#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbi n GLN 3 N 0.00 -2.71 -0.50 0.38 7.27 -1.26 -4.75 117.38 115.81 2qbi n GLN 3 Ca 0.00 2.03 -0.29 0.00 0.07 0.00 0.00 57.00 58.81 2qbi n GLN 3 Cb 0.00 -3.23 0.24 0.00 2.41 0.00 0.00 30.24 29.66 2qbi n GLN 3 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2qbi n GLU 4 N -4.06 -2.52 0.00 3.69 -0.58 -1.26 -4.64 120.64 111.27 2qbi n GLU 4 Ca -0.03 -0.72 0.00 0.00 -0.42 0.00 0.00 57.16 55.99 2qbi n GLU 4 Cb 0.58 -1.99 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 2qbi n GLU 4 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2qbi n GLN 5 N -4.17 0.00 -1.21 3.49 1.13 0.15 -4.90 117.38 111.86 2qbi n GLN 5 Ca 0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 2qbi n GLN 5 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.92 2qbi n GLN 5 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2qbi n THR 6 N 0.00 -4.09 -3.69 5.09 -1.04 -1.26 -2.37 114.28 106.92 2qbi n THR 6 Ca 0.00 1.72 -0.37 0.00 -2.04 0.00 0.00 64.05 63.36 2qbi n THR 6 Cb 0.00 -2.59 -0.10 0.00 -1.82 0.00 0.00 70.33 65.81 2qbi n THR 6 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2qbi s MET 7 N -2.82 3.96 -0.10 -2.82 -1.94 -1.26 -2.28 119.30 112.04 2qbi s MET 7 Ca 0.00 -0.33 0.04 0.00 -1.71 0.00 0.00 55.69 53.70 2qbi s MET 7 Cb 0.00 -3.51 -0.00 0.00 2.01 0.00 0.00 34.83 33.33 2qbi s MET 7 CO 0.00 -0.04 -0.24 -0.51 -0.01 0.00 0.00 175.02 174.22 2qbi s LEU 8 N 1.31 2.08 1.12 -0.03 1.02 -0.67 -4.91 118.68 118.60 2qbi s LEU 8 Ca 0.07 -0.55 -0.13 0.00 0.02 0.00 0.00 54.13 53.54 2qbi s LEU 8 Cb -0.14 -1.40 0.26 0.00 0.02 0.00 0.00 46.19 44.92 2qbi s LEU 8 CO 0.06 0.16 1.05 0.20 0.02 0.00 0.00 176.35 177.84 2qbi s ASN 9 N 0.31 1.42 -0.30 2.29 0.01 -1.24 -3.39 114.94 114.05 2qbi s ASN 9 Ca -0.18 1.44 -0.07 0.00 -0.71 0.00 0.00 52.86 53.34 2qbi s ASN 9 Cb -0.18 -2.19 0.01 0.00 0.41 0.00 0.00 41.25 39.30 2qbi s ASN 9 CO 0.09 -3.92 0.10 -0.69 -1.51 0.00 0.00 177.10 171.17 2qbi s VAL 10 N -2.60 4.06 -2.00 1.60 1.01 -1.26 -1.22 120.40 120.00 2qbi s VAL 10 Ca 0.68 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2qbi s VAL 10 Cb -0.23 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.10 2qbi s VAL 10 CO 0.63 0.05 1.08 0.00 0.00 0.00 0.00 175.10 176.85 2qbi n ALA 11 N 4.88 2.51 -2.38 5.51 0.00 0.36 -4.80 120.51 126.59 2qbi n ALA 11 Ca -0.14 -0.03 -0.20 0.00 0.00 0.00 0.00 53.44 53.07 2qbi n ALA 11 Cb 0.48 -1.03 -0.10 0.00 0.00 0.00 0.00 19.45 18.80 2qbi n ALA 11 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2qbi s ASP 12 N -1.06 1.79 0.70 0.00 1.47 -1.26 0.22 116.67 118.53 2qbi s ASP 12 Ca 0.04 -1.48 -0.06 0.00 1.18 0.00 0.00 52.55 52.22 2qbi s ASP 12 Cb 0.02 0.24 0.07 0.00 -0.34 0.00 0.00 42.92 42.90 2qbi s ASP 12 CO 0.03 -0.79 1.01 0.54 0.68 0.00 0.00 175.17 176.64 2qbi s ASN 13 N -3.41 4.75 0.38 2.11 2.20 -1.19 -4.70 114.94 115.07 2qbi s ASN 13 Ca 0.35 0.37 0.00 0.00 -0.94 0.00 0.00 52.86 52.64 2qbi s ASN 13 Cb 0.06 -1.00 0.00 0.00 -2.00 0.00 0.00 41.25 38.31 2qbi s ASN 13 CO 0.15 -1.63 0.00 -1.54 -2.94 0.00 0.00 177.10 171.15 2qbi n SER 14 N -2.91 -6.63 -2.21 3.54 3.41 -1.26 -4.63 113.62 102.93 2qbi n SER 14 Ca 0.09 0.91 -0.16 0.00 -0.26 0.00 0.00 58.87 59.45 2qbi n SER 14 Cb 0.60 -3.25 -0.02 0.00 -0.26 0.00 0.00 64.21 61.28 2qbi n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qbi n GLY 15 N -0.84 -0.04 1.53 5.00 0.00 -1.23 -4.84 105.19 104.77 2qbi n GLY 15 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2qbi n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbi n ALA 16 N -1.46 -2.37 -1.36 4.61 0.00 -1.26 -4.09 120.51 114.58 2qbi n ALA 16 Ca -0.18 -0.69 0.04 0.00 0.00 0.00 0.00 53.44 52.61 2qbi n ALA 16 Cb 0.62 -0.