#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbi s GLU 2 N 0.00 2.84 -0.22 2.12 0.41 -1.26 0.13 118.70 122.71 2qbi s GLU 2 Ca 0.00 -0.81 0.01 0.00 -0.41 0.00 0.00 54.97 53.76 2qbi s GLU 2 Cb 0.00 -2.16 0.03 0.00 -1.78 0.00 0.00 34.13 30.22 2qbi s GLU 2 CO 0.00 0.16 -0.13 -0.51 -0.49 0.00 0.00 175.26 174.29 2qbi s LEU 3 N 0.37 2.80 0.06 1.80 2.01 -1.26 -4.88 118.68 119.59 2qbi s LEU 3 Ca -0.18 -0.92 -0.30 0.00 0.01 0.00 0.00 54.13 52.74 2qbi s LEU 3 Cb -0.18 -1.55 -0.09 0.00 0.01 0.00 0.00 46.19 44.38 2qbi s LEU 3 CO 0.08 -0.09 1.87 -0.69 1.01 0.00 0.00 176.35 178.53 2qbi s VAL 4 N 1.25 2.92 0.00 -1.59 1.01 -1.26 -1.38 120.40 121.35 2qbi s VAL 4 Ca -0.00 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2qbi s VAL 4 Cb -0.16 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2qbi s VAL 4 CO -0.08 -0.01 0.81 0.18 0.00 0.00 0.00 175.10 176.00 2qbi n LEU 5 N 6.77 2.31 0.00 3.92 4.77 -1.25 -4.72 117.00 128.79 2qbi n LEU 5 Ca 0.19 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2qbi n LEU 5 Cb 0.40 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2qbi n LEU 5 CO 0.66 0.41 0.00 1.17 -1.33 0.00 0.00 177.39 178.30 2qbi n LYS 6 N 0.95 0.00 -0.25 3.23 4.81 -1.24 -2.14 118.16 123.53 2qbi n LYS 6 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.38 2qbi n LYS 6 Cb 0.32 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.31 2qbi n LYS 6 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2qbi n ASP 7 N 3.12 -0.62 -0.23 3.14 3.85 -1.26 -0.62 116.55 123.93 2qbi n ASP 7 Ca 0.00 1.44 0.18 0.00 -0.71 0.00 0.00 54.79 55.70 2qbi n ASP 7 Cb 0.00 -0.33 0.51 0.00 -1.35 0.00 0.00 41.12 39.95 2qbi n ASP 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2qbi h ALA 8 N -0.10 2.19 -4.37 2.12 0.00 -1.84 -3.45 119.26 113.81 2qbi h ALA 8 Ca 0.09 0.02 -0.41 0.00 0.00 0.00 0.00 54.91 54.61 2qbi h ALA 8 Cb 0.24 -0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.05 2qbi h ALA 8 CO -0.55 -0.46 -0.60 0.94 0.00 0.00 0.00 179.25 178.57 2qbi n GLN 9 N -4.51 -4.56 -0.62 0.00 -0.06 0.21 -4.87 117.38 102.97 2qbi n GLN 9 Ca 0.19 0.91 0.09 0.00 -2.00 0.00 0.00 57.00 56.19 2qbi n GLN 9 Cb 0.67 -5.75 0.36 0.00 -4.06 0.00 0.00 30.24 21.46 2qbi n GLN 9 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2qbi n SER 10 N -2.47 4.76 -0.73 1.69 7.64 -1.26 -4.80 113.62 118.44 2qbi n SER 10 Ca -0.12 -2.45 0.00 0.00 1.01 0.00 0.00 58.87 57.30 2qbi n SER 10 Cb 0.63 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 2qbi n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qbi n ALA 11 N 1.12 0.00 0.01 -0.43 0.00 -1.26 -4.81 120.51 115.14 2qbi n ALA 11 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2qbi n ALA 11 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.34 2qbi n ALA 11 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2qbi n LEU 12 N 0.00 -0.08 -2.29 0.00 -0.00 -0.48 -3.86 117.00 110.29 2qbi n LEU 12 Ca 0.00 0.02 -0.04 0.00 -0.00 0.00 0.00 56.01 55.99 2qbi n LEU 12 Cb 0.00 0.36 0.01 0.00 -0.00 0.00 0.00 43.42 43.79 2qbi n LEU 12 CO 0.00 -0.49 -0.02 0.41 -0.00 0.00 0.00 177.39 177.30 2qbi n THR 13 N -2.53 -7.49 -3.83 1.96 -1.04 -1.24 -4.89 114.28 95.22 2qbi n THR 13 Ca 0.00 0.61 -0.10 0.00 -2.04 0.00 0.00 64.05 62.52 2qbi n THR 13 Cb 0.00 -5.93 -0.01 0.00 -1.82 0.00 0.00 70.33 62.57 2qbi n THR 13 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2qbi n VAL 14 N -0.27 0.00 -2.77 12.58 0.24 0.12 -4.95 118.33 123.28 2qbi n VAL 14 Ca 0.06 -0.84 -0.42 0.00 -2.04 0.00 0.00 64.34 61.10 2qbi n VAL 14 Cb 0.23 -0.18 -0.03 0.00 -1.47 0.00 0.00 33.84 32.40 2qbi n VAL 14 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2qbi s SER 15 N -2.15 6.98 0.00 -1.34 0.15 -1.26 -2.23 113.70 113.84 2qbi s SER 15 Ca 0.08 1.22 0.13 0.00 0.70 0.00 0.00 55.95 58.08 2qbi s SER 15 Cb -0.01 -2.49 0.62 0.00 -1.71 0.00 0.00 66.02 62.43 2qbi s SER 15 CO 0.05 -0.60 1.34 1.21 1.20 0.00 0.00 173.24 176.45 2qbi n GLU 16 N 6.16 0.14 -0.02 5.44 2.13 -1.26 -1.55 120.64 131.68 2qbi n GLU 16 Ca 0.09 0.19 -0.03 0.00 0.66 0.00 0.00 57.16 58.07 2qbi n GLU 16 Cb 0.47 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.55 2qbi n GLU 16 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 2qbi n THR 17 N -1.34 1.22 0.40 6.31 -1.04 -1.26 -0.89 114.28 117.68 2qbi n THR 17 Ca 0.05 -0.74 0.10 0.00 -2.04 0.00 0.00 64.05 61.43 2qbi n THR 17 Cb 0.11 -0.67 0.16 0.00 -1.82 0.00 0.00 70.33 68.11 2qbi n THR 17 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2qbi n THR 18 N -2.83 0.38 -1.14 12.58 -2.24 -0.71 -3.95 114.28 116.37 2qbi n THR 18 Ca -0.16 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 2qbi n THR 18 Cb 0.94 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 70.24 2qbi n THR 18 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2qbi n PHE 19 N 1.21 0.00 -0.03 4.78 3.72 -0.59 -4.53 117.46 122.01 2qbi n PHE 19 Ca 0.15 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.52 2qbi n PHE 19 Cb 0.53 0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 39.03 2qbi n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qbi n GLY 20 N 0.00 -0.32 1.97 1.37 0.00 -0.06 -4.52 105.19 103.63 2qbi n GLY 20 Ca 0.00 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 2qbi n GLY 20 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qbi n ARG 21 N -2.26 0.00 -2.12 1.61 3.00 -1.16 -4.90 116.66 110.83 2qbi n ARG 21 Ca -0.11 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.44 2qbi n ARG 21 Cb 0.71 -0.58 -0.00 0.00 0.00 0.00 0.00 32.46 32.59 2qbi n ARG 21 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2qbi s ASP 22 N -0.58 6.31 0.33 6.15 1.47 -1.26 -4.55 116.67 124.54 2qbi s ASP 22 Ca 0.37 1.36 -0.29 0.00 1.18 0.00 0.00 52.55 55.17 2qbi s ASP 22 Cb -0.54 -2.44 -0.10 0.00 -0.34 0.00 0.00 42.92 39.50 2qbi s ASP 22 CO 0.33 -0.76 1.38 0.12 0.68 0.00 0.00 175.17 176.92 2qbi s PHE 23 N -2.98 2.93 -0.48 2.11 5.36 -1.26 -4.69 117.98 118.96 2qbi s PHE 23 Ca 0.54 1.28 0.08 0.00 -0.96 0.00 0.00 56.93 57.88 2qbi s PHE 23 Cb -0.11 -3.79 0.35 0.00 -0.34 0.00 0.00 43.02 39.14 2qbi s PHE 23 CO 0.48 -2.29 0.88 -1.71 -1.46 0.00 0.00 175.22 171.12 2qbi n ASN 24 N 1.00 3.08 -0.07 6.13 4.05 -1.26 -5.00 115.26 123.20 2qbi n ASN 24 Ca 0.01 -3.41 -0.02 0.00 0.45 0.00 0.00 54.58 51.62 2qbi n ASN 24 Cb 0.41 -0.57 -0.02 0.00 1.23 0.00 0.00 39.78 40.83 2qbi n ASN 24 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 2qbi n GLU 25 N -0.07 -0.07 -0.18 1.20 2.13 -1.26 -0.05 120.64 122.34 2qbi n GLU 25 Ca 0.28 0.30 -0.12 0.00 0.66 0.00 0.00 57.16 58.28 2qbi n GLU 25 Cb 0.52 -0.44 -0.09 0.00 0.27 0.00 0.00 31.44 31.71 2qbi n GLU 25 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2qbi h ALA 26 N 0.02 -0.68 -1.27 4.31 0.00 -1.98 0.18 119.26 119.84 2qbi h ALA 26 Ca 0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2qbi h ALA 26 Cb 0.06 1.14 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2qbi h ALA 26 CO -0.15 -0.95 0.00 -0.11 0.00 