#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qba n LYS 2 N 0.00 -0.35 -0.05 0.00 2.85 -1.26 0.22 118.16 119.57 2qba n LYS 2 Ca 0.00 1.29 -0.10 0.00 -1.05 0.00 0.00 58.31 58.45 2qba n LYS 2 Cb 0.00 -1.90 0.05 0.00 -0.65 0.00 0.00 35.03 32.53 2qba n LYS 2 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2qba h LEU 3 N 0.00 0.76 -0.35 -5.58 7.12 -1.98 -2.80 115.31 112.48 2qba h LEU 3 Ca 0.13 -0.35 0.04 0.00 0.13 0.00 0.00 57.88 57.82 2qba h LEU 3 Cb 0.33 -0.21 -0.07 0.00 -0.53 0.00 0.00 40.66 40.18 2qba h LEU 3 CO -0.75 1.08 -0.43 -0.74 -0.13 0.00 0.00 178.44 177.47 2qba h HIS 4 N 0.57 -1.34 0.11 1.25 2.76 -0.60 0.38 115.15 118.29 2qba h HIS 4 Ca 0.04 0.07 0.01 0.00 -2.20 0.00 0.00 60.37 58.28 2qba h HIS 4 Cb 0.97 0.63 -0.01 0.00 1.55 0.00 0.00 27.41 30.55 2qba h HIS 4 CO 0.05 -0.37 -0.12 -0.44 -1.30 0.00 0.00 177.93 175.74 2qba h ASP 5 N -0.29 -0.33 -1.21 3.26 5.19 -0.61 -1.36 116.42 121.08 2qba h ASP 5 Ca 0.06 0.03 0.38 0.00 -0.62 0.00 0.00 57.03 56.88 2qba h ASP 5 Cb 0.45 0.12 -0.12 0.00 0.18 0.00 0.00 39.33 39.96 2qba h ASP 5 CO -0.48 -0.19 0.77 0.22 -3.12 0.00 0.00 179.24 176.45 2qba h TYR 6 N -0.27 0.59 0.79 4.55 5.03 -1.04 0.15 116.97 126.76 2qba h TYR 6 Ca 0.01 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.30 2qba h TYR 6 Cb 0.26 -0.15 0.01 0.00 1.55 0.00 0.00 36.73 38.39 2qba h TYR 6 CO -0.13 -0.14 -0.38 -0.92 -1.32 0.00 0.00 178.16 175.28 2qba h TYR 7 N 0.18 -0.98 -0.14 -3.82 3.20 0.88 -0.86 116.97 115.43 2qba h TYR 7 Ca 0.75 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.61 2qba h TYR 7 Cb 2.21 0.32 -0.02 0.00 1.54 0.00 0.00 36.73 40.78 2qba h TYR 7 CO -0.01 -0.61 -0.15 -0.22 -1.64 0.00 0.00 178.16 175.53 2qba h LYS 8 N -1.23 -0.08 0.00 1.82 3.11 -0.43 -1.69 116.57 118.07 2qba h LYS 8 Ca -0.11 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 2qba h LYS 8 Cb 0.81 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.06 2qba h LYS 8 CO 0.18 -0.05 0.00 -0.25 -2.81 0.00 0.00 179.45 176.51 2qba n ASP 9 N -3.46 0.00 -0.11 4.20 9.92 -0.77 -4.36 116.55 121.98 2qba n ASP 9 Ca -0.01 0.07 -0.03 0.00 -0.53 0.00 0.00 54.79 54.29 2qba n ASP 9 Cb 0.09 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.54 2qba n ASP 9 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2qba h GLU 10 N 0.00 -0.02 0.00 -1.24 4.22 -1.49 -3.37 114.58 112.68 2qba h GLU 10 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2qba h GLU 10 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qba h GLU 10 CO 0.00 -0.01 0.00 0.28 -2.18 0.00 0.00 179.01 177.10 2qba n VAL 11 N -3.61 0.00 0.00 0.32 0.31 -0.41 -3.76 118.33 111.18 2qba n VAL 11 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2qba n VAL 11 Cb 0.08 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 2qba n VAL 11 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2qba n VAL 12 N -0.86 0.00 -0.29 2.52 0.31 -1.15 -3.82 118.33 115.05 2qba n VAL 12 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.37 2qba n VAL 12 Cb 0.00 0.00 0.18 0.00 -0.91 0.00 0.00 33.84 33.11 2qba n VAL 12 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 2qba h LYS 13 N 0.00 0.69 -0.81 5.55 2.10 -1.73 0.81 116.57 123.18 2qba h LYS 13 Ca 0.00 -0.04 0.11 0.00 -2.00 0.00 0.00 60.65 58.72 2qba h LYS 13 Cb 0.00 -0.15 -0.08 0.00 -0.90 0.00 0.00 32.23 31.10 2qba h LYS 13 CO 0.00 0.45 0.43 -0.22 -2.00 0.00 0.00 179.45 178.11 2qba h LYS 14 N 0.71 0.66 -0.01 0.07 3.11 -1.66 0.15 116.57 119.61 2qba h LYS 14 Ca 0.42 -0.04 -0.23 0.00 -2.81 0.00 0.00 60.65 57.98 2qba h LYS 14 Cb 0.47 -0.15 0.01 0.00 -1.00 0.00 0.00 32.23 31.56 2qba h LYS 14 CO -0.29 0.44 -0.95 -0.07 -2.81 0.00 0.00 179.45 175.76 2qba h LEU 15 N 0.68 0.62 -1.30 5.20 3.38 -1.26 -2.21 115.31 120.42 2qba h LEU 15 Ca 0.41 -0.49 0.07 0.00 0.09 0.00 0.00 57.88 57.96 2qba h LEU 15 Cb 0.47 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 2qba h LEU 15 CO -0.29 1.29 0.52 0.24 0.09 0.00 0.00 178.44 180.28 2qba h MET 16 N 0.27 0.82 -0.01 1.13 2.86 0.25 0.44 114.93 120.68 2qba h MET 16 Ca -0.09 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2qba h MET 16 Cb 1.59 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 33.07 2qba h MET 16 CO 0.17 0.54 -0.29 0.25 1.06 0.00 0.00 176.91 178.64 2qba n THR 17 N -4.49 0.00 0.00 2.22 -2.24 0.33 -2.62 114.28 107.49 2qba n THR 17 Ca 0.12 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2qba n THR 17 Cb 0.23 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 2qba n THR 17 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2qba n GLU 18 N -0.04 0.00 0.00 -0.78 0.00 -0.18 -4.50 120.64 115.15 2qba n GLU 18 Ca 0.12 0.09 0.15 0.00 0.00 0.00 0.00 57.16 57.52 2qba n GLU 18 Cb 0.43 -0.42 0.84 0.00 0.00 0.00 0.00 31.44 32.29 2qba n GLU 18 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2qba n PHE 19 N -1.67 0.00 -3.37 4.31 3.01 -0.03 -4.94 117.46 114.77 2qba n PHE 19 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.28 2qba n PHE 19 Cb 0.00 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.51 2qba n PHE 19 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2qba n ASN 20 N -0.74 -6.37 -4.64 4.37 5.15 -1.08 -4.91 115.26 107.04 2qba n ASN 20 Ca 0.22 -0.73 -0.43 0.00 -0.60 0.00 0.00 54.58 53.05 2qba n ASN 20 Cb 0.17 -4.60 -0.02 0.00 -0.53 0.00 0.00 39.78 34.80 2qba n ASN 20 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2qba s TYR 21 N -3.35 2.81 0.47 1.20 2.02 -1.13 -4.89 117.35 114.47 2qba s TYR 21 Ca 0.40 0.97 0.31 0.00 -0.37 0.00 0.00 57.07 58.37 2qba s TYR 21 Cb -0.08 -3.72 1.66 0.00 -0.40 0.00 0.00 41.96 39.41 2qba s TYR 21 CO 0.78 -1.57 2.15 -2.95 -1.57 0.00 0.00 175.55 172.39 2qba h ASN 22 N 8.75 0.00 -3.62 2.29 -1.07 -1.90 -3.42 115.58 116.61 2qba h ASN 22 Ca -0.25 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 55.63 2qba h ASN 22 Cb 1.09 0.00 -0.32 0.00 -2.07 0.00 0.00 38.32 37.02 2qba h ASN 22 CO 1.01 0.07 -0.81 -0.55 0.07 0.00 0.00 177.43 177.22 2qba s SER 23 N -5.99 1.58 0.51 6.14 0.15 -1.26 -5.00 113.70 109.83 2qba s SER 23 Ca -0.03 -0.26 0.28 0.00 0.70 0.00 0.00 55.95 