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.98 2qbi n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qbi n ARG 17 N -3.44 -2.81 0.00 0.00 5.12 -1.26 -0.65 116.66 113.63 2qbi n ARG 17 Ca 0.06 2.22 0.00 0.00 -1.93 0.00 0.00 57.85 58.20 2qbi n ARG 17 Cb 0.27 -3.03 0.00 0.00 -1.16 0.00 0.00 32.46 28.53 2qbi n ARG 17 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2qbi n ARG 18 N -2.97 0.00 -3.72 5.56 1.74 -1.26 -3.96 116.66 112.05 2qbi n ARG 18 Ca -0.02 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.94 2qbi n ARG 18 Cb 0.40 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.74 2qbi n ARG 18 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2qbi s VAL 19 N 0.00 -0.01 -0.10 1.55 -7.23 -1.22 -0.60 120.40 112.80 2qbi s VAL 19 Ca 0.00 0.03 -0.06 0.00 -1.81 0.00 0.00 61.98 60.14 2qbi s VAL 19 Cb 0.00 -0.60 -0.04 0.00 0.56 0.00 0.00 36.38 36.30 2qbi s VAL 19 CO 0.00 0.01 0.14 -0.32 -0.31 0.00 0.00 175.10 174.62 2qbi s MET 20 N 0.64 3.40 0.15 4.82 1.75 -1.08 -1.67 119.30 127.30 2qbi s MET 20 Ca -0.03 -0.18 -0.25 0.00 -1.25 0.00 0.00 55.69 53.98 2qbi s MET 20 Cb -0.05 -3.14 -0.08 0.00 2.84 0.00 0.00 34.83 34.40 2qbi s MET 20 CO -0.04 0.76 0.77 0.00 -0.65 0.00 0.00 175.02 175.85 2qbi n ILE 22 N 1.73 0.60 -3.65 0.00 -5.35 0.71 -0.68 119.36 112.73 2qbi n ILE 22 Ca -0.06 -0.77 -0.01 0.00 -0.27 0.00 0.00 62.75 61.64 2qbi n ILE 22 Cb 0.49 0.72 -0.06 0.00 -1.74 0.00 0.00 39.64 39.05 2qbi n ILE 22 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2qbi s LYS 23 N -0.60 0.16 -0.75 6.28 2.47 -1.19 -4.83 119.74 121.29 2qbi s LYS 23 Ca 0.00 0.24 -0.16 0.00 -1.56 0.00 0.00 55.97 54.50 2qbi s LYS 23 Cb 0.00 0.05 0.17 0.00 -1.46 0.00 0.00 37.83 36.59 2qbi s LYS 23 CO 0.00 -0.03 0.75 0.08 0.16 0.00 0.00 175.35 176.31 2qbi s VAL 24 N 0.76 5.31 0.83 4.02 1.01 -1.26 -1.31 120.40 129.75 2qbi s VAL 24 Ca -0.03 -1.95 -0.11 0.00 0.00 0.00 0.00 61.98 59.88 2qbi s VAL 24 Cb -0.03 -4.48 0.09 0.00 0.00 0.00 0.00 36.38 31.95 2qbi s VAL 24 CO -0.12 -1.07 1.14 -0.76 0.00 0.00 0.00 175.10 174.29 2qbi s LEU 25 N 1.13 3.01 0.00 3.92 1.43 -1.22 -4.62 118.68 122.33 2qbi s LEU 25 Ca 0.16 2.10 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 2qbi s LEU 25 Cb -0.16 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.51 2qbi s LEU 25 CO -0.04 -2.56 0.00 0.61 0.23 0.00 0.00 176.35 174.58 2qbi n GLY 26 N -0.22 1.80 0.00 -3.19 0.00 -1.26 -4.83 105.19 97.49 2qbi n GLY 26 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2qbi n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbi n GLY 27 N 0.00 1.18 3.78 -0.02 0.00 -1.26 -4.93 105.19 103.93 2qbi n GLY 27 Ca 0.00 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.50 2qbi n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qbi s SER 28 N 0.00 7.40 0.00 1.61 0.15 -1.26 -3.78 113.70 117.82 2qbi s SER 28 Ca 0.00 1.84 0.00 0.00 0.70 0.00 0.00 55.95 58.49 2qbi s SER 28 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2qbi s SER 28 CO 0.00 0.00 0.00 1.41 1.20 0.00 0.00 173.24 175.85 2qbi n HIS 29 N 0.82 0.00 -1.44 3.44 8.25 -1.26 -4.84 115.22 120.19 2qbi n HIS 29 Ca 0.01 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 56.99 2qbi n HIS 29 Cb 0.49 -1.56 -0.09 0.00 1.12 0.00 0.00 29.99 29.96 2qbi n HIS 29 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2qbi n ARG 30 N -0.69 0.69 0.00 -0.41 0.63 -1.25 -4.86 116.66 110.77 2qbi n ARG 30 Ca 0.00 0.14 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 2qbi n ARG 30 Cb 0.17 -2.28 0.00 0.00 0.45 0.00 0.00 32.46 30.80 2qbi n ARG 30 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2qbi n ARG 31 N 8.29 0.00 -2.41 -0.14 5.12 -1.26 -4.74 116.66 121.52 2qbi n ARG 31 Ca 0.48 0.04 -0.09 0.00 -1.93 0.00 0.00 57.85 56.35 2qbi n ARG 31 Cb 0.20 -0.59 -0.01 0.00 -1.16 0.00 0.00 32.46 30.90 2qbi n ARG 31 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2qbi n TYR 32 N -0.13 -0.72 -3.66 -1.55 4.01 -1.26 -4.24 117.16 109.61 2qbi n TYR 32 Ca 0.00 -0.73 -0.07 0.00 -0.16 0.00 0.00 57.90 56.94 2qbi n TYR 32 Cb 0.00 -0.13 -0.08 0.00 -0.31 0.00 0.00 39.34 38.83 2qbi n TYR 32 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qbi s ALA 33 N -2.25 -1.60 0.00 -0.72 0.00 -1.26 -4.74 121.76 111.19 2qbi s ALA 33 Ca 