0.00 0.00 179.25 178.05 2qbi n LEU 27 N -5.06 0.00 -0.36 0.00 7.94 0.93 -0.73 117.00 119.71 2qbi n LEU 27 Ca -0.02 0.79 0.28 0.00 -1.11 0.00 0.00 56.01 55.94 2qbi n LEU 27 Cb 0.29 -0.29 0.54 0.00 0.53 0.00 0.00 43.42 44.48 2qbi n LEU 27 CO -0.03 -0.29 1.18 -0.37 -1.11 0.00 0.00 177.39 176.77 2qbi h VAL 28 N 0.00 0.30 0.36 1.96 -1.51 -1.38 0.21 116.25 116.19 2qbi h VAL 28 Ca 0.00 -0.09 -0.02 0.00 -1.23 0.00 0.00 66.70 65.36 2qbi h VAL 28 Cb 0.00 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.17 2qbi h VAL 28 CO 0.00 0.05 -0.17 -0.74 -1.23 0.00 0.00 177.57 175.48 2qbi h HIS 29 N 0.27 -0.45 0.00 5.19 -0.00 0.34 0.70 115.15 121.19 2qbi h HIS 29 Ca 0.73 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 61.09 2qbi h HIS 29 Cb 1.91 0.15 0.00 0.00 -0.00 0.00 0.00 27.41 29.46 2qbi h HIS 29 CO -0.01 -0.27 0.00 0.94 -0.00 0.00 0.00 177.93 178.59 2qbi n GLN 30 N -5.30 0.28 -0.04 5.26 7.27 0.69 -1.71 117.38 123.85 2qbi n GLN 30 Ca -0.11 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 56.91 2qbi n GLN 30 Cb 0.21 -1.19 -0.03 0.00 2.41 0.00 0.00 30.24 31.64 2qbi n GLN 30 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2qbi n VAL 31 N -0.69 0.41 -0.24 1.69 0.31 -0.01 -3.97 118.33 115.83 2qbi n VAL 31 Ca 0.03 -0.15 -0.07 0.00 -0.01 0.00 0.00 64.34 64.14 2qbi n VAL 31 Cb 0.01 -0.84 0.04 0.00 -0.91 0.00 0.00 33.84 32.15 2qbi n VAL 31 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 2qbi h VAL 32 N -0.03 1.24 -0.09 2.52 -1.51 0.12 -0.02 116.25 118.49 2qbi h VAL 32 Ca -0.16 -0.75 -0.19 0.00 -1.23 0.00 0.00 66.70 64.36 2qbi h VAL 32 Cb 1.24 0.47 -0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2qbi h VAL 32 CO -0.03 0.30 -0.75 0.58 -1.23 0.00 0.00 177.57 176.44 2qbi h VAL 33 N 0.96 1.36 0.00 7.19 2.07 -1.63 0.16 116.25 126.36 2qbi h VAL 33 Ca 0.23 -2.13 -0.00 0.00 0.82 0.00 0.00 66.70 65.62 2qbi h VAL 33 Cb 0.21 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2qbi h VAL 33 CO -0.02 0.65 -0.01 0.00 0.02 0.00 0.00 177.57 178.21 2qbi h ALA 34 N 0.86 1.52 0.00 1.67 0.00 -1.54 0.34 119.26 122.11 2qbi h ALA 34 Ca -0.04 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 2qbi h ALA 34 Cb 1.34 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2qbi h ALA 34 CO 0.13 0.01 -1.58 0.98 0.00 0.00 0.00 179.25 178.79 2qbi n TYR 35 N -3.85 0.75 0.06 0.00 4.19 -0.07 -3.92 117.16 114.31 2qbi n TYR 35 Ca -0.03 0.25 -0.11 0.00 3.31 0.00 0.00 57.90 61.31 2qbi n TYR 35 Cb 0.09 -1.00 -0.05 0.00 0.49 0.00 0.00 39.34 38.86 2qbi n TYR 35 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2qbi h ALA 36 N 1.47 -0.13 -3.00 2.98 0.00 0.25 -3.37 119.26 117.46 2qbi h ALA 36 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2qbi h ALA 36 Cb 1.57 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.55 2qbi h ALA 36 CO 0.04 -0.61 0.00 0.00 0.00 0.00 0.00 179.25 178.68 2qbi n ALA 37 N -2.37 0.00 0.00 0.00 0.00 -0.12 -3.49 120.51 114.53 2qbi n ALA 37 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2qbi n ALA 37 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.61 2qbi n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbi n GLY 38 N 2.99 1.06 0.17 0.00 0.00 -1.25 -4.24 105.19 103.91 2qbi n GLY 38 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2qbi n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbi n ALA 39 N 0.00 3.28 -2.62 4.61 0.00 -1.23 -4.85 120.51 119.70 2qbi n ALA 39 Ca 0.00 -0.40 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 2qbi n ALA 39 Cb 0.00 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 2qbi n ALA 39 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qbi s ARG 40 N -2.67 4.49 -0.20 0.00 1.81 -1.26 -5.03 118.95 116.09 2qbi s ARG 40 Ca 0.20 1.51 -0.08 0.00 -1.72 0.00 0.00 55.73 55.64 2qbi s ARG 40 Cb 0.19 -3.46 -0.04 0.00 -0.45 0.00 0.00 34.95 31.19 2qbi s ARG 40 CO 0.59 -0.17 0.07 -1.14 -0.68 0.00 0.00 175.30 173.97 2qbi s GLN 41 N 1.28 3.93 0.00 3.54 0.74 -1.26 -4.72 119.66 123.17 2qbi s GLN 41 Ca 0.53 -0.36 0.00 0.00 0.05 0.00 0.00 55.36 55.58 2qbi s GLN 41 Cb -0.23 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.62 2qbi s GLN 41 CO 0.26 0.17 0.00 0.41 -0.55 0.00 0.00 175.29 175.59 2qbi n GLY 42 N 3.84 -1.18 3.28 2.59 0.00 -1.25 -4.90 105.19 107.57 2qbi n GLY 42 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 2qbi n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qbi n THR 43 N 0.00 -6.62 -4.67 2.61 -2.24 -1.26 -4.78 114.28 97.32 2qbi n THR 43 Ca 0.00 0.36 -0.23 0.00 -2.27 0.00 0.00 64.05 61.92 2qbi n THR 43 Cb 0.00 -4.95 -0.15 0.00 -2.10 0.00 0.00 70.33 63.13 2qbi n THR 43 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2qbi s ARG 44 N -2.61 1.17 0.00 -0.78 1.81 -1.26 -4.97 118.95 112.31 2qbi s ARG 44 Ca 0.32 -0.53 0.00 0.00 -1.72 0.00 0.00 55.73 53.80 2qbi s ARG 44 Cb -0.05 -1.14 0.00 0.00 -0.45 0.00 0.00 34.95 33.32 2qbi s ARG 44 CO 0.84 0.31 0.00 0.00 -0.68 0.00 0.00 175.30 175.77 2qbi n ALA 45 N 2.70 0.00 -1.29 2.13 0.00 -1.26 -4.32 120.51 118.47 2qbi n ALA 45 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2qbi n ALA 45 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2qbi n ALA 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2qbi n GLN 46 N 0.00 -3.44 -3.65 0.00 1.13 -1.26 -4.52 117.38 105.65 2qbi n GLN 46 Ca 0.00 2.52 -0.25 0.00 -1.94 0.00 0.00 57.00 57.33 2qbi n GLN 46 Cb 0.00 -2.70 -0.17 0.00 0.11 0.00 0.00 30.24 27.48 2qbi n GLN 46 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2qbi s LYS 47 N -2.43 0.15 1.25 -1.09 1.02 -1.26 -4.71 119.74 112.67 2qbi s LYS 47 Ca 0.00 -0.03 -0.18 0.00 0.02 0.00 0.00 55.97 55.78 2qbi s LYS 47 Cb 0.00 -1.58 0.28 0.00 -0.52 0.00 0.00 37.83 36.01 2qbi s LYS 47 CO 0.00 -0.58 0.71 0.25 -0.92 0.00 0.00 175.35 174.81 2qbi n THR 48 N 5.24 0.00 0.28 2.17 -2.24 -1.26 -4.37 114.28 114.11 2qbi n THR 48 Ca -0.07 -0.27 0.01 0.00 -2.27 0.00 0.00 64.05 61.46 2qbi n THR 48 Cb 0.49 -0.87 0.06 0.00 -2.10 0.00 0.00 70.33 67.91 2qbi n THR 48 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2qbi n ARG 49 N -4.40 0.14 -0.12 -0.78 1.85 -1.16 -2.13 116.66 110.06 2qbi n ARG 49 Ca 0.06 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.68 2qbi n ARG 49 Cb 0.55 -1.21 -0.08 0.00 -1.05 0.00 0.00 32.46 30.68 2qbi n ARG 49 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qbi n ALA 50 N -0.71 1.04 -0.01 2.89 0.00 -1.26 -4.56 120.51 117.90 2qbi n ALA 50 Ca 0.01 -0.94 -0.09 0.00 0.00 0.00 0.00 53.44 52.42 2qbi n ALA 50 Cb 0.01 0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.45 2qbi n ALA 50 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qbi h GLU 51 N -1.00 -0.04 -2.00 0.00 4.39 -1.72 -3.45 114.58 110.76 2qbi h GLU 51 Ca -0.45 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 58.99 2qbi h GLU 51 Cb 1.37 0.01 0.02 0.00 -0.10 0.00 0.00 28.75 30.05 2qbi h GLU 51 CO -0.28 -0.03 0.02 0.28 -1.16 0.00 0.00 179.01 177.85 2qbi n VAL 52 N -5.19 0.01 -2.49 3.13 0.31 -1.14 -4.73 