#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rqy s HIS 2 N 0.00 0.06 0.09 3.17 0.00 -1.26 -5.19 115.29 112.15 2rqy s HIS 2 Ca 0.00 -0.45 -0.00 0.00 -3.00 0.00 0.00 55.06 51.61 2rqy s HIS 2 Cb 0.00 0.70 0.00 0.00 -4.00 0.00 0.00 32.58 29.28 2rqy s HIS 2 CO 0.00 -0.91 0.12 0.72 -1.00 0.00 0.00 174.74 173.66 2rqy n HIS 3 N -0.68 -0.64 -3.61 0.38 -0.00 -1.26 -5.19 115.22 104.21 2rqy n HIS 3 Ca -0.03 -0.59 -0.03 0.00 -0.00 0.00 0.00 57.72 57.07 2rqy n HIS 3 Cb 0.60 0.13 0.01 0.00 -0.00 0.00 0.00 29.99 30.73 2rqy n HIS 3 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2rqy n HIS 4 N -0.14 -1.30 -3.66 4.41 -0.00 -1.26 -5.20 115.22 108.07 2rqy n HIS 4 Ca 0.00 -0.86 -0.07 0.00 -0.00 0.00 0.00 57.72 56.80 2rqy n HIS 4 Cb 0.15 0.42 -0.00 0.00 -0.00 0.00 0.00 29.99 30.56 2rqy n HIS 4 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2rqy n HIS 5 N -0.38 -1.32 -3.87 1.57 -0.00 -1.26 -5.19 115.22 104.77 2rqy n HIS 5 Ca -0.03 -1.17 -0.07 0.00 -0.00 0.00 0.00 57.72 56.45 2rqy n HIS 5 Cb 0.34 0.39 -0.02 0.00 -0.00 0.00 0.00 29.99 30.70 2rqy n HIS 5 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2rqy n HIS 6 N -0.31 -0.79 -4.69 4.41 -0.00 -1.26 -5.19 115.22 107.39 2rqy n HIS 6 Ca -0.02 -1.15 -0.32 0.00 -0.00 0.00 0.00 57.72 56.24 2rqy n HIS 6 Cb 0.32 0.23 -0.06 0.00 -0.00 0.00 0.00 29.99 30.48 2rqy n HIS 6 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2rqy n HIS 7 N -0.28 1.05 -3.80 1.57 -0.00 -1.26 -5.14 115.22 107.37 2rqy n HIS 7 Ca 0.01 -2.46 -0.36 0.00 -0.00 0.00 0.00 57.72 54.90 2rqy n HIS 7 Cb 0.28 -0.34 -0.07 0.00 -0.00 0.00 0.00 29.99 29.86 2rqy n HIS 7 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 2rqy s ILE 8 N -2.80 5.46 -0.00 1.59 2.07 -1.26 -5.05 121.20 121.20 2rqy s ILE 8 Ca 0.02 0.21 -0.00 0.00 -1.41 0.00 0.00 60.65 59.47 2rqy s ILE 8 Cb -0.00 -3.44 0.00 0.00 0.13 0.00 0.00 42.46 39.15 2rqy s ILE 8 CO 0.01 0.53 0.02 1.21 -1.91 0.00 0.00 174.94 174.80 2rqy n GLU 9 N 2.72 0.00 0.00 3.50 2.13 -1.26 -5.01 120.64 122.72 2rqy n GLU 9 Ca -0.18 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.63 2rqy n GLU 9 Cb 0.54 0.01 0.00 0.00 0.27 0.00 0.00 31.44 32.26 2rqy n GLU 9 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2rqy n GLY 10 N -0.01 3.15 1.02 8.31 0.00 -1.26 -4.73 105.19 111.67 2rqy n GLY 10 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2rqy n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rqy n ARG 11 N -0.98 0.13 0.00 1.61 1.74 -1.26 -4.65 116.66 113.26 2rqy n ARG 11 Ca 0.00 -1.72 0.00 0.00 -0.77 0.00 0.00 57.85 55.36 2rqy n ARG 11 Cb 0.00 -0.33 0.00 0.00 -1.02 0.00 0.00 32.46 31.11 2rqy n ARG 11 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2rqy n HIS 12 N 0.15 0.00 -4.96 -1.55 8.25 -1.26 -4.74 115.22 111.11 2rqy n HIS 12 Ca 0.05 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.18 2rqy n HIS 12 Cb 0.94 -0.47 -0.14 0.00 1.12 0.00 0.00 29.99 31.43 2rqy n HIS 12 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 2rqy s MET 13 N -2.50 2.57 -0.26 -0.41 1.75 -1.26 -4.86 119.30 114.33 2rqy s MET 13 Ca 0.00 -0.74 -0.08 0.00 -1.25 0.00 0.00 55.69 53.62 2rqy s MET 13 Cb 0.00 -2.35 0.01 0.00 2.84 0.00 0.00 34.83 35.33 2rqy s MET 13 CO 0.00 0.54 0.19 1.28 -0.65 0.00 0.00 175.02 176.38 2rqy n LEU 14 N 2.54 -6.14 -4.42 4.11 7.99 -1.26 -4.90 