56.64 2qba s SER 23 Cb 0.13 -0.60 1.40 0.00 -1.71 0.00 0.00 66.02 65.24 2qba s SER 23 CO 0.55 0.05 1.89 1.62 1.20 0.00 0.00 173.24 178.55 2qba h VAL 24 N 5.70 0.58 -0.13 4.45 3.04 -2.02 -1.99 116.25 125.89 2qba h VAL 24 Ca -0.33 -0.03 -0.41 0.00 -1.01 0.00 0.00 66.70 64.92 2qba h VAL 24 Cb 1.18 0.49 -0.04 0.00 -2.01 0.00 0.00 31.29 30.90 2qba h VAL 24 CO 0.48 0.02 1.32 0.80 -1.01 0.00 0.00 177.57 179.17 2qba n MET 25 N -4.33 2.76 0.00 4.17 0.00 -1.26 -2.90 117.12 115.56 2qba n MET 25 Ca 0.18 -1.64 0.00 0.00 -0.00 0.00 0.00 57.70 56.24 2qba n MET 25 Cb 0.89 -2.33 0.00 0.00 0.00 0.00 0.00 33.22 31.79 2qba n MET 25 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 2qba n GLN 26 N 2.73 0.94 -1.61 2.12 0.00 -0.75 -5.08 117.38 115.73 2qba n GLN 26 Ca 0.57 0.00 -0.45 0.00 -0.00 0.00 0.00 57.00 57.13 2qba n GLN 26 Cb 0.62 -0.20 -0.04 0.00 0.00 0.00 0.00 30.24 30.62 2qba n GLN 26 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2qba n VAL 27 N -0.30 0.48 -1.42 1.69 0.24 -1.14 -4.80 118.33 113.07 2qba n VAL 27 Ca 0.00 -0.30 -0.48 0.00 -2.04 0.00 0.00 64.34 61.53 2qba n VAL 27 Cb 0.00 -2.29 -0.11 0.00 -1.47 0.00 0.00 33.84 29.97 2qba n VAL 27 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2qba n PRO 28 N 8.04 0.30 -2.22 7.34 -0.02 -1.26 -4.92 135.00 142.25 2qba n PRO 28 Ca 0.27 0.05 -0.27 0.00 -2.02 0.00 0.00 63.50 61.53 2qba n PRO 28 Cb 0.39 -1.88 0.17 0.00 -0.02 0.00 0.00 33.50 32.17 2qba n PRO 28 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qba s ARG 29 N 7.54 0.81 -0.38 -0.52 3.00 -1.26 -4.92 118.95 123.21 2qba s ARG 29 Ca 1.23 -0.83 -0.18 0.00 0.00 0.00 0.00 55.73 55.94 2qba s ARG 29 Cb -1.15 -2.03 0.01 0.00 0.00 0.00 0.00 34.95 31.78 2qba s ARG 29 CO 0.52 -2.19 0.52 0.08 0.00 0.00 0.00 175.30 174.23 2qba s VAL 30 N -3.65 5.00 -1.09 3.52 1.01 -1.26 -3.46 120.40 120.47 2qba s VAL 30 Ca 0.73 0.17 -0.10 0.00 0.00 0.00 0.00 61.98 62.79 2qba s VAL 30 Cb -0.03 -4.02 0.26 0.00 0.00 0.00 0.00 36.38 32.60 2qba s VAL 30 CO 0.50 -0.32 1.10 -0.70 0.00 0.00 0.00 175.10 175.69 2qba s GLU 31 N 2.42 4.13 0.12 2.72 2.56 -1.12 -4.94 118.70 124.59 2qba s GLU 31 Ca 0.18 -3.08 0.00 0.00 0.00 0.00 0.00 54.97 52.07 2qba s GLU 31 Cb -0.15 -4.58 0.00 0.00 2.00 0.00 0.00 34.13 31.39 2qba s GLU 31 CO 0.14 -1.29 0.00 0.36 -0.56 0.00 0.00 175.26 173.91 2qba n LYS 32 N 3.09 -1.01 -2.59 4.30 0.00 -1.26 -4.46 118.16 116.24 2qba n LYS 32 Ca 0.24 0.75 -0.29 0.00 -0.00 0.00 0.00 58.31 59.00 2qba n LYS 32 Cb 0.40 -1.25 -0.01 0.00 -0.00 0.00 0.00 35.03 34.18 2qba n LYS 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2qba s ILE 33 N -3.14 4.81 -0.04 0.58 1.01 -1.23 -4.51 121.20 118.68 2qba s ILE 33 Ca 0.00 0.52 -0.06 0.00 0.00 0.00 0.00 60.65 61.11 2qba s ILE 33 Cb 0.00 -3.81 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 2qba s ILE 33 CO 0.00 -0.76 -0.12 0.35 0.00 0.00 0.00 174.94 174.41 2qba n THR 34 N -1.94 0.80 -1.08 2.92 -2.24 -1.12 0.93 114.28 112.56 2qba n THR 34 Ca 0.02 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 2qba n THR 34 Cb 0.54 -1.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.05 2qba n THR 34 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2qba n LEU 35 N -3.40 -1.58 0.06 3.22 4.77 -1.25 -2.01 117.00 116.81 2qba n LEU 35 Ca -0.05 2.03 0.00 0.00 -0.03 0.00 0.00 56.01 57.96 2qba n LEU 35 Cb 0.18 -1.75 0.00 0.00 -2.33 0.00 0.00 43.42 39.52 2qba n LEU 35 CO 0.07 -0.01 0.00 -3.20 -1.33 0.00 0.00 177.39 172.92 2qba n ASN 36 N -1.42 -0.48 -2.95 -1.43 5.15 -0.43 -3.90 115.26 109.80 2qba n ASN 36 Ca 0.00 0.21 -0.09 0.00 -0.60 0.00 0.00 54.58 54.11 2qba n ASN 36 Cb 0.12 0.60 0.01 0.00 -0.53 0.00 0.00 39.78 39.98 2qba n ASN 36 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 2qba n MET 37 N -2.83 -2.14 -2.67 1.20 0.00 -1.26 -3.09 117.12 106.33 2qba n MET 37 Ca 0.00 1.94 -0.43 0.00 -0.00 0.00 0.00 57.70 59.22 2qba n MET 37 Cb 0.00 -5.43 -0.01 0.00 0.00 0.00 0.00 33.22 27.78 2qba n MET 37 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2qba s GLY 38 N -2.62 1.66 0.59 -5.12 0.00 -1.26 -3.53 107.32 97.04 2qba s GLY 38 Ca 0.20 -2.75 0.35 0.00 0.00 0.00 0.00 44.72 42.53 2qba s GLY 38 CO 0.77 2.53 2.08 -0.24 0.00 0.00 0.00 173.10 178.24 2qba h VAL 39 N 5.87 0.00 0.00 1.40 3.04 -1.75 -3.46 116.25 121.35 2qba h VAL 39 Ca 0.31 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.00 2qba h VAL 39 Cb 0.94 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.00 2qba h VAL 39 CO 1.38 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 178.55 2qba n GLY 40 N -1.16 2.74 5.55 3.17 0.00 0.44 -4.55 105.19 111.38 2qba n GLY 40 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2qba n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qba n GLU 41 N 14.00 0.00 0.00 1.61 -0.58 -1.26 -4.64 120.64 129.77 2qba n GLU 41 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2qba n GLU 41 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2qba n GLU 41 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qba n ALA 42 N 5.71 0.00 -0.68 0.62 0.00 -1.26 -4.19 120.51 120.72 2qba n ALA 42 Ca 0.00 0.00 0.52 0.00 0.00 0.00 0.00 53.44 53.96 2qba n ALA 42 Cb 0.00 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.26 2qba n ALA 42 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2qba h ILE 43 N 0.00 0.01 0.00 0.00 6.09 -1.86 0.89 117.51 122.64 2qba h ILE 43 Ca 0.00 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2qba h ILE 43 Cb 0.00 0.01 0.00 0.00 0.47 0.00 0.00 36.82 37.30 2qba h ILE 43 CO 0.00 0.00 -0.25 0.00 -3.07 0.00 0.00 178.15 174.83 2qba h ALA 44 N 1.09 0.00 0.00 0.18 0.00 -1.95 -3.44 119.26 115.14 2qba h ALA 44 Ca 0.93 -0.25 -0.36 0.00 0.00 0.00 0.00 54.91 55.23 2qba h ALA 44 Cb 3.65 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 21.62 2qba h ALA 44 CO -0.07 0.25 -2.36 -3.47 0.00 0.00 0.00 179.25 173.59 2qba n ASP 45 N -4.65 1.97 0.00 0.00 -0.08 -0.70 -4.97 116.55 108.12 2qba n ASP 45 Ca -0.03 -0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 2qba n ASP 45 Cb 0.13 -0.26 0.00 0.00 2.34 0.00 0.00 41.12 43.33 