118.33 108.23 2qbi n VAL 52 Ca -0.04 -0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.89 2qbi n VAL 52 Cb 0.12 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.02 2qbi n VAL 52 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2qbi s THR 53 N -0.01 3.79 0.18 2.52 -4.23 -1.26 -4.91 115.64 111.72 2qbi s THR 53 Ca 0.30 -0.26 -0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2qbi s THR 53 Cb -0.42 -4.88 0.01 0.00 1.34 0.00 0.00 72.50 68.55 2qbi s THR 53 CO 0.19 -1.79 0.29 0.61 -0.54 0.00 0.00 174.62 173.38 2qbi n GLY 54 N 6.28 2.21 3.85 3.99 0.00 -1.26 -5.11 105.19 115.15 2qbi n GLY 54 Ca 0.22 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 2qbi n GLY 54 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qbi s SER 55 N -2.02 6.11 0.10 1.61 0.15 -1.26 -4.98 113.70 113.42 2qbi s SER 55 Ca 0.11 0.31 0.18 0.00 0.70 0.00 0.00 55.95 57.25 2qbi s SER 55 Cb -0.01 -1.88 0.76 0.00 -1.71 0.00 0.00 66.02 63.18 2qbi s SER 55 CO 0.08 0.31 1.56 0.61 1.20 0.00 0.00 173.24 177.00 2qbi n GLY 56 N 1.36 -1.11 3.66 9.45 0.00 -1.26 -4.62 105.19 112.67 2qbi n GLY 56 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2qbi n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qbi n LYS 57 N -1.79 1.64 -3.88 1.61 4.81 -1.26 -4.96 118.16 114.32 2qbi n LYS 57 Ca 0.03 0.59 -0.35 0.00 -0.87 0.00 0.00 58.31 57.70 2qbi n LYS 57 Cb 0.19 -2.24 -0.13 0.00 0.02 0.00 0.00 35.03 32.87 2qbi n LYS 57 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2qbi s LYS 58 N -2.17 2.40 -0.60 1.64 3.01 -1.26 -4.32 119.74 118.45 2qbi s LYS 58 Ca 0.63 -1.31 -0.26 0.00 -1.01 0.00 0.00 55.97 54.02 2qbi s LYS 58 Cb -0.52 -3.24 -0.10 0.00 -1.01 0.00 0.00 37.83 32.95 2qbi s LYS 58 CO 0.57 -0.66 2.44 -2.30 0.51 0.00 0.00 175.35 175.90 2qbi n PRO 59 N 4.64 0.85 0.00 -1.68 -0.02 -1.26 -4.77 135.00 132.75 2qbi n PRO 59 Ca -0.12 -0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.19 2qbi n PRO 59 Cb 0.43 -3.30 0.00 0.00 -0.02 0.00 0.00 33.50 30.61 2qbi n PRO 59 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2qbi n TRP 60 N 15.88 0.00 -0.95 6.00 5.03 -1.26 -4.60 117.44 137.54 2qbi n TRP 60 Ca 0.42 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.95 2qbi n TRP 60 Cb 0.48 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.76 2qbi n TRP 60 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 2qbi n ARG 61 N 0.00 0.00 0.00 -0.99 5.12 -1.26 -4.96 116.66 114.57 2qbi n ARG 61 Ca 0.00 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 2qbi n ARG 61 Cb 0.00 -1.89 0.00 0.00 -1.16 0.00 0.00 32.46 29.41 2qbi n ARG 61 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2qbi n GLN 62 N -1.28 0.00 -3.96 5.56 7.27 -1.26 -3.73 117.38 119.97 2qbi n GLN 62 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.78 2qbi n GLN 62 Cb 0.21 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 32.82 2qbi n GLN 62 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2qbi s LYS 63 N -0.97 3.32 0.00 3.69 1.02 -1.26 -4.57 119.74 120.96 2qbi s LYS 63 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2qbi s LYS 63 Cb 0.00 -2.94 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 2qbi s LYS 63 CO 0.00 0.56 0.00 0.41 -0.92 0.00 0.00 175.35 175.40 2qbi n GLY 64 N -0.02 2.69 3.74 -3.33 0.00 -1.25 -5.04 105.19 101.97 2qbi n GLY 64 Ca -0.06 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.94 2qbi n GLY 64 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qbi s THR 65 N 0.00 3.02 0.00 2.61 -1.32 -1.24 -4.99 115.64 113.71 2qbi s THR 65 Ca 0.00 0.33 -0.18 0.00 -1.21 0.00 0.00 61.69 60.63 2qbi s THR 65 Cb 0.00 -2.70 -0.31 0.00 -1.51 0.00 0.00 72.50 67.98 2qbi s THR 65 CO 0.00 -0.43 1.00 1.23 -2.21 0.00 0.00 174.62 174.21 2qbi h GLY 66 N -1.31 0.53 -1.68 6.08 0.00 -1.93 -3.47 103.07 101.27 2qbi h GLY 66 Ca -0.43 -1.21 -0.51 0.00 0.00 0.00 0.00 47.33 45.18 2qbi h GLY 66 CO 0.49 1.06 -0.52 -0.96 0.00 0.00 0.00 176.54 176.61 2qbi n ARG 67 N -3.95 -0.73 0.00 4.80 1.85 -1.26 -4.99 116.66 112.37 2qbi n ARG 67 Ca -0.14 -0.17 0.00 0.00 -1.00 0.00 0.00 57.85 56.53 2qbi n ARG 67 Cb 0.92 -1.92 0.00 0.00 -1.05 0.00 0.00 32.46 30.40 2qbi n ARG 67 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qbi n ALA 68 N -3.96 0.00 -0.67 2.89 0.00 -1.26 -4.94 120.51 112.56 2qbi n ALA 68 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2qbi n ALA 68 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2qbi n ALA 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qbi n ARG 69 N -1.16 0.00 -2.73 0.00 5.12 -1.26 -4.96 116.66 111.67 2qbi n ARG 69 Ca 0.00 0.66 -0.02 0.00 -1.93 0.00 0.00 57.85 56.56 2qbi n ARG 69 Cb 0.00 -1.15 -0.01 0.00 -1.16 0.00 0.00 32.46 30.13 2qbi n ARG 69 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2qbi n SER 70 N -1.64 -5.69 -0.21 0.55 3.41 -1.26 -4.76 113.62 104.01 2qbi n SER 70 Ca 0.00 1.34 0.03 0.00 -0.26 0.00 0.00 58.87 59.98 2qbi n SER 70 Cb 0.00 -5.00 0.03 0.00 -0.26 0.00 0.00 64.21 58.97 2qbi n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qbi n GLY 71 N 1.09 -0.63 3.65 5.00 0.00 -1.26 -4.51 105.19 108.53 2qbi n GLY 71 Ca -0.13 -0.15 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 2qbi n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qbi s SER 72 N -0.48 -0.15 -0.04 1.61 0.15 -1.26 -4.64 113.70 108.89 2qbi s SER 72 Ca 0.06 0.28 -0.01 0.00 0.70 0.00 0.00 55.95 56.98 2qbi s SER 72 Cb 0.04 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.69 2qbi s SER 72 CO 0.07 -0.05 2.38 0.00 1.20 0.00 0.00 173.24 176.84 2qbi n ILE 73 N 1.91 2.31 -1.31 6.45 3.06 -1.26 -2.05 119.36 128.47 2qbi n ILE 73 Ca -0.12 -0.87 0.00 0.00 -2.50 0.00 0.00 62.75 59.26 2qbi n ILE 73 Cb 0.57 -1.60 0.00 0.00 0.54 0.00 0.00 39.64 39.15 2qbi n ILE 73 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2qbi n LYS 74 N 1.61 0.00 -1.67 9.51 5.02 -1.26 -4.88 118.16 126.49 2qbi n LYS 74 Ca 0.13 -0.30 -0.42 0.00 -2.02 0.00 0.00 58.31 55.70 2qbi n LYS 74 Cb 0.60 -0.35 -0.03 0.00 -0.02 0.00 0.00 35.03 35.23 2qbi n LYS 74 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qbi s SER 75 N 0.00 6.30 0.63 4.39 0.01 -0.87 -4.55 113.70 119.60 2qbi s SER 75 Ca 0.00 2.53 0.20 0.00 1.31 0.00 0.00 55.95 59.99 2qbi s SER 75 Cb 0.00 -2.53 0.90 0.00 0.21 0.00 0.00 66.02 64.60 2qbi s SER 75 CO 0.00 -1.20 1.45 -0.65 0.41 0.00 0.00 173.24 173.25 2qbi h PRO 76 N 11.28 0.00 0.15 12.44 0.11 -1.88 1.86 132.00 155.96 2qbi h PRO 76 Ca -0.48 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.33 2qbi h PRO 76 Cb 1.24 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 2qbi h PRO 76 CO 0.94 0.00 -1.42 0.82 -0.21 0.00 0.00 178.00 178.13 2qbi h ILE 77 N 0.00 1.30 -2.43 4.15 2.04 -1.88 -3.42 117.51 117.27 2qbi h ILE 77 Ca 0.20 -2.87 -0.45 0.00 1.00 0.00 0.00 64.86 62.75 2qbi h ILE 77 Cb 1.88 2.89 0.23 0.00 -0.74 0.00 0.00 36.82 41.09 2qbi h ILE 77 CO -0.00 0.85 -0.90 0.79 0.00 0.00 0.00 178.15 178.88 2qbi n TRP 78 N -3.55 -1.44 0.00 1.37 5.03 0.63 -5.01 117.44 114.48 2qbi n TRP 78 Ca -0.14 0.07 0.00 0.00 3.03 0.00 0.00 57.50 60.46 2qbi n TRP 78 Cb 1.05 -1.57 0.00 0.00 -1.03 0.00 0.00 31.31 29.76 2qbi n TRP 78 CO 0.00 0.00 0.00 -2.13 -0.03 0.00 0.00 177.69 175.53 2qbi n ARG 79 N -2.64 0.00 -2.06 -0.99 0.63 -1.26 -4.78 116.66 105.55 2qbi n ARG 79 Ca 0.01 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.52 2qbi n ARG 79 Cb 0.61 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.49 2qbi n ARG 79 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2qbi s SER 80 N -1.91 6.71 0.00 6.15 1.04 -1.26 -4.67 113.70 119.75 2qbi s SER 80 Ca 0.00 2.48 0.00 0.00 0.48 0.00 0.00 55.95 58.91 2qbi s SER 80 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2qbi s SER 80 CO 0.00 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.10 2qbi n GLY 81 N 3.48 -1.29 0.00 7.32 0.00 -1.26 -4.81 105.19 108.63 2qbi n GLY 81 Ca 0.12 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2qbi n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbi n GLY 82 N 1.36 -0.84 2.75 -0.02 0.00 -1.26 -4.48 105.19 102.71 2qbi n GLY 82 Ca 0.00 0.65 -0.01 0.00 0.00 0.00 0.00 46.02 46.66 2qbi n GLY 82 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qbi n VAL 83 N 0.00-11.26 0.02 1.61 0.31 -1.26 -2.98 118.33 104.76 2qbi n VAL 83 Ca 0.00 1.86 -0.02 0.00 -0.01 0.00 0.00 64.34 66.17 2qbi n VAL 83 Cb 0.00 -6.52 -0.01 0.00 -0.91 0.00 0.00 33.84 26.40 2qbi n VAL 83 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2qbi h THR 84 N 3.29 0.00 -2.53 2.52 2.02 -1.90 -3.25 112.91 113.06 2qbi h THR 84 Ca -0.08 0.00 -0.74 0.00 0.77 0.00 0.00 66.41 66.36 2qbi h THR 84 Cb 0.27 0.00 -0.33 0.00 -1.74 0.00 0.00 68.15 66.35 2qbi h THR 84 CO 0.08 0.00 0.37 0.49 0.37 0.00 0.00 175.52 176.82 2qbi n PHE 85 N -2.85 2.88 -1.37 3.16 3.72 -1.26 -4.78 117.46 116.95 2qbi n PHE 85 Ca -0.01 -3.09 -0.53 0.00 -0.05 0.00 0.00 57.45 53.76 2qbi n PHE 85 Cb 0.06 -0.99 -0.09 0.00 -0.94 0.00 0.00 39.48 37.51 2qbi n PHE 85 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qbi n ALA 86 N 0.72 0.68 -1.15 4.37 0.00 -1.23 -4.88 120.51 119.02 2qbi n ALA 86 Ca 0.32 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.43 2qbi n ALA 86 Cb 0.34 -2.36 0.12 0.00 0.00 0.00 0.00 19.45 17.55 2qbi n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbi s ALA 87 N 7.02 1.89 0.14 0.00 0.00 -1.26 -4.83 121.76 124.73 2qbi s ALA 87 Ca 1.15 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 53.91 2qbi s ALA 87 Cb -1.12 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 18.48 2qbi s ALA 87 CO 0.55 -2.21 0.08 1.03 0.00 0.00 0.00 175.76 175.21 2qbi s ARG 88 N -4.14 0.98 -0.42 0.00 1.81 -1.26 -4.24 118.95 111.67 2qbi s ARG 88 Ca 0.73 -1.46 -0.44 0.00 -1.72 0.00 0.00 55.73 52.84 2qbi s ARG 88 Cb -0.28 0.25 -0.18 0.00 -0.45 0.00 0.00 34.95 34.29 2qbi s ARG 88 CO 0.50 -0.29 1.70 -2.30 -0.68 0.00 0.00 175.30 174.23 2qbi n PRO 89 N -0.13 0.42 -4.13 3.54 -0.02 -1.26 -4.77 135.00 128.66 2qbi n PRO 89 Ca -0.04 0.15 -0.27 0.00 -2.02 0.00 0.00 63.50 61.32 2qbi n PRO 89 Cb 0.64 -1.73 -0.05 0.00 -0.02 0.00 0.00 33.50 32.34 2qbi n PRO 89 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2qbi s GLN 90 N 3.48 2.24 -0.37 -0.52 -0.21 -1.26 -4.95 119.66 118.08 2qbi s GLN 90 Ca 1.04 -2.01 0.00 0.00 0.02 0.00 0.00 55.36 54.42 2qbi s GLN 90 Cb -1.34 -1.96 0.13 0.00 1.00 0.00 0.00 33.01 30.85 2qbi s GLN 90 CO 0.75 -0.36 0.21 0.34 -2.12 0.00 0.00 175.29 174.10 2qbi s ASP 91 N -4.05 3.22 0.00 5.90 2.15 -1.26 -3.84 116.67 118.79 2qbi s ASP 91 Ca 0.32 -2.21 0.00 0.00 0.43 0.00 0.00 52.55 51.08 2qbi s ASP 91 Cb 0.01 -0.57 0.00 0.00 -0.30 0.00 0.00 42.92 42.05 2qbi s ASP 91 CO 0.18 -0.31 0.50 1.41 -0.17 0.00 0.00 175.17 176.78 2qbi n HIS 92 N 4.03 0.00 -1.99 -5.34 8.25 -1.26 -4.82 115.22 114.09 2qbi n HIS 92 Ca 0.09 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.14 2qbi n HIS 92 Cb 0.37 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 2qbi n HIS 92 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2qbi s SER 93 N -0.55 5.64 1.00 0.41 0.01 -1.26 -3.78 113.70 115.17 2qbi s SER 93 Ca 0.00 1.00 -0.00 0.00 1.31 0.00 0.00 55.95 58.26 2qbi s SER 93 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2qbi s SER 93 CO 0.00 -1.97 0.00 0.00 0.41 0.00 0.00 173.24 171.69 2qbi n GLN 94 N 8.68 -0.23 0.00 12.44 6.02 -1.26 -4.98 117.38 138.04 2qbi n GLN 94 Ca 0.23 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 2qbi n GLN 94 Cb 0.49 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.74 2qbi n GLN 94 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2qbi n LYS 95 N -1.12 0.00 -2.16 -1.09 0.00 -1.26 -5.05 118.16 107.48 2qbi n LYS 95 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.31 58.30 2qbi n LYS 95 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 35.03 34.79 2qbi n LYS 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2qbi n VAL 96 N -2.26-11.16 -1.11 3.15 0.31 -1.26 -4.93 118.33 101.07 2qbi n VAL 96 Ca 0.00 2.47 -0.35 0.00 -0.01 0.00 0.00 64.34 66.45 2qbi n VAL 96 Cb 0.00 -5.63 0.09 0.00 -0.91 0.00 0.00 33.84 27.39 2qbi n VAL 96 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2qbi n ASN 97 N 1.44 -1.24 0.28 4.52 3.02 -1.26 -4.79 115.26 117.24 2qbi n ASN 97 Ca -0.09 0.51 0.19 0.00 -0.03 0.00 0.00 54.58 55.16 2qbi n ASN 97 Cb 0.14 -1.24 0.89 0.00 -0.61 0.00 0.00 39.78 38.96 2qbi n ASN 97 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2qbi h LYS 98 N -0.77 0.00 0.03 3.52 3.64 -2.01 -2.34 116.57 118.65 2qbi h LYS 98 Ca -0.45 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.57 2qbi h LYS 98 Cb 1.32 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.09 2qbi h LYS 98 CO 0.40 0.00 -2.23 1.63 -2.27 0.00 0.00 179.45 176.99 2qbi n LYS 99 N -2.94 0.68 0.23 1.90 5.02 -1.26 -3.89 118.16 117.90 2qbi n LYS 99 Ca -0.01 0.16 0.09 0.00 -2.02 0.00 0.00 58.31 56.53 2qbi n LYS 99 Cb 0.17 -1.61 0.54 0.00 -0.02 0.00 0.00 35.03 34.12 2qbi n LYS 99 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 2qbi h MET 100 N 0.02 0.00 -0.18 1.97 2.86 -1.86 -0.66 114.93 117.08 2qbi h MET 100 Ca -0.49 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.11 2qbi h MET 100 Cb 2.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.69 2qbi h MET 100 CO 0.01 0.23 -0.05 -0.92 1.06 0.00 0.00 176.91 177.24 2qbi h TYR 101 N 0.00 0.40 -0.20 -0.22 3.20 -1.59 -2.13 116.97 116.43 2qbi h TYR 101 Ca -0.00 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 2qbi h TYR 101 Cb 0.57 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2qbi h TYR 101 CO 0.00 0.62 0.02 0.00 -1.64 0.00 0.00 178.16 177.15 2qbi h ARG 102 N 0.06 0.34 -0.08 1.82 3.08 -1.59 -2.08 114.38 115.93 2qbi h ARG 102 Ca 0.05 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 60.00 2qbi h ARG 102 Cb 0.49 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 2qbi h ARG 102 CO 0.02 0.52 -0.11 0.78 -1.07 0.00 0.00 179.97 180.11 2qbi h GLY 103 N 0.12 -1.78 -0.63 0.04 0.00 -1.07 -0.13 103.07 99.62 2qbi h GLY 103 Ca 0.06 0.82 0.15 0.00 0.00 0.00 0.00 47.33 48.36 2qbi h GLY 103 CO 0.01 -0.63 -0.24 0.00 0.00 0.00 0.00 176.54 175.68 2qbi h ALA 104 N -1.05 0.43 0.00 3.60 0.00 -1.41 -0.38 119.26 120.46 2qbi h ALA 104 Ca 0.01 0.29 -0.37 0.00 0.00 0.00 0.00 54.91 54.85 2qbi h ALA 104 Cb 0.11 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2qbi h ALA 104 CO -0.12 -0.46 2.05 1.28 0.00 0.00 0.00 179.25 182.01 2qbi n LEU 105 N -5.51 5.44 0.00 0.00 4.77 -0.07 -0.79 117.00 120.84 2qbi n LEU 105 Ca 0.11 -3.08 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 2qbi n LEU 105 Cb 0.41 -1.