#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qa4 s HIS 2 N 0.00 3.49 -0.31 1.12 3.76 0.59 -4.42 115.29 119.52 2qa4 s HIS 2 Ca 0.00 0.33 0.01 0.00 -0.15 0.00 0.00 55.06 55.24 2qa4 s HIS 2 Cb 0.00 -1.87 0.07 0.00 1.11 0.00 0.00 32.58 31.89 2qa4 s HIS 2 CO 0.00 0.18 -0.00 0.00 -0.85 0.00 0.00 174.74 174.07 2qa4 s ALA 3 N -2.23 2.79 -0.01 -1.40 0.00 0.10 -0.54 121.76 120.47 2qa4 s ALA 3 Ca 0.39 -1.99 -0.18 0.00 0.00 0.00 0.00 51.96 50.18 2qa4 s ALA 3 Cb -0.10 -1.88 -0.06 0.00 0.00 0.00 0.00 23.12 21.08 2qa4 s ALA 3 CO 0.34 -1.38 0.52 -0.51 0.00 0.00 0.00 175.76 174.73 2qa4 s LEU 4 N 1.13 4.43 -0.13 0.00 1.43 -0.35 -3.43 118.68 121.76 2qa4 s LEU 4 Ca -0.02 1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 54.14 2qa4 s LEU 4 Cb -0.20 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 43.26 2qa4 s LEU 4 CO -0.04 0.18 -0.04 -0.69 0.23 0.00 0.00 176.35 175.98 2qa4 s VAL 5 N -0.45 0.88 0.06 -1.59 1.01 -0.48 -1.58 120.40 118.25 2qa4 s VAL 5 Ca 0.28 -0.36 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 2qa4 s VAL 5 Cb -0.18 -1.03 -0.07 0.00 0.00 0.00 0.00 36.38 35.10 2qa4 s VAL 5 CO 0.15 0.21 1.43 -1.58 0.00 0.00 0.00 175.10 175.31 2qa4 s GLN 6 N 1.75 4.29 -0.01 2.72 0.74 -0.77 -1.58 119.66 126.80 2qa4 s GLN 6 Ca 0.03 2.06 0.09 0.00 0.05 0.00 0.00 55.36 57.59 2qa4 s GLN 6 Cb -0.14 -3.44 -0.14 0.00 1.10 0.00 0.00 33.01 30.39 2qa4 s GLN 6 CO -0.07 -0.54 0.22 1.28 -0.55 0.00 0.00 175.29 175.63 2qa4 n LEU 7 N 4.81 0.05 -4.43 3.68 4.77 0.40 -0.30 117.00 125.98 2qa4 n LEU 7 Ca 0.13 -0.06 -0.31 0.00 -0.03 0.00 0.00 56.01 55.74 2qa4 n LEU 7 Cb 0.43 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 2qa4 n LEU 7 CO 0.59 0.01 -0.50 -0.13 -1.33 0.00 0.00 177.39 176.03 2qa4 s ARG 8 N -2.53 2.11 0.69 3.23 0.52 -0.95 -4.88 118.95 117.13 2qa4 s ARG 8 Ca -0.03 -0.95 -0.12 0.00 -0.52 0.00 0.00 55.73 54.12 2qa4 s ARG 8 Cb 0.06 -2.17 0.18 0.00 0.52 0.00 0.00 34.95 33.53 2qa4 s ARG 8 CO 0.38 0.55 0.50 0.41 0.02 0.00 0.00 175.30 177.16 2qa4 n GLY 9 N 1.79 -3.23 0.09 -3.53 0.00 -1.26 -4.80 105.19 94.25 2qa4 n GLY 9 Ca -0.16 -1.37 0.03 0.00 0.00 0.00 0.00 46.02 44.51 2qa4 n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2qa4 n GLU 10 N -3.57 0.63 -1.68 1.61 0.28 -1.26 -4.75 120.64 111.89 2qa4 n GLU 10 Ca 0.07 0.11 -0.46 0.00 -0.16 0.00 0.00 57.16 56.73 2qa4 n GLU 10 Cb 0.30 -1.73 -0.04 0.00 1.43 0.00 0.00 31.44 31.40 2qa4 n GLU 10 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2qa4 n VAL 11 N -2.73 0.19 -0.29 3.84 0.31 -1.26 -2.41 118.33 115.97 2qa4 n VAL 11 Ca -0.10 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 2qa4 n VAL 11 Cb 0.79 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 2qa4 n VAL 11 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2qa4 n ASN 12 N 4.56 0.00 -4.77 4.52 3.02 -1.26 -5.01 115.26 116.32 2qa4 n ASN 12 Ca 0.18 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.34 2qa4 n ASN 12 Cb 0.31 -0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 38.81 2qa4 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qa4 s MET 13 N -0.12 4.46 0.22 3.52 0.23 -1.01 -4.99 119.30 121.61 2qa4 s MET 13 Ca 0.00 1.02 -0.29 0.00 -1.03 0.00 0.00 55.69 55.39 2qa4 s MET 13 Cb 0.00 -3.29 -0.16 0.00 -1.53 0.00 0.00 34.83 29.85 2qa4 s MET 13 CO 0.00 0.49 0.75 0.72 -2.03 0.00 0.00 175.02 174.94 2qa4 n HIS 14 N 2.05 0.25 -0.18 3.16 8.25 -1.26 -4.79 115.22 122.69 2qa4 n HIS 14 Ca -0.06 0.87 -0.01 0.00 -0.26 0.00 0.00 57.72 58.26 2qa4 n HIS 14 Cb 0.50 -2.08 0.08 0.00 1.12 0.00 0.00 29.99 29.61 2qa4 n HIS 14 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2qa4 h THR 15 N 1.53 0.61 0.00 1.59 2.02 -1.96 -2.18 112.91 114.51 2qa4 h THR 15 Ca -0.34 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 2qa4 h THR 15 Cb 1.40 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2qa4 h THR 15 CO 0.59 0.03 -0.05 -2.24 0.37 0.00 0.00 175.52 174.23 2qa4 h ASP 16 N 0.16 0.00 0.08 4.18 2.03 -2.00 -1.83 116.42 119.04 2qa4 h ASP 16 Ca 0.28 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.58 2qa4 h ASP 16 Cb 0.42 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.92 2qa4 h ASP 16 CO -0.42 0.05 -0.04 0.40 -1.03 0.00 0.00 179.24 178.20 2qa4 h ILE 17 N 0.00 1.13 -0.76 4.15 2.04 -1.75 -2.92 117.51 119.40 2qa4 h ILE 17 Ca -0.00 -1.46 0.14 0.00 1.00 0.00 0.00 64.86 64.54 2qa4 h ILE 17 Cb 0.13 1.97 -0.10 0.00 -0.74 0.00 0.00 36.82 38.08 2qa4 h ILE 17 CO 0.01 0.32 0.30 -0.61 0.00 0.00 0.00 178.15 178.17 2qa4 h GLN 18 N -0.85 0.42 -0.14 2.37 4.15 -1.31 -0.25 115.11 119.50 2qa4 h GLN 18 Ca -0.01 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2qa4 h GLN 18 Cb 0.61 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 2qa4 h GLN 18 CO 0.02 0.28 0.09 -0.44 -1.93 0.00 0.00 178.83 176.85 2qa4 h ASP 19 N 0.44 0.15 -0.39 -0.69 3.32 -1.43 0.79 116.42 118.61 2qa4 h ASP 19 Ca 0.42 -0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.54 2qa4 h ASP 19 Cb 0.64 -0.04 -0.07 0.00 0.22 0.00 0.00 39.33 40.08 2qa4 h ASP 19 CO -0.41 0.11 -0.09 0.74 -1.72 0.00 0.00 179.24 177.87 2qa4 h THR 20 N 0.19 0.62 -0.82 0.35 2.02 -0.94 0.66 112.91 114.98 2qa4 h THR 20 Ca 0.05 -0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.33 2qa4 h THR 20 Cb -0.02 0.60 -0.06 