2qba n ASP 45 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2qba n LYS 46 N -3.16 0.00 -0.04 -0.67 5.02 0.30 -4.61 118.16 115.00 2qba n LYS 46 Ca -0.42 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 55.80 2qba n LYS 46 Cb 0.97 -2.65 -0.14 0.00 -0.02 0.00 0.00 35.03 33.18 2qba n LYS 46 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qba n LYS 47 N -1.69 0.65 0.10 1.97 4.01 -1.26 -3.90 118.16 118.03 2qba n LYS 47 Ca 0.00 0.18 0.09 0.00 -0.51 0.00 0.00 58.31 58.07 2qba n LYS 47 Cb 0.00 -1.70 0.42 0.00 -0.51 0.00 0.00 35.03 33.24 2qba n LYS 47 CO 0.00 0.00 0.00 1.47 -1.11 0.00 0.00 177.40 177.76 2qba n LEU 48 N -2.91 0.44 0.04 -0.35 -0.00 -1.26 -1.71 117.00 111.25 2qba n LEU 48 Ca -0.21 0.64 -0.08 0.00 -0.00 0.00 0.00 56.01 56.36 2qba n LEU 48 Cb 1.05 -0.62 -0.05 0.00 -0.00 0.00 0.00 43.42 43.80 2qba n LEU 48 CO 0.44 -0.60 0.24 0.25 -0.00 0.00 0.00 177.39 177.73 2qba h LEU 49 N 0.00 -0.18 -1.46 1.47 7.12 -1.91 -2.00 115.31 118.35 2qba h LEU 49 Ca 0.00 -0.24 0.03 0.00 0.13 0.00 0.00 57.88 57.80 2qba h LEU 49 Cb 0.21 0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.35 2qba h LEU 49 CO 0.00 0.39 0.40 -2.24 -0.13 0.00 0.00 178.44 176.86 2qba h ASP 50 N -0.98 0.61 0.01 1.25 2.03 -1.65 0.32 116.42 118.01 2qba h ASP 50 Ca -0.02 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.27 2qba h ASP 50 Cb 0.41 -0.14 -0.00 0.00 -0.83 0.00 0.00 39.33 38.77 2qba h ASP 50 CO 0.04 0.42 -0.02 0.78 -1.03 0.00 0.00 179.24 179.43 2qba h ASN 51 N 0.71 -0.04 -0.54 4.15 -0.26 -1.38 0.56 115.58 118.77 2qba h ASN 51 Ca 0.24 0.01 0.02 0.00 -0.56 0.00 0.00 56.30 56.01 2qba h ASN 51 Cb 0.08 0.02 -0.03 0.00 -1.06 0.00 0.00 38.32 37.33 2qba h ASN 51 CO -0.07 -0.02 0.34 0.00 -1.06 0.00 0.00 177.43 176.62 2qba h ALA 52 N 0.96 0.70 0.55 -0.83 0.00 -0.42 0.50 119.26 120.72 2qba h ALA 52 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2qba h ALA 52 Cb 0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2qba h ALA 52 CO -0.01 0.07 -0.51 0.00 0.00 0.00 0.00 179.25 178.81 2qba h ALA 53 N 1.23 -1.18 -0.83 0.00 0.00 0.28 0.31 119.26 119.07 2qba h ALA 53 Ca 0.21 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.04 2qba h ALA 53 Cb -0.02 0.72 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 2qba h ALA 53 CO -0.08 -1.20 0.45 0.00 0.00 0.00 0.00 179.25 178.43 2qba h ALA 54 N -0.95 1.21 -0.01 0.00 0.00 0.37 1.23 119.26 121.11 2qba h ALA 54 Ca -0.07 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qba h ALA 54 Cb 0.89 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2qba h ALA 54 CO -0.04 0.01 0.01 -0.44 0.00 0.00 0.00 179.25 178.79 2qba h ASP 55 N 0.71 0.00 0.17 0.00 5.19 0.76 -0.25 116.42 123.00 2qba h ASP 55 Ca 0.42 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.51 2qba h ASP 55 Cb 0.49 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.01 2qba h ASP 55 CO -0.30 0.00 -1.64 0.25 -3.12 0.00 0.00 179.24 174.43 2qba h LEU 56 N 0.00 0.56 0.00 1.55 7.12 0.40 -3.24 115.31 121.69 2qba h LEU 56 Ca 0.00 -0.92 0.00 0.00 0.13 0.00 0.00 57.88 57.10 2qba h LEU 56 Cb 0.02 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 39.97 2qba h LEU 56 CO -0.00 1.74 0.00 0.00 -0.13 0.00 0.00 178.44 180.05 2qba n ALA 57 N -2.89 1.55 -0.03 1.25 0.00 0.37 -1.14 120.51 119.62 2qba n ALA 57 Ca -0.25 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.14 2qba n ALA 57 Cb 1.02 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 19.35 2qba n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qba h ALA 58 N 2.36 0.00 -0.29 0.00 0.00 -1.11 -3.37 119.26 116.84 2qba h ALA 58 Ca 0.00 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.71 2qba h ALA 58 Cb 0.06 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2qba h ALA 58 CO 0.00 0.16 0.27 0.82 0.00 0.00 0.00 179.25 180.50 2qba h ILE 59 N -0.38 0.55 -3.13 0.00 2.04 -1.57 -3.37 117.51 111.65 2qba h ILE 59 Ca 0.00 0.00 -0.67 0.00 1.00 0.00 0.00 64.86 65.19 2qba h ILE 59 Cb 0.16 0.79 -0.35 0.00 -0.74 0.00 0.00 36.82 36.68 2qba h ILE 59 CO 0.00 0.00 -0.86 -0.44 0.00 0.00 0.00 178.15 176.85 2qba s SER 60 N -5.89 3.10 0.13 1.72 0.01 -0.29 -4.99 113.70 107.49 2qba s SER 60 Ca -0.05 -0.62 0.13 0.00 1.31 0.00 0.00 55.95 56.72 2qba s SER 60 Cb 0.16 -1.45 0.63 0.00 0.21 0.00 0.00 66.02 65.57 2qba s SER 60 CO 0.60 0.04 1.41 0.61 0.41 0.00 0.00 173.24 176.30 2qba n GLY 61 N 4.36 -0.86 3.91 3.44 0.00 -1.26 -4.18 105.19 110.61 2qba n GLY 61 Ca -0.20 0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2qba n GLY 61 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2qba s GLN 62 N -3.20 3.60 0.08 1.61 0.00 -1.26 -5.03 119.66 115.46 2qba s GLN 62 Ca 0.02 -0.06 -0.31 0.00 -0.00 0.00 0.00 55.36 55.01 2qba s GLN 62 Cb 0.06 -2.65 -0.07 0.00 0.00 0.00 0.00 33.01 30.35 2qba s GLN 62 CO 0.19 0.19 1.41 0.21 0.00 0.00 0.00 175.29 177.29 2qba s LYS 63 N -3.72 4.30 0.63 9.60 2.20 -1.26 -4.54 119.74 126.96 2qba s LYS 63 Ca 0.43 2.07 -0.18 0.00 -0.36 0.00 0.00 55.97 57.93 2qba s LYS 63 Cb -0.10 -3.35 -0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2qba s LYS 63 CO 0.32 -0.49 1.26 -2.14 -0.36 0.00 0.00 175.35 173.94 2qba s PRO 64 N 1.53 2.66 -0.69 4.03 0.02 -1.26 -4.96 135.00 136.33 2qba s PRO 64 Ca 0.65 1.98 -0.10 0.00 0.02 0.00 0.00 61.00 63.55 2qba s PRO 64 Cb -0.36 -1.87 0.18 0.00 0.02 0.00 0.00 34.50 32.47 2qba s PRO 64 CO 0.29 -1.49 0.59 -1.17 -0.33 0.00 0.00 177.00 174.89 2qba s LEU 65 N -4.32 6.09 -0.22 -5.54 2.96 -1.26 -5.02 118.68 111.38 2qba s LEU 65 Ca 0.81 -2.57 -0.30 0.00 -0.22 0.00 0.00 54.13 51.85 2qba s LEU 65 Cb -0.35 -2.07 -0.07 0.00 0.50 0.00 0.00 46.19 44.20 2qba s LEU 65 CO 0.38 -0.55 2.19 0.00 -1.32 0.00 0.00 176.35 177.05 2qba n ILE 66 N 4.04 0.35 -1.34 6.68 3.06 -1.25 -3.26 119.36 127.63 2qba n ILE 66 Ca 0.07 -0.39 -0.30 0.00 -2.50 0.00 0.00 62.75 59.63 2qba n ILE 66 Cb 0.43 -2.35 0.22 0.00 0.54 0.00 0.00 39.64 38.47 2qba n ILE 66 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2qba s THR 67 N 7.75 1.73 0.11 9.51 -4.23 0.28 -4.93 115.64 125.85 2qba s THR 67 Ca 1.02 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 