#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbf n LYS 13 N 0.00 4.21 -2.39 2.89 5.02 -1.26 -5.12 118.16 121.50 2qbf n LYS 13 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 2qbf n LYS 13 Cb 0.00 -0.62 -0.02 0.00 -0.02 0.00 0.00 35.03 34.37 2qbf n LYS 13 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2qbf n GLN 14 N -0.41 -4.86 -0.05 1.97 1.13 -1.16 -5.01 117.38 109.00 2qbf n GLN 14 Ca 0.00 3.58 -0.05 0.00 -1.94 0.00 0.00 57.00 58.59 2qbf n GLN 14 Cb 0.01 -4.73 -0.06 0.00 0.11 0.00 0.00 30.24 25.57 2qbf n GLN 14 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2qbf n VAL 15 N 1.74 0.59 0.00 5.09 0.31 -0.83 -5.00 118.33 120.23 2qbf n VAL 15 Ca -0.14 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 2qbf n VAL 15 Cb 0.22 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 2qbf n VAL 15 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2qbf n SER 16 N -2.47 0.00 -3.21 4.52 7.64 -0.73 -4.77 113.62 114.60 2qbf n SER 16 Ca -0.15 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.77 2qbf n SER 16 Cb 0.75 -0.42 -0.02 0.00 -1.01 0.00 0.00 64.21 63.51 2qbf n SER 16 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2qbf s ASP 17 N -1.26 -0.62 0.00 6.43 -4.77 -1.25 0.16 116.67 115.36 2qbf s ASP 17 Ca 0.00 0.50 0.00 0.00 -3.30 0.00 0.00 52.55 49.75 2qbf s ASP 17 Cb 0.00 1.56 0.00 0.00 -1.09 0.00 0.00 42.92 43.39 2qbf s ASP 17 CO 0.00 -0.12 0.00 0.61 0.70 0.00 0.00 175.17 176.36 2qbf n GLY 18 N 5.32 5.38 3.06 2.12 0.00 -1.06 -4.41 105.19 115.60 2qbf n GLY 18 Ca -0.07 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.64 2qbf n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbf s VAL 19 N 3.10 0.17 -0.19 1.61 -7.23 0.32 -1.79 120.40 116.39 2qbf s VAL 19 Ca 0.00 -1.41 0.01 0.00 -1.81 0.00 0.00 61.98 58.77 2qbf s VAL 19 Cb 0.00 -1.01 0.04 0.00 0.56 0.00 0.00 36.38 35.97 2qbf s VAL 19 CO 0.00 -0.78 -0.10 0.00 -0.31 0.00 0.00 175.10 173.91 2qbf s ALA 20 N -2.92 1.92 0.06 1.32 0.00 0.51 -0.95 121.76 121.70 2qbf s ALA 20 Ca -0.02 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 50.71 2qbf s ALA 20 Cb 0.01 -1.23 -0.06 0.00 0.00 0.00 0.00 23.12 21.84 2qbf s ALA 20 CO -0.06 -0.76 0.40 -1.01 0.00 0.00 0.00 175.76 174.32 2qbf s HIS 21 N 1.44 3.61 -0.17 0.00 3.76 -0.99 -0.31 115.29 122.62 2qbf s HIS 21 Ca -0.00 0.82 -0.01 0.00 -0.15 0.00 0.00 55.06 55.72 2qbf s HIS 21 Cb -0.16 -2.18 0.05 0.00 1.11 0.00 0.00 32.58 31.40 2qbf s HIS 21 CO -0.08 0.54 -0.03 0.42 -0.85 0.00 0.00 174.74 174.74 2qbf s ILE 22 N -1.34 0.93 -1.22 0.60 1.01 -0.35 -1.65 121.20 119.19 2qbf s ILE 22 Ca 0.31 -0.59 -0.13 0.00 0.00 0.00 0.00 60.65 60.25 2qbf s ILE 22 Cb -0.14 -1.19 0.17 0.00 0.01 0.00 0.00 42.46 41.31 2qbf s ILE 22 CO 0.17 0.04 1.49 1.57 0.00 0.00 0.00 174.94 178.21 2qbf n HIS 23 N 4.93 4.68 -1.84 3.97 -0.00 -0.41 -2.82 115.22 123.73 2qbf n HIS 23 Ca -0.11 -3.29 -0.40 0.00 0.46 0.00 0.00 57.72 54.39 2qbf n HIS 23 Cb 0.47 -2.14 -0.03 0.00 -0.12 0.00 0.00 29.99 28.18 2qbf n HIS 23 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2qbf n ALA 24 N 5.28 3.70 -2.27 1.57 0.00 -0.92 -3.38 120.51 124.48 2qbf n ALA 24 Ca 0.37 -3.54 -0.39 0.00 0.00 0.00 0.00 53.44 49.88 2qbf n ALA 24 Cb 0.42 -3.57 -0.06 0.00 0.00 0.00 0.00 19.45 16.24 2qbf n ALA 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qbf s SER 25 N 4.61 7.11 0.56 0.00 1.04 -0.36 -2.67 113.70 123.98 2qbf s SER 25 Ca 0.56 1.31 0.11 0.00 0.48 0.00 0.00 55.95 58.41 2qbf s SER 25 Cb 0.09 -2.39 0.59 0.00 0.10 0.00 0.00 66.02 64.41 2qbf s SER 25 CO 0.05 0.22 1.28 -0.26 0.98 0.00 0.00 173.24 175.52 2qbf h PHE 26 N 4.76 0.00 0.00 5.02 0.04 -1.92 -1.89 116.94 122.94 2qbf h PHE 26 Ca -0.48 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.09 2qbf h PHE 26 Cb 1.21 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.32 2qbf h PHE 26 CO 0.67 0.00 -1.74 0.09 -0.60 0.00 0.00 178.31 