117.00 114.92 2rqy n LEU 14 Ca -0.17 0.80 -0.33 0.00 -0.01 0.00 0.00 56.01 56.30 2rqy n LEU 14 Cb 0.52 -2.67 0.13 0.00 -0.11 0.00 0.00 43.42 41.29 2rqy n LEU 14 CO 0.26 -2.19 -0.09 0.54 -1.51 0.00 0.00 177.39 174.40 2rqy n ARG 15 N 0.58 -0.38 -1.92 3.23 1.74 -1.26 -4.76 116.66 113.88 2rqy n ARG 15 Ca 0.01 -0.07 -0.30 0.00 -0.77 0.00 0.00 57.85 56.72 2rqy n ARG 15 Cb 0.30 -1.86 -0.06 0.00 -1.02 0.00 0.00 32.46 29.82 2rqy n ARG 15 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2rqy n PRO 16 N -1.81 1.57 0.00 5.56 -0.04 -1.26 -4.59 135.00 134.43 2rqy n PRO 16 Ca 0.06 -2.37 0.00 0.00 -0.04 0.00 0.00 63.50 61.16 2rqy n PRO 16 Cb 0.54 -3.61 0.00 0.00 -0.04 0.00 0.00 33.50 30.39 2rqy n PRO 16 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rqy n GLY 17 N 5.60 2.60 7.00 0.55 0.00 -1.26 -4.74 105.19 114.94 2rqy n GLY 17 Ca 0.46 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2rqy n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2rqy n ASP 18 N 0.00 -3.62 -1.18 1.61 2.03 -1.26 -4.15 116.55 109.97 2rqy n ASP 18 Ca 0.00 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.31 2rqy n ASP 18 Cb 0.00 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 40.63 2rqy n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2rqy h GLU 20 N 1.44 0.00 0.00 0.00 4.22 -2.01 -3.38 114.58 114.85 2rqy h GLU 20 Ca 0.16 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.60 2rqy h GLU 20 Cb 1.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 2rqy h GLU 20 CO 0.40 0.00 0.00 1.33 -2.18 0.00 0.00 179.01 178.56 2rqy n VAL 21 N -3.96 0.00 -3.66 0.32 0.24 -1.26 -5.16 118.33 104.84 2rqy n VAL 21 Ca 0.04 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.29 2rqy n VAL 21 Cb 0.42 -0.03 0.02 0.00 -1.47 0.00 0.00 33.84 32.78 2rqy n VAL 21 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rqy s ILE 23 N -2.27 2.51 0.05 0.00 -1.09 -1.26 -4.29 121.20 114.85 2rqy s ILE 23 Ca 0.14 0.33 -0.20 0.00 -2.23 0.00 0.00 60.65 58.69 2rqy s ILE 23 Cb -0.03 -3.14 -0.13 0.00 -1.58 0.00 0.00 42.46 37.58 2rqy s ILE 23 CO 0.07 -0.06 1.41 -1.28 -1.23 0.00 0.00 174.94 173.86 2rqy h SER 24 N 1.00 0.36 0.42 3.58 0.87 -1.83 -1.90 113.55 116.05 2rqy h SER 24 Ca -0.51 -0.41 -0.02 0.00 -1.23 0.00 0.00 61.79 59.63 2rqy h SER 24 Cb 1.30 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2rqy h SER 24 CO 0.55 0.68 -0.28 0.22 -0.53 0.00 0.00 176.83 177.48 2rqy h TYR 25 N 0.03 -0.76 -0.89 2.24 3.20 -1.92 0.30 116.97 119.16 2rqy h TYR 25 Ca 0.04 -0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.11 2rqy h TYR 25 Cb 0.55 0.28 -0.06 0.00 1.54 0.00 0.00 36.73 39.03 2rqy h TYR 25 CO 0.06 -0.41 0.60 -0.07 -1.64 0.00 0.00 178.16 176.70 2rqy h LEU 26 N -0.67 0.35 -0.49 2.82 -0.00 -1.97 0.39 115.31 115.74 2rqy h LEU 26 Ca -0.06 0.04 -0.09 0.00 -0.00 0.00 0.00 57.88 57.77 2rqy h LEU 26 Cb 0.54 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.16 2rqy h LEU 26 CO 0.04 0.13 -0.44 1.23 -0.00 0.00 0.00 178.44 179.41 2rqy h GLY 27 N 0.34 0.00 1.07 0.83 0.00 -0.92 -3.11 103.07 101.29 2rqy h GLY 27 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.79 2rqy h GLY 27 CO -0.15 0.00 -0.80 -0.09 0.00 0.00 0.00 176.54 175.50 2rqy h ARG 28 N 0.00 0.00 0.19 4.80 2.43 0.35 -3.29 114.38 118.86 2rqy h ARG 28 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2rqy h ARG 28 Cb 1.