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2qbi n LEU 105 CO -0.04 1.09 0.00 0.29 -1.33 0.00 0.00 177.39 177.40 2qbi n LYS 106 N 3.57 0.00 0.11 3.23 5.02 -0.18 -4.80 118.16 125.11 2qbi n LYS 106 Ca 0.48 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.88 2qbi n LYS 106 Cb 0.32 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.33 2qbi n LYS 106 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2qbi h SER 107 N 0.00 0.00 0.86 4.39 0.87 -0.97 0.16 113.55 118.86 2qbi h SER 107 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 2qbi h SER 107 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2qbi h SER 107 CO 0.00 0.04 -1.21 -0.29 -0.53 0.00 0.00 176.83 174.84 2qbi h ILE 108 N 0.00 0.37 0.04 2.23 -0.00 -1.22 -3.08 117.51 115.86 2qbi h ILE 108 Ca -0.01 -1.70 -0.29 0.00 -0.00 0.00 0.00 64.86 62.86 2qbi h ILE 108 Cb 1.04 1.90 -0.03 0.00 -0.00 0.00 0.00 36.82 39.74 2qbi h ILE 108 CO 0.00 0.21 -1.58 -0.11 -0.00 0.00 0.00 178.15 176.67 2qbi n LEU 109 N -2.85 2.15 -0.17 2.19 7.94 -1.23 -3.21 117.00 121.82 2qbi n LEU 109 Ca -0.06 0.34 -0.02 0.00 -1.11 0.00 0.00 56.01 55.16 2qbi n LEU 109 Cb 0.74 -1.02 0.08 0.00 0.53 0.00 0.00 43.42 43.75 2qbi n LEU 109 CO 0.42 0.50 0.93 0.28 -1.11 0.00 0.00 177.39 178.40 2qbi h SER 110 N -0.62 0.06 -0.62 1.96 0.02 -0.83 0.13 113.55 113.65 2qbi h SER 110 Ca -0.39 0.09 0.05 0.00 -0.84 0.00 0.00 61.79 60.69 2qbi h SER 110 Cb 1.58 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 64.17 2qbi h SER 110 CO -0.11 0.06 0.35 -0.08 -1.14 0.00 0.00 176.83 175.90 2qbi h GLU 111 N 0.28 0.65 -0.78 3.45 4.22 -1.70 0.19 114.58 120.88 2qbi h GLU 111 Ca 0.26 -0.04 0.16 0.00 0.08 0.00 0.00 59.36 59.82 2qbi h GLU 111 Cb 0.34 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 2qbi h GLU 111 CO -0.32 0.43 0.52 -0.07 -2.18 0.00 0.00 179.01 177.39 2qbi h LEU 112 N 0.66 0.38 -0.03 1.64 3.38 -0.77 0.70 115.31 121.28 2qbi h LEU 112 Ca 0.27 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 2qbi h LEU 112 Cb 0.13 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2qbi h LEU 112 CO -0.16 0.19 -0.06 0.58 0.09 0.00 0.00 178.44 179.08 2qbi h VAL 113 N 0.40 1.46 0.00 1.22 2.07 0.76 -0.17 116.25 121.99 2qbi h VAL 113 Ca 0.39 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.45 2qbi h VAL 113 Cb 0.92 2.36 -0.00 0.00 -1.52 0.00 0.00 31.29 33.04 2qbi h VAL 113 CO -0.13 0.39 -0.09 0.03 0.02 0.00 0.00 177.57 177.79 2qbi h ARG 114 N -0.47 0.00 -0.54 1.57 3.08 0.77 -0.09 114.38 118.70 2qbi h ARG 114 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qbi h ARG 114 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2qbi h ARG 114 CO 0.01 0.09 0.00 1.04 -1.07 0.00 0.00 179.97 180.05 2qbi n GLN 115 N -4.02 2.34 -4.12 0.04 6.02 0.23 -4.92 117.38 112.94 2qbi n GLN 115 Ca -0.02 -1.49 -0.32 0.00 -0.01 0.00 0.00 57.00 55.16 2qbi n GLN 115 Cb 0.18 -1.53 -0.05 0.00 1.02 0.00 0.00 30.24 29.86 2qbi n GLN 115 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2qbi n ASP 116 N 0.51 -0.70 0.00 1.08 9.92 -0.05 -4.84 116.55 122.48 2qbi n ASP 116 Ca 0.14 -1.18 0.00 0.00 -0.53 0.00 0.00 54.79 53.21 2qbi n ASP 116 Cb 0.49 -2.17 0.00 0.00 -0.64 0.00 0.00 41.12 38.80 2qbi n ASP 116 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2qbi n ARG 117 N -4.58 0.63 -3.35 -1.24 1.74 -0.10 -4.85 116.66 104.92 2qbi n ARG 117 Ca -0.27 -0.88 -0.41 0.00 -0.77 0.00 0.00 57.85 55.51 2qbi n ARG 117 Cb 0.67 -0.98 -0.02 0.00 -1.02 0.00 0.00 32.46 31.11 2qbi n ARG 117 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2qbi n LEU 118 N -0.20 5.29 -4.00 0.55 0.00 -1.22 0.11 117.00 117.53 2qbi n LEU 118 Ca 0.00 -5.13 -0.40 0.00 0.00 0.00 0.00 56.01 50.48 2qbi n LEU 118 Cb 0.12 -1.29 -0.03 0.00 0.00 0.00 0.00 43.42 42.21 2qbi n LEU 118 CO 0.00 1.52 2.14 -0.38 0.00 0.00 0.00 177.39 180.67 2qbi n ILE 119 N 2.17 2.67 -2.36 1.96 2.08 0.17 -4.94 119.36 121.11 2qbi n ILE 119 Ca 0.24 -2.50 -0.42 0.00 0.56 0.00 0.00 62.75 60.63 2qbi n ILE 119 Cb 0.37 -2.38 -0.03 0.00 -0.75 0.00 0.00 39.64 36.85 2qbi n ILE 119 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2qbi s VAL 120 N 5.49 3.90 0.02 1.39 0.11 -1.04 -4.36 120.40 125.91 2qbi s VAL 120 Ca 0.56 1.35 0.00 0.00 -2.93 0.00 0.00 61.98 60.96 2qbi s VAL 120 Cb 0.10 -3.86 -0.02 0.00 -1.53 0.00 0.00 36.38 31.07 2qbi s VAL 120 CO 0.06 0.08 -0.03 0.68 -3.33 0.00 0.00 175.10 172.56 2qbi s VAL 121 N 1.35 0.15 -0.56 2.04 -7.23 -1.13 -3.66 120.40 111.36 2qbi s VAL 121 Ca 0.60 -0.72 -0.27 0.00 -1.81 0.00 0.00 61.98 59.78 2qbi s VAL 121 Cb -0.30 -0.25 -0.00 0.00 0.56 0.00 0.00 36.38 36.38 2qbi s VAL 121 CO 0.28 -0.36 1.63 -1.83 -0.31 0.00 0.00 175.10 174.51 2qbi s GLU 122 N -1.12 3.03 0.18 4.82 4.04 -1.26 -2.39 118.70 126.00 2qbi s GLU 122 Ca -0.11 0.59 0.00 0.00 0.04 0.00 0.00 54.97 55.49 2qbi s GLU 122 Cb -0.08 -4.24 0.00 0.00 0.02 0.00 0.00 34.13 29.83 2qbi s GLU 122 CO -0.01 -2.26 0.00 1.63 -1.84 0.00 0.00 175.26 172.78 2qbi n LYS 123 N 8.90 -1.20 -3.64 -4.83 5.02 -1.26 -4.92 118.16 116.23 2qbi n LYS 123 Ca 0.16 0.94 -0.06 0.00 -2.02 0.00 0.00 58.31 57.33 2qbi n LYS 123 Cb 0.50 -1.20 -0.07 0.00 -0.02 0.00 0.00 35.03 34.25 2qbi n LYS 123 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2qbi s PHE 124 N -4.26 -0.84 0.00 2.13 2.19 -1.26 -4.99 117.98 110.95 2qbi s PHE 124 Ca 0.00 1.72 -0.29 0.00 0.33 0.00 0.00 56.93 58.69 2qbi s PHE 124 Cb 0.00 0.49 0.11 0.00 -1.31 0.00 0.00 43.02 42.31 2qbi s PHE 124 CO 0.00 -0.41 1.26 0.45 1.83 0.00 0.00 175.22 178.35 2qbi s SER 125 N 1.35 -0.05 0.16 6.13 0.15 -1.26 -5.03 113.70 115.16 2qbi s SER 125 Ca -0.08 -0.19 0.08 0.00 0.70 0.00 0.00 55.95 56.46 2qbi s SER 125 Cb -0.05 0.19 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 2qbi s SER 125 CO -0.16 -0.36 -0.17 0.54 1.20 0.00 0.00 173.24 174.29 2qbi s VAL 126 N -2.36 1.75 0.01 4.45 0.11 -1.26 -5.05 120.40 118.05 2qbi s VAL 126 Ca 0.18 -1.91 -0.26 0.00 -2.93 0.00 0.00 61.98 57.06 2qbi s VAL 126 Cb 0.03 -1.82 -0.16 0.00 -1.53 0.00 0.00 36.38 32.91 2qbi s VAL 126 CO -0.02 -0.35 1.18 -0.33 -3.33 0.00 0.00 175.10 172.24 2qbi h GLU 127 N 3.23 -0.65 -5.35 1.54 4.39 -1.98 -3.46 114.58 112.30 2qbi h GLU 127 Ca -0.42 0.04 -0.40 0.00 0.34 0.00 0.00 59.36 58.93 2qbi h GLU 127 Cb 1.21 0.15 -0.18 0.00 -0.10 0.00 0.00 28.75 29.83 2qbi h GLU 127 CO 0.52 -0.35 -0.75 0.00 -1.16 0.00 