61.54 2qba s THR 67 Cb -0.45 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 70.70 2qba s THR 67 CO 0.39 0.00 -0.06 -0.54 -0.54 0.00 0.00 174.62 173.87 2qba s LYS 68 N -5.55 0.88 0.74 3.99 3.01 -1.26 -3.43 119.74 118.12 2qba s LYS 68 Ca 0.72 -1.36 -0.12 0.00 -1.01 0.00 0.00 55.97 54.20 2qba s LYS 68 Cb -0.08 -0.23 0.04 0.00 -1.01 0.00 0.00 37.83 36.55 2qba s LYS 68 CO 0.55 -0.03 1.10 0.00 0.51 0.00 0.00 175.35 177.48 2qba s ALA 69 N -3.62 2.31 0.00 5.17 0.00 0.30 -4.80 121.76 121.12 2qba s ALA 69 Ca 0.14 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.43 2qba s ALA 69 Cb 0.05 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2qba s ALA 69 CO -0.03 -1.64 0.00 -2.13 0.00 0.00 0.00 175.76 171.95 2qba n ARG 70 N -3.25 0.00 0.26 0.00 0.00 -1.26 -4.65 116.66 107.77 2qba n ARG 70 Ca 0.09 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 58.08 2qba n ARG 70 Cb 0.53 -0.05 0.72 0.00 0.00 0.00 0.00 32.46 33.65 2qba n ARG 70 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2qba h LYS 71 N 0.00 0.00 0.00 -0.14 3.64 -1.91 -3.45 116.57 114.70 2qba h LYS 71 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2qba h LYS 71 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2qba h LYS 71 CO 0.00 0.11 0.00 0.45 -2.27 0.00 0.00 179.45 177.74 2qba n SER 72 N -3.48 0.00 -4.62 4.20 2.88 -1.26 -4.87 113.62 106.48 2qba n SER 72 Ca -0.01 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.12 2qba n SER 72 Cb 0.27 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.75 2qba n SER 72 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2qba n VAL 73 N 0.00 2.74 -3.79 2.46 0.31 -1.26 -4.12 118.33 114.67 2qba n VAL 73 Ca 0.00 -0.50 0.02 0.00 -0.01 0.00 0.00 64.34 63.85 2qba n VAL 73 Cb 0.00 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 2qba n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qba s ALA 74 N -1.34 -2.36 -2.00 3.52 0.00 -1.26 -4.96 121.76 113.36 2qba s ALA 74 Ca 0.66 0.39 0.06 0.00 0.00 0.00 0.00 51.96 53.07 2qba s ALA 74 Cb -0.51 0.61 0.33 0.00 0.00 0.00 0.00 23.12 23.54 2qba s ALA 74 CO 0.55 -1.10 0.72 0.41 0.00 0.00 0.00 175.76 176.34 2qba n GLY 75 N -0.69 -0.25 0.00 0.00 0.00 -1.26 -4.58 105.19 98.40 2qba n GLY 75 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2qba n GLY 75 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qba n PHE 76 N -0.84 0.00 0.00 1.61 -1.74 -1.26 -5.15 117.46 110.07 2qba n PHE 76 Ca 0.04 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.93 2qba n PHE 76 Cb 0.02 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.02 2qba n PHE 76 CO 0.00 0.00 0.00 1.17 -0.56 0.00 0.00 176.76 177.37 2qba n LYS 77 N 0.00 0.00 -1.32 3.97 3.00 -1.26 -4.99 118.16 117.56 2qba n LYS 77 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2qba n LYS 77 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2qba n LYS 77 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2qba n ILE 78 N 0.00 -4.42 -3.71 3.15 -0.00 -1.26 -4.08 119.36 109.03 2qba n ILE 78 Ca 0.00 1.90 0.00 0.00 -0.00 0.00 0.00 62.75 64.65 2qba n ILE 78 Cb 0.00 -2.72 0.00 0.00 -0.00 0.00 0.00 39.64 36.92 2qba n ILE 78 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2qba n ARG 79 N -0.11 0.99 0.00 0.38 1.74 -1.26 -4.02 116.66 114.39 2qba n ARG 79 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2qba n ARG 79 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2qba n ARG 79 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2qba n GLN 80 N 0.00 0.00 0.00 5.56 -0.06 -1.26 -4.06 117.38 117.56 2qba n GLN 80 Ca 0.00 0.87 0.00 0.00 -2.00 0.00 0.00 57.00 55.87 2qba n GLN 80 Cb 0.00 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 24.71 2qba n GLN 80 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qba n GLY 81 N -0.99 -1.29 3.18 1.69 0.00 -1.26 -3.73 105.19 102.78 2qba n GLY 81 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2qba n GLY 81 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qba n TYR 82 N 0.00 -2.72 -1.72 1.61 4.19 -1.26 0.11 117.16 117.38 2qba n TYR 82 Ca 0.00 1.13 -0.40 0.00 3.31 0.00 0.00 57.90 61.94 2qba n TYR 82 Cb 0.00 -2.62 0.02 0.00 0.49 0.00 0.00 39.34 37.23 2qba n TYR 82 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 2qba n PRO 83 N 0.07 1.89 0.00 2.98 -0.02 -1.26 -1.62 135.00 137.03 2qba n PRO 83 Ca -0.00 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2qba n PRO 83 Cb 0.52 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2qba n PRO 83 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2qba n ILE 84 N -0.47 0.00 -1.51 4.25 5.41 -1.22 -4.74 119.36 121.08 2qba n ILE 84 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.82 2qba n ILE 84 Cb 0.41 -0.34 0.00 0.00 -0.71 0.00 0.00 39.64 39.00 2qba n ILE 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2qba n GLY 85 N 2.43 3.07 3.13 7.39 0.00 -1.26 0.17 105.19 120.11 2qba n GLY 85 Ca 0.00 -0.58 0.03 0.00 0.00 0.00 0.00 46.02 45.47 2qba n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qba n LYS 87 N 5.37 0.00 -1.96 0.00 2.85 -1.20 -4.29 118.16 118.92 2qba n LYS 87 Ca 0.05 0.05 -0.02 0.00 -1.05 0.00 0.00 58.31 57.33 2qba n LYS 87 Cb 0.54 -0.68 0.00 0.00 -0.65 0.00 0.00 35.03 34.23 2qba n LYS 87 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2qba n VAL 88 N -0.23 -5.24 -1.42 0.58 0.31 -1.25 -3.22 118.33 107.85 2qba n VAL 88 Ca 0.00 0.38 -0.30 0.00 -0.01 0.00 0.00 64.34 64.41 2qba n VAL 88 Cb 0.00 -5.13 0.24 0.00 -0.91 0.00 0.00 33.84 28.04 2qba n VAL 88 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2qba s THR 89 N -1.37 1.71 0.17 2.52 -4.23 -0.85 -4.28 115.64 109.31 2qba s THR 89 Ca 0.07 0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.69 2qba s THR 89 Cb -0.02 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 2qba s THR 89 CO 0.27 0.00 -0.25 -0.76 -0.54 0.00 0.00 174.62 173.34 2qba s LEU 90 N -6.60 2.40 -0.15 4.79 2.01 0.26 -4.90 118.68 116.49 2qba s LEU 90 Ca 0.74 -0.83 0.00 0.00 0.01 0.00 0.00 54.13 54.05 2qba s LEU 90 Cb -0.05 -1.17 0.02 0.00 0.01 0.00 0.00 46.19 45.00 2qba s LEU 