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2rqy h ARG 28 CO 0.06 0.00 -0.09 0.35 -1.51 0.00 0.00 179.97 178.77 2rqy h PHE 29 N 0.00 -0.24 -0.46 2.20 3.57 -0.72 -3.31 116.94 117.98 2rqy h PHE 29 Ca 0.00 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.61 2rqy h PHE 29 Cb 0.85 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 2rqy h PHE 29 CO 0.00 -0.15 0.33 0.10 -2.23 0.00 0.00 178.31 176.35 2rqy h TYR 30 N -0.92 0.10 -0.80 0.41 -0.00 -1.73 -0.52 116.97 113.50 2rqy h TYR 30 Ca -0.03 0.00 0.19 0.00 0.00 0.00 0.00 58.73 58.90 2rqy h TYR 30 Cb 0.20 -0.03 -0.05 0.00 0.00 0.00 0.00 36.73 36.85 2rqy h TYR 30 CO 0.01 0.05 0.55 0.37 -0.00 0.00 0.00 178.16 179.13 2rqy h GLN 31 N 0.09 0.28 0.20 0.10 4.15 -1.65 -0.87 115.11 117.42 2rqy h GLN 31 Ca 0.22 -0.02 -0.35 0.00 0.77 0.00 0.00 58.65 59.28 2rqy h GLN 31 Cb 0.74 -0.06 0.02 0.00 0.21 0.00 0.00 27.48 28.39 2rqy h GLN 31 CO -0.02 0.18 -1.68 -0.44 -1.93 0.00 0.00 178.83 174.95 2rqy h ASP 32 N 0.29 0.66 -0.95 -0.69 3.32 -1.20 -2.90 116.42 114.94 2rqy h ASP 32 Ca 0.40 -0.90 0.13 0.00 0.02 0.00 0.00 57.03 56.69 2rqy h ASP 32 Cb 1.14 -0.21 -0.08 0.00 0.22 0.00 0.00 39.33 40.40 2rqy h ASP 32 CO -0.11 1.75 0.61 -0.07 -1.72 0.00 0.00 179.24 179.70 2rqy h LEU 33 N 0.11 0.81 0.00 1.55 3.38 -1.04 0.11 115.31 120.23 2rqy h LEU 33 Ca -0.32 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2rqy h LEU 33 Cb 2.11 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.75 2rqy h LEU 33 CO 0.20 0.41 -0.54 0.11 0.09 0.00 0.00 178.44 178.72 2rqy h LYS 34 N 0.86 0.00 -1.89 1.13 1.57 -1.44 -3.22 116.57 113.58 2rqy h LYS 34 Ca 0.48 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 59.06 2rqy h LYS 34 Cb 0.60 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.83 2rqy h LYS 34 CO -0.24 0.00 0.05 -3.47 -0.57 0.00 0.00 179.45 175.21 2rqy n ASP 35 N -2.17 5.75 -3.41 0.86 2.03 0.37 -4.73 116.55 115.25 2rqy n ASP 35 Ca 0.03 -2.70 -0.23 0.00 0.52 0.00 0.00 54.79 52.42 2rqy n ASP 35 Cb 0.44 -1.21 -0.02 0.00 -0.72 0.00 0.00 41.12 39.62 2rqy n ASP 35 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2rqy n ARG 36 N 1.41 -2.79 -0.05 -0.67 0.63 -1.25 -4.78 116.66 109.16 2rqy n ARG 36 Ca 0.26 0.34 -0.04 0.00 -0.92 0.00 0.00 57.85 57.49 2rqy n ARG 36 Cb 0.64 -4.98 -0.10 0.00 0.45 0.00 0.00 32.46 28.47 2rqy n ARG 36 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2rqy n ASP 37 N -2.17 2.04 -3.81 6.15 -0.08 -1.06 -5.03 116.55 112.58 2rqy n ASP 37 Ca 0.01 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.17 2rqy n ASP 37 Cb 0.52 0.91 -0.09 0.00 2.34 0.00 0.00 41.12 44.80 2rqy n ASP 37 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2rqy s VAL 38 N -2.38 0.07 0.27 5.18 1.01 -1.21 -4.94 120.40 118.40 2rqy s VAL 38 Ca -0.06 -0.62 -0.19 0.00 0.00 0.00 0.00 61.98 61.11 2rqy s VAL 38 Cb 0.04 -0.60 -0.09 0.00 0.00 0.00 0.00 36.38 35.73 2rqy s VAL 38 CO 0.50 -0.34 0.76 -0.89 0.00 0.00 0.00 175.10 175.13 2rqy s THR 39 N -1.57 4.55 -1.22 3.92 2.01 -1.26 -4.55 115.64 117.51 2rqy s THR 39 Ca -0.13 1.27 -0.14 0.00 0.31 0.00 0.00 61.69 63.01 2rqy s THR 39 Cb -0.05 -3.80 -0.06 0.00 0.01 0.00 0.00 72.50 68.60 2rqy s THR 39 CO 0.02 0.09 2.29 0.49 -0.69 0.00 0.00 174.62 176.82 2rqy n PHE 40 N 0.39 2.47 -4.20 4.92 3.72 -1.26 -4.07 117.46 119.43 2rqy n PHE 40 