176.73 2qbf n ASN 27 N -2.44 2.94 -4.03 2.17 3.02 -1.26 -4.88 115.26 110.78 2qbf n ASN 27 Ca -0.01 -0.06 -0.08 0.00 -0.03 0.00 0.00 54.58 54.40 2qbf n ASN 27 Cb 0.68 -0.12 -0.09 0.00 -0.61 0.00 0.00 39.78 39.63 2qbf n ASN 27 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2qbf s ASN 28 N -5.18 0.31 -0.05 6.41 3.04 -0.71 -3.80 114.94 114.95 2qbf s ASN 28 Ca -0.17 -0.94 -0.00 0.00 0.04 0.00 0.00 52.86 51.80 2qbf s ASN 28 Cb 0.04 0.28 0.03 0.00 -1.54 0.00 0.00 41.25 40.06 2qbf s ASN 28 CO 0.31 -0.69 -0.02 -0.89 -3.04 0.00 0.00 177.10 172.78 2qbf s THR 29 N -3.93 0.41 -0.02 -5.21 2.01 -1.26 -1.22 115.64 106.42 2qbf s THR 29 Ca 0.11 0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.16 2qbf s THR 29 Cb 0.07 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 2qbf s THR 29 CO -0.07 0.23 -0.15 0.27 -0.69 0.00 0.00 174.62 174.21 2qbf s ILE 30 N 1.36 1.22 -0.12 1.82 -4.36 -1.22 -0.18 121.20 119.72 2qbf s ILE 30 Ca -0.04 -0.64 0.00 0.00 -0.26 0.00 0.00 60.65 59.71 2qbf s ILE 30 Cb -0.13 -1.02 -0.01 0.00 1.25 0.00 0.00 42.46 42.54 2qbf s ILE 30 CO -0.02 0.35 -0.14 0.68 0.24 0.00 0.00 174.94 176.04 2qbf s VAL 31 N -0.23 2.97 -0.27 8.37 -7.23 0.12 -1.28 120.40 122.85 2qbf s VAL 31 Ca 0.03 -0.69 0.01 0.00 -1.81 0.00 0.00 61.98 59.52 2qbf s VAL 31 Cb -0.07 -2.23 0.07 0.00 0.56 0.00 0.00 36.38 34.71 2qbf s VAL 31 CO 0.00 0.53 -0.01 -0.89 -0.31 0.00 0.00 175.10 174.42 2qbf s THR 32 N 0.28 1.63 -0.05 5.32 2.01 -0.66 -0.16 115.64 124.01 2qbf s THR 32 Ca -0.10 -1.51 -0.28 0.00 0.31 0.00 0.00 61.69 60.11 2qbf s THR 32 Cb -0.16 -1.99 -0.03 0.00 0.01 0.00 0.00 72.50 70.33 2qbf s THR 32 CO 0.06 -0.29 0.90 -0.63 -0.69 0.00 0.00 174.62 173.97 2qbf s ILE 33 N 1.31 4.90 0.02 1.82 -1.09 0.78 -2.35 121.20 126.58 2qbf s ILE 33 Ca -0.00 1.87 -0.16 0.00 -2.23 0.00 0.00 60.65 60.13 2qbf s ILE 33 Cb -0.19 -4.23 0.03 0.00 -1.58 0.00 0.00 42.46 36.49 2qbf s ILE 33 CO -0.09 0.14 0.35 0.28 -1.23 0.00 0.00 174.94 174.38 2qbf s THR 34 N 1.27 0.07 1.17 2.92 -1.32 -0.13 0.12 115.64 119.74 2qbf s THR 34 Ca 0.46 -0.54 -0.13 0.00 -1.21 0.00 0.00 61.69 60.27 2qbf s THR 34 Cb -0.19 -0.85 0.29 0.00 -1.51 0.00 0.00 72.50 70.23 2qbf s THR 34 CO 0.22 -0.30 1.03 1.51 -2.21 0.00 0.00 174.62 174.87 2qbf s ASP 35 N -1.81 0.92 0.00 8.08 1.47 -1.18 0.12 116.67 124.27 2qbf s ASP 35 Ca -0.08 1.53 0.02 0.00 1.18 0.00 0.00 52.55 55.20 2qbf s ASP 35 Cb -0.02 -2.31 0.09 0.00 -0.34 0.00 0.00 42.92 40.34 2qbf s ASP 35 CO -0.00 -4.24 0.78 0.54 0.68 0.00 0.00 175.17 172.93 2qbf n ARG 36 N -4.94 0.03 -0.01 2.11 1.74 -1.26 -1.91 116.66 112.41 2qbf n ARG 36 Ca 0.03 0.19 -0.21 0.00 -0.77 0.00 0.00 57.85 57.10 2qbf n ARG 36 Cb 0.54 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.35 2qbf n ARG 36 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2qbf h GLN 37 N 0.00 0.19 0.00 5.56 1.08 -1.97 -3.49 115.11 116.49 2qbf h GLN 37 Ca 0.00 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 56.87 2qbf h GLN 37 Cb 0.01 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2qbf h GLN 37 CO 0.00 1.16 0.00 0.41 -0.95 0.00 0.00 178.83 179.45 2qbf n GLY 38 N 1.68 1.28 3.59 3.46 0.00 -0.81 -5.09 105.19 109.31 2qbf n GLY 38 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 2qbf n GLY 38 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qbf s ASN 39 N -0.43 5.30 0.31 1.61 0.01 -1.26 -4.81 114.94 115.67 2qbf s ASN 39 Ca 0.00 1.77 -0.29 0.00 -0.71 0.00 0.00 52.86 53.63 2qbf s ASN 39 Cb 0.00 -2.51 -0.12 0.00 0.41 0.00 0.00 41.25 39.03 2qbf s ASN 39 CO 0.00 -2.10 1.42 0.00 -1.51 0.00 0.00 177.10 174.90 2qbf n ALA 40 N 12.35 1.70 -0.04 0.60 0.00 -1.26 -3.10 120.51 130.75 2qbf n ALA 40 Ca 0.31 0.37 -0.02 0.00 0.00 0.00 0.00 53.44 54.10 2qbf n ALA 40 Cb 0.46 -2.33 -0.10 0.00 0.00 0.00 0.00 19.45 17.48 2qbf n ALA 40 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qbf n LEU 41 N 1.35 0.00 0.00 0.00 