0.00 179.01 177.27 2qbi s ALA 128 N -4.92 1.47 -1.05 3.43 0.00 -1.26 -5.05 121.76 114.37 2qbi s ALA 128 Ca -0.14 -1.30 -0.26 0.00 0.00 0.00 0.00 51.96 50.25 2qbi s ALA 128 Cb 0.02 -0.06 -0.23 0.00 0.00 0.00 0.00 23.12 22.85 2qbi s ALA 128 CO 0.48 0.07 2.10 -2.30 0.00 0.00 0.00 175.76 176.11 2qbi n PRO 129 N 0.47 0.10 -3.66 0.00 -0.02 -1.22 -4.82 135.00 125.85 2qbi n PRO 129 Ca -0.15 -1.64 -0.25 0.00 -2.02 0.00 0.00 63.50 59.44 2qbi n PRO 129 Cb 0.57 -3.87 -0.17 0.00 -0.02 0.00 0.00 33.50 30.01 2qbi n PRO 129 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2qbi s LYS 130 N 8.49 0.17 0.00 -0.52 -0.14 -1.26 -4.86 119.74 121.61 2qbi s LYS 130 Ca 0.80 -0.00 0.00 0.00 -1.36 0.00 0.00 55.97 55.41 2qbi s LYS 130 Cb -0.05 -1.47 0.00 0.00 -1.68 0.00 0.00 37.83 34.62 2qbi s LYS 130 CO 0.18 -0.55 0.59 0.25 -0.76 0.00 0.00 175.35 175.06 2qbi n THR 131 N 5.24 0.59 -0.03 2.17 -2.24 -1.26 -2.27 114.28 116.47 2qbi n THR 131 Ca -0.06 -0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.65 2qbi n THR 131 Cb 0.49 -0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 67.90 2qbi n THR 131 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2qbi n LYS 132 N 0.71 0.14 0.00 -0.78 4.81 -1.26 -4.26 118.16 117.52 2qbi n LYS 132 Ca 0.00 0.06 -0.12 0.00 -0.87 0.00 0.00 58.31 57.38 2qbi n LYS 132 Cb 0.29 -0.75 -0.07 0.00 0.02 0.00 0.00 35.03 34.52 2qbi n LYS 132 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2qbi h LEU 133 N -0.23 0.08 -0.86 3.14 3.38 -1.81 0.15 115.31 119.17 2qbi h LEU 133 Ca -0.17 -0.12 0.15 0.00 0.09 0.00 0.00 57.88 57.84 2qbi h LEU 133 Cb 1.15 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.78 2qbi h LEU 133 CO -0.10 0.18 0.44 0.25 0.09 0.00 0.00 178.44 179.30 2qbi h LEU 134 N -0.02 0.52 -1.11 1.67 5.85 -1.83 1.09 115.31 121.48 2qbi h LEU 134 Ca 0.02 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 2qbi h LEU 134 Cb 0.12 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2qbi h LEU 134 CO -0.00 0.20 0.08 0.00 -0.34 0.00 0.00 178.44 178.38 2qbi h ALA 135 N 1.58 1.28 -0.23 1.25 0.00 -1.56 -0.56 119.26 121.02 2qbi h ALA 135 Ca 0.48 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 2qbi h ALA 135 Cb 0.70 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qbi h ALA 135 CO -0.38 0.50 -0.16 0.37 0.00 0.00 0.00 179.25 179.58 2qbi h GLN 136 N 0.69 0.51 -0.88 0.00 5.75 0.22 -2.29 115.11 119.11 2qbi h GLN 136 Ca 0.15 -0.25 0.11 0.00 -0.15 0.00 0.00 58.65 58.52 2qbi h GLN 136 Cb 0.30 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.79 2qbi h GLN 136 CO 0.00 0.81 0.57 -0.22 -2.65 0.00 0.00 178.83 177.34 2qbi h LYS 137 N 0.21 0.78 0.67 1.69 1.63 0.15 -0.40 116.57 121.30 2qbi h LYS 137 Ca 0.04 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.76 2qbi h LYS 137 Cb 0.69 -0.18 0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2qbi h LYS 137 CO 0.04 0.51 -0.32 -0.07 -3.45 0.00 0.00 179.45 176.17 2qbi h LEU 138 N 0.80 -0.76 -0.84 5.20 3.38 -0.85 -1.17 115.31 121.07 2qbi h LEU 138 Ca 0.42 0.03 0.21 0.00 0.09 0.00 0.00 57.88 58.62 2qbi h LEU 138 Cb 0.52 0.20 -0.14 0.00 0.09 0.00 0.00 40.66 41.32 2qbi h LEU 138 CO -0.18 -0.49 0.13 0.50 0.09 0.00 0.00 178.44 178.48 2qbi h LYS 139 N -1.00 0.15 -0.71 1.13 3.64 -0.93 1.27 116.57 120.12 2qbi h LYS 139 Ca -0.09 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2qbi h LYS 139 Cb 0.69 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 2qbi h LYS 139 CO 0.15 0.10 0.42 -0.44 -2.27 0.00 0.00 179.45 177.41 2qbi h ASP 140 N 0.15 0.86 -0.45 4.20 3.45 -1.01 -1.07 116.42 122.54 2qbi h ASP 140 Ca 0.50 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.89 2qbi h ASP 140 Cb 0.95 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 39.51 2qbi h ASP 140 CO -0.68 0.68 0.00 0.23 -1.57 0.00 0.00 179.24 177.90 2qbi n MET 141 N -4.53 2.20 -4.19 3.56 2.81 0.87 -4.93 117.12 112.91 2qbi n MET 141 Ca 0.06 -1.69 -0.32 0.00 -1.81 0.00 0.00 57.70 53.95 2qbi n MET 141 Cb 0.06 -1.42 -0.06 0.00 -0.71 0.00 0.00 33.22 31.09 2qbi n MET 141 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qbi n ALA 142 N 0.80 -2.10 -2.85 3.04 0.00 0.40 -4.94 120.51 114.85 2qbi n ALA 142 Ca 0.16 -0.40 -0.24 0.00 0.00 0.00 0.00 53.44 52.96 2qbi n ALA 142 Cb 0.43 -1.27 -0.16 0.00 0.00 0.00 0.00 19.45 18.45 2qbi n ALA 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qbi s LEU 143 N -7.28 1.90 -0.00 0.00 1.43 -0.42 -4.98 118.68 109.33 2qbi s LEU 143 Ca 0.08 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 2qbi s LEU 143 Cb -0.04 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.38 2qbi s LEU 143 CO 0.97 0.14 0.14 -1.83 0.23 0.00 0.00 176.35 176.00 2qbi s GLU 144 N -0.01 0.47 -1.00 1.70 -1.05 -1.26 -4.46 118.70 113.09 2qbi s GLU 144 Ca -0.01 -0.37 -0.05 0.00 -0.15 0.00 0.00 54.97 54.39 2qbi s GLU 144 Cb -0.09 0.20 -0.06 0.00 -0.44 0.00 0.00 34.13 33.74 2qbi s GLU 144 CO 0.01 -0.11 0.88 -3.47 0.95 0.00 0.00 175.26 173.52 2qbi n ASP 145 N 1.52 -6.82 -4.50 0.83 -0.08 -1.09 -4.71 116.55 101.70 2qbi n ASP 145 Ca -0.22 -0.61 -0.24 0.00 -1.51 0.00 0.00 54.79 52.21 2qbi n ASP 145 Cb 0.56 -5.19 -0.10 0.00 2.34 0.00 0.00 41.12 38.73 2qbi n ASP 145 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2qbi s VAL 146 N -3.32 2.51 -0.18 5.18 1.01 -1.20 -1.88 120.40 122.52 2qbi s VAL 146 Ca 0.38 -2.33 -0.22 0.00 0.00 0.00 0.00 61.98 59.81 2qbi s VAL 146 Cb -0.05 -2.40 -0.22 0.00 0.00 0.00 0.00 36.38 33.71 2qbi s VAL 146 CO 0.74 -0.36 0.37 0.25 0.00 0.00 0.00 175.10 176.10 2qbi h LEU 147 N 2.19 0.07 -1.48 3.92 7.12 -0.55 -3.30 115.31 123.28 2qbi h LEU 147 Ca -0.41 -0.67 -0.31 0.00 0.13 0.00 0.00 57.88 56.63 2qbi h LEU 147 Cb 1.26 -0.02 0.14 0.00 -0.53 0.00 0.00 40.66 41.51 2qbi h LEU 147 CO 0.62 1.43 -0.67 -0.38 -0.13 0.00 0.00 178.44 179.31 2qbi n ILE 148 N -4.36 -4.67 -2.17 4.05 2.08 -1.26 -3.69 119.36 109.34 2qbi n ILE 148 Ca -0.27 -0.33 -0.43 0.00 0.56 0.00 0.00 62.75 62.28 2qbi n ILE 148 Cb 0.69 -4.47 -0.02 0.00 -0.75 0.00 0.00 39.64 35.08 2qbi n ILE 148 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2qbi s ILE 149 N -3.31 3.67 0.77 1.39 2.07 -1.26 -3.72 121.20 120.81 2qbi s ILE 149 Ca 0.13 0.67 -0.13 0.00 -1.41 0.00 0.00 60.65 59.92 2qbi s ILE 149 Cb -0.06 -3.94 0.18 0.00 0.13 0.00 0.00 42.46 38.77 2qbi s ILE 149 CO 0.65 -0.62 0.95 1.07 -1.91 0.00 0.00 174.94 175.08 2qbi n THR 150 N 7.24 0.00 -0.12 4.00 5.66 0.46 -2.92 114.28 128.60 2qbi n THR 150 Ca 0.19 -0.65 -0.16 0.00 -3.05 0.00 0.00 64.05 60.38 2qbi n THR 150 Cb 0.48 -1.54 -0.13 0.00 -1.55 0.00 0.00 70.33 67.58 2qbi n THR 150 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qbi n GLY 151 N -1.75 -0.55 0.00 1.09 0.00 -1.26 -3.47 105.19 99.24 2qbi n GLY 151 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2qbi n GLY 151 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qbi n GLU 152 N -3.13 0.15 -1.48 1.61 4.07 -1.26 -4.39 120.64 116.22 2qbi n GLU 152 Ca -0.42 -0.10 0.19 0.00 -0.06 0.00 0.00 