0.07 2.03 0.00 0.00 0.00 0.00 0.00 51.96 54.06 2qbi s ALA 33 Cb -0.01 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.74 2qbi s ALA 33 CO 0.04 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2qbi n GLY 34 N 4.76 5.13 3.18 0.00 0.00 -1.26 -3.14 105.19 113.86 2qbi n GLY 34 Ca -0.17 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2qbi n GLY 34 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qbi n VAL 35 N 0.00 0.00 -2.85 1.61 0.24 -1.26 -1.93 118.33 114.14 2qbi n VAL 35 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.18 2qbi n VAL 35 Cb 0.00 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.40 2qbi n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qbi n GLY 36 N 0.00 0.90 3.82 7.63 0.00 -1.18 -3.67 105.19 112.69 2qbi n GLY 36 Ca 0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 2qbi n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qbi s ASP 37 N -1.57 5.31 -0.12 1.61 1.01 -0.81 -4.70 116.67 117.40 2qbi s ASP 37 Ca 0.31 -0.42 -0.16 0.00 0.71 0.00 0.00 52.55 52.99 2qbi s ASP 37 Cb 0.25 -1.12 -0.05 0.00 1.01 0.00 0.00 42.92 43.00 2qbi s ASP 37 CO -0.16 -0.20 0.38 -0.63 0.21 0.00 0.00 175.17 174.76 2qbi s ILE 38 N -2.24 5.22 -0.04 0.77 -1.09 -1.26 -1.10 121.20 121.45 2qbi s ILE 38 Ca 0.37 0.75 -0.05 0.00 -2.23 0.00 0.00 60.65 59.49 2qbi s ILE 38 Cb -0.06 -3.71 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 2qbi s ILE 38 CO 0.25 0.40 0.14 0.27 -1.23 0.00 0.00 174.94 174.77 2qbi s ILE 39 N 0.23 0.02 0.25 2.92 -0.00 -0.97 -3.46 121.20 120.20 2qbi s ILE 39 Ca 0.21 -0.15 -0.30 0.00 -0.00 0.00 0.00 60.65 60.42 2qbi s ILE 39 Cb -0.14 -0.25 -0.09 0.00 -0.00 0.00 0.00 42.46 41.98 2qbi s ILE 39 CO 0.08 -0.08 1.29 -0.75 -0.00 0.00 0.00 174.94 175.48 2qbi s LYS 40 N -0.22 4.41 0.05 0.37 2.47 -0.43 -2.26 119.74 124.13 2qbi s LYS 40 Ca -0.03 2.08 0.00 0.00 -1.56 0.00 0.00 55.97 56.46 2qbi s LYS 40 Cb -0.02 -3.15 -0.04 0.00 -1.46 0.00 0.00 37.83 33.16 2qbi s LYS 40 CO 0.00 -0.18 -0.04 -1.50 0.16 0.00 0.00 175.35 173.79 2qbi s ILE 41 N -0.46 0.34 -0.25 5.43 2.07 -0.87 -0.21 121.20 127.25 2qbi s ILE 41 Ca 0.53 -1.62 0.00 0.00 -1.41 0.00 0.00 60.65 58.15 2qbi s ILE 41 Cb -0.37 -1.26 0.07 0.00 0.13 0.00 0.00 42.46 41.03 2qbi s ILE 41 CO 0.43 -0.83 -0.00 -0.89 -1.91 0.00 0.00 174.94 171.74 2qbi s THR 42 N -3.20 1.31 -0.28 4.00 2.01 0.14 -2.07 115.64 117.55 2qbi s THR 42 Ca 0.03 -1.25 -0.37 0.00 0.31 0.00 0.00 61.69 60.40 2qbi s THR 42 Cb 0.03 -1.73 -0.13 0.00 0.01 0.00 0.00 72.50 70.68 2qbi s THR 42 CO -0.06 -0.27 1.95 -0.38 -0.69 0.00 0.00 174.62 175.16 2qbi n ILE 43 N 4.73 0.31 0.25 1.82 5.41 -0.28 -2.65 119.36 128.95 2qbi n ILE 43 Ca -0.08 -0.14 0.09 0.00 1.00 0.00 0.00 62.75 63.62 2qbi n ILE 43 Cb 0.44 -1.49 -0.12 0.00 -0.71 0.00 0.00 39.64 37.76 2qbi n ILE 43 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2qbi n LYS 44 N 6.74 0.79 0.00 0.38 4.76 -1.20 -2.09 118.16 127.54 2qbi n LYS 44 Ca 0.32 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 2qbi n LYS 44 Cb 0.19 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 2qbi n LYS 44 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2qbi n GLU 45 N -1.89 0.00 -1.60 1.97 -0.58 0.23 -4.95 120.64 113.83 2qbi n GLU 45 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2qbi n GLU 45 Cb 0.40 -0.07 0.00 0.00 -0.57 0.00 0.00 31.44 31.20 2qbi n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qbi n ALA 46 N -2.38 -1.96 -1.92 0.62 0.00 0.18 -4.61 120.51 110.45 2qbi n ALA 46 Ca 0.00 0.48 -0.30 0.00 0.00 0.00 0.00 53.44 53.63 2qbi n ALA 46 Cb 0.00 -1.47 0.04 0.00 0.00 0.00 0.00 19.45 18.03 2qbi n ALA 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2qbi s ILE 47 N -4.93 3.52 0.13 0.00 2.07 -1.26 -4.74 121.20 115.99 2qbi s ILE 47 Ca 0.00 0.40 -0.25 0.00 -1.41 0.00 0.00 60.65 59.39 2qbi s ILE 47 Cb 0.00 -3.48 -0.04 0.00 0.13 0.00 0.00 42.46 39.08 2qbi s ILE 47 CO 0.00 -0.61 1.63 1.55 -1.91 0.00 0.00 174.94 175.61 2qbi h PRO 48 N -0.57 -0.35 0.00 3.50 