90 CO 0.55 0.13 -0.14 0.00 1.01 0.00 0.00 176.35 177.90 2qba s ARG 91 N -2.49 2.32 0.00 1.70 3.03 -1.26 -3.55 118.95 118.70 2qba s ARG 91 Ca 0.18 -0.60 0.00 0.00 2.03 0.00 0.00 55.73 57.35 2qba s ARG 91 Cb -0.08 -2.16 0.00 0.00 -1.03 0.00 0.00 34.95 31.68 2qba s ARG 91 CO 0.09 -0.25 0.00 0.41 -1.13 0.00 0.00 175.30 174.42 2qba n GLY 92 N 4.76 0.09 0.00 3.88 0.00 -1.26 -1.42 105.19 111.24 2qba n GLY 92 Ca -0.17 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2qba n GLY 92 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qba n GLU 93 N 0.00 0.00 0.08 1.61 -0.58 -1.26 0.66 120.64 121.15 2qba n GLU 93 Ca 0.00 0.57 0.20 0.00 -0.42 0.00 0.00 57.16 57.51 2qba n GLU 93 Cb 0.00 -1.22 0.75 0.00 -0.57 0.00 0.00 31.44 30.39 2qba n GLU 93 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2qba h ARG 94 N 0.00 0.00 0.00 3.49 9.65 -1.66 -0.13 114.38 125.74 2qba h ARG 94 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2qba h ARG 94 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 2qba h ARG 94 CO 0.00 0.00 0.00 -0.12 2.80 0.00 0.00 179.97 182.65 2qba n MET 95 N -3.99 0.00 -0.24 0.20 1.56 -0.12 -1.19 117.12 113.34 2qba n MET 95 Ca 0.07 0.16 0.04 0.00 -0.27 0.00 0.00 57.70 57.70 2qba n MET 95 Cb 0.54 -1.06 0.17 0.00 2.15 0.00 0.00 33.22 35.02 2qba n MET 95 CO 0.00 0.00 0.00 -1.49 -0.73 0.00 0.00 175.97 173.75 2qba h TRP 96 N 0.00 0.31 -0.93 1.12 6.55 0.35 1.19 115.95 124.54 2qba h TRP 96 Ca 0.00 0.04 0.19 0.00 0.95 0.00 0.00 58.89 60.07 2qba h TRP 96 Cb 0.00 -0.03 -0.11 0.00 -0.86 0.00 0.00 29.16 28.16 2qba h TRP 96 CO 0.06 -0.04 0.51 1.49 -1.05 0.00 0.00 178.44 179.41 2qba h GLU 97 N 0.31 0.60 -0.05 0.49 4.22 -1.10 1.22 114.58 120.26 2qba h GLU 97 Ca 0.39 -0.04 -0.07 0.00 0.08 0.00 0.00 59.36 59.73 2qba h GLU 97 Cb 0.64 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2qba h GLU 97 CO -0.46 0.39 -0.25 0.35 -2.18 0.00 0.00 179.01 176.86 2qba h PHE 98 N 0.61 0.35 0.00 0.92 3.57 0.15 -1.98 116.94 120.55 2qba h PHE 98 Ca 0.55 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.90 2qba h PHE 98 Cb 0.91 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.60 2qba h PHE 98 CO -0.06 0.88 0.15 0.34 -2.23 0.00 0.00 178.31 177.39 2qba n PHE 99 N -4.50 0.47 -0.04 0.41 7.35 0.36 -0.46 117.46 121.04 2qba n PHE 99 Ca -0.09 0.24 -0.02 0.00 -0.76 0.00 0.00 57.45 56.83 2qba n PHE 99 Cb 0.47 -0.78 -0.01 0.00 0.35 0.00 0.00 39.48 39.51 2qba n PHE 99 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2qba h GLU 100 N 0.00 0.00 0.00 -4.13 4.57 0.18 -3.31 114.58 111.88 2qba h GLU 100 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2qba h GLU 100 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 2qba h GLU 100 CO 0.00 0.00 0.17 -2.13 -1.18 0.00 0.00 179.01 175.87 2qba n ARG 101 N -3.78 0.01 -4.22 1.92 0.63 -0.53 -2.50 116.66 108.19 2qba n ARG 101 Ca -0.03 0.36 -0.35 0.00 -0.92 0.00 0.00 57.85 56.90 2qba n ARG 101 Cb 0.12 -1.70 -0.09 0.00 0.45 0.00 0.00 32.46 31.24 2qba n ARG 101 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2qba s LEU 102 N -2.81 3.81 0.00 6.15 1.98 0.39 0.11 118.68 128.31 2qba s LEU 102 Ca -0.00 0.22 0.00 0.00 -2.89 0.00 0.00 54.13 51.46 2qba s LEU 102 Cb 0.00 -1.89 0.00 0.00 0.66 0.00 0.00 46.19 44.96 2qba s LEU 102 CO 0.01 0.37 0.00 -0.38 -1.89 0.00 0.00 176.35 174.46 2qba n ILE 103 N 2.20 0.00 0.03 6.68 5.41 -1.26 -4.49 119.36 127.93 2qba n ILE 103 Ca -0.19 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.59 2qba n ILE 103 Cb 0.54 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 39.39 2qba n ILE 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2qba n THR 104 N 0.00 0.94 0.00 1.39 -1.04 -1.04 -4.23 114.28 110.29 2qba n THR 104 Ca 0.00 -0.65 0.00 0.00 -2.04 0.00 0.00 64.05 61.36 2qba n THR 104 Cb 0.00 -0.54 0.00 0.00 -1.82 0.00 0.00 70.33 67.97 2qba n THR 104 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2qba n ILE 105 N -2.75 0.00 0.00 12.58 5.41 -1.17 -4.75 119.36 128.68 2qba n ILE 105 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2qba n ILE 105 Cb 0.77 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.70 2qba n ILE 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qba n ALA 106 N -0.97 -0.24 -0.31 -1.39 0.00 0.12 -1.08 120.51 116.64 2qba n ALA 106 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2qba n ALA 106 Cb 0.00 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.86 2qba n ALA 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qba h VAL 107 N 0.00 0.68 -0.91 0.00 2.07 -1.83 0.14 116.25 116.41 2qba h VAL 107 Ca 0.00 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.35 2qba h VAL 107 Cb 0.00 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 29.75 2qba h VAL 107 CO 0.00 0.11 0.59 -0.65 0.02 0.00 0.00 177.57 177.63 2qba h PRO 108 N 0.59 1.11 -3.01 1.57 0.11 -1.73 -2.61 132.00 128.03 2qba h PRO 108 Ca 0.54 -0.07 -0.50 0.00 0.11 0.00 0.00 66.00 66.08 2qba h PRO 108 Cb 1.07 -0.25 0.01 0.00 0.11 0.00 0.00 31.00 31.95 2qba h PRO 108 CO -0.29 0.73 2.88 -2.13 -0.21 0.00 0.00 178.00 178.98 2qba n ARG 109 N -4.51 2.91 0.00 1.05 0.00 0.50 -4.88 116.66 111.73 2qba n ARG 109 Ca 0.12 -1.77 0.00 0.00 -0.00 0.00 0.00 57.85 56.19 2qba n ARG 109 Cb 0.09 -2.56 0.00 0.00 0.00 0.00 0.00 32.46 29.99 2qba n ARG 109 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2qba n ILE 110 N 3.62 0.00 0.00 5.15 -5.35 -0.99 -4.84 119.36 116.96 2qba n ILE 110 Ca 0.62 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 63.10 2qba n ILE 110 Cb 0.28 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.18 2qba n ILE 110 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2qba n ARG 111 N -0.82 1.59 0.00 6.28 3.00 -1.26 -4.91 116.66 120.54 2qba n ARG 111 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2qba n ARG 111 Cb 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 32.46 31.96 2qba n ARG 111 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2qba n ASP 112 N -0.37 0.00 -4.66 0.55 2.03 -1.26 -5.14 116.55 107.69 2qba n ASP 112 Ca 0.00 0.00 -0.51 0.00 0.52 0.00 0.00 54.79 54.80 2qba