57.16 56.77 2qbi n GLU 152 Cb 1.04 -0.52 -0.08 0.00 -0.06 0.00 0.00 31.44 31.82 2qbi n GLU 152 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2qbi n LEU 153 N -0.05 -0.94 -3.30 4.31 0.00 -1.26 -5.03 117.00 110.73 2qbi n LEU 153 Ca 0.00 2.15 0.03 0.00 0.00 0.00 0.00 56.01 58.19 2qbi n LEU 153 Cb 0.15 -4.43 -0.04 0.00 0.00 0.00 0.00 43.42 39.10 2qbi n LEU 153 CO 0.00 -2.89 0.70 1.51 0.00 0.00 0.00 177.39 176.71 2qbi s ASP 154 N -7.31 -0.41 0.66 1.96 1.47 -1.26 -5.02 116.67 106.76 2qbi s ASP 154 Ca 0.00 0.51 0.32 0.00 1.18 0.00 0.00 52.55 54.56 2qbi s ASP 154 Cb 0.00 1.45 1.74 0.00 -0.34 0.00 0.00 42.92 45.77 2qbi s ASP 154 CO 0.00 -0.08 1.99 -0.33 0.68 0.00 0.00 175.17 177.44 2qbi h GLU 155 N 7.44 0.00 0.00 2.11 4.39 -1.96 0.63 114.58 127.19 2qbi h GLU 155 Ca -0.15 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.54 2qbi h GLU 155 Cb 1.13 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 2qbi h GLU 155 CO 0.05 0.00 -0.04 -0.97 -1.16 0.00 0.00 179.01 176.89 2qbi h ASN 156 N 0.00 0.00 0.00 1.42 -1.24 -1.96 1.15 115.58 114.96 2qbi h ASN 156 Ca 0.02 0.00 -0.18 0.00 0.71 0.00 0.00 56.30 56.85 2qbi h ASN 156 Cb 0.59 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.61 2qbi h ASN 156 CO -0.00 0.04 -1.67 -0.11 -1.29 0.00 0.00 177.43 174.40 2qbi n LEU 157 N -3.39 1.56 -0.00 0.34 7.94 0.17 -3.39 117.00 120.23 2qbi n LEU 157 Ca -0.02 -0.03 0.01 0.00 -1.11 0.00 0.00 56.01 54.86 2qbi n LEU 157 Cb 0.17 -0.11 0.35 0.00 0.53 0.00 0.00 43.42 44.36 2qbi n LEU 157 CO 0.26 0.48 1.03 0.15 -1.11 0.00 0.00 177.39 178.20 2qbi h PHE 158 N 0.00 0.54 -0.19 1.96 3.04 0.12 0.16 116.94 122.57 2qbi h PHE 158 Ca -0.26 -0.03 -0.04 0.00 3.98 0.00 0.00 57.97 61.62 2qbi h PHE 158 Cb 1.50 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 39.83 2qbi h PHE 158 CO 0.01 0.45 -0.08 -0.07 -2.02 0.00 0.00 178.31 176.60 2qbi h LEU 159 N 0.53 0.27-10.56 0.59 4.07 0.11 -3.38 115.31 106.94 2qbi h LEU 159 Ca 0.13 -0.05 -0.47 0.00 0.08 0.00 0.00 57.88 57.57 2qbi h LEU 159 Cb 0.17 -0.07 0.09 0.00 1.08 0.00 0.00 40.66 41.93 2qbi h LEU 159 CO -0.01 0.39 0.35 0.00 -1.08 0.00 0.00 178.44 178.10 2qbi s ALA 160 N -4.82 2.86 0.00 1.53 0.00 0.56 -3.53 121.76 118.36 2qbi s ALA 160 Ca -0.06 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.26 2qbi s ALA 160 Cb 0.16 -2.87 0.00 0.00 0.00 0.00 0.00 23.12 20.41 2qbi s ALA 160 CO 0.73 -1.41 0.00 0.00 0.00 0.00 0.00 175.76 175.08 2qbi n ALA 161 N -3.11 0.00 -0.66 0.00 0.00 -1.26 -4.84 120.51 110.64 2qbi n ALA 161 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2qbi n ALA 161 Cb 0.60 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2qbi n ALA 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qbi n ARG 162 N -2.00 0.00 0.06 0.00 1.74 -1.23 -3.60 116.66 111.63 2qbi n ARG 162 Ca 0.00 0.17 0.19 0.00 -0.77 0.00 0.00 57.85 57.44 2qbi n ARG 162 Cb 0.00 -0.91 0.71 0.00 -1.02 0.00 0.00 32.46 31.24 2qbi n ARG 162 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2qbi h ASN 163 N 0.00 0.00 -2.50 0.55 2.35 -1.88 -3.38 115.58 110.71 2qbi h ASN 163 Ca 0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 2qbi h ASN 163 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2qbi h ASN 163 CO 0.00 0.00 1.24 -0.76 -1.65 0.00 0.00 177.43 176.26 2qbi s LEU 164 N -8.55 3.87 0.00 1.61 1.43 -1.24 -4.95 118.68 110.86 2qbi s LEU 164 Ca -0.05 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.92 2qbi s LEU 164 Cb 0.19 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.88 2qbi s LEU 164 CO 0.69 -1.41 0.06 1.57 0.23 0.00 0.00 176.35 177.49 2qbi n HIS 165 N 9.14 0.00 -1.00 0.29 -0.00 -1.26 -4.14 115.22 118.25 2qbi n HIS 165 Ca 0.22 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.57 2qbi n HIS 165 Cb 0.44 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.33 2qbi n HIS 165 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2qbi n LYS 166 N -0.07 0.47 0.00 1.57 4.76 -1.26 -4.68 118.16 118.95 2qbi n LYS 166 Ca 0.00 -1.45 0.00 0.00 -2.87 0.00 0.00 58.31 53.99 2qbi n LYS 166 Cb 0.00 -3.00 0.00 0.00 -1.84 0.00 0.00 35.03 30.19 2qbi n LYS 166 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 2qbi n VAL 167 N 7.31 0.00 -3.54 -0.18 3.14 -1.26 -2.68 118.33 121.12 2qbi n VAL 167 Ca 0.46 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.62 2qbi n VAL 167 Cb 0.43 0.00 -0.15 0.00 -1.06 0.00 0.00 33.84 33.06 2qbi n VAL 167 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2qbi s ASP 168 N 0.00 1.95 -0.75 6.55 3.68 -1.24 -4.71 116.67 122.15 2qbi s ASP 168 Ca 0.00 -0.48 -0.26 0.00 2.13 0.00 0.00 52.55 53.93 2qbi s ASP 168 Cb 0.00 0.07 0.02 0.00 -1.45 0.00 0.00 42.92 41.56 2qbi s ASP 168 CO 0.00 -0.35 1.41 0.68 0.13 0.00 0.00 175.17 177.05 2qbi s VAL 169 N 2.23 3.67 0.35 1.11 -7.23 -1.24 -4.42 120.40 114.86 2qbi s VAL 169 Ca 0.05 0.24 0.05 0.00 -1.81 0.00 0.00 61.98 60.51 2qbi s VAL 169 Cb -0.16 -4.74 -0.01 0.00 0.56 0.00 0.00 36.38 32.03 2qbi s VAL 169 CO -0.13 -1.68 0.50 -0.13 -0.31 0.00 0.00 175.10 173.35 2qbi s ARG 170 N 5.92 3.16 0.58 4.82 3.00 -1.24 -4.87 118.95 130.32 2qbi s ARG 170 Ca 0.43 -0.83 -0.06 0.00 0.00 0.00 0.00 55.73 55.26 2qbi s ARG 170 Cb -0.08 -2.77 0.13 0.00 0.00 0.00 0.00 34.95 32.23 2qbi s ARG 170 CO 0.13 0.04 0.80 -3.47 0.00 0.00 0.00 175.30 172.80 2qbi n ASP 171 N -1.71 0.45 0.06 0.23 2.03 -1.26 -0.40 116.55 115.94 2qbi n ASP 171 Ca -0.01 -1.52 -0.13 0.00 0.52 0.00 0.00 54.79 53.64 2qbi n ASP 171 Cb 0.58 -0.57 -0.04 0.00 -0.72 0.00 0.00 41.12 40.36 2qbi n ASP 171 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qbi h ALA 172 N -1.28 0.37 0.00 -1.67 0.00 -1.76 -3.12 119.26 111.80 2qbi h ALA 172 Ca -0.26 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 53.87 2qbi h ALA 172 Cb 0.81 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2qbi h ALA 172 CO 0.22 0.81 -0.57 1.79 0.00 0.00 0.00 179.25 181.50 2qbi h THR 173 N 0.24 0.48 0.00 0.00 1.35 -1.92 -3.19 112.91 109.87 2qbi h THR 173 Ca -0.08 -1.73 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 2qbi h THR 173 Cb 1.56 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 70.13 2qbi h THR 173 CO 0.16 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.32 2qbi n GLY 174 N 1.21 0.29 3.67 5.82 0.00 -1.18 -4.88 105.19 110.12 2qbi n GLY 174 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2qbi n GLY 174 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qbi n ILE 175 N -0.23 3.50 -3.91 -0.61 3.06 -1.21 -4.66 119.36 115.31 2qbi n ILE 175 Ca 0.00 -0.50 -0.17 0.00 -2.50 0.00 0.00 62.75 59.58 2qbi n ILE 175 Cb 0.13 -1.38 -0.16 0.00 0.54 0.00 0.00 39.64 38.77 2qbi n ILE 175 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2qbi s ASP 176 N -0.99 0.46 0.04 9.51 -1.08 -1.26 -5.07 116.67 118.27 2qbi s ASP 176 Ca 0.71 -0.02 -0.25 0.00 -0.52 0.00 0.00 52.55 52.47 2qbi s ASP 176 Cb -0.45 -0.22 -0.14 0.00 -1.46 0.00 0.00 42.92 40.66 2qbi s ASP 176 CO 0.50 -0.11 1.38 -0.65 0.52 0.00 0.00 175.17 176.81 