0.13 -1.99 -3.39 132.00 129.33 2qbi h PRO 48 Ca -0.45 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2qbi h PRO 48 Cb 1.25 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2qbi h PRO 48 CO 0.63 -0.24 0.00 0.54 -0.23 0.00 0.00 178.00 178.71 2qbi n ARG 49 N -5.37 0.00 0.00 0.86 1.74 -1.26 -5.00 116.66 107.63 2qbi n ARG 49 Ca -0.04 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2qbi n ARG 49 Cb 0.29 -0.37 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 2qbi n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qbi n GLY 50 N 2.01 0.81 0.00 -0.13 0.00 -1.26 -4.44 105.19 102.17 2qbi n GLY 50 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2qbi n GLY 50 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qbi n LYS 51 N 0.00 1.33 -3.39 1.61 4.81 -1.26 -4.94 118.16 116.32 2qbi n LYS 51 Ca 0.00 -0.19 -0.16 0.00 -0.87 0.00 0.00 58.31 57.09 2qbi n LYS 51 Cb 0.00 -0.62 -0.09 0.00 0.02 0.00 0.00 35.03 34.34 2qbi n LYS 51 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2qbi s VAL 52 N -0.24 -0.44 1.06 3.15 -7.23 -1.26 -4.97 120.40 110.47 2qbi s VAL 52 Ca 0.00 -0.43 -0.14 0.00 -1.81 0.00 0.00 61.98 59.60 2qbi s VAL 52 Cb 0.00 -0.97 0.22 0.00 0.56 0.00 0.00 36.38 36.19 2qbi s VAL 52 CO 0.00 -0.42 1.09 -1.59 -0.31 0.00 0.00 175.10 173.87 2qbi s LYS 53 N 2.39 -0.09 1.26 4.82 0.00 -1.26 -3.57 119.74 123.29 2qbi s LYS 53 Ca 0.09 0.38 -0.20 0.00 0.00 0.00 0.00 55.97 56.25 2qbi s LYS 53 Cb -0.14 -1.69 0.31 0.00 0.00 0.00 0.00 37.83 36.31 2qbi s LYS 53 CO -0.31 -3.05 0.69 0.36 0.00 0.00 0.00 175.35 173.04 2qbi n LYS 54 N -4.37 -3.70 -1.34 1.78 0.00 -1.26 -3.62 118.16 105.65 2qbi n LYS 54 Ca 0.07 -1.17 -0.13 0.00 -0.00 0.00 0.00 58.31 57.08 2qbi n LYS 54 Cb 0.58 -1.67 -0.05 0.00 -0.00 0.00 0.00 35.03 33.88 2qbi n LYS 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2qbi n GLY 55 N -4.20 1.21 3.87 2.58 0.00 -0.89 -4.95 105.19 102.81 2qbi n GLY 55 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 2qbi n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qbi s ASP 56 N -2.34 6.65 -0.34 1.61 1.01 -1.24 -4.92 116.67 117.11 2qbi s ASP 56 Ca 0.00 0.81 0.03 0.00 0.71 0.00 0.00 52.55 54.10 2qbi s ASP 56 Cb 0.00 -2.18 0.10 0.00 1.01 0.00 0.00 42.92 41.85 2qbi s ASP 56 CO 0.00 0.16 0.06 -0.69 0.21 0.00 0.00 175.17 174.91 2qbi s VAL 57 N -1.42 2.04 0.00 -1.27 1.01 -1.26 -1.12 120.40 118.39 2qbi s VAL 57 Ca 0.34 -2.21 0.00 0.00 0.00 0.00 0.00 61.98 60.11 2qbi s VAL 57 Cb -0.14 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.73 2qbi s VAL 57 CO 0.18 -0.62 0.00 0.00 0.00 0.00 0.00 175.10 174.66 2qbi n LEU 58 N 4.32 0.00 -3.79 3.92 -0.00 -0.88 -4.97 117.00 115.61 2qbi n LEU 58 Ca 0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.91 2qbi n LEU 58 Cb 0.42 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.72 2qbi n LEU 58 CO 0.20 0.00 -0.10 -1.59 -0.00 0.00 0.00 177.39 175.91 2qbi s LYS 59 N 3.37 0.28 0.29 1.47 -2.85 -1.26 -2.05 119.74 118.99 2qbi s LYS 59 Ca 0.00 0.34 0.04 0.00 -1.00 0.00 0.00 55.97 55.35 2qbi s LYS 59 Cb 0.00 0.14 -0.06 0.00 -2.06 0.00 0.00 37.83 35.85 2qbi s LYS 59 CO 0.00 -0.03 0.02 0.00 0.10 0.00 0.00 175.35 175.43 2qbi s ALA 60 N 0.13 2.20 -0.21 0.59 0.00 -0.96 -1.16 121.76 122.37 2qbi s ALA 60 Ca -0.00 -1.95 -0.06 0.00 0.00 0.00 0.00 51.96 49.95 2qbi s ALA 60 Cb -0.02 0.52 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 2qbi s ALA 60 CO 0.00 -0.25 0.03 0.14 0.00 0.00 0.00 175.76 175.69 2qbi s VAL 61 N -3.27 4.26 0.07 0.00 -7.23 0.15 -2.30 120.40 112.07 2qbi s VAL 61 Ca 0.33 -0.21 -0.31 0.00 -1.81 0.00 0.00 61.98 59.98 2qbi s VAL 61 Cb 0.07 -2.94 -0.08 0.00 0.56 0.00 0.00 36.38 33.99 2qbi s VAL 61 CO 0.13 0.42 1.54 -0.69 -0.31 0.00 0.00 175.10 176.18 2qbi s VAL 62 N 0.96 3.21 -0.07 1.32 1.01 -0.26 -0.93 120.40 125.65 2qbi s VAL 62 Ca 0.03 0.71 -0.04 0.00 0.00 0.00 0.00 61.98 62.68 2qbi s VAL 62 Cb -0.14 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2qbi s VAL 62 CO 0.02 0.01 -0.09 0.52 