Ca -0.00 -2.52 -0.19 0.00 -0.05 0.00 0.00 57.45 54.69 2rqy n PHE 40 Cb 0.52 -2.17 -0.12 0.00 -0.94 0.00 0.00 39.48 36.77 2rqy n PHE 40 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2rqy s SER 41 N 3.47 1.85 0.00 4.37 0.01 -1.26 -4.40 113.70 117.73 2rqy s SER 41 Ca 0.53 -0.67 0.14 0.00 1.31 0.00 0.00 55.95 57.26 2rqy s SER 41 Cb 0.14 -0.06 0.66 0.00 0.21 0.00 0.00 66.02 66.97 2rqy s SER 41 CO -0.02 -0.08 1.43 -0.81 0.41 0.00 0.00 173.24 174.17 2rqy n PRO 42 N 1.07 0.09 -0.03 12.44 -0.04 -1.26 -0.84 135.00 146.43 2rqy n PRO 42 Ca -0.20 0.21 -0.01 0.00 -0.04 0.00 0.00 63.50 63.47 2rqy n PRO 42 Cb 0.55 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.44 2rqy n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rqy n ALA 43 N -1.41 2.00 0.08 0.55 0.00 -1.26 -3.97 120.51 116.50 2rqy n ALA 43 Ca 0.05 -0.41 0.07 0.00 0.00 0.00 0.00 53.44 53.15 2rqy n ALA 43 Cb 0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.50 2rqy n ALA 43 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2rqy h THR 44 N 0.00 0.20 0.07 0.00 2.02 -1.78 -3.24 112.91 110.18 2rqy h THR 44 Ca -0.13 -1.40 -0.36 0.00 0.77 0.00 0.00 66.41 65.29 2rqy h THR 44 Cb 1.07 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 69.17 2rqy h THR 44 CO 0.01 0.11 -2.06 -0.38 0.37 0.00 0.00 175.52 173.57 2rqy n ILE 45 N -2.77 1.67 0.23 3.11 5.41 -0.02 -4.11 119.36 122.88 2rqy n ILE 45 Ca -0.04 -0.68 0.11 0.00 1.00 0.00 0.00 62.75 63.14 2rqy n ILE 45 Cb 0.66 -1.46 0.53 0.00 -0.71 0.00 0.00 39.64 38.67 2rqy n ILE 45 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 2rqy h GLU 46 N 0.04 0.00 0.00 0.38 4.11 -1.73 -0.86 114.58 116.52 2rqy h GLU 46 Ca -0.44 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.92 2rqy h GLU 46 Cb 2.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.26 2rqy h GLU 46 CO 0.05 0.19 -0.37 1.05 0.07 0.00 0.00 179.01 180.00 2rqy h GLU 47 N 0.00 0.00 0.03 1.06 4.11 -1.71 -2.18 114.58 115.89 2rqy h GLU 47 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.08 2rqy h GLU 47 Cb 0.64 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 2rqy h GLU 47 CO 0.02 0.37 -1.96 0.39 0.07 0.00 0.00 179.01 177.90 2rqy n GLU 48 N -3.52 0.63 -0.35 1.06 -0.58 -0.99 -4.28 120.64 112.61 2rqy n GLU 48 Ca -0.00 0.36 -0.00 0.00 -0.42 0.00 0.00 57.16 57.09 2rqy n GLU 48 Cb 0.51 -1.63 0.13 0.00 -0.57 0.00 0.00 31.44 29.88 2rqy n GLU 48 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2rqy h LEU 49 N -0.61 1.03 -0.86 -4.62 5.85 -1.25 -2.16 115.31 112.69 2rqy h LEU 49 Ca -0.50 -0.01 0.17 0.00 0.84 0.00 0.00 57.88 58.38 2rqy h LEU 49 Cb 1.64 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 42.34 2rqy h LEU 49 CO -0.18 0.70 0.42 -0.29 -0.34 0.00 0.00 178.44 178.75 2rqy h ILE 50 N 1.20 0.64 -0.58 4.05 2.10 -1.59 0.18 117.51 123.50 2rqy h ILE 50 Ca 0.38 -0.19 -0.00 0.00 1.08 0.00 0.00 64.86 66.13 2rqy h ILE 50 Cb 0.01 0.05 -0.03 0.00 -1.09 0.00 0.00 36.82 35.76 2rqy h ILE 50 CO -0.12 0.10 0.36 0.11 -1.08 0.00 0.00 178.15 177.51 2rqy h LYS 51 N 0.54 0.79 -0.41 2.19 1.57 -1.57 -0.48 116.57 119.20 2rqy h LYS 51 Ca 0.49 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 59.14 2rqy h LYS 51 Cb 0.79 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2rqy h LYS 51 CO -0.42 0.56 -0.03 0.74 -0.57 0.00 0.00 179.45 179.73 2rqy h PHE 52 N 