 -3.20 112.91 111.90 2qbn h THR 376 Ca -0.00 -2.11 -0.37 0.00 0.77 0.00 0.00 66.41 64.69 2qbn h THR 376 Cb 0.29 2.09 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 2qbn h THR 376 CO 0.01 0.64 -2.30 0.54 0.37 0.00 0.00 175.52 174.79 2qbn n ARG 377 N -3.86 0.68 -3.65 6.66 1.74 -0.90 -4.50 116.66 112.84 2qbn n ARG 377 Ca -0.05 0.16 -0.27 0.00 -0.77 0.00 0.00 57.85 56.92 2qbn n ARG 377 Cb 0.72 -1.59 -0.11 0.00 -1.02 0.00 0.00 32.46 30.47 2qbn n ARG 377 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2qbn n ILE 378 N -3.23 0.70 0.14 0.55 -0.00 0.21 -1.41 119.36 116.33 2qbn n ILE 378 Ca -0.39 -4.41 -0.00 0.00 -0.00 0.00 0.00 62.75 57.95 2qbn n ILE 378 Cb 1.03 -2.00 0.25 0.00 -0.00 0.00 0.00 39.64 38.93 2qbn n ILE 378 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.55 178.10 2qbn h PRO 379 N 5.24 0.07 -5.03 0.38 0.13 -1.73 -3.39 132.00 127.68 2qbn h PRO 379 Ca 0.19 -0.04 -0.67 0.00 -0.87 0.00 0.00 66.00 64.61 2qbn h PRO 379 Cb 0.80 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.58 2qbn h PRO 379 CO 0.61 0.53 -0.84 0.34 -0.23 0.00 0.00 178.00 178.41 2qbn s ASP 380 N -6.89 3.41 0.18 1.44 2.15 -1.26 -4.90 116.67 110.79 2qbn s ASP 380 Ca -0.03 -0.73 -0.17 0.00 0.43 0.00 0.00 52.55 52.05 2qbn s ASP 380 Cb 0.13 -1.51 0.03 0.00 -0.30 0.00 0.00 42.92 41.27 2qbn s ASP 380 CO 0.75 -0.03 0.50 0.72 -0.17 0.00 0.00 175.17 176.94 2qbn s PHE 381 N 1.28 -0.16 0.24 -5.34 -0.12 -1.26 -4.51 117.98 108.11 2qbn s PHE 381 Ca 0.03 -0.17 -0.09 0.00 -0.05 0.00 0.00 56.93 56.66 2qbn s PHE 381 Cb -0.14 0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 42.60 2qbn s PHE 381 CO -0.11 -0.86 0.37 -1.12 -0.05 0.00 0.00 175.22 173.45 2qbn s SER 382 N -2.85 0.05 0.38 1.98 0.01 -0.43 -4.73 113.70 108.11 2qbn s SER 382 Ca 0.07 -1.11 -0.26 0.00 1.31 0.00 0.00 55.95 55.97 2qbn s SER 382 Cb -0.00 0.53 -0.09 0.00 0.21 0.00 0.00 66.02 66.67 2qbn s SER 382 CO -0.06 -1.06 1.17 -0.63 0.41 0.00 0.00 173.24 173.07 2qbn s ILE 383 N -4.00 3.19 0.60 1.44 1.09 -1.26 -1.02 121.20 121.24 2qbn s ILE 383 Ca 0.28 1.02 -0.19 0.00 -1.10 0.00 0.00 60.65 60.67 2qbn s ILE 383 Cb 0.02 -3.59 -0.04 0.00 -1.06 0.00 0.00 42.46 37.79 2qbn s ILE 383 CO 0.11 0.12 1.06 0.00 -0.10 0.00 0.00 174.94 176.12 2qbn n ALA 384 N 0.23 0.47 -1.62 9.38 0.00 -0.10 -4.69 120.51 124.19 2qbn n ALA 384 Ca 0.03 0.02 -0.51 0.00 0.00 0.00 0.00 53.44 52.99 2qbn n ALA 384 Cb 0.46 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.69 2qbn n ALA 384 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qbn n PRO 385 N -1.15 1.40 -0.83 0.00 -0.02 -1.26 -1.63 135.00 131.50 2qbn n PRO 385 Ca 0.14 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2qbn