0.00 -1.74 0.00 0.00 68.15 66.94 2qa4 h THR 20 CO -0.02 0.00 0.53 -0.07 0.37 0.00 0.00 175.52 176.34 2qa4 h LEU 21 N 0.01 0.68 0.04 2.58 3.38 -0.20 0.17 115.31 121.97 2qa4 h LEU 21 Ca 0.19 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 2qa4 h LEU 21 Cb 0.29 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2qa4 h LEU 21 CO -0.40 0.40 -0.02 -0.33 0.09 0.00 0.00 178.44 178.19 2qa4 h GLU 22 N 0.76 -0.05 0.00 1.13 5.08 0.16 -1.16 114.58 120.49 2qa4 h GLU 22 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 2qa4 h GLU 22 Cb 0.45 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2qa4 h GLU 22 CO -0.15 0.45 0.32 0.52 -1.00 0.00 0.00 179.01 179.16 2qa4 h MET 23 N -0.58 0.00 -1.30 2.33 2.86 0.20 0.96 114.93 119.40 2qa4 h MET 23 Ca -0.01 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.97 2qa4 h MET 23 Cb 0.53 0.00 -0.33 0.00 0.06 0.00 0.00 31.60 31.86 2qa4 h MET 23 CO 0.01 0.00 0.37 1.28 1.06 0.00 0.00 176.91 179.63 2qa4 n LEU 24 N -2.75 6.70 -2.67 1.22 4.77 0.40 -4.95 117.00 119.71 2qa4 n LEU 24 Ca -0.02 -4.66 -0.09 0.00 -0.03 0.00 0.00 56.01 51.20 2qa4 n LEU 24 Cb 0.37 -0.81 -0.02 0.00 -2.33 0.00 0.00 43.42 40.63 2qa4 n LEU 24 CO 0.12 1.79 -0.03 0.59 -1.33 0.00 0.00 177.39 178.52 2qa4 n ASN 25 N -0.71 -1.02 -4.02 -1.43 3.02 0.33 -4.89 115.26 106.54 2qa4 n ASN 25 Ca 0.53 0.05 -0.27 0.00 -0.03 0.00 0.00 54.58 54.86 2qa4 n ASN 25 Cb 0.60 -0.98 -0.17 0.00 -0.61 0.00 0.00 39.78 38.63 2qa4 n ASN 25 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2qa4 s ILE 26 N -2.00 1.33 -0.08 2.41 -4.36 -0.50 -4.52 121.20 113.49 2qa4 s ILE 26 Ca 0.18 -0.54 0.11 0.00 -0.26 0.00 0.00 60.65 60.14 2qa4 s ILE 26 Cb -0.11 -1.24 0.17 0.00 1.25 0.00 0.00 42.46 42.54 2qa4 s ILE 26 CO 0.22 0.41 1.07 1.41 0.24 0.00 0.00 174.94 178.28 2qa4 n HIS 27 N 4.25 0.00 -3.76 1.37 8.25 -1.26 -3.74 115.22 120.33 2qa4 n HIS 27 Ca -0.19 -0.68 -0.10 0.00 -0.26 0.00 0.00 57.72 56.49 2qa4 n HIS 27 Cb 0.51 -0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.47 2qa4 n HIS 27 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2qa4 s HIS 28 N -1.90 -0.05 0.64 4.41 3.76 -1.26 -5.08 115.29 115.82 2qa4 s HIS 28 Ca 0.19 -0.29 -0.14 0.00 -0.15 0.00 0.00 55.06 54.67 2qa4 s HIS 28 Cb 0.17 0.32 -0.01 0.00 1.11 0.00 0.00 32.58 34.16 2qa4 s HIS 28 CO 0.02 -0.87 1.06 0.08 -0.85 0.00 0.00 174.74 174.18 2qa4 s VAL 29 N -3.88 3.83 0.00 -0.90 1.01 -1.26 -3.23 120.40 115.97 2qa4 s VAL 29 Ca 0.10 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.83 2qa4 s VAL 29 Cb -0.00 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 33.03 2qa4 s VAL 29 CO -0.03 -0.63 0.00 0.59 0.00 0.00 0.00 175.10 175.03 2qa4 n ASN 30 N -2.53 0.00 -4.80 3.32 3.02 0.59 -4.93 115.26 109.92 2qa4 n ASN 30 Ca 0.08 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.30 2qa4 n ASN 30 Cb 0.53 -1.40 -0.03 0.00 -0.61 0.00 0.00 39.78 38.27 2qa4 n ASN 30 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2qa4 s HIS 31 N -1.95 3.05 0.02 3.10 3.76 -1.20 -2.16 115.29 119.91 2qa4 s HIS 31 Ca 0.00 1.57 -0.06 0.00 -0.15 0.00 0.00 55.06 56.42 2qa4 s HIS 31 Cb 0.00 -3.03 -0.00 0.00 1.11 0.00 0.00 32.58 30.66 2qa4 s HIS 31 CO 0.00 -0.76 0.12 0.00 -0.85 0.00 0.00 174.74 173.25 2qa4 s THR 33 N -1.81 0.05 -0.31 0.00 -1.32 -0.62 0.15 115.64 111.78 2qa4 s THR 33 Ca -0.12 -1.60 -0.05 0.00 -1.21 0.00 0.00 61.69 58.71 2qa4 s THR 33 Cb -0.06 -2.08 0.03 0.00 -1.51 0.00 0.00 72.50 68.89 2qa4 s THR 33 CO -0.01 -0.21 0.05 -0.76 -2.21 0.00 0.00 174.62 171.48 2qa4 s LEU 34 N -3.03 3.95 -0.16 9.08 1.43 -1.26 -1.21 118.68 127.48 2qa4 s LEU 34 Ca 0.24 -1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 52.26 2qa4 s LEU 34 Cb 0.04 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 2qa4 s LEU 34 CO 0.04 -0.25 -0.08 0.54 0.23 0.00 0.00 176.35 176.83 2qa4 s VAL 35 N 1.37 3.45 1.22 -1.59 0.11 0.30 -4.96 120.40 120.30 2qa4 s VAL 35 Ca -0.02 -0.51 -0.17 0.00 -2.93 0.00 0.00 61.98 58.36 2qa4 s VAL 35 Cb -0.19 -2.50 0.29 0.00 -1.53 0.00 0.00 36.38 32.46 2qa4 s VAL 35 CO 0.01 0.49 1.03 -2.84 -3.33 0.00 0.00 175.10 170.46 2qa4 s PRO 36 N 0.54 -1.37 -0.77 1.54 0.02 -1.26 -0.30 135.00 133.40 2qa4 s PRO 36 Ca -0.05 0.39 0.00 0.00 0.02 0.00 0.00 61.00 61.36 2qa4 s PRO 36 Cb -0.15 -1.54 0.19 0.00 0.02 0.00 0.00 34.50 33.02 2qa4 s PRO 36 CO 0.03 -3.91 0.61 -1.21 -0.33 0.00 0.00 177.00 172.20 2qa4 s GLU 37 N -4.90 2.86 0.00 5.54 2.02 -1.26 -4.67 118.70 118.29 2qa4 s GLU 37 Ca 0.68 -3.11 0.00 0.00 0.02 0.00 0.00 54.97 52.57 2qa4 s GLU 37 Cb -0.18 -3.75 0.00 0.00 0.10 0.00 0.00 34.13 30.31 2qa4 s GLU 37 CO 0.60 -1.24 0.00 2.41 0.02 0.00 0.00 175.26 177.05 2qa4 n THR 38 N 2.52 0.00 -0.03 3.63 -1.04 -1.26 -4.98 114.28 113.13 2qa4 n THR 38 Ca 0.17 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.97 2qa4 n THR 38 Cb 0.36 -0.66 -0.13 0.00 -1.82 0.00 0.00 70.33 68.08 2qa4 n THR 38 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2qa4 n ASP 39 N -0.85 2.09 -0.31 8.00 8.00 -1.26 -3.06 116.55 129.15 2qa4 n ASP 39 Ca 0.00 0.14 0.05 0.00 0.71 0.00 0.00 54.79 55.70 2qa4 n ASP 39 Cb 0.00 -0.78 0.25 0.00 -0.02 0.00 0.00 41.12 40.58 2qa4 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qa4 h ALA 40 N 0.03 1.54 0.14 2.24 0.00 -1.98 0.50 119.26 121.75 