0.79 0.71 0.23 -1.35 -1.00 -0.98 0.26 116.94 115.59 2rqy h PHE 52 Ca 0.21 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 2rqy h PHE 52 Cb -0.03 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.33 2rqy h PHE 52 CO -0.02 0.70 -0.11 0.00 -1.61 0.00 0.00 178.31 177.26 2rqy h ARG 54 N -0.70 0.00 -0.49 0.00 2.43 -1.06 -2.49 114.38 112.07 2rqy h ARG 54 Ca -0.03 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 2rqy h ARG 54 Cb 0.48 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2rqy h ARG 54 CO 0.05 0.30 0.05 -1.91 -1.51 0.00 0.00 179.97 176.95 2rqy n GLU 55 N -3.82 3.83 -2.13 0.20 2.13 0.90 -4.72 120.64 117.04 2rqy n GLU 55 Ca -0.01 -3.04 -0.31 0.00 0.66 0.00 0.00 57.16 54.45 2rqy n GLU 55 Cb 0.39 -2.09 -0.01 0.00 0.27 0.00 0.00 31.44 30.00 2rqy n GLU 55 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2rqy s ALA 56 N -2.87 3.11 -0.22 4.31 0.00 0.98 -4.75 121.76 122.33 2rqy s ALA 56 Ca 0.50 -0.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.40 2rqy s ALA 56 Cb 0.40 -3.06 0.11 0.00 0.00 0.00 0.00 23.12 20.57 2rqy s ALA 56 CO 0.12 -0.49 0.33 0.50 0.00 0.00 0.00 175.76 176.23 2rqy s ARG 57 N -4.72 0.29 2.37 0.00 6.06 -1.26 -4.73 118.95 116.96 2rqy s ARG 57 Ca 0.56 0.53 0.00 0.00 -2.50 0.00 0.00 55.73 54.32 2rqy s ARG 57 Cb -0.11 -0.52 0.00 0.00 0.06 0.00 0.00 34.95 34.39 2rqy s ARG 57 CO 0.45 -0.56 0.00 0.41 -2.50 0.00 0.00 175.30 173.09 2rqy n GLY 58 N 5.36 0.71 0.28 8.12 0.00 -1.26 -3.93 105.19 114.46 2rqy n GLY 58 Ca -0.05 -1.17 0.19 0.00 0.00 0.00 0.00 46.02 44.99 2rqy n GLY 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2rqy h LYS 59 N 0.00 0.00 0.00 1.61 2.10 -1.99 0.11 116.57 118.39 2rqy h LYS 59 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2rqy h LYS 59 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2rqy h LYS 59 CO 0.00 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 177.84 2rqy n GLU 60 N -2.80 0.26 -0.09 0.07 1.02 -1.25 -3.21 120.64 114.64 2rqy n GLU 60 Ca -0.02 0.23 -0.12 0.00 -0.02 0.00 0.00 57.16 57.23 2rqy n GLU 60 Cb 0.08 -1.81 -0.15 0.00 -0.02 0.00 0.00 31.44 29.53 2rqy n GLU 60 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2rqy n ASN 61 N -2.27 0.51 0.20 1.62 2.85 0.33 -4.21 115.26 114.28 2rqy n ASN 61 Ca 0.05 0.03 0.14 0.00 -0.11 0.00 0.00 54.58 54.70 2rqy n ASN 61 Cb 0.42 0.58 0.55 0.00 1.24 0.00 0.00 39.78 42.58 2rqy n ASN 61 CO 0.00 0.00 0.00 0.08 -2.11 0.00 0.00 177.26 175.23 2rqy h ARG 62 N 0.00 0.00 0.12 1.20 0.11 -1.50 -3.14 114.38 111.17 2rqy h ARG 62 Ca -0.52 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.55 2rqy h ARG 62 Cb 2.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.24 2rqy h ARG 62 CO 0.02 0.00 -0.06 -0.07 0.10 0.00 0.00 179.97 179.96 2rqy h LEU 63 N 0.00 -0.13 -1.97 0.08 4.07 -1.72 -3.04 115.31 112.59 2rqy h LEU 63 Ca 0.00 -0.27 0.21 0.00 0.08 0.00 0.00 57.88 57.89 2rqy h LEU 63 Cb 0.49 0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 2rqy h LEU 63 CO 0.00 0.46 0.52 0.00 -1.08 0.00 0.00 178.44 178.34 2rqy h TYR 65 N 0.02 0.44 0.25 0.00 3.20 -1.61 0.18 116.97 119.46 2rqy h TYR 65 Ca 0.35 -0.17 -0.34 0.00 3.14 0.00 0.00 58.73 61.71 2rqy h TYR 65 Cb 1.36 -0.08 0.04 0.00 1.54 0.00 0.00 36.73 39.59 2rqy h TYR 65 CO -0.00 0.86 -1.50 -0.92 -1.64 0.00 0.00 178.16 174.96 2rqy h TYR 66 N 0.26 0.96 0.00 -3.82 5.03 -0.39 -3.30 116.97 115.70 2rqy h TYR 66 Ca -0.00 -0.70 -0.11 0.00 2.58 0.00 0.00 58.73 60.50 2rqy h TYR 66 Cb 1.12 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.34 2rqy h TYR 66 CO 0.03 1.57 -0.51 0.82 -1.32 0.00 0.00 178.16 178.75 2rqy h ILE 67 N 0.13 0.98 -3.72 1.81 2.04 -0.83 -3.49 117.51 114.43 2rqy h ILE 67 Ca -0.27 -2.08 0.00 0.00 1.00 0.00 0.00 64.86 63.52 2rqy h ILE 67 Cb 2.16 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 40.50 2rqy h ILE 67 CO 0.27 0.50 -0.12 0.61 0.00 0.00 0.00 178.15 179.41 2rqy n GLY 68 N 0.82 -0.82 0.01 5.37 0.00 0.61 -4.72 105.19 106.46 2rqy n GLY 68 Ca 0.01 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2rqy n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rqy n ALA 69 N -0.63 2.05 -2.53 4.61 0.00 -1.03 -4.10 120.51 118.88 2rqy n ALA 69 Ca 0.03 -0.13 -0.24 0.00 0.00 0.00 0.00 53.44 53.09 2rqy n ALA 69 Cb 0.23 -0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.59 2rqy n ALA 69 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2rqy s THR 70 N -2.18 2.77 0.43 0.00 -1.32 -1.26 -4.72 115.64 109.35 2rqy s THR 70 Ca -0.01 -1.89 0.15 0.00 -1.21 0.00 0.00 61.69 58.73 2rqy s THR 70 Cb 0.02 -2.85 0.17 0.00 -1.51 0.00 0.00 72.50 68.33 2rqy s THR 70 CO 0.14 -0.20 1.96 0.44 -2.21 0.00 0.00 174.62 174.75 2rqy h ASP 71 N 1.74 0.00 0.04 8.08 3.32 -1.96 -2.02 116.42 125.62 2rqy h ASP 71 Ca -0.43 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.62 2rqy h ASP 71 Cb 1.25 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 2rqy h ASP 71 CO 0.66 0.22 -0.01 0.44 -1.72 0.00 0.00 179.24 178.82 2rqy h ASP 72 N 0.00 0.00 0.42 6.45 5.19 -1.99 -0.22 116.42 126.27 2rqy h ASP 72 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2rqy h ASP 72 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 2rqy h ASP 72 CO 0.03 0.01 0.00 0.00 -3.12 0.00 0.00 179.24 176.16 2rqy n ALA 73 N -2.30 1.43 -1.72 3.45 0.00 -0.76 -4.84 120.51 115.77 2rqy n ALA 73 Ca -0.03 0.08 -0.15 0.00 0.00 0.00 0.00 53.44 53.34 2rqy n ALA 73 Cb 0.10 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.20 2rqy n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rqy n ALA 74 N -1.69 -0.30 -0.10 0.00 0.00 -0.10 -4.86 120.51 113.46 2rqy n ALA 74 Ca 0.01 0.21 -0.11 0.00 0.00 0.00 0.00 53.44 53.55 2rqy n ALA 74 Cb 0.14 -1.67 -0.13 0.00 0.00 0.00 0.00 19.45 17.80 2rqy n ALA 74 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2rqy n THR 75 N -3.04 1.24 -2.10 0.00 5.66 -1.26 -5.00 114.28 109.77 2rqy n THR 75 Ca -0.16 -0.66 -0.15 0.00 -3.05 0.00 0.00 64.05 60.03 2rqy n THR 75 Cb 0.54 -0.79 -0.02 0.00 -1.55 0.00 0.00 70.33 68.52 2rqy n THR 75 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2rqy n LYS 76 N -2.82 -1.15 -3.74 1.09 4.81 -1.26 -4.99 118.16 110.10 2rqy n LYS 76 Ca -0.32 0.78 -0.13 0.00 -0.87 0.00 0.00 58.31 57.76 2rqy n LYS 76 Cb 1.02 -5.06 -0.10 0.00 0.02 0.00 0.00 35.03 30.92 2rqy n LYS 76 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2rqy s ILE 77 N -2.70 0.02 0.00 3.15 -5.25 -1.26 -5.03 121.20 110.12 2rqy s ILE 77 Ca 0.00 -0.13 0.00 0.00 -0.99 0.00 0.00 60.65 59.53 2rqy s ILE 77 Cb 0.00 -0.57 0.00 0.00 2.95 0.00 0.00 42.46 44.84 2rqy s ILE 77 CO 0.00 -0.07 0.08 0.00 -1.79 0.00 0.00 174.94 173.16 2rqy n ILE 78 N 2.38 0.00 0.32 8.37 3.06 -1.26 -4.16 119.36 128.07 