n ASP 112 Cb 0.00 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.35 2qba n ASP 112 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2qba n PHE 113 N 0.00 2.03 -2.75 -0.67 7.35 -1.26 -4.88 117.46 117.29 2qba n PHE 113 Ca 0.00 0.36 -0.03 0.00 -0.76 0.00 0.00 57.45 57.03 2qba n PHE 113 Cb 0.00 -2.50 0.08 0.00 0.35 0.00 0.00 39.48 37.41 2qba n PHE 113 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2qba n ARG 114 N 4.53 1.48 0.00 -4.13 3.00 -1.26 -5.07 116.66 115.22 2qba n ARG 114 Ca 0.21 -2.66 0.00 0.00 -0.00 0.00 0.00 57.85 55.40 2qba n ARG 114 Cb 0.22 -0.83 0.00 0.00 0.00 0.00 0.00 32.46 31.86 2qba n ARG 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qba n GLY 115 N -0.78 3.47 3.86 5.14 0.00 -1.26 -5.05 105.19 110.57 2qba n GLY 115 Ca -0.01 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 2qba n GLY 115 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qba s LEU 116 N 0.00 4.40 0.79 0.99 2.96 0.46 -4.82 118.68 123.46 2qba s LEU 116 Ca 0.00 0.78 -0.15 0.00 -0.22 0.00 0.00 54.13 54.54 2qba s LEU 116 Cb 0.00 -2.71 0.00 0.00 0.50 0.00 0.00 46.19 43.98 2qba s LEU 116 CO 0.00 0.26 0.63 -0.24 -1.32 0.00 0.00 176.35 175.68 2qba n SER 117 N 1.35 -0.98 -0.04 3.68 2.88 -1.26 -0.70 113.62 118.54 2qba n SER 117 Ca -0.12 0.53 0.03 0.00 -1.33 0.00 0.00 58.87 57.98 2qba n SER 117 Cb 0.53 -1.27 0.04 0.00 -0.75 0.00 0.00 64.21 62.76 2qba n SER 117 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qba n ALA 118 N -2.83 1.99 -1.15 -1.46 0.00 -1.26 -4.56 120.51 111.25 2qba n ALA 118 Ca 0.10 -1.44 0.04 0.00 0.00 0.00 0.00 53.44 52.14 2qba n ALA 118 Cb 0.51 -0.13 0.06 0.00 0.00 0.00 0.00 19.45 19.88 2qba n ALA 118 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qba n LYS 119 N -0.71 1.04 0.00 0.00 4.01 -1.26 -4.73 118.16 116.51 2qba n LYS 119 Ca 0.05 -1.66 0.08 0.00 -0.51 0.00 0.00 58.31 56.27 2qba n LYS 119 Cb 0.40 -0.99 0.47 0.00 -0.51 0.00 0.00 35.03 34.41 2qba n LYS 119 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2qba n SER 120 N -0.66 0.00 -4.78 4.39 3.41 -1.26 -4.78 113.62 109.93 2qba n SER 120 Ca 0.06 -0.44 -0.30 0.00 -0.26 0.00 0.00 58.87 57.94 2qba n SER 120 Cb 0.57 -0.04 0.09 0.00 -0.26 0.00 0.00 64.21 64.58 2qba n SER 120 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2qba s PHE 121 N -2.07 2.75 0.00 7.33 -0.00 -1.26 -1.65 117.98 123.08 2qba s PHE 121 Ca 0.23 1.29 0.00 0.00 -0.00 0.00 0.00 56.93 58.45 2qba s PHE 121 Cb 0.11 -3.07 0.00 0.00 -0.00 0.00 0.00 43.02 40.06 2qba s PHE 121 CO 0.19 -1.79 0.00 -0.25 -0.00 0.00 0.00 175.22 173.38 2qba n ASP 122 N -3.47 0.00 0.00 1.98 10.43 -0.24 -4.88 116.55 120.37 2qba n ASP 122 Ca 0.07 0.29 0.00 0.00 2.57 0.00 0.00 54.79 57.73 2qba n ASP 122 Cb 0.55 -0.43 0.00 0.00 1.84 0.00 0.00 41.12 43.08 2qba n ASP 122 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qba n GLY 123 N 1.93 0.00 0.03 0.44 0.00 -1.26 -4.96 105.19 101.37 2qba n GLY 123 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2qba n GLY 123 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2qba n ARG 124 N 0.00 0.57 0.00 1.61 3.00 -1.26 -3.93 116.66 116.65 2qba n ARG 124 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 2qba n ARG 124 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 32.46 30.87 2qba n ARG 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qba n GLY 125 N 1.27 1.31 3.80 5.14 0.00 -1.26 -1.00 105.19 114.45 2qba n GLY 125 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2qba n GLY 125 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qba s ASN 126 N -0.51 6.99 0.37 1.61 -0.87 -1.26 -4.34 114.94 116.92 2qba s ASN 126 Ca 0.00 1.84 0.08 0.00 -1.57 0.00 0.00 52.86 53.21 2qba s ASN 126 Cb 0.00 -2.57 -0.05 0.00 -0.02 0.00 0.00 41.25 38.62 2qba s ASN 126 CO 0.00 -0.32 0.15 -0.31 -2.57 0.00 0.00 177.10 174.04 2qba s TYR 127 N -1.85 2.64 -0.29 2.20 1.51 -1.26 -1.08 117.35 119.22 2qba s TYR 127 Ca 0.57 -0.48 -0.16 0.00 -1.01 0.00 0.00 57.07 56.00 2qba s TYR 127 Cb -0.16 -1.77 0.12 0.00 -0.11 0.00 0.00 41.96 40.04 2qba s TYR 127 CO 0.20 0.28 0.86 -1.54 -1.11 0.00 0.00 175.55 174.24 2qba s SER 128 N -3.86 -0.69 -0.27 2.29 1.04 -0.66 0.14 113.70 111.68 2qba s SER 128 Ca 0.39 1.10 -0.05 0.00 0.48 0.00 0.00 55.95 57.87 2qba s SER 128 Cb 0.00 1.28 0.14 0.00 0.10 0.00 0.00 66.02 67.55 2qba s SER 128 CO 0.22 -0.17 0.56 0.00 0.98 0.00 0.00 173.24 174.83 2qba s MET 129 N 1.46 0.50 -0.06 4.02 0.23 0.74 -4.59 119.30 121.60 2qba s MET 129 Ca -0.09 1.11 -0.30 0.00 -1.03 0.00 0.00 55.69 55.38 2qba s MET 129 Cb -0.04 0.50 -0.02 0.00 -1.53 0.00 0.00 34.83 33.73 2qba s MET 129 CO -0.17 -0.41 1.05 0.20 -2.03 0.00 0.00 175.02 173.66 2qba s GLY 130 N 2.79 2.47 0.00 3.16 0.00 -1.26 -3.36 107.32 111.12 2qba s GLY 130 Ca 0.06 0.49 0.00 0.00 0.00 0.00 0.00 44.72 45.28 2qba s GLY 130 CO -0.18 1.91 0.77 3.33 0.00 0.00 0.00 173.10 178.93 2qba n VAL 131 N 4.34 1.18 0.00 1.40 0.24 -0.97 -4.74 118.33 119.78 2qba n VAL 131 Ca 0.08 0.37 0.00 0.00 -2.04 0.00 0.00 64.34 62.75 2qba n VAL 131 Cb 0.49 -1.37 0.00 0.00 -1.47 0.00 0.00 33.84 31.49 2qba n VAL 131 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2qba n ARG 132 N -1.27 0.00 -3.65 7.34 5.12 -1.25 -4.79 116.66 118.17 2qba n ARG 132 Ca 0.00 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.91 2qba n ARG 132 Cb 0.07 -2.75 -0.07 0.00 -1.16 0.00 0.00 32.46 28.55 2qba n ARG 132 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2qba s GLU 133 N 0.00 0.12 -0.22 5.56 -6.30 -1.26 -4.76 118.70 111.83 2qba s GLU 133 Ca 0.00 0.17 -0.29 0.00 -2.50 0.00 0.00 54.97 52.35 2qba s GLU 133 Cb 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 34.13 34.11 2qba s GLU 133 CO 0.00 -0.02 2.21 0.94 0.02 0.00 0.00 175.26 178.42 2qba n GLN 134 N 2.39 1.91 0.00 4.30 7.27 -1.26 -4.67 117.38 127.31 2qba n GLN 134 Ca -0.14 0.53 0.00 0.00 0.07 0.00 0.00 57.00 57.46 2qba n GLN 134 Cb 0.57 -3.16 0.00 0.00 2.41 0.00 0.00 30.24 30.06 2qba n GLN 134 CO 0.00 0.00 0.00 0.44 0.07 0.00 0.00 177.06 177.57 2qba n ILE 135 N 7.62 0.00 -1.26 1.69 -5.35 -1.26 -4.67 119.36 116.13 