n PRO 385 Cb 0.47 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2qbn n PRO 385 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qbn n GLY 386 N 2.87 0.24 3.73 -1.23 0.00 -1.26 -4.97 105.19 104.57 2qbn n GLY 386 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2qbn n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbn s ALA 387 N -1.65 3.35 -0.33 4.61 0.00 -0.65 -5.01 121.76 122.09 2qbn s ALA 387 Ca 0.00 0.79 -0.00 0.00 0.00 0.00 0.00 51.96 52.75 2qbn s ALA 387 Cb 0.00 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 19.83 2qbn s ALA 387 CO 0.00 -0.26 0.05 -0.65 0.00 0.00 0.00 175.76 174.90 2qbn s GLN 388 N 0.09 2.12 0.04 0.00 -0.21 -1.26 -4.92 119.66 115.52 2qbn s GLN 388 Ca 0.52 -1.53 -0.30 0.00 0.02 0.00 0.00 55.36 54.06 2qbn s GLN 388 Cb -0.29 -3.26 -0.07 0.00 1.00 0.00 0.00 33.01 30.39 2qbn s GLN 388 CO 0.33 -0.79 1.61 0.42 -2.12 0.00 0.00 175.29 174.74 2qbn s ILE 389 N 1.14 3.25 -0.17 1.08 1.01 -1.26 -5.01 121.20 121.24 2qbn s ILE 389 Ca 0.01 0.63 -0.06 0.00 0.00 0.00 0.00 60.65 61.22 2qbn s ILE 389 Cb -0.20 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 2qbn s ILE 389 CO -0.04 -0.01 0.04 -1.58 0.00 0.00 0.00 174.94 173.35 2qbn s GLN 390 N 2.85 3.89 0.30 2.79 2.00 -1.26 -4.99 119.66 125.24 2qbn s GLN 390 Ca 0.72 -0.38 0.06 0.00 -2.00 0.00 0.00 55.36 53.76 2qbn s GLN 390 Cb -0.37 -3.14 -0.02 0.00 0.80 0.00 0.00 33.01 30.28 2qbn s GLN 390 CO 0.31 0.28 0.40 -1.01 -0.50 0.00 0.00 175.29 174.77 2qbn s HIS 391 N 0.32 3.17 -0.00 1.67 3.76 -1.26 -0.44 115.29 122.51 2qbn s HIS 391 Ca 0.02 -0.17 0.04 0.00 -0.15 0.00 0.00 55.06 54.79 2qbn s HIS 391 Cb -0.13 -1.81 -0.01 0.00 1.11 0.00 0.00 32.58 31.74 2qbn s HIS 391 CO 0.01 0.17 -0.11 0.15 -0.85 0.00 0.00 174.74 174.11 2qbn s LYS 392 N -4.07 0.88 0.14 1.40 -0.14 0.27 -4.79 119.74 113.42 2qbn s LYS 392 Ca 0.41 -0.44 0.08 0.00 -1.36 0.00 0.00 55.97 54.65 2qbn s LYS 392 Cb -0.09 -0.85 -0.04 0.00 -1.68 0.00 0.00 37.83 35.17 2qbn s LYS 392 CO 0.29 0.23 -0.10 0.45 -0.76 0.00 0.00 175.35 175.47 2qbn s SER 393 N -0.39 4.32 0.00 2.83 0.15 -1.26 -0.85 113.70 118.50 2qbn s SER 393 Ca 0.04 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2qbn s SER 393 Cb -0.05 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 63.48 2qbn s SER 393 CO -0.00 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.19 2qbn n GLY 394 N 0.41 -0.63 0.35 9.45 0.00 -1.14 -4.53 105.19 109.11 2qbn n GLY 394 Ca -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2qbn n GLY 394 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qbn h ILE 395 N 0.00 1.20 -3.19 -0.61 1.08 -1.48 -3.37 117.51 111.14 2qbn h