2rqy n ILE 78 Ca -0.16 -0.38 0.20 0.00 -2.50 0.00 0.00 62.75 59.92 2rqy n ILE 78 Cb 0.57 1.05 1.07 0.00 0.54 0.00 0.00 39.64 42.88 2rqy n ILE 78 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 2rqy h ASN 79 N 0.00 0.00 -0.03 9.51 -1.07 -1.95 -1.61 115.58 120.43 2rqy h ASN 79 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 56.30 56.38 2rqy h ASN 79 Cb 0.03 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.28 2rqy h ASN 79 CO 0.00 0.01 0.14 -0.33 0.07 0.00 0.00 177.43 177.32 2rqy h GLU 80 N 0.00 0.00 0.00 4.14 5.08 -1.84 0.21 114.58 122.17 2rqy h GLU 80 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2rqy h GLU 80 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2rqy h GLU 80 CO 0.00 0.00 -0.02 1.55 -1.00 0.00 0.00 179.01 179.54 2rqy n VAL 81 N -3.16 0.61 -0.01 3.13 3.14 -0.63 -4.75 118.33 116.65 2rqy n VAL 81 Ca -0.02 -0.63 -0.01 0.00 -2.96 0.00 0.00 64.34 60.72 2rqy n VAL 81 Cb 0.21 0.66 -0.00 0.00 -1.06 0.00 0.00 33.84 33.65 2rqy n VAL 81 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2rqy n SER 82 N -0.33 1.93 0.33 6.55 7.64 -0.50 -4.28 113.62 124.96 2rqy n SER 82 Ca 0.01 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.71 2rqy n SER 82 Cb 0.39 -0.03 -0.09 0.00 -1.01 0.00 0.00 64.21 63.47 2rqy n SER 82 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2rqy h LYS 83 N -0.02 -0.98 -0.16 1.43 3.64 -0.90 0.30 116.57 119.88 2rqy h LYS 83 Ca -0.03 0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.29 2rqy h LYS 83 Cb 1.03 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 2rqy h LYS 83 CO -0.01 -0.65 -0.45 -1.00 -2.27 0.00 0.00 179.45 175.07 2rqy h PRO 84 N -1.01 0.38 0.00 1.90 0.13 -1.86 -2.86 132.00 128.67 2rqy h PRO 84 Ca -0.07 -0.20 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 2rqy h PRO 84 Cb 0.85 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.99 2rqy h PRO 84 CO 0.01 0.75 -0.10 1.25 -0.23 0.00 0.00 178.00 179.69 2rqy h LEU 85 N 0.31 0.00 -0.64 1.56 5.85 -1.71 -2.81 115.31 117.86 2rqy h LEU 85 Ca 0.02 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 2rqy h LEU 85 Cb 0.91 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2rqy h LEU 85 CO 0.08 0.10 -0.29 0.00 -0.34 0.00 0.00 178.44 177.98 2rqy h ALA 86 N 1.90 0.83 -2.01 1.25 0.00 -0.16 -3.37 119.26 117.70 2rqy h ALA 86 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2rqy h ALA 86 Cb 0.69 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2rqy h ALA 86 CO 0.01 0.64 0.00 0.72 0.00 0.00 0.00 179.25 180.62 2rqy n HIS 87 N -4.08 0.00 0.00 0.00 8.25 -1.14 -4.36 115.22 113.88 2rqy n HIS 87 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2rqy n HIS 87 Cb 0.47 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.42 2rqy n HIS 87 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2rqy n HIS 88 N -0.99 0.00 -3.42 4.41 -0.00 -1.20 -5.01 115.22 109.01 2rqy n HIS 88 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.39 2rqy n HIS 88 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 2rqy n HIS 88 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.34 175.45 2rqy n ILE 89 N 0.00 3.13 -2.04 3.57 5.41 -1.07 -5.02 119.36 123.34 2rqy n ILE 89 Ca 0.00 -5.34 -0.36 0.00 1.00 0.00 0.00 62.75 58.05 2rqy n ILE 89 Cb 0.00 -2.16 -0.03 0.00 -0.71 0.00 0.00 39.64 36.73 2rqy n ILE 89 