0.00 0.00 0.00 175.10 175.56 2qbi n VAL 63 N 4.52 0.48 -5.02 2.92 0.31 -0.81 -3.13 118.33 117.60 2qbi n VAL 63 Ca 0.14 -0.06 -0.29 0.00 -0.01 0.00 0.00 64.34 64.11 2qbi n VAL 63 Cb 0.41 -1.62 -0.17 0.00 -0.91 0.00 0.00 33.84 31.56 2qbi n VAL 63 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2qbi s ARG 64 N -2.14 2.48 0.02 5.55 3.00 -0.97 -4.56 118.95 122.33 2qbi s ARG 64 Ca -0.10 -0.73 0.04 0.00 0.00 0.00 0.00 55.73 54.93 2qbi s ARG 64 Cb 0.04 -1.96 -0.02 0.00 0.00 0.00 0.00 34.95 33.01 2qbi s ARG 64 CO 0.13 0.18 -0.12 0.95 0.00 0.00 0.00 175.30 176.44 2qbi s THR 65 N 0.30 0.96 0.33 0.02 -4.23 -1.26 -0.73 115.64 111.03 2qbi s THR 65 Ca -0.14 -0.82 0.10 0.00 -1.18 0.00 0.00 61.69 59.65 2qbi s THR 65 Cb -0.16 -0.86 0.07 0.00 1.34 0.00 0.00 72.50 72.89 2qbi s THR 65 CO 0.06 0.05 1.77 0.11 -0.54 0.00 0.00 174.62 176.06 2qbi h LYS 66 N 5.22 0.13 0.00 3.99 1.57 -1.84 -1.77 116.57 123.86 2qbi h LYS 66 Ca -0.36 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.36 2qbi h LYS 66 Cb 1.18 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.48 2qbi h LYS 66 CO 0.45 0.49 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.57 2qbi h LYS 67 N 0.11 0.00 0.00 3.15 3.11 -1.96 -3.42 116.57 117.56 2qbi h LYS 67 Ca 0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 2qbi h LYS 67 Cb 0.72 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.95 2qbi h LYS 67 CO 0.05 0.04 0.00 0.41 -2.81 0.00 0.00 179.45 177.15 2qbi n GLY 68 N -0.73 -1.67 3.30 5.01 0.00 -0.68 -4.87 105.19 105.55 2qbi n GLY 68 Ca -0.02 -1.33 -0.13 0.00 0.00 0.00 0.00 46.02 44.54 2qbi n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbi s VAL 69 N 0.00 0.01 0.06 1.61 1.01 -0.79 -4.74 120.40 117.56 2qbi s VAL 69 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.90 2qbi s VAL 69 Cb 0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2qbi s VAL 69 CO 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 175.10 175.01 2qbi s ARG 70 N -0.09 0.63 0.22 2.72 1.70 -1.26 -1.53 118.95 121.35 2qbi s ARG 70 Ca -0.03 -1.14 0.00 0.00 -0.47 0.00 0.00 55.73 54.09 2qbi s ARG 70 Cb -0.03 0.04 -0.04 0.00 -0.57 0.00 0.00 34.95 34.35 2qbi s ARG 70 CO 0.02 -0.06 0.15 1.03 -1.08 0.00 0.00 175.30 175.35 2qbi s ARG 71 N -3.41 1.30 0.00 3.89 1.81 -1.23 -5.01 118.95 116.30 2qbi s ARG 71 Ca 0.04 -1.70 0.00 0.00 -1.72 0.00 0.00 55.73 52.36 2qbi s ARG 71 Cb 0.04 0.23 0.00 0.00 -0.45 0.00 0.00 34.95 34.77 2qbi s ARG 71 CO -0.07 -0.42 0.00 -2.30 -0.68 0.00 0.00 175.30 171.83 2qbi n PRO 72 N -0.34 0.00 -0.06 3.54 -0.02 -1.26 0.74 135.00 137.61 2qbi n PRO 72 Ca 0.03 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.64 2qbi n PRO 72 Cb 0.66 0.00 0.20 0.00 -0.02 0.00 0.00 33.50 34.33 2qbi n PRO 72 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2qbi n ASP 73 N 0.00 0.00 0.00 2.55 5.75 -1.26 -4.65 116.55 118.94 2qbi n ASP 73 Ca 0.00 0.41 0.00 0.00 -0.01 0.00 0.00 54.79 55.19 2qbi n ASP 73 Cb 0.00 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 39.97 2qbi n ASP 73 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qbi n GLY 74 N -1.27 3.06 3.48 6.12 0.00 0.23 -5.04 105.19 111.77 2qbi n GLY 74 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2qbi n GLY 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qbi n SER 75 N 0.00 -0.41 -4.33 1.61 3.41 -1.26 -4.62 113.62 108.02 2qbi n SER 75 Ca 0.00 0.99 -0.18 0.00 -0.26 0.00 0.00 58.87 59.42 2qbi n SER 75 Cb 0.00 -1.14 -0.10 0.00 -0.26 0.00 0.00 64.21 62.71 2qbi n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qbi s VAL 76 N -1.34 1.61 -0.13 -3.33 1.01 -1.26 -3.53 120.40 113.42 2qbi s VAL 76 Ca 0.62 -2.17 -0.03 0.00 0.00 0.00 0.00 61.98 60.40 2qbi s VAL 76 Cb -0.65 -2.05 0.05 0.00 0.00 0.00 0.00 36.38 33.73 2qbi s VAL 76 CO 0.58 -0.59 0.06 0.27 0.00 0.00 0.00 175.10 175.42 2qbi s ILE 77 N -3.05 0.08 -0.11 2.22 -4.36 -0.58 -4.97 121.20 110.43 2qbi s ILE 77 Ca 0.22 -0.07 0.03 0.00 -0.26 0.00 0.00 60.65 60.58 2qbi s ILE 77 Cb 0.00 -0.56 