ILE 395 Ca 0.00 -0.36 -0.52 0.00 -0.39 0.00 0.00 64.86 63.59 2qbn h ILE 395 Cb 0.00 0.05 -0.37 0.00 -3.07 0.00 0.00 36.82 33.43 2qbn h ILE 395 CO 0.00 0.19 -0.80 -0.69 -0.69 0.00 0.00 178.15 176.16 2qbn s VAL 396 N -5.88 0.96 0.53 1.67 1.01 -1.26 -0.44 120.40 116.99 2qbn s VAL 396 Ca -0.11 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 2qbn s VAL 396 Cb 0.18 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2qbn s VAL 396 CO 0.79 0.35 0.85 -0.44 0.00 0.00 0.00 175.10 176.64 2qbn s SER 397 N 1.73 6.06 0.13 3.32 0.01 -0.30 -4.73 113.70 119.93 2qbn s SER 397 Ca 0.05 0.92 -0.04 0.00 1.31 0.00 0.00 55.95 58.19 2qbn s SER 397 Cb -0.13 -2.11 0.02 0.00 0.21 0.00 0.00 66.02 64.01 2qbn s SER 397 CO -0.08 -0.75 0.25 0.61 0.41 0.00 0.00 173.24 173.67 2qbn n GLY 398 N -2.41 1.99 3.33 3.44 0.00 -0.03 -4.81 105.19 106.71 2qbn n GLY 398 Ca 0.02 -1.21 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 2qbn n GLY 398 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbn s VAL 399 N -2.65 3.13 0.12 1.61 1.01 -1.26 -0.57 120.40 121.79 2qbn s VAL 399 Ca 0.07 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.25 2qbn s VAL 399 Cb -0.01 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 2qbn s VAL 399 CO 0.05 0.49 1.75 -0.61 0.00 0.00 0.00 175.10 176.78 2qbn h GLN 400 N 7.32 0.32 -2.06 2.72 5.75 -1.06 -3.46 115.11 124.64 2qbn h GLN 400 Ca -0.33 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.08 2qbn h GLN 400 Cb 1.19 -0.07 -0.19 0.00 1.07 0.00 0.00 27.48 29.48 2qbn h GLN 400 CO 0.58 0.25 0.16 0.00 -2.65 0.00 0.00 178.83 177.18 2qbn s ALA 401 N -6.03 -1.71 -0.42 3.38 0.00 -1.26 -4.99 121.76 110.72 2qbn s ALA 401 Ca -0.13 1.28 0.04 0.00 0.00 0.00 0.00 51.96 53.15 2qbn s ALA 401 Cb 0.09 -0.03 0.17 0.00 0.00 0.00 0.00 23.12 23.34 2qbn s ALA 401 CO 0.70 -0.36 0.34 -1.17 0.00 0.00 0.00 175.76 175.27 2qbn s LEU 402 N -1.15 1.54 -0.05 0.00 2.96 -1.26 -4.55 118.68 116.17 2qbn s LEU 402 Ca -0.11 -3.05 -0.30 0.00 -0.22 0.00 0.00 54.13 50.45 2qbn s LEU 402 Cb -0.00 -0.49 -0.04 0.00 0.50 0.00 0.00 46.19 46.16 2qbn s LEU 402 CO 0.09 -0.18 1.23 -2.16 -1.32 0.00 0.00 176.35 174.02 2qbn s PRO 403 N 0.05 4.34 0.19 0.98 0.04 -1.26 -1.45 135.00 137.89 2qbn s PRO 403 Ca 0.32 1.72 0.11 0.00 0.04 0.00 0.00 61.00 63.18 2qbn s PRO 403 Cb 0.02 -3.56 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 2qbn s PRO 403 CO -0.18 -0.47 -0.23 -0.51 0.04 0.00 0.00 177.00 175.64 2qbn s LEU 404 N 2.27 2.43 0.05 -3.56 1.43 -0.03 -0.92 118.68 120.35 2qbn s LEU 404 Ca 0.57 -0.87 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 2qbn s LEU 404 Cb -0.26 -1.13 -0.03 0.00 0.03 0.00 0.00 46.19 44.80 