2qa4 h ALA 40 Ca -0.46 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.18 2qa4 h ALA 40 Cb 1.99 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 19.54 2qa4 h ALA 40 CO 0.04 0.29 -1.27 1.88 0.00 0.00 0.00 179.25 180.19 2qa4 h TYR 41 N 1.00 0.55 -0.16 0.00 -1.99 -1.87 -3.26 116.97 111.25 2qa4 h TYR 41 Ca 0.42 -0.40 0.02 0.00 2.00 0.00 0.00 58.73 60.76 2qa4 h TYR 41 Cb 0.31 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.00 2qa4 h TYR 41 CO -0.00 1.49 0.05 0.00 -0.00 0.00 0.00 178.16 179.70 2qa4 h ARG 42 N -0.25 0.12 0.00 4.88 3.08 -1.43 0.40 114.38 121.18 2qa4 h ARG 42 Ca -0.25 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2qa4 h ARG 42 Cb 1.79 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.81 2qa4 h ARG 42 CO 0.12 0.08 0.00 0.41 -1.07 0.00 0.00 179.97 179.51 2qa4 n GLY 43 N -1.15 -0.64 0.06 0.04 0.00 0.15 -1.26 105.19 102.39 2qa4 n GLY 43 Ca -0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.93 2qa4 n GLY 43 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qa4 h MET 44 N 0.00 0.00 0.00 1.61 2.86 -0.98 -3.36 114.93 115.06 2qa4 h MET 44 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2qa4 h MET 44 Cb 0.08 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 2qa4 h MET 44 CO 0.00 0.00 -0.06 -0.39 1.06 0.00 0.00 176.91 177.52 2qa4 h VAL 45 N -0.95 1.00 -0.04 -2.22 -1.51 -1.13 0.99 116.25 112.40 2qa4 h VAL 45 Ca 0.00 -0.20 0.01 0.00 -1.23 0.00 0.00 66.70 65.28 2qa4 h VAL 45 Cb 0.37 1.11 -0.00 0.00 -2.13 0.00 0.00 31.29 30.64 2qa4 h VAL 45 CO 0.00 0.06 0.06 0.00 -1.23 0.00 0.00 177.57 176.46 2qa4 h ALA 46 N 1.94 1.46 0.00 5.19 0.00 -1.36 1.20 119.26 127.69 2qa4 h ALA 46 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qa4 h ALA 46 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2qa4 h ALA 46 CO 0.01 -0.08 -1.08 1.17 0.00 0.00 0.00 179.25 179.27 2qa4 n LYS 47 N -3.62 0.37 0.00 0.00 4.81 0.32 -3.84 118.16 116.20 2qa4 n LYS 47 Ca -0.02 0.01 0.07 0.00 -0.87 0.00 0.00 58.31 57.50 2qa4 n LYS 47 Cb 0.15 -1.63 0.01 0.00 0.02 0.00 0.00 35.03 33.57 2qa4 n LYS 47 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2qa4 n VAL 48 N -2.11 0.00 -0.34 3.15 0.31 0.41 -4.73 118.33 115.03 2qa4 n VAL 48 Ca 0.01 -0.37 0.08 0.00 -0.01 0.00 0.00 64.34 64.05 2qa4 n VAL 48 Cb 0.47 1.20 0.17 0.00 -0.91 0.00 0.00 33.84 34.76 2qa4 n VAL 48 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2qa4 n ASN 49 N 0.01 -0.28 0.26 4.52 2.85 0.39 -1.43 115.26 121.57 2qa4 n ASN 49 Ca 0.06 1.62 0.17 0.00 -0.11 0.00 0.00 54.58 56.32 2qa4 n ASN 49 Cb 0.32 -0.52 0.72 0.00 1.24 0.00 0.00 39.78 41.54 2qa4 n ASN 49 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 2qa4 h ASP 50 N 0.00 0.00 -0.01 1.20 3.32 -1.86 -3.14 116.42 115.93 2qa4 h ASP 50 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 2qa4 h ASP 50 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2qa4 h ASP 50 CO -0.95 0.00 -0.06 0.49 -1.72 0.00 0.00 179.24 177.00 2qa4 n PHE 51 N -2.92 0.00 -4.71 4.55 3.01 -0.52 -4.81 117.46 112.06 2qa4 n PHE 51 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.15 2qa4 n PHE 51 Cb 0.26 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.64 2qa4 n PHE 51 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2qa4 s VAL 52 N -0.91 1.38 -0.05 -4.37 0.11 -1.08 -0.45 120.40 115.03 2qa4 s VAL 52 Ca 0.09 -2.00 0.01 0.00 -2.93 0.00 0.00 61.98 57.15 2qa4 s VAL 52 Cb 0.07 -2.41 0.02 0.00 -1.53 0.00 0.00 36.38 32.54 2qa4 s VAL 52 CO 0.15 0.00 -0.04 0.00 -3.33 0.00 0.00 175.10 171.87 2qa4 s ALA 53 N -2.84 0.69 0.22 1.54 0.00 -0.61 -1.73 121.76 119.03 2qa4 s ALA 53 Ca 0.15 -0.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.92 2qa4 s ALA 53 Cb 0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 2qa4 s ALA 53 CO 0.07 -0.05 0.41 -0.59 0.00 0.00 0.00 175.76 175.60 2qa4 s PHE 54 N 1.00 0.40 -3.22 0.00 -0.12 -0.86 -1.38 117.98 113.79 2qa4 s PHE 54 Ca -0.10 -0.74 0.00 0.00 -0.05 0.00 0.00 56.93 56.04 2qa4 s PHE 54 Cb -0.14 0.09 0.00 0.00 -0.63 0.00 0.00 43.02 42.34 2qa4 s PHE 54 CO -0.00 -0.90 0.00 0.41 -0.05 0.00 0.00 175.22 174.68 2qa4 n GLY 55 N -0.33 -1.42 3.39 1.99 0.00 -1.22 0.28 105.19 107.87 2qa4 n GLY 55 Ca -0.03 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.54 2qa4 n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qa4 s GLU 56 N -1.35 3.50 0.63 1.61 2.12 -1.26 0.02 118.70 123.96 2qa4 s GLU 56 Ca 0.00 -0.57 -0.14 0.00 0.36 0.00 0.00 54.97 54.63 2qa4 s GLU 56 Cb 0.00 -3.22 -0.02 0.00 0.26 0.00 0.00 34.13 31.15 2qa4 s GLU 56 CO 0.00 -0.22 1.05 -1.25 -0.54 0.00 0.00 175.26 174.30 2qa4 s PRO 57 N 1.56 3.26 0.32 4.30 0.04 -1.26 -4.50 135.00 138.72 2qa4 s PRO 57 Ca 0.06 1.05 -0.16 0.00 0.04 0.00 0.00 61.00 61.98 2qa4 s PRO 57 Cb -0.15 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2qa4 s PRO 57 CO 0.01 -0.84 0.76 -1.54 0.04 0.00 0.00 177.00 175.42 2qa4 s SER 58 N -3.30 6.83 0.14 6.66 1.04 -1.26 -4.90 113.70 118.91 2qa4 s SER 58 Ca 0.60 1.34 -0.31 0.00 0.48 0.00 0.00 55.95 58.07 2qa4 s SER 58 Cb -0.14 -2.40 -0.07 0.00 0.10 0.00 0.00 66.02 63.51 2qa4 s SER 58 CO 0.44 -0.19 1.55 -0.61 0.98 0.00 0.00 173.24 175.42 2qa4 h GLN 59 N 2.37 -0.33 -0.93 4.02 5.75 -1.97 -1.02 115.11 123.02 2qa4 h GLN 59 Ca -0.48 0.02 0.18 0.00 -0.15 0.00 0.00 58.65 58.23 2qa4 h GLN 59 Cb 1.18 0.07 -0.17 0.00 1.07 0.00 0.00 27.48 29.63 2qa4 h GLN 59 CO 0.65 -0.22 -0.24 0.39 -2.65 0.00 0.00 178.83 176.76 2qa4 n GLU 60 N -5.38 -0.09 0.06 1.69 1.02 -1.26 -1.00 120.64 115.68 2qa4 n GLU 60 Ca -0.02 1.45 -0.13 0.00 -0.02 0.00 0.00 57.16 58.44 2qa4 n GLU 60 Cb 0.34 -2.16 -0.09 0.00 -0.02 0.00 0.00 31.44 29.51 2qa4 n GLU 60 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2qa4 h THR 61 N 0.00 1.06 -0.67 2.62 2.02 -1.62 -1.54 112.91 114.78 2qa4 h THR 61 Ca 0.44 -0.77 0.11 0.00 0.77 0.00 0.00 66.41 66.96 2qa4 h THR 61 Cb 0.67 1.53 -0.08 0.00 -1.74 0.00 0.00 68.15 68.53 2qa4 h THR 61 CO -0.95 0.18 0.26 0.25 0.37 0.00 0.00 175.52 175.62 2qa4 h LEU 62 N -0.53 0.24 0.13 2.58 5.85 -0.05 0.31 115.31 123.84 2qa4 h LEU 62 Ca -0.02 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.81 2qa4 h LEU 62 Cb 0.42 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2qa4 h LEU 62 CO 0.03 0.12 -0.32 -0.33 -0.34 0.00 0.00 178.44 177.60 2qa4 h GLU 63 N 0.42 -0.53 -0.55 1.25 5.08 -0.99 0.29 114.58 119.55 2qa4 h GLU 63 Ca 0.35 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.82 2qa4 h GLU 63 Cb 0.48 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 2qa4 h GLU 63 CO -0.35 -0.36 0.37 1.15 -1.00 0.00 0.00 179.01 178.82 2qa4 h THR 64 N -0.55 0.95 0.03 1.13 2.02 -0.15 -1.02 112.91 115.31 2qa4 h THR 64 Ca 0.03 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.05 2qa4 h THR 64 Cb 0.58 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 2qa4 h THR 64 CO -0.19 0.08 -0.02 0.58 0.37 0.00 0.00 175.52 176.35 2qa4 h VAL 65 N 0.44 1.38 0.00 3.16 2.07 -0.22 -2.34 116.25 120.75 2qa4 h VAL 65 Ca 0.25 -1.44 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2qa4 h VAL 65 Cb 0.39 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2qa4 h VAL 65 CO -0.07 0.36 0.01 -0.07 0.02 0.00 0.00 177.57 177.82 2qa4 h LEU 66 N -0.68 0.00 0.00 2.57 3.38 0.17 0.82 115.31 121.57 2qa4 h LEU 66 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qa4 h LEU 66 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2qa4 h LEU 66 CO 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.51 2qa4 h ALA 67 N 1.98 0.00 0.00 1.53 0.00 -1.18 -3.24 119.26 118.35 2qa4 h ALA 67 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2qa4 h ALA 67 Cb 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2qa4 h ALA 67 CO 0.00 0.03 -0.17 0.00 0.00 0.00 0.00 179.25 179.11 2qa4 h THR 68 N -0.12 0.83 0.00 0.00 1.03 -1.23 -3.35 112.91 110.06 2qa4 h THR 68 Ca 0.00 -0.65 -0.00 0.00 -0.01 0.00 0.00 66.41 65.75 2qa4 h THR 68 Cb 0.03 1.38 -0.00 0.00 -1.07 0.00 0.00 68.15 68.49 2qa4 h THR 68 CO 0.00 0.17 -0.25 0.54 -0.01 0.00 0.00 175.52 175.97 2qa4 n ARG 69 N -3.91 0.67 -3.33 0.00 5.12 0.28 -5.07 116.66 110.42 2qa4 n ARG 69 Ca -0.02 -1.83 -0.32 0.00 -1.93 0.00 0.00 57.85 53.75 2qa4 n ARG 69 Cb 0.26 -1.02 -0.06 0.00 -1.16 0.00 0.00 32.46 30.49 2qa4 n ARG 69 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2qa4 s ALA 70 N -1.49 3.50 0.02 7.54 0.00 -1.22 -4.35 121.76 125.75 2qa4 s ALA 70 Ca 0.17 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.96 2qa4 s ALA 70 Cb 0.15 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.72 2qa4 s ALA 70 CO 0.01 0.46 -0.04 -1.21 0.00 0.00 0.00 175.76 174.98 2qa4 s GLU 71 N -2.82 0.34 0.44 0.00 2.02 -1.26 -4.29 118.70 113.13 2qa4 s GLU 71 Ca 0.49 -0.48 -0.22 0.00 0.02 0.00 0.00 54.97 54.78 2qa4 s GLU 71 Cb -0.11 -0.11 -0.09 0.00 0.10 0.00 0.00 34.13 33.91 2qa4 s GLU 71 CO 0.20 0.01 1.02 -2.14 0.02 0.00 0.00 175.26 174.37 2qa4 s PRO 72 N -1.03 4.04 0.47 0.39 0.02 -1.26 -0.22 135.00 137.41 2qa4 s PRO 72 Ca -0.09 1.36 0.35 0.00 0.02 0.00 0.00 61.00 62.64 2qa4 s PRO 72 Cb -0.07 -2.29 1.50 0.00 0.02 0.00 0.00 34.50 33.66 2qa4 s PRO 72 CO -0.00 -0.22 1.63 -0.07 -0.33 0.00 0.00 177.00 178.00 2qa4 h LEU 73 N 2.01 0.17 -7.36 -5.54 4.07 -1.17 -3.37 115.31 104.12 2qa4 h LEU 73 Ca -0.49 0.09 -0.18 0.00 0.08 0.00 0.00 57.88 57.39 2qa4 h LEU 73 Cb 1.21 0.09 -0.28 0.00 1.08 0.00 0.00 40.66 42.75 2qa4 h LEU 73 CO 0.61 -0.12 -0.45 -1.61 -1.08 0.00 0.00 178.44 175.79 2qa4 s GLU 74 N -5.18 0.25 0.00 1.13 2.02 -1.26 -4.84 118.70 110.82 2qa4 s GLU 74 Ca -0.07 0.52 0.00 0.00 0.02 0.00 0.00 54.97 55.44 2qa4 s GLU 74 Cb 0.29 -0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.47 2qa4 s GLU 74 CO 0.84 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 176.39 2qa4 n GLY 75 N 3.94 3.45 0.03 -1.39 0.00 -1.26 -4.84 105.19 105.12 2qa4 n GLY 75 Ca -0.22 -1.86 0.12 0.00 0.00 0.00 0.00 46.02 44.05 2qa4 n GLY 75 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qa4 n ASP 76 N 0.00 0.58 -4.51 1.61 -0.08 -1.26 -4.61 116.55 108.27 2qa4 n ASP 76 Ca 0.00 -0.10 -0.50 0.00 -1.51 0.00 0.00 54.79 52.68 2qa4 n ASP 76 Cb 0.00 0.27 -0.04 0.00 2.34 0.00 0.00 41.12 43.69 2qa4 n ASP 76 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qa4 n ALA 77 N -1.66 -1.92 -2.46 -1.67 0.00 -1.26 -4.97 120.51 106.57 2qa4 n ALA 77 Ca 0.04 0.48 -0.39 0.00 0.00 0.00 0.00 53.44 53.57 2qa4 n ALA 77 Cb 0.38 -1.85 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 2qa4 n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qa4 s ASP 78 N -0.36 7.09 -0.55 0.00 -0.00 -1.26 -4.46 116.67 117.14 2qa4 s ASP 78 Ca 0.73 1.30 -0.19 0.00 -0.00 0.00 0.00 52.55 54.39 2qa4 s ASP 78 Cb -0.94 -2.42 0.07 0.00 -0.00 0.00 0.00 42.92 39.63 2qa4 s ASP 78 CO 0.55 0.04 0.68 -0.69 -0.00 0.00 0.00 175.17 175.75 2qa4 s VAL 79 N -0.03 4.81 0.42 -1.27 1.01 -1.26 -4.76 120.40 119.32 2qa4 s VAL 79 Ca 0.35 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2qa4 s VAL 79 Cb -0.19 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.76 2qa4 s VAL 79 CO 0.20 -0.96 0.07 1.51 0.00 0.00 0.00 175.10 175.91 2qa4 s ASP 80 N 3.08 3.15 0.25 3.32 1.47 -1.26 -4.62 116.67 122.06 2qa4 s ASP 80 Ca 0.15 -1.57 -0.05 0.00 1.18 0.00 0.00 52.55 52.26 2qa4 s ASP 80 Cb -0.21 0.28 0.47 0.00 -0.34 0.00 0.00 42.92 43.12 2qa4 s ASP 80 CO 0.10 -0.79 1.66 0.44 0.68 0.00 0.00 175.17 177.27 2qa4 h ASP 81 N 1.75 -0.11 -0.34 2.11 3.32 -1.94 0.82 116.42 122.03 2qa4 h ASP 81 Ca -0.40 0.17 0.02 0.00 0.02 0.00 0.00 57.03 56.83 2qa4 h ASP 81 Cb 1.27 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 41.05 2qa4 h ASP 81 CO 0.67 -0.10 0.19 -0.08 -1.72 0.00 0.00 179.24 178.20 2qa4 h GLU 82 N 0.20 0.38 0.42 3.56 4.81 -1.96 -0.59 114.58 121.41 2qa4 h GLU 82 Ca 0.42 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.61 2qa4 h GLU 82 Cb 0.75 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2qa4 h GLU 82 CO -0.57 0.25 -0.20 2.35 -0.73 0.00 0.00 179.01 180.11 2qa4 h TRP 83 N 0.40 -0.53 -1.01 0.92 7.01 -1.46 -2.36 115.95 118.92 2qa4 h TRP 83 Ca 0.13 -0.01 0.24 0.00 2.11 0.00 0.00 58.89 61.36 2qa4 h TRP 83 Cb 0.01 0.17 -0.11 0.00 -2.10 0.00 0.00 29.16 27.13 2qa4 h TRP 83 CO -0.08 -0.33 0.61 0.28 -2.79 0.00 0.00 178.44 176.14 2qa4 h VAL 84 N -0.57 0.57 -0.15 2.65 2.07 -0.52 -1.28 116.25 119.03 2qa4 h VAL 84 Ca -0.06 -0.20 -0.14 0.00 0.82 0.00 0.00 66.70 67.12 2qa4 h VAL 84 Cb 0.44 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 2qa4 h VAL 84 CO 0.10 0.11 -0.44 0.00 0.02 0.00 0.00 177.57 177.36 2qa4 h ALA 85 N 1.69 0.25 0.00 1.67 0.00 -0.84 -0.34 119.26 121.69 2qa4 h ALA 85 Ca 0.62 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qa4 h ALA 85 Cb 1.20 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2qa4 h ALA 85 CO -0.42 0.38 -0.02 0.93 0.00 0.00 0.00 179.25 180.12 2qa4 h GLU 86 N 0.19 0.00 0.00 0.00 5.08 -0.81 -3.35 114.58 115.69 2qa4 h GLU 86 Ca -0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2qa4 h GLU 86 Cb 1.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 2qa4 h GLU 86 CO 0.09 0.02 -1.25 0.72 -1.00 0.00 0.00 179.01 177.60 2qa4 n HIS 87 N -3.11 0.00 -4.14 4.33 8.25 -0.57 -5.07 115.22 114.92 2qa4 n HIS 87 Ca 0.02 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.24 2qa4 n HIS 87 Cb 0.43 -0.15 -0.05 0.00 1.12 0.00 0.00 29.99 31.33 2qa4 n HIS 87 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2qa4 s THR 88 N -2.22 4.25 0.40 1.59 2.01 -0.14 -5.00 115.64 116.53 2qa4 s THR 88 Ca -0.02 -1.36 0.14 0.00 0.31 0.00 0.00 61.69 60.76 2qa4 s THR 88 Cb 0.02 -3.23 0.35 0.00 0.01 0.00 0.00 72.50 69.65 2qa4 s THR 88 CO 0.18 -0.24 1.89 0.44 -0.69 0.00 0.00 174.62 176.20 2qa4 h ASP 89 N 2.00 0.49 -4.24 3.53 3.32 -1.88 -3.43 116.42 116.21 2qa4 h ASP 89 Ca -0.48 0.03 -0.46 0.00 0.02 0.00 0.00 57.03 56.15 2qa4 h ASP 89 Cb 1.22 -0.06 0.13 0.00 0.22 0.00 0.00 39.33 40.85 2qa4 h ASP 89 CO 0.61 0.24 0.34 -0.31 -1.72 0.00 0.00 179.24 178.40 2qa4 s TYR 90 N -5.51 2.26 -0.04 4.55 1.51 -1.26 -5.03 117.35 113.82 2qa4 s TYR 90 Ca -0.09 0.67 0.03 0.00 -1.01 0.00 0.00 57.07 56.67 2qa4 s TYR 90 Cb 0.22 -3.59 -0.25 0.00 -0.11 0.00 0.00 41.96 38.23 2qa4 s TYR 90 CO 0.78 -2.40 0.67 -0.44 -1.11 0.00 0.00 175.55 173.06 2qa4 h ASP 91 N -1.50 0.22 -0.80 2.29 3.32 -1.85 -3.36 116.42 114.74 2qa4 h ASP 91 Ca -0.47 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.17 2qa4 h ASP 91 Cb 1.31 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2qa4 h ASP 91 CO 0.55 1.36 0.00 -0.90 -1.72 0.00 0.00 179.24 178.53 2qa4 n ASP 92 N -3.29 0.00 -0.06 6.45 5.75 -1.26 -4.15 116.55 119.99 2qa4 n ASP 92 Ca -0.20 -0.80 -0.10 0.00 -0.01 0.00 0.00 54.79 53.68 2qa4 n ASP 92 Cb 1.04 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 41.10 2qa4 n ASP 92 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2qa4 h ILE 93 N 0.80 1.08 0.41 2.12 2.04 -1.87 -2.63 117.51 119.46 2qa4 h ILE 93 Ca 0.00 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 2qa4 h ILE 93 Cb 0.00 0.80 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2qa4 h ILE 93 CO 0.00 0.08 -0.26 0.28 0.00 0.00 0.00 178.15 178.25 2qa4 h SER 94 N 0.29 -0.67 -1.50 1.72 0.02 -1.96 0.67 113.55 112.11 2qa4 h SER 94 Ca 0.08 0.04 0.44 0.00 -0.84 0.00 0.00 61.79 61.51 2qa4 h SER 94 Cb 0.01 0.20 -0.06 0.00 0.14 0.00 0.00 62.40 62.68 2qa4 h SER 94 CO -0.02 -0.40 1.08 1.23 -1.14 0.00 0.00 176.83 177.59 2qa4 h GLY 95 N -0.63 0.00 0.13 -3.77 0.00 -1.96 0.48 103.07 97.32 2qa4 h GLY 95 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2qa4 h GLY 95 CO 0.05 0.00 -0.06 -2.00 0.00 0.00 0.00 176.54 174.52 2qa4 h LEU 96 N 0.00 -0.15 -1.38 3.11 5.85 -0.99 -3.07 115.31 118.68 2qa4 h LEU 96 Ca 0.71 0.01 0.31 0.00 0.84 0.00 0.00 57.88 59.74 2qa4 h LEU 96 Cb 2.87 0.04 -0.10 0.00 0.37 0.00 0.00 40.66 43.84 2qa4 h LEU 96 CO -0.01 0.17 0.71 0.00 -0.34 0.00 