2qbi h PRO 177 N 7.33 -0.85 -0.15 4.34 0.11 -1.98 0.50 132.00 141.30 2qbi h PRO 177 Ca -0.41 0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.80 2qbi h PRO 177 Cb 1.13 0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 2qbi h PRO 177 CO 0.46 -0.56 0.12 -0.24 -0.21 0.00 0.00 178.00 177.57 2qbi h VAL 178 N -0.88 0.77 -0.04 3.15 3.04 -1.92 -2.29 116.25 118.08 2qbi h VAL 178 Ca -0.09 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.51 2qbi h VAL 178 Cb 0.68 0.91 0.01 0.00 -2.01 0.00 0.00 31.29 30.88 2qbi h VAL 178 CO 0.12 0.00 -0.34 0.28 -1.01 0.00 0.00 177.57 176.62 2qbi h SER 179 N 0.00 0.37 -0.63 3.17 0.02 -1.89 -1.18 113.55 113.42 2qbi h SER 179 Ca 0.07 -0.69 0.09 0.00 -0.84 0.00 0.00 61.79 60.42 2qbi h SER 179 Cb 0.31 -0.11 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 2qbi h SER 179 CO -0.00 1.01 0.27 -0.07 -1.14 0.00 0.00 176.83 176.90 2qbi h LEU 180 N -0.24 0.31 -0.92 5.07 3.38 -0.33 0.29 115.31 122.86 2qbi h LEU 180 Ca -0.03 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2qbi h LEU 180 Cb 1.03 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2qbi h LEU 180 CO 0.07 0.19 -0.16 -0.29 0.09 0.00 0.00 178.44 178.33 2qbi h ILE 181 N 0.48 0.36 -2.25 1.22 2.10 -1.53 -3.45 117.51 114.43 2qbi h ILE 181 Ca 0.31 -1.06 -0.09 0.00 1.08 0.00 0.00 64.86 65.10 2qbi h ILE 181 Cb 0.35 1.80 0.04 0.00 -1.09 0.00 0.00 36.82 37.93 2qbi h ILE 181 CO -0.28 0.16 0.07 0.00 -1.08 0.00 0.00 178.15 177.02 2qbi n ALA 182 N -2.17 -0.47 -0.91 0.18 0.00 0.10 -4.89 120.51 112.35 2qbi n ALA 182 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2qbi n ALA 182 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2qbi n ALA 182 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2qbi n PHE 183 N -2.60 -0.30 0.00 0.00 3.01 -1.26 -4.67 117.46 111.65 2qbi n PHE 183 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 2qbi n PHE 183 Cb 0.13 0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 2qbi n PHE 183 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2qbi n ASP 184 N -2.66 2.14 -3.76 4.37 8.00 -0.79 -5.05 116.55 118.80 2qbi n ASP 184 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2qbi n ASP 184 Cb 0.00 0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 41.19 2qbi n ASP 184 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2qbi s LYS 185 N -1.44 0.47 -0.11 -1.24 1.02 -0.92 -4.84 119.74 112.69 2qbi s LYS 185 Ca 0.00 0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.30 2qbi s LYS 185 Cb 0.00 0.22 -0.02 0.00 -0.52 0.00 0.00 37.83 37.51 2qbi s LYS 185 CO 0.00 -0.08 -0.12 0.54 -0.92 0.00 0.00 175.35 174.76 2qbi s VAL 186 N -0.20 3.15 0.00 3.17 0.11 0.30 0.20 120.40 127.12 2qbi s VAL 186 Ca -0.03 -0.65 0.00 0.00 -2.93 0.00 0.00 61.98 58.37 2qbi s VAL 186 Cb -0.03 -2.30 0.00 0.00 -1.53 0.00 0.00 36.38 32.52 2qbi s VAL 186 CO 0.01 0.54 0.00 0.52 -3.33 0.00 0.00 175.10 172.85 2qbi n VAL 187 N 3.12 0.00 -1.83 2.04 0.31 -1.26 0.44 118.33 121.15 2qbi n VAL 187 Ca -0.18 0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2qbi n VAL 187 Cb 0.53 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 2qbi n VAL 187 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2qbi n MET 188 N -0.50 -4.38 -2.22 5.55 0.00 -1.15 -2.49 117.12 111.93 2qbi n MET 188 Ca 0.00 3.22 -0.28 0.00 0.00 0.00 0.00 57.70 60.64 2qbi n MET 188 Cb 0.00 -3.51 0.04 0.00 0.00 0.00 0.00 33.22 29.75 2qbi n MET 188 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2qbi s THR 189 N -0.43 3.65 0.60 1.12 -4.23 -1.18 -2.84 115.64 112.33 2qbi s THR 189 Ca 0.00 0.18 0.29 0.00 -1.18 0.00 0.00 61.69 60.98 2qbi s THR 189 Cb 0.00 -3.48 0.36 0.00 1.34 0.00 0.00 72.50 70.72 2qbi s THR 189 CO 0.00 -0.54 1.97 0.00 -0.54 0.00 0.00 174.62 175.50 2qbi h ALA 190 N -0.33 1.91 0.14 3.99 0.00 -1.83 0.37 119.26 123.51 2qbi h ALA 190 Ca -0.45 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.13 2qbi h ALA 190 Cb 1.25 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2qbi h ALA 190 CO 0.62 -0.52 -1.61 0.22 0.00 0.00 0.00 179.25 177.96 2qbi h ASP 191 N 0.00 0.45 -0.06 0.00 1.82 -1.92 -3.26 116.42 113.46 2qbi h ASP 191 Ca 0.14 -0.89 0.02 0.00 -0.39 0.00 0.00 57.03 55.92 2qbi h ASP 191 Cb 0.87 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 40.71 2qbi h ASP 191 CO -0.00 1.71 -0.09 0.00 -1.61 0.00 0.00 179.24 179.24 2qbi h ALA 192 N 0.01 -0.05 -0.87 -0.78 0.00 -1.27 -0.63 119.26 115.67 2qbi h ALA 192 Ca -0.34 0.03 0.18 0.00 0.00 0.00 0.00 54.91 54.78 2qbi h ALA 192 Cb 1.90 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 19.80 2qbi h ALA 192 CO 0.09 -0.57 0.57 0.28 0.00 0.00 0.00 179.25 179.63 2qbi h VAL 193 N -0.13 0.73 -0.46 0.00 2.07 -1.24 0.38 116.25 117.60 2qbi h VAL 193 Ca 0.06 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 2qbi h VAL 193 Cb 0.21 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 2qbi h VAL 193 CO -0.14 0.09 0.18 0.50 0.02 0.00 0.00 177.57 178.22 2qbi h LYS 194 N 0.48 0.69 -0.09 1.57 3.64 -1.18 0.22 116.57 121.91 2qbi h LYS 194 Ca 0.45 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 59.62 2qbi h LYS 194 Cb 1.00 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2qbi h LYS 194 CO -0.18 0.63 -0.28 1.96 -2.27 0.00 0.00 179.45 179.31 2qbi h GLN 195 N 0.60 0.35 0.00 1.90 4.20 -0.14 -2.53 115.11 119.50 2qbi h GLN 195 Ca 0.15 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2qbi h GLN 195 Cb 0.20 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2qbi h GLN 195 CO -0.01 0.87 0.00 0.28 -0.67 0.00 0.00 178.83 179.30 2qbi n VAL 196 N -4.45 1.12 -0.03 -0.54 0.31 0.11 0.58 118.33 115.43 2qbi n VAL 196 Ca -0.08 0.36 -0.13 0.00 -0.01 0.00 0.00 64.34 64.48 2qbi n VAL 196 Cb 0.47 -1.25 -0.11 0.00 -0.91 0.00 0.00 33.84 32.03 2qbi n VAL 196 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2qbi h GLU 197 N 0.00 -0.02 0.00 5.55 4.57 -0.12 -3.19 114.58 121.38 2qbi h GLU 197 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2qbi h GLU 197 Cb 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 2qbi h GLU 197 CO 0.00 0.67 -0.52 1.05 -1.18 0.00 0.00 179.01 179.03 2qbi h GLU 198 N -0.73 0.00 -0.37 1.92 9.09 -1.23 -3.28 114.58 119.98 2qbi h GLU 198 Ca -0.00 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.41 2qbi h GLU 198 Cb 0.69 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.77 2qbi h GLU 198 CO 0.00 0.00 0.25 1.98 0.05 0.00 0.00 179.01 181.29 2qbi h MET 199 N 0.00 0.48 -5.47 1.06 4.05 0.08 -3.40 114.93 111.73 2qbi h MET 199 Ca 0.00 -0.03 -0.64 0.00 -0.28 0.00 0.00 59.70 58.76 2qbi h MET 199 Cb 0.88 -0.11 -0.11 0.00 -0.80 0.00 0.00 31.60 31.46 2qbi h MET 199 CO 0.00 0.31 -0.50 -0.51 0.23 0.00 0.00 176.91 176.44 2qbi s LEU 200 N -9.44 4.19 0.00 3.39 2.01 -1.20 -5.05 118.68 112.57 2qbi s LEU 200 Ca -0.08 0.30 0.00 0.00 0.01 0.00 0.00 54.13 54.36 2qbi s LEU 200 Cb 0.17 -2.05 0.00 0.00 0.01 0.00 0.00 46.19 44.33 2qbi s LEU 200 CO 0.72 0.28 0.00 0.00 1.01 0.00 0.00 176.35 178.37