4.77 0.12 -4.94 117.00 118.31 2qbf n LEU 41 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2qbf n LEU 41 Cb 0.35 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 2qbf n LEU 41 CO 0.63 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 2qbf n GLY 42 N 2.03 1.23 3.39 -0.72 0.00 -0.89 -4.79 105.19 105.43 2qbf n GLY 42 Ca -0.15 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 2qbf n GLY 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2qbf s TRP 43 N -2.00 0.66 0.10 1.61 1.48 -1.26 -0.16 118.94 119.37 2qbf s TRP 43 Ca 0.00 -0.97 -0.13 0.00 -1.06 0.00 0.00 56.10 53.94 2qbf s TRP 43 Cb 0.00 -0.14 0.02 0.00 -1.16 0.00 0.00 33.47 32.19 2qbf s TRP 43 CO 0.00 -0.80 0.30 0.00 -4.06 0.00 0.00 176.95 172.39 2qbf s ALA 44 N -4.06 -0.59 -0.10 2.67 0.00 0.77 -4.74 121.76 115.71 2qbf s ALA 44 Ca 0.27 -0.29 -0.10 0.00 0.00 0.00 0.00 51.96 51.85 2qbf s ALA 44 Cb 0.03 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.73 2qbf s ALA 44 CO 0.08 -0.55 0.27 -0.08 0.00 0.00 0.00 175.76 175.48 2qbf s THR 45 N -3.66 0.00 0.21 0.00 -1.32 -1.26 0.13 115.64 109.74 2qbf s THR 45 Ca 0.03 -0.02 -0.09 0.00 -1.21 0.00 0.00 61.69 60.40 2qbf s THR 45 Cb 0.03 -0.39 0.15 0.00 -1.51 0.00 0.00 72.50 70.78 2qbf s THR 45 CO -0.10 -0.01 1.76 0.00 -2.21 0.00 0.00 174.62 174.06 2qbf h ALA 46 N 5.67 0.85 -0.89 11.08 0.00 -0.83 0.11 119.26 135.26 2qbf h ALA 46 Ca -0.26 0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.80 2qbf h ALA 46 Cb 1.19 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 2qbf h ALA 46 CO 0.34 -0.13 0.57 0.78 0.00 0.00 0.00 179.25 180.81 2qbf h GLY 47 N 0.48 1.28 1.66 0.00 0.00 -1.80 -1.85 103.07 102.84 2qbf h GLY 47 Ca 0.32 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.15 2qbf h GLY 47 CO -0.28 0.24 -0.80 -1.33 0.00 0.00 0.00 176.54 174.37 2qbf h GLY 48 N 0.93 0.00 -1.15 4.60 0.00 -1.55 -3.33 103.07 102.57 2qbf h GLY 48 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 2qbf h GLY 48 CO -0.16 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.82 2qbf n SER 49 N -3.11 0.52 0.00 0.19 7.64 0.28 -4.87 113.62 114.27 2qbf n SER 49 Ca -0.02 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 59.06 2qbf n SER 49 Cb 0.76 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2qbf n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qbf n GLY 50 N 0.37 1.32 3.34 0.23 0.00 -1.25 -4.98 105.19 104.22 2qbf n GLY 50 Ca 0.00 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 2qbf n GLY 50 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qbf n PHE 51 N 0.00 -1.76 -4.42 1.61 1.16 -1.26 -4.94 117.46 107.85 2qbf n PHE 51 Ca 0.00 0.56 -0.21 0.00 -1.87 0.00 0.00 57.45 55.94 2qbf n PHE 51 Cb 0.00 -1.82 -0.10 0.00 -1.61 0.00 0.00 39.48 35.94 2qbf n PHE 51 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 2qbf s ARG 52 N -1.25 1.55 0.00 3.97 1.81 -1.26 -4.16 118.95 119.60 2qbf s ARG 52 Ca 0.61 -1.82 0.00 0.00 -1.72 0.00 0.00 55.73 52.80 2qbf s ARG 52 Cb -0.58 -0.94 0.00 0.00 -0.45 0.00 0.00 34.95 32.99 2qbf s ARG 52 CO 0.61 -0.08 0.00 0.41 -0.68 0.00 0.00 175.30 175.56 2qbf n GLY 53 N -0.59 1.81 0.19 -3.53 0.00 -1.26 -0.68 105.19 101.13 2qbf n GLY 53 Ca -0.04 0.54 0.08 0.00 0.00 0.00 0.00 46.02 46.60 2qbf n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qbf h SER 54 N 0.00 0.00 0.00 1.61 4.64 -1.97 -1.95 113.55 115.88 2qbf h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qbf h SER 54 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qbf h SER 54 CO 0.00 0.00 -0.80 -1.14 -0.87 0.00 0.00 176.83 174.02 2qbf n ARG 55 N -2.17 2.08 0.03 4.77 0.00 0.15 -4.63 116.66 116.88 2qbf n ARG 55 Ca -0.01 -0.02 0.13 0.00 -0.00 0.00 0.00 57.85 57.95 2qbf n ARG 55 Cb 0.31 -0.92 0.32 0.00 0.00 0.00 0.00 32.46 32.17 2qbf n ARG 55 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 2qbf n LYS 56 N -1.42 0.11 -1.16 -0.14 2.85 -0.75 -3.89 