0.00 178.44 178.97 2qa4 h ALA 97 N -1.37 2.35 0.29 1.25 0.00 0.32 0.85 119.26 122.96 2qa4 h ALA 97 Ca -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qa4 h ALA 97 Cb 0.14 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2qa4 h ALA 97 CO 0.03 -0.81 -0.14 0.35 0.00 0.00 0.00 179.25 178.68 2qa4 h PHE 98 N 0.31 -0.36 -0.70 0.00 3.57 -0.29 0.29 116.94 119.76 2qa4 h PHE 98 Ca 0.65 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 62.23 2qa4 h PHE 98 Cb 1.76 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 40.57 2qa4 h PHE 98 CO -0.00 -0.12 0.46 0.00 -2.23 0.00 0.00 178.31 176.42 2qa4 h ALA 99 N 0.11 1.87 0.27 2.41 0.00 -0.78 0.12 119.26 123.25 2qa4 h ALA 99 Ca -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2qa4 h ALA 99 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2qa4 h ALA 99 CO 0.07 -0.02 -0.13 -0.07 0.00 0.00 0.00 179.25 179.10 2qa4 h LEU 100 N 0.59 -0.31 -1.63 0.00 3.38 -0.91 0.37 115.31 116.80 2qa4 h LEU 100 Ca 0.32 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 58.17 2qa4 h LEU 100 Cb 0.47 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2qa4 h LEU 100 CO -0.11 0.09 0.40 -0.07 0.09 0.00 0.00 178.44 178.84 2qa4 h LEU 101 N -0.76 0.38 -0.72 1.67 3.38 -0.31 0.45 115.31 119.40 2qa4 h LEU 101 Ca -0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qa4 h LEU 101 Cb 0.50 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2qa4 h LEU 101 CO 0.06 0.24 0.00 -1.54 0.09 0.00 0.00 178.44 177.29 2qa4 n SER 102 N -4.47 1.09 -3.52 -0.43 3.41 0.36 -4.36 113.62 105.69 2qa4 n SER 102 Ca 0.09 -1.52 -0.24 0.00 -0.26 0.00 0.00 58.87 56.94 2qa4 n SER 102 Cb 0.35 -0.05 0.05 0.00 -0.26 0.00 0.00 64.21 64.30 2qa4 n SER 102 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2qa4 n GLU 103 N -0.09 -2.00 -0.01 4.33 1.02 0.16 -4.94 120.64 119.10 2qa4 n GLU 103 Ca 0.17 0.63 0.05 0.00 -0.02 0.00 0.00 57.16 57.99 2qa4 n GLU 103 Cb 0.25 -4.87 -0.10 0.00 -0.02 0.00 0.00 31.44 26.71 2qa4 n GLU 103 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2qa4 n GLU 104 N -3.84 0.59 -3.96 3.49 4.07 0.12 -5.02 120.64 116.10 2qa4 n GLU 104 Ca -0.11 -0.11 -0.09 0.00 -0.06 0.00 0.00 57.16 56.80 2qa4 n GLU 104 Cb 0.61 -1.31 -0.04 0.00 -0.06 0.00 0.00 31.44 30.64 2qa4 n GLU 104 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2qa4 s THR 105 N -2.83 0.00 0.51 6.31 -1.32 -1.25 -5.05 115.64 112.00 2qa4 s THR 105 Ca -0.05 -1.29 0.04 0.00 -1.21 0.00 0.00 61.69 59.18 2qa4 s THR 105 Cb 0.08 -2.21 0.00 0.00 -1.51 0.00 0.00 72.50 68.86 2qa4 s THR 105 CO 0.54 0.00 0.18 0.42 -2.21 0.00 0.00 174.62 173.55 2qa4 s THR 106 N -3.85 1.50 0.17 5.08 -4.23 -1.26 -4.65 115.64 108.38 2qa4 s THR 106 Ca 0.19 -1.77 0.10 0.00 -1.18 0.00 0.00 61.69 59.04 2qa4 s THR 106 Cb -0.02 -2.26 -0.08 0.00 1.34 0.00 0.00 72.50 71.47 2qa4 s THR 106 CO 0.09 0.00 1.47 -0.07 -0.54 0.00 0.00 174.62 175.58 2qa4 h LEU 107 N 1.13 0.00 0.15 4.79 3.38 -1.93 -3.18 115.31 119.65 2qa4 h LEU 107 Ca -0.41 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 2qa4 h LEU 107 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2qa4 h LEU 107 CO 0.67 0.75 -0.07 0.03 0.09 0.00 0.00 178.44 179.91 2qa4 h ARG 108 N 0.00 -0.19 0.00 1.13 3.08 -1.91 0.35 114.38 116.85 2qa4 h ARG 108 Ca -0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2qa4 h ARG 108 Cb 1.38 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.47 2qa4 h ARG 108 CO 0.10 0.23 0.36 0.93 -1.07 0.00 0.00 179.97 180.51 2qa4 h GLU 109 N -0.69 0.00 -0.23 0.04 5.08 -1.89 0.45 114.58 117.34 2qa4 h GLU 109 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2qa4 h GLU 109 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2qa4 h GLU 109 CO 0.03 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.08 2qa4 n GLN 110 N -2.43 1.93 -1.06 2.33 1.13 -1.11 -4.96 117.38 113.20 2qa4 n GLN 110 Ca -0.01 -1.74 -0.02 0.00 -1.94 0.00 0.00 57.00 53.28 2qa4 n GLN 110 Cb 0.39 -1.28 -0.01 0.00 0.11 0.00 0.00 30.24 29.45 2qa4 n GLN 110 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qa4 n GLY 111 N 0.69 0.54 3.66 1.08 0.00 0.16 -4.81 105.19 106.50 2qa4 n GLY 111 Ca 0.11 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 2qa4 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qa4 s LEU 112 N -0.45 3.43 0.24 0.99 1.43 0.12 -0.71 118.68 123.73 2qa4 s LEU 112 Ca 0.00 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 52.78 2qa4 s LEU 112 Cb 0.00 -1.93 -0.10 0.00 0.03 0.00 0.00 46.19 44.19 2qa4 s LEU 112 CO 0.00 0.30 1.47 -0.55 0.23 0.00 0.00 176.35 177.80 2qa4 s SER 113 N -1.41 6.61 0.60 2.29 0.15 0.69 -3.42 113.70 119.22 2qa4 s SER 113 Ca 0.18 2.69 0.29 0.00 0.70 0.00 0.00 55.95 59.81 2qa4 s SER 113 Cb -0.11 -2.62 1.56 0.00 -1.71 0.00 0.00 66.02 63.13 2qa4 s SER 113 CO 0.08 -0.74 1.96 -0.65 1.20 0.00 0.00 173.24 175.09 2qa4 h PRO 114 N 5.23 0.00 -5.48 5.44 0.11 -1.89 -3.42 132.00 131.99 2qa4 h PRO 114 Ca -0.46 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.02 2qa4 h PRO 114 Cb 1.22 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.21 2qa4 h PRO 114 CO 0.80 0.00 -0.51 0.99 -0.21 0.00 0.00 178.00 179.06 2qa4 s THR 115 N -4.56 5.21 -0.73 -1.15 2.01 -1.26 -4.39 115.64 110.77 2qa4 s THR 115 Ca -0.04 0.11 -0.06 0.00 0.31 0.00 0.00 