2qba n ILE 135 Ca 0.31 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.68 2qba n ILE 135 Cb 0.43 -0.20 -0.04 0.00 -1.74 0.00 0.00 39.64 38.08 2qba n ILE 135 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 2qba n ILE 136 N 0.10 0.00 -0.84 7.28 2.08 -1.26 -4.93 119.36 121.79 2qba n ILE 136 Ca 0.00 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 62.97 2qba n ILE 136 Cb 0.01 -1.40 0.10 0.00 -0.75 0.00 0.00 39.64 37.60 2qba n ILE 136 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 2qba n PHE 137 N -2.06 -2.34 0.00 1.39 -0.00 -1.26 -4.07 117.46 109.12 2qba n PHE 137 Ca -0.10 0.19 0.00 0.00 -0.00 0.00 0.00 57.45 57.54 2qba n PHE 137 Cb 0.55 -1.61 0.00 0.00 -0.00 0.00 0.00 39.48 38.42 2qba n PHE 137 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2qba n PRO 138 N -0.34 0.00 -4.05 3.97 -0.02 -1.26 -4.82 135.00 128.47 2qba n PRO 138 Ca 0.02 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.26 2qba n PRO 138 Cb 0.58 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 34.00 2qba n PRO 138 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2qba s GLU 139 N 0.00 2.27 -0.45 -0.52 -6.30 -1.26 -4.60 118.70 107.84 2qba s GLU 139 Ca 0.00 -1.86 -0.27 0.00 -2.50 0.00 0.00 54.97 50.34 2qba s GLU 139 Cb 0.00 -2.03 -0.04 0.00 0.00 0.00 0.00 34.13 32.07 2qba s GLU 139 CO 0.00 -0.21 2.04 0.42 0.02 0.00 0.00 175.26 177.53 2qba s ILE 140 N -2.62 3.25 -0.31 -3.70 1.01 -1.26 -3.76 121.20 113.81 2qba s ILE 140 Ca 0.39 0.20 -0.15 0.00 0.00 0.00 0.00 60.65 61.10 2qba s ILE 140 Cb 0.02 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 39.02 2qba s ILE 140 CO 0.22 -0.41 0.34 0.47 0.00 0.00 0.00 174.94 175.56 2qba n ASP 141 N 12.81 -7.05 -0.57 3.58 8.00 -1.26 -4.23 116.55 127.83 2qba n ASP 141 Ca 0.27 0.55 0.46 0.00 0.71 0.00 0.00 54.79 56.79 2qba n ASP 141 Cb 0.50 -3.59 0.74 0.00 -0.02 0.00 0.00 41.12 38.76 2qba n ASP 141 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2qba h TYR 142 N 2.64 0.00 0.04 1.24 -1.99 -1.88 0.70 116.97 117.72 2qba h TYR 142 Ca -0.15 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 60.24 2qba h TYR 142 Cb 0.86 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.54 2qba h TYR 142 CO 0.03 0.00 -2.05 -0.40 -0.00 0.00 0.00 178.16 175.74 2qba n ASP 143 N -3.82 1.35 -2.91 3.88 5.75 -1.26 -4.31 116.55 115.23 2qba n ASP 143 Ca 0.38 0.18 -0.33 0.00 -0.01 0.00 0.00 54.79 55.02 2qba n ASP 143 Cb 1.83 -0.22 -0.03 0.00 -1.03 0.00 0.00 41.12 41.67 2qba n ASP 143 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qba n LYS 144 N -3.18 3.31 -4.41 0.11 5.02 0.24 -4.93 118.16 114.32 2qba n LYS 144 Ca -0.30 -2.93 -0.28 0.00 -2.02 0.00 0.00 58.31 52.78 2qba n LYS 144 Cb 1.06 -2.33 -0.07 0.00 -0.02 0.00 0.00 35.03 33.67 2qba n LYS 144 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2qba s VAL 145 N -2.25 1.76 0.65 -0.18 -7.23 -1.10 -4.67 120.40 107.39 2qba s VAL 145 Ca 0.56 -1.84 -0.11 0.00 -1.81 0.00 0.00 61.98 58.78 2qba s VAL 145 Cb 0.31 -2.59 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 2qba s VAL 145 CO -0.19 0.00 1.04 -0.62 -0.31 0.00 0.00 175.10 175.02 2qba s ASP 146 N -3.91 5.79 -0.26 4.85 3.68 -1.26 -4.93 116.67 120.63 2qba s ASP 146 Ca 0.27 1.54 -0.34 0.00 2.13 0.00 0.00 52.55 56.15 2qba s ASP 146 Cb 0.04 -2.49 -0.10 0.00 -1.45 0.00 0.00 42.92 38.92 2qba s ASP 146 CO 0.15 -1.16 2.12 -1.14 0.13 0.00 0.00 175.17 175.26 2qba n ARG 147 N -2.89 1.50 0.00 4.34 0.00 -1.26 -4.77 116.66 113.58 2qba n ARG 147 Ca 0.07 0.45 0.00 0.00 -0.00 0.00 0.00 57.85 58.37 2qba n ARG 147 Cb 0.54 -2.66 0.00 0.00 0.00 0.00 0.00 32.46 30.34 2qba n ARG 147 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2qba n VAL 148 N 6.81 0.00 0.00 5.15 0.24 -1.26 -5.00 118.33 124.27 2qba n VAL 148 Ca 0.34 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.64 2qba n VAL 148 Cb 0.29 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.66 2qba n VAL 148 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2qba n ARG 149 N 0.00 0.00 -0.39 7.34 5.12 -1.26 -4.98 116.66 122.48 2qba n ARG 149 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2qba n ARG 149 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2qba n ARG 149 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qba n GLY 150 N -0.40 -3.37 3.83 -0.13 0.00 -1.26 -4.73 105.19 99.14 2qba n GLY 150 Ca 0.00 -1.07 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 2qba n GLY 150 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2qba s LEU 151 N -2.47 -0.19 -0.02 0.99 0.05 -1.26 -4.70 118.68 111.08 2qba s LEU 151 Ca 0.00 -0.67 0.07 0.00 0.05 0.00 0.00 54.13 53.58 2qba s LEU 151 Cb 0.00 2.63 -0.02 0.00 -2.05 0.00 0.00 46.19 46.75 2qba s LEU 151 CO 0.00 -1.32 -0.23 -1.81 -0.55 0.00 0.00 176.35 172.45 2qba s ASP 152 N -2.97 2.67 -0.07 1.48 -0.00 -1.26 -2.28 116.67 114.23 2qba s ASP 152 Ca 0.12 -0.41 0.03 0.00 -0.00 0.00 0.00 52.55 52.29 2qba s ASP 152 Cb -0.05 -0.35 0.01 0.00 -0.00 0.00 0.00 42.92 42.53 2qba s ASP 152 CO 0.07 0.27 -0.16 -0.63 -0.00 0.00 0.00 175.17 174.72 2qba s ILE 153 N -0.48 1.45 -0.24 0.77 1.01 -1.21 -1.32 121.20 121.18 2qba s ILE 153 Ca 0.07 -0.67 -0.04 0.00 0.00 0.00 0.00 60.65 60.02 2qba s ILE 153 Cb -0.09 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.09 2qba s ILE 153 CO -0.00 0.42 -0.03 -0.89 0.00 0.00 0.00 174.94 174.44 2qba s THR 154 N 0.51 3.35 0.02 2.92 2.01 -1.26 -0.19 115.64 123.00 2qba s THR 154 Ca -0.15 -0.63 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 2qba s THR 154 Cb -0.16 -2.59 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 2qba s THR 154 CO 0.05 0.33 1.09 0.40 -0.69 0.00 0.00 174.62 175.81 2qba h ILE 155 N 5.82 0.00 -4.46 1.82 5.03 0.86 -2.95 117.51 123.63 2qba h ILE 155 Ca -0.38 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.36 2qba h ILE 155 Cb 1.14 0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 34.88 2qba h ILE 155 CO 0.60 0.00 -0.95 0.41 -0.68 0.00 0.00 178.15 177.53 2qba n THR 156 N -2.90 -9.70 -4.35 -0.27 -1.04 -1.11 -4.32 114.28 90.59 2qba n THR 156 Ca -0.02 1.70 -0.24 0.00 -2.04 0.00 0.00 