0.01 0.00 1.25 0.00 0.00 42.46 43.16 2qbi s ILE 77 CO 0.06 -0.09 -0.20 0.00 0.24 0.00 0.00 174.94 174.94 2qbi s ARG 78 N 2.07 2.73 -0.42 0.37 1.70 -1.26 -1.88 118.95 122.27 2qbi s ARG 78 Ca 0.03 -0.76 -0.21 0.00 -0.47 0.00 0.00 55.73 54.31 2qbi s ARG 78 Cb -0.15 -2.16 0.02 0.00 -0.57 0.00 0.00 34.95 32.09 2qbi s ARG 78 CO -0.07 0.06 0.69 -0.06 -1.08 0.00 0.00 175.30 174.84 2qbi s PHE 79 N 0.63 3.07 -0.55 5.89 0.40 -1.11 -4.93 117.98 121.38 2qbi s PHE 79 Ca -0.13 0.14 -0.25 0.00 -0.60 0.00 0.00 56.93 56.10 2qbi s PHE 79 Cb -0.16 -3.39 -0.23 0.00 0.51 0.00 0.00 43.02 39.75 2qbi s PHE 79 CO 0.03 -0.83 1.83 -0.40 0.70 0.00 0.00 175.22 176.54 2qbi n ASP 80 N 6.35 2.05 0.00 1.36 5.75 -1.26 -3.15 116.55 127.65 2qbi n ASP 80 Ca -0.00 -2.62 0.00 0.00 -0.01 0.00 0.00 54.79 52.16 2qbi n ASP 80 Cb 0.48 -0.95 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 2qbi n ASP 80 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qbi n GLY 81 N 4.73 0.73 3.40 6.12 0.00 -1.26 -5.03 105.19 113.88 2qbi n GLY 81 Ca 0.49 0.50 -0.35 0.00 0.00 0.00 0.00 46.02 46.66 2qbi n GLY 81 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qbi n ASN 82 N 0.00 -2.01 -3.57 1.61 3.02 -1.26 -4.61 115.26 108.44 2qbi n ASN 82 Ca 0.00 0.44 -0.10 0.00 -0.03 0.00 0.00 54.58 54.89 2qbi n ASN 82 Cb 0.00 -1.17 -0.05 0.00 -0.61 0.00 0.00 39.78 37.95 2qbi n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qbi s ALA 83 N -2.14 -1.93 0.21 5.41 0.00 0.09 -3.60 121.76 119.82 2qbi s ALA 83 Ca 0.59 1.55 -0.15 0.00 0.00 0.00 0.00 51.96 53.95 2qbi s ALA 83 Cb -0.28 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2qbi s ALA 83 CO 0.64 -0.33 0.50 0.00 0.00 0.00 0.00 175.76 176.57 2qbi s VAL 85 N -3.93 1.11 1.00 0.00 1.01 -0.10 -0.49 120.40 119.00 2qbi s VAL 85 Ca 0.14 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2qbi s VAL 85 Cb -0.01 -1.17 0.19 0.00 0.00 0.00 0.00 36.38 35.40 2qbi s VAL 85 CO 0.02 0.30 1.08 -0.76 0.00 0.00 0.00 175.10 175.74 2qbi s LEU 86 N 1.66 1.83 -0.13 3.92 1.43 -1.26 0.34 118.68 126.47 2qbi s LEU 86 Ca 0.04 1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 54.46 2qbi s LEU 86 Cb -0.13 -3.84 0.11 0.00 0.03 0.00 0.00 46.19 42.36 2qbi s LEU 86 CO -0.08 -3.32 0.93 -1.48 0.23 0.00 0.00 176.35 172.62 2qbi s LEU 87 N -6.67 -0.43 0.11 1.79 2.34 -0.31 -3.44 118.68 112.09 2qbi s LEU 87 Ca 0.66 0.46 -0.24 0.00 0.06 0.00 0.00 54.13 55.06 2qbi s LEU 87 Cb -0.21 2.01 -0.14 0.00 -0.56 0.00 0.00 46.19 47.29 2qbi s LEU 87 CO 0.60 -0.41 0.52 -3.20 -1.06 0.00 0.00 176.35 172.80 2qbi n ASN 88 N 0.73 -0.72 0.00 1.48 4.05 -0.70 -4.13 115.26 115.98 2qbi n ASN 88 Ca -0.12 0.88 0.00 0.00 0.45 0.00 0.00 54.58 55.79 2qbi n ASN 88 Cb 0.58 -0.73 0.00 0.00 1.23 0.00 0.00 39.78 40.86 2qbi n ASN 88 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2qbi n ASN 89 N 1.45 0.00 0.00 1.20 4.05 -1.26 -2.72 115.26 117.98 2qbi n ASN 89 Ca 0.14 0.67 0.02 0.00 0.45 0.00 0.00 54.58 55.87 2qbi n ASN 89 Cb 0.16 -0.47 0.12 0.00 1.23 0.00 0.00 39.78 40.82 2qbi n ASN 89 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 2qbi n ASN 90 N -1.92 0.00 -2.69 1.20 6.94 -1.26 -3.73 115.26 113.80 2qbi n ASN 90 Ca 0.00 0.15 -0.02 0.00 -0.02 0.00 0.00 54.58 54.69 2qbi n ASN 90 Cb 0.00 -0.23 0.11 0.00 -2.36 0.00 0.00 39.78 37.30 2qbi n ASN 90 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2qbi n SER 91 N -1.23 -0.88 -0.01 0.53 7.64 -1.26 -5.16 113.62 113.25 2qbi n SER 91 Ca 0.02 -2.18 0.00 0.00 1.01 0.00 0.00 58.87 57.72 2qbi n SER 91 Cb 0.03 0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2qbi n SER 91 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qbi n GLU 92 N -1.37 0.00 -1.52 1.43 -0.58 -1.10 -4.89 120.64 112.61 2qbi n GLU 92 Ca -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 2qbi n GLU 92 Cb 0.86 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.73 2qbi n GLU 92 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2qbi n GLN 93 N -0.02 -4.35 -1.63 3.49 1.13 -1.26 -3.60 117.38 111.13 2qbi n GLN 93 Ca 0.00 3.22 -0.44 0.00 -1.94 0.00 0.00 57.00 57.84 2qbi n GLN 93 Cb 0.00 -3.61 -0.01 0.00 0.11 0.00 0.00 30.24 26.73 2qbi n GLN 93 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2qbi n PRO 94 N -0.62 1.61 0.06 -1.09 -0.04 -1.26 -1.72 135.00 131.94 2qbi n PRO 94 Ca 0.00 0.57 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 2qbi n PRO 94 Cb 0.00 -2.01 0.12 0.00 -0.04 0.00 0.00 33.50 31.57 2qbi n PRO 94 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 2qbi h ILE 95 N 2.17 0.00 -2.44 0.52 2.10 -1.88 -3.43 117.51 114.55 2qbi h ILE 95 Ca -0.42 -0.54 -0.45 0.00 1.08 0.00 0.00 64.86 64.53 2qbi h ILE 95 Cb 1.32 1.05 0.03 0.00 -1.09 0.00 0.00 36.82 38.13 2qbi h ILE 95 CO 0.61 0.00 -0.15 -0.83 -1.08 0.00 0.00 178.15 176.70 2qbi s GLY 96 N -3.73 1.63 -0.17 8.18 0.00 -1.26 -5.03 107.32 106.93 2qbi s GLY 96 Ca 0.05 -1.22 -0.14 0.00 0.00 0.00 0.00 44.72 43.42 2qbi s GLY 96 CO 0.75 -1.05 -0.16 -1.30 0.00 0.00 0.00 173.10 171.33 2qbi n THR 97 N -2.00 1.47 -3.84 0.90 -2.24 -1.26 -4.97 114.28 102.34 2qbi n THR 97 Ca 0.02 0.10 -0.33 0.00 -2.27 0.00 0.00 64.05 61.57 2qbi n THR 97 Cb 0.58 -2.27 -0.05 0.00 -2.10 0.00 0.00 70.33 66.49 2qbi n THR 97 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qbi s ARG 98 N -2.44 3.50 -0.14 -0.78 1.81 -1.26 -5.05 118.95 114.59 2qbi s ARG 98 Ca -0.23 -0.23 0.01 0.00 -1.72 0.00 0.00 55.73 53.56 2qbi s ARG 98 Cb 0.04 -3.07 -0.01 0.00 -0.45 0.00 0.00 34.95 31.47 2qbi s ARG 98 CO 0.36 0.64 -0.15 0.42 -0.68 0.00 0.00 175.30 175.89 2qbi s ILE 99 N -1.36 2.74 0.37 1.52 1.09 -1.26 -3.15 121.20 121.15 2qbi s ILE 99 Ca 0.29 -0.76 0.02 0.00 -1.10 0.00 0.00 60.65 59.10 2qbi s ILE 99 Cb -0.13 -2.14 -0.02 0.00 -1.06 0.00 0.00 42.46 39.11 2qbi s ILE 99 CO 0.19 0.52 0.56 -0.36 -0.10 0.00 0.00 174.94 175.75 2qbi s PHE 100 N 0.58 3.34 0.44 3.97 0.40 0.59 -4.70 117.98 122.59 2qbi s PHE 100 Ca -0.09 0.18 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 2qbi s PHE 100 Cb -0.16 -2.02 0.00 0.00 0.51 0.00 0.00 43.02 41.35 2qbi s PHE 100 CO 0.03 -0.04 0.00 0.41 0.70 0.00 0.00 175.22 176.33 2qbi n GLY 101 N -1.83 -3.60 3.77 4.36 0.00 -1.26 -4.72 105.19 101.90 2qbi n GLY 101 Ca -0.02 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 2qbi n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qbi s PRO 102 N -4.79 4.22 0.04 1.61 0.04 -1.26 -4.67 135.00 130.20 2qbi s PRO 102 Ca 0.00 1.94 0.01 0.00 0.04 0.00 0.00 61.00 62.98 2qbi s PRO 102 Cb 0.00 -2.86 0.01 0.00 0.04 0.00 0.00 34.50 31.68 2qbi s PRO 102 CO 0.00 -0.20 0.05 1.33 0.04 0.00 0.00 177.00 178.22 2qbi n VAL 103 N 0.44 0.00 -4.15 -0.36 0.24 -1.24 -4.85 118.33 108.41 2qbi n VAL 103 Ca 0.02 -0.16 -0.24 0.00 -2.04 0.00 0.00 64.34 61.93 2qbi n VAL 103 Cb 0.45 -0.78 -0.07 0.00 -1.47 0.00 0.00 33.84 31.97 2qbi n VAL 103 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2qbi s THR 104 N 0.37 2.80 -2.23 3.34 -4.23 -1.24 -4.17 115.64 110.28 2qbi s THR 104 Ca 0.04 -1.76 0.22 0.00 -1.18 0.00 0.00 61.69 59.01 2qbi s THR 104 Cb -0.00 -2.94 0.51 0.00 1.34 0.00 0.00 72.50 71.41 2qbi s THR 104 CO 0.02 -0.15 1.64 -2.11 -0.54 0.00 0.00 174.62 173.49 2qbi n ARG 105 N -1.12 1.52 0.10 3.99 0.00 -0.86 -3.68 116.66 116.61 2qbi n ARG 105 Ca -0.03 -0.78 -0.14 0.00 -0.00 0.00 0.00 57.85 56.90 2qbi n ARG 105 Cb 0.62 -1.39 -0.13 0.00 -0.00 0.00 0.00 32.46 31.57 2qbi n ARG 105 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2qbi h GLU 106 N 1.64 0.24 0.00 2.89 3.07 -1.96 -3.21 114.58 117.25 2qbi h GLU 106 Ca 0.00 -0.39 0.00 0.00 -0.50 0.00 0.00 59.36 58.47 2qbi h GLU 106 Cb 0.36 0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2qbi h GLU 106 CO 0.00 1.18 0.00 1.28 -1.40 0.00 0.00 179.01 180.07 2qbi n LEU 107 N -3.53 0.00 -0.64 1.33 4.32 -1.24 -3.93 117.00 113.31 2qbi n LEU 107 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 2qbi n LEU 107 Cb 0.99 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.79 2qbi n LEU 107 CO 0.53 0.00 0.17 -2.11 -1.22 0.00 0.00 177.39 174.76 2qbi n ARG 108 N -0.72 0.53 -2.56 3.23 -4.01 -1.22 -4.16 116.66 107.76 2qbi n ARG 108 Ca 0.08 0.00 -0.37 0.00 -1.04 0.00 0.00 57.85 56.53 2qbi n ARG 108 Cb 0.04 -1.26 -0.04 0.00 -3.04 0.00 0.00 32.46 28.16 2qbi n ARG 108 CO 0.00 0.00 0.00 -1.54 -3.04 0.00 0.00 177.63 173.05 2qbi s SER 109 N -0.04 6.87 0.00 2.89 1.04 -1.25 -4.86 113.70 118.35 2qbi s SER 109 Ca 0.00 2.04 0.00 0.00 0.48 0.00 0.00 55.95 58.47 2qbi s SER 109 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2qbi s SER 109 CO 0.00 -0.41 0.16 -0.62 0.98 0.00 0.00 173.24 173.35 2qbi n GLU 110 N 0.12 0.19 -0.02 4.02 4.71 -1.26 -1.63 120.64 126.77 2qbi n GLU 110 Ca 0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.18 2qbi n GLU 110 Cb 0.49 -1.03 -0.06 0.00 -1.01 0.00 0.00 31.44 29.83 2qbi n GLU 110 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 2qbi n LYS 111 N -0.23 1.75 0.00 3.49 0.00 -1.26 -4.62 118.16 117.29 2qbi n LYS 111 Ca 0.00 -0.03 0.04 0.00 -0.00 0.00 0.00 58.31 58.32 2qbi n LYS 111 Cb 0.01 -1.19 0.03 0.00 -0.00 0.00 0.00 35.03 33.88 2qbi n LYS 111 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2qbi n PHE 112 N -2.07 0.00 -0.20 5.58 0.99 -0.64 -4.80 117.46 116.31 2qbi n PHE 112 Ca -0.08 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.34 2qbi n PHE 112 Cb 0.53 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.99 2qbi n PHE 112 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.76 175.43 2qbi n MET 113 N 0.34 -0.17 -0.26 -1.08 2.81 -0.65 -0.06 117.12 118.04 2qbi n MET 113 Ca 0.04 0.77 0.24 0.00 -1.81 0.00 0.00 57.70 56.95 2qbi n MET 113 Cb 0.18 -1.14 0.45 0.00 -0.71 0.00 0.00 33.22 32.01 2qbi n MET 113 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 2qbi n LYS 114 N -4.68 -0.05 0.02 0.03 3.00 -1.26 -1.37 118.16 113.84 2qbi n LYS 114 Ca 0.03 1.12 -0.10 0.00 -0.00 0.00 0.00 58.31 59.36 2qbi n LYS 114 Cb 0.16 -1.99 -0.07 0.00 0.00 0.00 0.00 35.03 33.14 2qbi n LYS 114 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.40 178.37 2qbi h ILE 115 N 0.00 0.86 -0.13 3.15 2.10 -0.86 -3.29 117.51 119.34 2qbi h ILE 115 Ca 0.66 -1.31 0.04 0.00 1.08 0.00 0.00 64.86 65.33 2qbi h ILE 115 Cb 1.73 1.51 -0.01 0.00 -1.09 0.00 0.00 36.82 38.97 2qbi h ILE 115 CO -0.63 0.25 0.15 0.16 -1.08 0.00 0.00 178.15 177.00 2qbi h ILE 116 N -0.91 0.46 0.00 2.19 -0.00 -1.29 -1.73 117.51 116.22 2qbi h ILE 116 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.84 2qbi h ILE 116 Cb 0.52 0.88 0.00 0.00 -0.00 0.00 0.00 36.82 38.22 2qbi h ILE 116 CO 0.03 0.00 0.00 -1.54 -0.00 0.00 0.00 178.15 176.64 2qbi n SER 117 N -3.78 1.19 -4.30 2.16 3.41 -0.55 -4.74 113.62 107.01 2qbi n SER 117 Ca 0.00 -1.34 -0.32 0.00 -0.26 0.00 0.00 58.87 56.95 2qbi n SER 117 Cb 0.26 -0.34 -0.16 0.00 -0.26 0.00 0.00 64.21 63.71 2qbi n SER 117 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qbi s LEU 118 N 0.00 2.30 0.00 1.04 1.02 -0.65 -5.06 118.68 117.33 2qbi s LEU 118 Ca 0.00 -0.45 0.00 0.00 0.02 0.00 0.00 54.13 53.70 2qbi s LEU 118 Cb 0.00 -1.46 0.00 0.00 0.02 0.00 0.00 46.19 44.75 2qbi s LEU 118 CO 0.00 0.20 0.00 0.00 0.02 0.00 0.00 176.35 176.57 2qbi n ALA 119 N 3.23 0.00 0.00 4.21 0.00 -1.26 -4.41 120.51 122.28 2qbi n ALA 119 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2qbi n ALA 119 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2qbi n ALA 119 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qbi n PRO 120 N -0.31 0.00 -1.38 0.00 -0.02 -1.26 -4.96 135.00 127.08 2qbi n PRO 120 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2qbi n PRO 120 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2qbi n PRO 120 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qbi n GLU 121 N 0.00 0.00 0.00 -0.52 1.02 -1.26 -4.91 120.64 114.97 2qbi n GLU 121 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2qbi n GLU 121 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2qbi n GLU 121 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59