61.69 62.00 2qa4 s THR 115 Cb 0.15 -3.31 0.19 0.00 0.01 0.00 0.00 72.50 69.53 2qa4 s THR 115 CO 0.51 0.53 0.60 -0.76 -0.69 0.00 0.00 174.62 174.81 2qa4 s LEU 116 N -0.27 5.77 -0.41 4.42 1.43 0.39 -4.71 118.68 125.30 2qa4 s LEU 116 Ca 0.10 -2.94 -0.28 0.00 -1.03 0.00 0.00 54.13 49.99 2qa4 s LEU 116 Cb -0.12 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 2qa4 s LEU 116 CO 0.01 -0.41 1.91 -0.13 0.23 0.00 0.00 176.35 177.96 2qa4 s ARG 117 N -0.19 3.02 0.79 1.70 0.52 -1.26 -1.37 118.95 122.15 2qa4 s ARG 117 Ca 0.19 1.27 -0.09 0.00 -0.52 0.00 0.00 55.73 56.59 2qa4 s ARG 117 Cb -0.15 -4.30 0.17 0.00 0.52 0.00 0.00 34.95 31.19 2qa4 s ARG 117 CO -0.06 -2.24 1.07 1.28 0.02 0.00 0.00 175.30 175.38 2qa4 n LEU 118 N 11.57 0.00 -4.87 2.53 4.77 -0.92 -4.93 117.00 125.16 2qa4 n LEU 118 Ca 0.24 -1.58 -0.24 0.00 -0.03 0.00 0.00 56.01 54.41 2qa4 n LEU 118 Cb 0.49 -0.77 -0.04 0.00 -2.33 0.00 0.00 43.42 40.76 2qa4 n LEU 118 CO 0.69 -1.18 -0.14 -2.28 -1.33 0.00 0.00 177.39 173.15 2qa4 s HIS 119 N -3.26 3.25 0.25 -1.77 5.65 -0.54 -4.86 115.29 114.02 2qa4 s HIS 119 Ca 0.65 -0.03 -0.31 0.00 0.25 0.00 0.00 55.06 55.62 2qa4 s HIS 119 Cb -0.02 -1.51 -0.12 0.00 -1.18 0.00 0.00 32.58 29.75 2qa4 s HIS 119 CO 0.44 0.50 1.66 -2.30 -0.65 0.00 0.00 174.74 174.39 2qa4 n PRO 120 N -0.90 2.73 -1.39 2.88 -0.02 -1.26 -4.50 135.00 132.54 2qa4 n PRO 120 Ca -0.08 0.98 -0.57 0.00 -2.02 0.00 0.00 63.50 61.81 2qa4 n PRO 120 Cb 0.56 -2.79 -0.10 0.00 -0.02 0.00 0.00 33.50 31.15 2qa4 n PRO 120 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2qa4 n PRO 121 N 3.05 0.45 -1.87 0.52 -0.04 -1.26 -4.67 135.00 131.18 2qa4 n PRO 121 Ca 0.12 0.13 -0.42 0.00 -0.04 0.00 0.00 63.50 63.29 2qa4 n PRO 121 Cb 0.36 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 31.92 2qa4 n PRO 121 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qa4 s ARG 122 N 5.65 4.18 -0.01 0.54 0.52 -0.50 -0.75 118.95 128.58 2qa4 s ARG 122 Ca 1.14 2.39 0.00 0.00 -0.52 0.00 0.00 55.73 58.74 2qa4 s ARG 122 Cb -1.25 -3.69 0.00 0.00 0.52 0.00 0.00 34.95 30.53 2qa4 s ARG 122 CO 0.62 -0.79 0.00 0.41 0.02 0.00 0.00 175.30 175.56 2qa4 n GLY 123 N 4.10 0.45 1.13 -3.53 0.00 -1.26 -4.88 105.19 101.19 2qa4 n GLY 123 Ca 0.17 -0.51 0.15 0.00 0.00 0.00 0.00 46.02 45.82 2qa4 n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa4 n GLY 124 N -2.97 -2.43 3.87 -0.02 0.00 0.07 -5.00 105.19 98.71 2qa4 n GLY 124 Ca -0.00 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 2qa4 n GLY 124 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2qa4 s HIS 125 N -2.89 1.76 -1.65 1.61 -3.43 -1.26 -4.94 115.29 104.49 2qa4 s HIS 125 Ca 0.00 -0.84 0.23 0.00 -0.80 0.00 0.00 55.06 53.65 2qa4 s HIS 125 Cb 0.00 -1.87 1.23 0.00 -1.43 0.00 0.00 32.58 30.50 2qa4 s HIS 125 CO 0.00 -0.30 1.74 -0.25 -2.00 0.00 0.00 174.74 173.92 2qa4 n ASP 126 N -1.64 0.00 0.00 7.38 8.00 -1.26 -4.95 116.55 124.08 2qa4 n ASP 126 Ca -0.05 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2qa4 n ASP 126 Cb 0.65 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2qa4 n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qa4 n GLY 127 N 0.55 3.65 1.94 0.44 0.00 -1.26 -4.08 105.19 106.43 2qa4 n GLY 127 Ca 0.13 -1.48 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 2qa4 n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qa4 n VAL 128 N -0.13 2.96 -0.00 1.61 0.24 -1.26 -1.47 118.33 120.27 2qa4 n VAL 128 Ca 0.00 -1.83 0.03 0.00 -2.04 0.00 0.00 64.34 60.49 2qa4 n VAL 128 Cb 0.00 -0.38 -0.04 0.00 -1.47 0.00 0.00 33.84 31.94 2qa4 n VAL 128 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2qa4 n LYS 129 N -0.54 0.30 -4.12 7.34 5.02 -1.26 -5.03 118.16 119.88 2qa4 n LYS 129 Ca 0.45 -0.05 -0.11 0.00 -2.02 0.00 0.00 58.31 56.58 2qa4 n LYS 129 Cb 1.42 -1.13 -0.11 0.00 -0.02 0.00 0.00 35.03 35.19 2qa4 n LYS 129 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2qa4 s HIS 130 N -2.38 0.77 0.08 2.13 3.76 -1.26 -5.06 115.29 113.32 2qa4 s HIS 130 Ca -0.02 -0.75 -0.01 0.00 -0.15 0.00 0.00 55.06 54.13 2qa4 s HIS 130 Cb 0.04 -0.46 0.02 0.00 1.11 0.00 0.00 32.58 33.29 2qa4 s HIS 130 CO 0.23 -0.14 0.10 -0.35 -0.85 0.00 0.00 174.74 173.73 2qa4 n PRO 131 N 0.61 -0.43 0.06 8.40 -0.04 -1.26 -3.06 135.00 139.28 2qa4 n PRO 131 Ca -0.17 -0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.02 2qa4 n PRO 131 Cb 0.58 -0.11 -0.09 0.00 -0.04 0.00 0.00 33.50 33.84 2qa4 n PRO 131 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qa4 h VAL 132 N -1.22 1.02 -0.12 0.52 2.07 -0.80 0.60 116.25 118.32 2qa4 h VAL 132 Ca -0.03 -0.85 0.04 0.00 0.82 0.00 0.00 66.70 66.67 2qa4 h VAL 132 Cb 0.09 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2qa4 h VAL 132 CO 0.02 0.20 0.32 0.11 0.02 0.00 0.00 177.57 178.23 2qa4 h LYS 133 N -0.61 0.00 0.00 1.57 1.57 -1.89 0.43 116.57 117.65 2qa4 h LYS 133 Ca -0.02 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.53 2qa4 h LYS 133 Cb 0.46 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 2qa4 h LYS 133 CO 0.03 0.00 -1.51 0.93 -0.57 0.00 0.00 179.45 178.33 2qa4 h GLU 134 N 0.00 0.00 0.00 3.15 5.08 -1.89 -3.48 114.58 117.44 2qa4 h GLU 134 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2qa4 h GLU 134 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2qa4 