2qbn s LEU 404 CO 0.22 0.10 -0.04 0.68 0.23 0.00 0.00 176.35 177.55 2qbn s VAL 405 N -1.71 0.29 0.04 -1.59 -7.23 -0.18 -1.68 120.40 108.33 2qbn s VAL 405 Ca 0.20 -1.51 -0.28 0.00 -1.81 0.00 0.00 61.98 58.59 2qbn s VAL 405 Cb -0.08 -1.10 0.09 0.00 0.56 0.00 0.00 36.38 35.85 2qbn s VAL 405 CO 0.09 -0.78 0.86 -1.66 -0.31 0.00 0.00 175.10 173.30 2qbn s TRP 406 N -2.95 -0.34 -0.39 2.82 -2.14 -0.13 -1.31 118.94 114.50 2qbn s TRP 406 Ca -0.00 0.17 -0.20 0.00 2.66 0.00 0.00 56.10 58.73 2qbn s TRP 406 Cb 0.01 0.56 0.01 0.00 -3.10 0.00 0.00 33.47 30.95 2qbn s TRP 406 CO -0.06 -0.62 0.59 0.34 -2.66 0.00 0.00 176.95 174.54 2qbn s ASP 407 N -2.58 6.34 0.46 -2.66 3.68 -1.26 -4.44 116.67 116.21 2qbn s ASP 407 Ca 0.06 -0.16 0.27 0.00 2.13 0.00 0.00 52.55 54.84 2qbn s ASP 407 Cb -0.01 -2.30 1.32 0.00 -1.45 0.00 0.00 42.92 40.47 2qbn s ASP 407 CO -0.08 -0.64 1.76 -0.65 0.13 0.00 0.00 175.17 175.69 2qbn h PRO 408 N 8.66 0.20 0.00 4.34 0.11 -1.89 0.30 132.00 143.72 2qbn h PRO 408 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2qbn h PRO 408 Cb 1.11 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2qbn h PRO 408 CO 0.84 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 178.76 2qbn h ALA 409 N 1.53 1.00 -0.14 -0.75 0.00 -1.94 -1.11 119.26 117.85 2qbn h ALA 409 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.54 2qbn h ALA 409 Cb 1.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2qbn h ALA 409 CO -0.21 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.29 2qbn n THR 410 N -2.42 0.15 -3.41 0.00 -2.24 0.10 -4.96 114.28 101.51 2qbn n THR 410 Ca -0.01 -0.54 -0.22 0.00 -2.27 0.00 0.00 64.05 61.02 2qbn n THR 410 Cb 0.10 1.20 -0.00 0.00 -2.10 0.00 0.00 70.33 69.52 2qbn n THR 410 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2qbn s THR 411 N -1.85 4.54 -0.13 4.28 -4.23 -0.42 -4.61 115.64 113.22 2qbn s THR 411 Ca 0.32 -0.73 -0.00 0.00 -1.18 0.00 0.00 61.69 60.10 2qbn s THR 411 Cb 0.21 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.45 2qbn s THR 411 CO 0.31 -0.34 -0.09 -0.54 -0.54 0.00 0.00 174.62 173.42 2qbn s LYS 412 N -4.28 1.67 -0.22 3.99 3.01 -0.50 -5.04 119.74 118.38 2qbn s LYS 412 Ca 0.42 -0.37 -0.22 0.00 -1.01 0.00 0.00 55.97 54.79 2qbn s LYS 412 Cb -0.10 -1.78 -0.02 0.00 -1.01 0.00 0.00 37.83 34.93 2qbn s LYS 412 CO 0.34 -0.29 0.70 0.00 0.51 0.00 0.00 175.35 176.61 2qbn s ALA 413 N 1.65 3.58 0.00 5.17 0.00 -1.26 -4.31 121.76 126.58 2qbn s ALA 413 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 51.77 2qbn s ALA 413 Cb -0.13 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2qbn s ALA 413 CO -0.09 -0.71 0.00 1.55 0.00 0.00 0.00 175.76 176.51