118.16 113.77 2qbf n LYS 56 Ca -0.00 0.05 -0.19 0.00 -1.05 0.00 0.00 58.31 57.11 2qbf n LYS 56 Cb 0.07 -1.59 0.21 0.00 -0.65 0.00 0.00 35.03 33.07 2qbf n LYS 56 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2qbf n SER 57 N -1.76 4.02 -4.81 -5.58 2.88 -1.13 -4.63 113.62 102.62 2qbf n SER 57 Ca 0.05 -3.48 -0.22 0.00 -1.33 0.00 0.00 58.87 53.90 2qbf n SER 57 Cb 0.38 -0.81 -0.04 0.00 -0.75 0.00 0.00 64.21 62.98 2qbf n SER 57 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2qbf s THR 58 N -3.16 3.74 0.35 2.46 -4.23 -1.25 -4.70 115.64 108.85 2qbf s THR 58 Ca 0.55 -1.46 0.03 0.00 -1.18 0.00 0.00 61.69 59.63 2qbf s THR 58 Cb 0.46 -3.20 0.25 0.00 1.34 0.00 0.00 72.50 71.35 2qbf s THR 58 CO 0.11 -0.24 1.99 1.55 -0.54 0.00 0.00 174.62 177.49 2qbf h PRO 59 N 1.41 0.77 -0.90 3.99 0.13 -1.93 -2.10 132.00 133.39 2qbf h PRO 59 Ca -0.46 -0.06 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2qbf h PRO 59 Cb 1.25 -0.16 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 2qbf h PRO 59 CO 0.60 0.55 0.59 0.35 -0.23 0.00 0.00 178.00 179.85 2qbf h PHE 60 N 0.79 1.13 -0.54 1.56 -0.00 -1.95 -3.03 116.94 114.90 2qbf h PHE 60 Ca 0.21 0.02 0.09 0.00 -0.00 0.00 0.00 57.97 58.28 2qbf h PHE 60 Cb -0.03 -0.38 -0.10 0.00 -0.00 0.00 0.00 35.95 35.44 2qbf h PHE 60 CO 0.00 0.72 -0.42 0.00 -0.00 0.00 0.00 178.31 178.61 2qbf h ALA 61 N 1.32 -0.31 -0.66 2.41 0.00 -1.65 0.45 119.26 120.82 2qbf h ALA 61 Ca 0.33 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.42 2qbf h ALA 61 Cb -0.13 0.92 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2qbf h ALA 61 CO -0.07 -0.82 0.44 0.00 0.00 0.00 0.00 179.25 178.80 2qbf h ALA 62 N 0.62 1.81 0.40 0.00 0.00 -1.60 -2.10 119.26 118.39 2qbf h ALA 62 Ca 0.18 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2qbf h ALA 62 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qbf h ALA 62 CO -0.66 0.07 -0.29 0.37 0.00 0.00 0.00 179.25 178.74 2qbf h GLN 63 N 0.62 -0.64 -0.07 0.00 4.15 -0.90 0.81 115.11 119.08 2qbf h GLN 63 Ca 0.29 0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.77 2qbf h GLN 63 Cb 0.34 0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 2qbf h GLN 63 CO -0.09 -0.42 0.13 -0.24 -1.93 0.00 0.00 178.83 176.27 2qbf h VAL 64 N -0.66 0.28 0.03 2.39 3.04 -1.33 -1.00 116.25 119.00 2qbf h VAL 64 Ca -0.05 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2qbf h VAL 64 Cb 0.55 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 30.72 2qbf h VAL 64 CO 0.02 0.00 -0.01 0.00 -1.01 0.00 0.00 177.57 176.57 2qbf h ALA 65 N 1.81 -0.04 -0.36 3.17 0.00 -0.68 -2.91 119.26 120.25 2qbf h ALA 65 Ca 0.03 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2qbf h ALA 65 Cb 0.28 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 2qbf h ALA 65 CO -0.00 -0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.23 2qbf h ALA 66 N -0.71 0.35 -0.11 0.00 0.00 0.10 0.72 119.26 119.61 2qbf h ALA 66 Ca -0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2qbf h ALA 66 Cb 0.31 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2qbf h ALA 66 CO 0.01 -0.38 0.03 1.05 0.00 0.00 0.00 179.25 179.96 2qbf h GLU 67 N 0.13 0.15 0.00 0.00 4.11 -1.35 -0.70 114.58 116.92 2qbf h GLU 67 Ca 0.18 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 59.48 2qbf h GLU 67 Cb 0.23 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2qbf h GLU 67 CO -0.28 0.14 -0.53 -0.09 0.07 0.00 0.00 179.01 178.33 2qbf h ARG 68 N 0.16 0.00 0.00 1.06 2.43 -0.78 -2.97 114.38 114.28 2qbf h ARG 68 Ca 0.04 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 2qbf h ARG 68 Cb 0.05 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 2qbf h ARG 68 CO -0.00 0.53 -0.36 0.00 -1.51 0.00 0.00 179.97 178.62 2qbf h ALA 70 N 1.64 0.07 0.00 0.00 0.00 -1.34 -2.72 119.26 116.91 2qbf h ALA 70 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2qbf h ALA 70 Cb 0.84 