h GLU 134 CO -0.00 0.44 0.00 0.41 -1.00 0.00 0.00 179.01 178.86 2qa4 n GLY 135 N 1.47 0.31 3.87 -3.84 0.00 0.14 -4.97 105.19 102.17 2qa4 n GLY 135 Ca -0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 2qa4 n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qa4 s GLY 136 N -0.36 1.59 0.00 -0.02 0.00 0.20 -4.70 107.32 104.03 2qa4 s GLY 136 Ca 0.00 -1.52 0.03 0.00 0.00 0.00 0.00 44.72 43.23 2qa4 s GLY 136 CO 0.00 -1.48 0.99 -0.18 0.00 0.00 0.00 173.10 172.43 2qa4 n GLN 137 N -1.36 0.89 -2.40 2.90 -0.06 -0.54 -1.99 117.38 114.82 2qa4 n GLN 137 Ca -0.04 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 54.72 2qa4 n GLN 137 Cb 0.59 -1.05 0.06 0.00 -4.06 0.00 0.00 30.24 25.78 2qa4 n GLN 137 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2qa4 s LEU 138 N -1.09 3.01 0.00 1.69 1.43 -1.17 -4.68 118.68 117.87 2qa4 s LEU 138 Ca 0.04 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2qa4 s LEU 138 Cb 0.02 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.30 2qa4 s LEU 138 CO 0.03 -1.43 0.00 0.61 0.23 0.00 0.00 176.35 175.79 2qa4 n GLY 139 N -2.68 -0.15 3.76 -3.19 0.00 -0.71 -2.05 105.19 100.17 2qa4 n GLY 139 Ca 0.08 -1.03 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 2qa4 n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qa4 s LYS 140 N 0.00 4.49 0.42 1.61 2.20 -1.26 -2.03 119.74 125.17 2qa4 s LYS 140 Ca 0.00 1.90 0.06 0.00 -0.36 0.00 0.00 55.97 57.57 2qa4 s LYS 140 Cb 0.00 -3.08 -0.06 0.00 -1.51 0.00 0.00 37.83 33.18 2qa4 s LYS 140 CO 0.00 0.04 0.05 -1.01 -0.36 0.00 0.00 175.35 174.07 2qa4 s HIS 141 N -1.21 2.44 1.16 4.03 3.76 0.14 -4.69 115.29 120.93 2qa4 s HIS 141 Ca 0.47 -0.69 -0.19 0.00 -0.15 0.00 0.00 55.06 54.50 2qa4 s HIS 141 Cb -0.33 -1.80 0.28 0.00 1.11 0.00 0.00 32.58 31.84 2qa4 s HIS 141 CO 0.43 0.36 1.19 0.34 -0.85 0.00 0.00 174.74 176.21 2qa4 s ASP 142 N -3.78 1.34 0.05 1.40 2.15 -1.26 -4.68 116.67 111.88 2qa4 s ASP 142 Ca 0.33 0.40 -0.07 0.00 0.43 0.00 0.00 52.55 53.64 2qa4 s ASP 142 Cb 0.08 -0.48 -0.30 0.00 -0.30 0.00 0.00 42.92 41.92 2qa4 s ASP 142 CO 0.17 -3.85 1.03 0.74 -0.17 0.00 0.00 175.17 173.10 2qa4 h THR 143 N -2.40 1.36 -0.06 1.71 2.02 -1.98 -2.88 112.91 110.68 2qa4 h THR 143 Ca -0.43 -2.91 -0.20 0.00 0.77 0.00 0.00 66.41 63.64 2qa4 h THR 143 Cb 1.26 2.92 -0.00 0.00 -1.74 0.00 0.00 68.15 70.59 2qa4 h THR 143 CO 0.30 0.86 -0.80 -0.08 0.37 0.00 0.00 175.52 176.17 2qa4 h GLU 144 N 0.09 0.44 -0.42 6.66 4.81 -1.93 -2.94 114.58 121.28 2qa4 h GLU 144 Ca -0.19 -0.39 -0.04 0.00 -0.13 0.00 0.00 59.36 58.60 2qa4 h GLU 144 Cb 2.03 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.48 2qa4 h GLU 144 CO 0.21 1.03 0.08 0.78 -0.73 0.00 0.00 179.01 180.39 2qa4 h GLY 145 N 1.21 0.69 1.30 1.92 0.00 -1.92 -1.90 103.07 104.37 2qa4 h GLY 145 Ca -0.05 -0.38 -0.19 0.00 0.00 0.00 0.00 47.33 46.71 2qa4 h GLY 145 CO 0.14 0.36 -0.63 -2.22 0.00 0.00 0.00 176.54 174.19 2qa4 h ILE 146 N 0.62 1.30 0.55 2.60 1.08 -1.50 -3.06 117.51 119.10 2qa4 h ILE 146 Ca 0.14 -1.86 -0.03 0.00 -0.39 0.00 0.00 64.86 62.72 2qa4 h ILE 146 Cb 0.27 1.81 0.01 0.00 -3.07 0.00 0.00 36.82 35.83 2qa4 h ILE 146 CO 0.00 0.59 -0.27 0.44 -0.69 0.00 0.00 178.15 178.22 2qa4 h ASP 147 N 0.53 -0.63 -1.16 1.72 5.19 -1.33 -0.29 116.42 120.46 2qa4 h ASP 147 Ca -0.01 -0.02 0.36 0.00 -0.62 0.00 0.00 57.03 56.74 2qa4 h ASP 147 Cb 1.22 0.16 -0.13 0.00 0.18 0.00 0.00 39.33 40.77 2qa4 h ASP 147 CO 0.13 -0.37 0.72 0.44 -3.12 0.00 0.00 179.24 177.04 2qa4 h ASP 148 N -0.87 0.37 0.16 6.45 3.32 -1.39 0.88 116.42 125.34 2qa4 h ASP 148 Ca -0.08 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 2qa4 h ASP 148 Cb 0.62 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2qa4 h ASP 148 CO 0.12 -0.11 -0.08 0.25 -1.72 0.00 0.00 179.24 177.71 2qa4 h LEU 149 N 0.22 -0.19 -0.85 1.55 5.85 -1.39 -2.57 115.31 117.93 2qa4 h LEU 149 Ca 0.74 -0.01 0.19 0.00 0.84 0.00 0.00 57.88 59.64 2qa4 h LEU 149 Cb 2.06 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 43.02 2qa4 h LEU 149 CO -0.45 0.29 0.33 -0.07 -0.34 0.00 0.00 178.44 178.21 2qa4 h LEU 150 N -1.06 0.26 -1.26 2.25 3.38 0.46 0.21 115.31 119.56 2qa4 h LEU 150 Ca -0.02 0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 2qa4 h LEU 150 Cb 0.19 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2qa4 h LEU 150 CO 0.04 0.01 -0.32 -0.33 0.09 0.00 0.00 178.44 177.92 2qa4 h GLU 151 N 0.39 0.00 0.00 1.13 5.08 0.61 -0.02 114.58 121.77 2qa4 h GLU 151 Ca 0.51 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.69 2qa4 h GLU 151 Cb 0.92 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 2qa4 h GLU 151 CO -0.51 0.32 -0.85 0.00 -1.00 0.00 0.00 179.01 176.98 2qa4 h ALA 152 N 1.68 0.60 -0.54 3.43 0.00 -0.24 -3.02 119.26 121.16 2qa4 h ALA 152 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.13 2qa4 h ALA 152 Cb 0.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2qa4 h ALA 152 CO 0.04 1.06 0.00 -1.33 0.00 0.00 0.00 179.25 179.02 2qa4 n MET 153 N -3.53 2.54 0.00 0.00 2.81 -0.14 -1.41 117.12 117.40 2qa4 n MET 153 Ca -0.00 -2.05 0.00 0.00 -1.81 0.00 0.00 57.70 53.84 2qa4 n MET 153 Cb 0.81 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.79 2qa4 n MET 153 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35