64.05 63.45 2qba n THR 156 Cb 0.07 -5.88 -0.12 0.00 -1.82 0.00 0.00 70.33 62.59 2qba n THR 156 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2qba s THR 157 N -0.79 1.97 -0.54 12.58 -1.32 -1.26 -2.79 115.64 123.49 2qba s THR 157 Ca -0.12 -1.85 0.00 0.00 -1.21 0.00 0.00 61.69 58.51 2qba s THR 157 Cb 0.01 -1.87 0.00 0.00 -1.51 0.00 0.00 72.50 69.13 2qba s THR 157 CO 0.57 -0.18 0.41 0.35 -2.21 0.00 0.00 174.62 173.56 2qba n THR 158 N 0.50 0.26 -2.40 5.08 -2.24 -1.22 -4.29 114.28 109.96 2qba n THR 158 Ca -0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 2qba n THR 158 Cb 0.56 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 2qba n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qba s ALA 159 N -0.34 3.42 -1.24 6.98 0.00 -1.26 -4.78 121.76 124.54 2qba s ALA 159 Ca 0.00 0.90 0.27 0.00 0.00 0.00 0.00 51.96 53.13 2qba s ALA 159 Cb 0.00 -3.43 1.26 0.00 0.00 0.00 0.00 23.12 20.96 2qba s ALA 159 CO 0.00 -0.39 1.89 0.36 0.00 0.00 0.00 175.76 177.62 2qba n LYS 160 N 3.18 0.21 -3.60 0.00 2.85 -1.25 -4.12 118.16 115.43 2qba n LYS 160 Ca 0.06 0.04 -0.16 0.00 -1.05 0.00 0.00 58.31 57.20 2qba n LYS 160 Cb 0.45 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.26 2qba n LYS 160 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2qba s SER 161 N -2.76 -0.60 0.31 -5.58 1.04 -0.17 -4.76 113.70 101.18 2qba s SER 161 Ca 0.20 0.83 0.04 0.00 0.48 0.00 0.00 55.95 57.50 2qba s SER 161 Cb 0.18 0.78 0.65 0.00 0.10 0.00 0.00 66.02 67.73 2qba s SER 161 CO 0.44 -0.45 1.85 -2.24 0.98 0.00 0.00 173.24 173.82 2qba h ASP 162 N 3.87 0.83 0.02 7.02 2.03 -1.68 -1.54 116.42 126.97 2qba h ASP 162 Ca -0.28 0.05 0.02 0.00 -0.73 0.00 0.00 57.03 56.09 2qba h ASP 162 Cb 1.15 -0.12 -0.05 0.00 -0.83 0.00 0.00 39.33 39.48 2qba h ASP 162 CO 0.29 0.43 -0.48 -0.08 -1.03 0.00 0.00 179.24 178.37 2qba h GLU 163 N 0.89 -0.62 -0.21 4.15 4.81 -1.92 0.39 114.58 122.06 2qba h GLU 163 Ca 0.48 0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.82 2qba h GLU 163 Cb 0.57 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2qba h GLU 163 CO -0.25 -0.42 0.18 0.93 -0.73 0.00 0.00 179.01 178.72 2qba h GLU 164 N -0.65 0.00 0.00 1.92 5.08 -1.76 0.35 114.58 119.52 2qba h GLU 164 Ca 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2qba h GLU 164 Cb 0.70 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 2qba h GLU 164 CO -0.33 0.00 -0.12 0.78 -1.00 0.00 0.00 179.01 178.34 2qba h GLY 165 N 0.00 0.00 0.78 -3.84 0.00 0.69 -1.74 103.07 98.97 2qba h GLY 165 Ca 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.36 2qba h GLY 165 CO -0.00 0.00 -0.15 3.21 0.00 0.00 0.00 176.54 179.60 2qba h ARG 166 N 0.00 0.41 0.20 4.80 3.08 0.71 -3.21 114.38 120.37 2qba h ARG 166 Ca -0.00 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.85 2qba h ARG 166 Cb 0.22 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2qba h ARG 166 CO 0.02 0.76 -0.25 0.00 -1.07 0.00 0.00 179.97 179.42 2qba h ALA 167 N 0.64 -0.48 -2.06 0.04 0.00 -1.33 -3.26 119.26 112.82 2qba h ALA 167 Ca 0.03 -0.06 -0.41 0.00 0.00 0.00 0.00 54.91 54.47 2qba h ALA 167 Cb 0.67 0.38 0.21 0.00 0.00 0.00 0.00 17.79 19.05 2qba h ALA 167 CO 0.04 -0.81 -0.02 -1.17 0.00 0.00 0.00 179.25 177.28 2qba s LEU 168 N -10.25 -0.12 0.00 0.00 1.98 -0.71 0.41 118.68 109.99 2qba s LEU 168 Ca -0.16 1.03 0.00 0.00 -2.89 0.00 0.00 54.13 52.11 2qba s LEU 168 Cb 0.07 -2.69 0.00 0.00 0.66 0.00 0.00 46.19 44.24 2qba s LEU 168 CO 0.65 -4.72 0.00 0.18 -1.89 0.00 0.00 176.35 170.57 2qba n LEU 169 N -5.21 0.00 0.30 -0.68 4.77 -1.26 -3.40 117.00 111.52 2qba n LEU 169 Ca 0.09 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.23 2qba n LEU 169 Cb 0.58 0.00 0.95 0.00 -2.33 0.00 0.00 43.42 42.62 2qba n LEU 169 CO 0.49 0.00 1.12 0.00 -1.33 0.00 0.00 177.39 177.67 2qba h ALA 170 N -0.15 1.42 -0.05 -1.18 0.00 -1.59 0.29 119.26 118.01 2qba h ALA 170 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2qba h ALA 170 Cb 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qba h ALA 170 CO 0.00 0.01 0.12 0.00 0.00 0.00 0.00 179.25 179.39 2qba h ALA 171 N 1.99 1.37 -4.06 0.00 0.00 -0.06 -3.41 119.26 115.09 2qba h ALA 171 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qba h ALA 171 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2qba h ALA 171 CO 0.00 -0.15 -0.01 1.19 0.00 0.00 0.00 179.25 180.29 2qba n PHE 172 N -3.36 -2.05 0.63 0.00 3.72 0.10 -4.88 117.46 111.62 2qba n PHE 172 Ca -0.01 -0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2qba n PHE 172 Cb 0.20 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 2qba n PHE 172 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2qba n ASP 173 N -2.37 1.66 -4.66 4.37 5.75 -1.26 -4.84 116.55 115.21 2qba n ASP 173 Ca 0.00 -1.26 -0.42 0.00 -0.01 0.00 0.00 54.79 53.10 2qba n ASP 173 Cb 0.02 -0.31 -0.03 0.00 -1.03 0.00 0.00 41.12 39.76 2qba n ASP 173 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2qba s PHE 174 N 0.13 1.52 0.00 2.11 5.36 -1.23 -4.93 117.98 120.93 2qba s PHE 174 Ca 0.00 -0.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.81 2qba s PHE 174 Cb 0.00 -4.12 0.00 0.00 -0.34 0.00 0.00 43.02 38.56 2qba s PHE 174 CO 0.00 -4.86 0.59 -0.35 -1.46 0.00 0.00 175.22 169.15 2qba n PRO 175 N 7.50 0.00 0.00 10.12 -0.04 -1.26 -4.74 135.00 146.58 2qba n PRO 175 Ca 0.20 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 2qba n PRO 175 Cb 0.42 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 2qba n PRO 175 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2qba n PHE 176 N -1.17 -1.27 -3.55 0.54 3.01 -1.26 -4.83 117.46 108.93 2qba n PHE 176 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 2qba n PHE 176 Cb 0.00 0.17 -0.03 0.00 -0.01 0.00 0.00 39.48 39.62 2qba n PHE 176 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2qba s ARG 177 N 0.00 0.63 0.00 -1.08 6.06 0.12 -0.40 118.95 124.27 2qba s ARG 177 Ca 0.00 -0.14 0.05 0.00 -2.50 0.00 0.00 55.73 53.14 2qba s ARG 177 Cb 0.00 0.29 0.04 0.00 0.06 0.00 0.00 34.95 35.34 2qba s ARG 177 CO 0.00 -0.26 0.65 1.17 -2.50 0.00 0.00 175.30 174.36