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2qbf h ALA 70 CO 0.05 0.18 0.00 -3.47 0.00 0.00 0.00 179.25 176.00 2qbf n ASP 71 N -4.42 0.00 -0.01 0.00 4.64 -1.17 0.11 116.55 115.70 2qbf n ASP 71 Ca -0.10 -0.21 -0.02 0.00 -1.38 0.00 0.00 54.79 53.09 2qbf n ASP 71 Cb 0.54 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.61 2qbf n ASP 71 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2qbf n ALA 72 N -0.71 1.94 -0.04 -1.67 0.00 -1.17 -4.80 120.51 114.06 2qbf n ALA 72 Ca 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 53.44 53.30 2qbf n ALA 72 Cb 0.01 0.28 -0.11 0.00 0.00 0.00 0.00 19.45 19.63 2qbf n ALA 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2qbf n VAL 73 N -2.27 0.51 0.25 0.00 0.24 -0.44 -4.38 118.33 112.24 2qbf n VAL 73 Ca -0.05 -0.47 0.17 0.00 -2.04 0.00 0.00 64.34 61.95 2qbf n VAL 73 Cb 0.57 -0.27 0.78 0.00 -1.47 0.00 0.00 33.84 33.46 2qbf n VAL 73 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2qbf h LYS 74 N 0.00 0.00 0.00 7.34 1.57 0.52 1.00 116.57 127.00 2qbf h LYS 74 Ca -0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2qbf h LYS 74 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 2qbf h LYS 74 CO 0.01 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.28 2qbf n GLU 75 N -3.17 0.51 -0.09 3.15 -0.58 -1.26 -1.64 120.64 117.56 2qbf n GLU 75 Ca 0.01 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.86 2qbf n GLU 75 Cb 0.47 -1.21 0.14 0.00 -0.57 0.00 0.00 31.44 30.28 2qbf n GLU 75 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qbf n TYR 76 N -0.71 0.22 -2.85 -0.32 4.02 0.35 -2.96 117.16 114.91 2qbf n TYR 76 Ca 0.05 -0.12 -0.11 0.00 -0.01 0.00 0.00 57.90 57.72 2qbf n TYR 76 Cb 0.02 -0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.37 2qbf n TYR 76 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qbf n GLY 77 N 1.33 0.23 3.78 2.72 0.00 -0.65 -1.98 105.19 110.62 2qbf n GLY 77 Ca 0.16 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2qbf n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbf s ILE 78 N -3.02 4.03 0.08 -0.61 -1.09 -1.26 -1.78 121.20 117.55 2qbf s ILE 78 Ca 0.22 1.67 0.00 0.00 -2.23 0.00 0.00 60.65 60.30 2qbf s ILE 78 Cb -0.10 -3.92 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 2qbf s ILE 78 CO 0.27 0.12 0.00 0.29 -1.23 0.00 0.00 174.94 174.39 2qbf n LYS 79 N 0.43 0.00 -4.27 2.79 4.76 0.43 -4.83 118.16 117.46 2qbf n LYS 79 Ca 0.03 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.21 2qbf n LYS 79 Cb 0.50 -0.48 -0.08 0.00 -1.84 0.00 0.00 35.03 33.13 2qbf n LYS 79 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2qbf s ASN 80 N -5.68 4.27 -0.30 4.39 -0.87 0.10 0.07 114.94 116.93 2qbf s ASN 80 Ca 0.00 -1.09 -0.19 0.00 -1.57 0.00 0.00 52.86 50.01 2qbf s ASN 80 Cb 0.00 -0.49 0.19 0.00 -0.02 0.00 0.00 41.25 40.92 2qbf s ASN 80 CO 0.00 -0.43 1.22 -1.48 -2.57 0.00 0.00 177.10 173.83 2qbf s LEU 81 N -3.82 -0.19 0.77 0.60 2.34 -0.98 -2.56 118.68 114.85 2qbf s LEU 81 Ca 0.38 0.31 -0.12 0.00 0.06 0.00 0.00 54.13 54.77 2qbf s LEU 81 Cb 0.04 1.30 0.05 0.00 -0.56 0.00 0.00 46.19 47.02 2qbf s LEU 81 CO 0.21 -0.05 1.14 -1.61 -1.06 0.00 0.00 176.35 174.98 2qbf s GLU 82 N 0.83 2.31 -0.08 1.48 2.02 -0.74 -3.68 118.70 120.84 2qbf s GLU 82 Ca -0.04 0.29 0.04 0.00 0.02 0.00 0.00 54.97 55.28 2qbf s GLU 82 Cb -0.03 -1.97 -0.00 0.00 0.10 0.00 0.00 34.13 32.22 2qbf s GLU 82 CO -0.12 -1.39 -0.21 0.08 0.02 0.00 0.00 175.26 173.64 2qbf s VAL 83 N -3.45 1.80 -0.40 2.63 1.01 0.25 -0.36 120.40 121.87 2qbf s VAL 83 Ca 0.60 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2qbf s VAL 83 Cb -0.11 -1.56 0.11 0.00 0.00 0.00 0.00 36.38 34.82 2qbf s VAL 83 CO 0.51 0.50 0.15 -0.04 0.00 0.00 0.00 175.10 176.22 2qbf s MET 84 N 0.24 1.79 -0.16 2.72 -1.94 0.57 -1.96 119.30 120.56 2qbf s MET 84 Ca -0.13 -1.97 -0.09 0.00 -1.71 0.00 0.00 55.69 51.79 2qbf s MET 84 Cb -0.16 -3.39 -0.05 0.00 2.01 0.00 0.00 34.83 33.24 2qbf s MET 84 CO 0.06 -1.02 0.16 0.08 -0.01 0.00 0.00 175.02 174.29 2qbf s VAL 85 N 0.81 5.43 -0.11 -6.03 1.01 -1.00 -1.21 120.40 119.30 2qbf s VAL 85 Ca 0.11 0.25 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 2qbf s VAL 85 Cb -0.21 -3.47 0.04 0.00 0.00 0.00 0.00 36.38 32.75 2qbf s VAL 85 CO -0.06 0.51 0.26 -1.59 0.00 0.00 0.00 175.10 174.22 2qbf s LYS 86 N -0.20 0.24 0.00 2.72 -2.85 -1.13 0.99 119.74 119.51 2qbf s LYS 86 Ca 0.12 0.51 0.00 0.00 -1.00 0.00 0.00 55.97 55.60 2qbf s LYS 86 Cb -0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 37.83 35.60 2qbf s LYS 86 CO 0.01 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.74 2qbf n GLY 87 N 3.94 1.77 0.00 0.59 0.00 -1.26 -2.17 105.19 108.06 2qbf n GLY 87 Ca -0.22 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.08 2qbf n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbf n PRO 88 N 1.70 1.36 -1.21 1.61 -0.04 -1.09 -4.59 135.00 132.74 2qbf n PRO 88 Ca 0.00 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.61 2qbf n PRO 88 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 2qbf n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qbf n GLY 89 N 5.00 -1.84 3.40 0.55 0.00 -1.26 -4.36 105.19 106.68 2qbf n GLY 89 Ca 0.00 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 2qbf n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbf n PRO 90 N -3.67 -3.74 -1.01 1.61 -0.04 -1.26 -3.66 135.00 123.24 2qbf n PRO 90 Ca -0.02 -1.66 -0.00 0.00 -0.04 0.00 0.00 63.50 61.78 2qbf n PRO 90 Cb 0.64 -1.73 -0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2qbf n PRO 90 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qbf n GLY 91 N -5.12 0.10 0.17 0.55 0.00 -1.26 -4.74 105.19 94.89 2qbf n GLY 91 Ca 0.15 -0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 2qbf n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qbf h ARG 92 N 0.15 0.58 0.00 1.61 2.43 -1.81 -3.28 114.38 114.06 2qbf h ARG 92 Ca -0.01 -0.65 -0.25 0.00 -0.81 0.00 0.00 59.98 58.26 2qbf h ARG 92 Cb 0.86 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.55 2qbf h ARG 92 CO 0.01 1.26 -1.94 0.39 -1.51 0.00 0.00 179.97 178.18 2qbf n GLU 93 N -3.98 0.66 -0.19 0.20 1.02 -1.26 -4.61 120.64 112.48 2qbf n GLU 93 Ca -0.11 0.08 -0.02 0.00 -0.02 0.00 0.00 57.16 57.09 2qbf n GLU 93 Cb 0.83 -1.33 0.05 0.00 -0.02 0.00 0.00 31.44 30.96 2qbf n GLU 93 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qbf h SER 94 N 0.00 -0.60 -0.46 1.62 0.87 -1.89 -1.86 113.55 111.22 2qbf h SER 94 Ca -0.37 0.18 0.09 0.00 -1.23 0.00 0.00 61.79 60.46 2qbf h SER 94 Cb 1.62 0.38 -0.08 0.00 -0.44 0.00 0.00 62.40 63.88 2qbf h SER 94 CO -0.04 -0.21 -0.03 0.00 -0.53 0.00 0.00 176.83 176.02 2qbf h THR 95 N -0.03 0.61 0.29 2.23 1.03 -1.82 -2.61 112.91 112.62 2qbf h THR 95 Ca 0.27 -0.03 0.00 0.00 -0.01 0.00 0.00 66.41 66.65 2qbf h THR 95 Cb 0.44 0.52 -0.02 0.00 -1.07 0.00 0.00 68.15 68.02 2qbf h THR 95 CO -0.60 0.01 -0.31 0.40 -0.01 0.00 0.00 175.52 175.01 2qbf h ILE 96 N 0.08 0.35 -0.28 0.00 2.04 -1.60 -1.77 117.51 116.33 2qbf h ILE 96 Ca 0.23 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.13 2qbf h ILE 96 Cb 0.34 0.35 -0.06 0.00 -0.74 0.00 0.00 36.82 36.71 2qbf h ILE 96 CO -0.41 0.00 -0.46 0.03 0.00 0.00 0.00 178.15 177.31 2qbf h ARG 97 N -0.64 -0.35 -0.88 2.37 2.47 -1.18 -0.18 114.38 116.00 2qbf h ARG 97 Ca -0.01 0.02 0.17 0.00 -1.26 0.00 0.00 59.98 58.90 2qbf h ARG 97 Cb 0.59 0.08 -0.10 0.00 -1.65 0.00 0.00 29.97 28.89 2qbf h ARG 97 CO -0.07 -0.24 0.45 0.00 0.56 0.00 0.00 179.97 180.67 2qbf h ALA 98 N -0.33 1.36 0.52 0.04 0.00 -1.43 0.47 119.26 119.89 2qbf h ALA 98 Ca 0.05 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2qbf h ALA 98 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2qbf h ALA 98 CO -0.46 -0.14 -0.51 1.25 0.00 0.00 0.00 179.25 179.39 2qbf h LEU 99 N 0.59 -1.41 -0.71 0.00 5.85 -0.17 -1.50 115.31 117.96 2qbf h LEU 99 Ca 0.50 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 59.33 2qbf h LEU 99 Cb 0.77 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2qbf h LEU 99 CO -0.40 -0.68 0.44 -1.13 -0.34 0.00 0.00 178.44 176.33 2qbf h ASN 100 N -1.03 0.84 0.05 1.25 -0.73 -0.35 -1.38 115.58 114.23 2qbf h ASN 100 Ca -0.07 -0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.05 2qbf h ASN 100 Cb 0.89 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 39.27 2qbf h ASN 100 CO -0.06 0.65 0.00 0.00 -0.37 0.00 0.00 177.43 177.65 2qbf n ALA 101 N -2.32 1.06 1.12 1.57 0.00 0.16 -0.82 120.51 121.29 2qbf n ALA 101 Ca 0.06 0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.62 2qbf n ALA 101 Cb 0.05 -1.10 0.24 0.00 0.00 0.00 0.00 19.45 18.63 2qbf n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbf n ALA 102 N -1.58 2.48 0.00 0.00 0.00 -0.52 -4.87 120.51 116.02 2qbf n ALA 102 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2qbf n ALA 102 Cb 0.02 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2qbf n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbf n GLY 103 N 1.03 3.14 3.68 0.00 0.00 0.00 -5.02 105.19 108.02 2qbf n GLY 103 Ca 0.12 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.62 2qbf n GLY 103 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qbf n PHE 104 N -2.00 2.16 -2.24 1.61 3.72 -1.21 -4.84 117.46 114.67 2qbf n PHE 104 Ca 0.00 0.25 -0.33 0.00 -0.05 0.00 0.00 57.45 57.33 2qbf n PHE 104 Cb 0.00 -2.57 -0.04 0.00 -0.94 0.00 0.00 39.48 35.93 2qbf n PHE 104 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2qbf s ARG 105 N 4.03 2.93 0.95 -1.08 6.06 0.11 -4.56 118.95 127.39 2qbf s ARG 105 Ca 0.97 -0.53 -0.11 0.00 -2.50 0.00 0.00 55.73 53.56 2qbf s ARG 105 Cb -0.87 -5.11 0.16 0.00 0.06 0.00 0.00 34.95 29.19 2qbf s ARG 105 CO 0.58 -2.91 1.11 -1.50 -2.50 0.00 0.00 175.30 170.08 2qbf s ILE 106 N 8.17 2.26 0.30 4.11 2.07 -1.26 -2.31 121.20 134.54 2qbf s ILE 106 Ca 0.61 0.08 0.00 0.00 -1.41 0.00 0.00 60.65 59.93 2qbf s ILE 106 Cb -0.05 -2.21 0.00 0.00 0.13 0.00 0.00 42.46 40.33 2qbf s ILE 106 CO -0.03 -0.11 0.00 0.35 -1.91 0.00 0.00 174.94 173.24 2qbf n THR 107 N -4.26 0.00 -4.90 4.00 -2.24 -1.24 -4.80 114.28 100.83 2qbf n THR 107 Ca 0.09 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.59 2qbf n THR 107 Cb 0.53 -0.28 -0.17 0.00 -2.10 0.00 0.00 70.33 68.31 2qbf n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2qbf s ASN 108 N -3.88 2.40 -0.29 3.42 -0.87 -1.26 -5.04 114.94 109.41 2qbf s ASN 108 Ca 0.00 -0.42 0.03 0.00 -1.57 0.00 0.00 52.86 50.90 2qbf s ASN 108 Cb 0.00 -1.03 0.08 0.00 -0.02 0.00 0.00 41.25 40.28 2qbf s ASN 108 CO 0.00 0.11 -0.02 -0.63 -2.57 0.00 0.00 177.10 173.98 2qbf s ILE 109 N 0.42 2.08 -0.04 0.60 1.01 -1.26 0.84 121.20 124.84 2qbf s ILE 109 Ca -0.15 -1.89 0.05 0.00 0.00 0.00 0.00 60.65 58.66 2qbf s ILE 109 Cb -0.16 -2.37 -0.01 0.00 0.01 0.00 0.00 42.46 39.93 2qbf s ILE 109 CO 0.06 -0.32 -0.19 0.42 0.00 0.00 0.00 174.94 174.91 2qbf s THR 110 N 1.07 1.53 -0.21 2.92 -4.23 -0.83 -5.00 115.64 110.90 2qbf s THR 110 Ca 0.01 -0.78 -0.26 0.00 -1.18 0.00 0.00 61.69 59.48 2qbf s THR 110 Cb -0.19 -1.31 -0.00 0.00 1.34 0.00 0.00 72.50 72.33 2qbf s THR 110 CO -0.07 0.44 0.89 -0.62 -0.54 0.00 0.00 174.62 174.71 2qbf s ASP 111 N -0.04 6.96 -0.15 3.99 2.15 -1.26 -2.38 116.67 125.94 2qbf s ASP 111 Ca -0.03 1.19 0.16 0.00 0.43 0.00 0.00 52.55 54.30 2qbf s ASP 111 Cb -0.11 -2.47 0.52 0.00 -0.30 0.00 0.00 42.92 40.55 2qbf s ASP 111 CO 0.02 -0.51 1.42 1.33 -0.17 0.00 0.00 175.17 177.26 2qbf n VAL 112 N 5.06 2.12 -1.65 1.11 0.24 0.28 -4.94 118.33 120.55 2qbf n VAL 112 Ca 0.07 -1.71 -0.47 0.00 -2.04 0.00 0.00 64.34 60.19 2qbf n VAL 112 Cb 0.48 -0.14 -0.04 0.00 -1.47 0.00 0.00 33.84 32.67 2qbf n VAL 112 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2qbf n THR 113 N -0.25 0.04 -2.07 3.34 -1.04 -1.19 -4.81 114.28 108.30 2qbf n THR 113 Ca 0.20 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.78 2qbf n THR 113 Cb 0.84 -1.40 -0.03 0.00 -1.82 0.00 0.00 70.33 67.93 2qbf n THR 113 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2qbf s PRO 114 N 0.77 4.27 -0.35 -2.82 0.04 -1.26 -4.94 135.00 130.71 2qbf s PRO 114 Ca 0.79 2.18 0.00 0.00 0.04 0.00 0.00 61.00 64.01 2qbf s PRO 114 Cb -0.73 -3.34 0.14 0.00 0.04 0.00 0.00 34.50 30.61 2qbf s PRO 114 CO 0.40 -0.56 0.24 0.96 0.04 0.00 0.00 177.00 178.08 2qbf s ILE 115 N 1.61 0.00 0.25 0.56 -5.25 -1.26 -5.03 121.20 112.08 2qbf s ILE 115 Ca 0.68 -1.43 -0.30 0.00 -0.99 0.00 0.00 60.65 58.61 2qbf s ILE 115 Cb -0.38 -1.01 -0.09 0.00 2.95 0.00 0.00 42.46 43.93 2qbf s ILE 115 CO 0.30 -0.87 1.30 -2.16 -1.79 0.00 0.00 174.94 171.72 2qbf s PRO 116 N 1.29 4.40 -0.12 0.37 0.04 -1.26 -4.89 135.00 134.82 2qbf s PRO 116 Ca 0.17 2.10 -0.06 0.00 0.04 0.00 0.00 61.00 63.25 2qbf s PRO 116 Cb -0.20 -3.15 -0.23 0.00 0.04 0.00 0.00 34.50 30.96 2qbf s PRO 116 CO -0.05 -0.20 3.25 0.72 0.04 0.00 0.00 177.00 180.77 2qbf n HIS 117 N 1.88 0.18 -1.79 0.56 8.25 -1.26 -4.55 115.22 118.48 2qbf n HIS 117 Ca 0.03 -1.46 -0.01 0.00 -0.26 0.00 0.00 57.72 56.02 2qbf n HIS 117 Cb 0.42 -1.54 0.00 0.00 1.12 0.00 0.00 29.99 30.00 2qbf n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2qbf n ASN 118 N 2.65 -3.37 0.00 0.41 5.03 -1.26 -5.10 115.26 113.63 2qbf n ASN 118 Ca 0.41 0.21 0.00 0.00 0.87 0.00 0.00 54.58 56.07 2qbf n ASN 118 Cb 0.77 -2.00 0.00 0.00 -1.02 0.00 0.00 39.78 37.53 2qbf n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qbf n GLY 119 N -0.20 1.47 3.61 7.41 0.00 -1.26 -5.11 105.19 111.11 2qbf n GLY 119 Ca 0.02 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2qbf n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbf s ARG 121 N -4.54 3.51 0.64 0.00 3.52 -1.26 -5.07 118.95 115.75 2qbf s ARG 121 Ca 0.67 -0.44 -0.18 0.00 -0.13 0.00 0.00 55.73 55.64 2qbf s ARG 121 Cb -0.23 -3.83 -0.02 0.00 -1.56 0.00 0.00 34.95 29.31 2qbf s ARG 121 CO 0.60 -0.58 1.28 -0.35 -0.81 0.00 0.00 175.30 175.44 2qbf n PRO 122 N 5.44 1.15 -2.37 5.12 -0.04 -1.26 -4.96 135.00 138.09 2qbf n PRO 122 Ca -0.09 0.45 -0.40 0.00 -0.04 0.00 0.00 63.50 63.43 2qbf n PRO 122 Cb 0.49 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.40 2qbf n PRO 122 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2qbf s PRO 123 N -3.29 4.44 0.00 0.54 0.04 -1.26 -4.99 135.00 130.48 2qbf s PRO 123 Ca 0.81 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.74 2qbf s PRO 123 Cb -0.39 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2qbf s PRO 123 CO 0.41 0.01 0.87 1.63 0.04 0.00 0.00 177.00 179.96 2qbf n LYS 124 N 0.82 0.00 -0.45 4.56 5.02 -1.26 -4.93 118.16 121.92 2qbf n LYS 124 Ca 0.00 0.51 0.06 0.00 -2.02 0.00 0.00 58.31 56.87 2qbf n LYS 124 Cb 0.45 -1.37 -0.02 0.00 -0.02 0.00 0.00 35.03 34.07 2qbf n LYS 124 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qbf n LYS 125 N -1.85 -0.92 -0.02 1.97 5.02 -1.26 -4.92 118.16 116.18 2qbf n LYS 125 Ca 0.00 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 2qbf n LYS 125 Cb 0.00 -1.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 2qbf n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbf n ARG 126 N -2.19 -0.00 -2.97 1.97 5.12 -1.26 -4.97 116.66 112.36 2qbf n ARG 126 Ca 0.00 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.78 2qbf n ARG 126 Cb 0.21 -0.01 -0.01 0.00 -1.16 0.00 0.00 32.46 31.49 2qbf n ARG 126 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2qbf n ARG 127 N 1.50 0.63 0.00 5.56 0.00 -1.26 -5.27 116.66 117.82 2qbf n ARG 127 Ca 0.00 -2.42 0.00 0.00 -0.00 0.00 0.00 57.85 55.43 2qbf n ARG 127 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 32.46 31.04 2qbf n ARG 127 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96