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2rqy s PRO 90 N -2.23 2.61 -0.87 0.38 0.04 -1.26 -3.80 135.00 129.87 2rqy s PRO 90 Ca 0.34 0.45 -0.10 0.00 0.04 0.00 0.00 61.00 61.73 2rqy s PRO 90 Cb 0.06 -4.51 0.10 0.00 0.04 0.00 0.00 34.50 30.19 2rqy s PRO 90 CO -0.02 -2.85 0.28 1.55 0.04 0.00 0.00 177.00 175.99 2rqy n VAL 91 N 7.33 -0.12 0.08 -0.36 3.14 -1.26 -4.77 118.33 122.37 2rqy n VAL 91 Ca 0.24 0.00 -0.21 0.00 -2.96 0.00 0.00 64.34 61.41 2rqy n VAL 91 Cb 0.51 -0.42 -0.15 0.00 -1.06 0.00 0.00 33.84 32.72 2rqy n VAL 91 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2rqy h GLU 92 N -0.43 0.37 0.00 1.45 4.81 -1.96 -3.37 114.58 115.45 2rqy h GLU 92 Ca -0.28 -0.63 0.00 0.00 -0.13 0.00 0.00 59.36 58.32 2rqy h GLU 92 Cb 1.18 0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.80 2rqy h GLU 92 CO 0.40 1.27 -1.18 1.17 -0.73 0.00 0.00 179.01 179.94 2rqy n LYS 93 N -3.56 1.13 0.32 1.92 0.00 -1.26 0.13 118.16 116.83 2rqy n LYS 93 Ca -0.20 -0.06 0.19 0.00 0.00 0.00 0.00 58.31 58.24 2rqy n LYS 93 Cb 1.07 -1.33 1.07 0.00 0.00 0.00 0.00 35.03 35.84 2rqy n LYS 93 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2rqy h ILE 94 N 0.00 0.27 0.00 3.15 1.08 -1.91 -2.93 117.51 117.16 2rqy h ILE 94 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2rqy h ILE 94 Cb 0.55 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 35.29 2rqy h ILE 94 CO 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 2rqy h GLU 96 N 0.00 0.18 0.06 0.00 4.39 -1.70 0.32 114.58 117.84 2rqy h GLU 96 Ca 0.00 -0.01 -0.29 0.00 0.34 0.00 0.00 59.36 59.40 2rqy h GLU 96 Cb 0.00 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2rqy h GLU 96 CO 0.00 0.12 -1.54 -0.22 -1.16 0.00 0.00 179.01 176.21 2rqy h LYS 97 N 0.19 0.13 -0.49 2.33 1.63 -0.50 -3.35 116.57 116.51 2rqy h LYS 97 Ca 0.35 -0.23 0.14 0.00 -0.85 0.00 0.00 60.65 60.07 2rqy h LYS 97 Cb 0.58 0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.28 2rqy h LYS 97 CO -0.51 1.11 0.46 1.25 -3.45 0.00 0.00 179.45 178.31 2rqy h LEU 98 N -0.51 0.00 -1.86 5.20 6.46 -1.34 0.03 115.31 123.29 2rqy h LEU 98 Ca -0.37 0.00 0.27 0.00 -0.12 0.00 0.00 57.88 57.66 2rqy h LEU 98 Cb 1.63 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 41.52 2rqy h LEU 98 CO -0.06 0.00 0.68 0.11 -0.62 0.00 0.00 178.44 178.55 2rqy h LYS 99 N 0.00 0.10 -0.69 1.25 1.57 -0.50 0.30 116.57 118.60 2rqy h LYS 99 Ca 0.23 -0.01 0.20 0.00 -1.87 0.00 0.00 60.65 59.21 2rqy h LYS 99 Cb 1.15 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 2rqy h LYS 99 CO -0.00 0.06 0.53 -0.22 -0.57 0.00 0.00 179.45 179.25 2rqy h LYS 100 N 0.10 0.00 0.00 3.15 1.63 -1.23 -2.59 116.57 117.63 2rqy h LYS 100 Ca 0.48 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 60.05 2rqy h LYS 100 Cb 1.72 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 33.31 2rqy h LYS 100 CO -0.06 0.00 -1.69 1.17 -3.45 0.00 0.00 179.45 175.42 2rqy n LYS 101 N -4.18 0.33 -3.81 1.90 4.81 0.91 -4.89 118.16 113.23 2rqy n LYS 101 Ca 0.14 0.14 -0.29 0.00 -0.87 0.00 0.00 58.31 57.43 2rqy n LYS 101 Cb 0.79 -1.06 -0.13 0.00 0.02 0.00 0.00 35.03 34.66 2rqy n LYS 101 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2rqy s ASP 102 N -6.36 4.00 0.53 3.14 1.01 -0.21 -4.92 116.67 113.86 2rqy s ASP 102 Ca -0.21 -3.23 0.34 0.00 0.71 0.00 0.00 52.55 50.15 2rqy s ASP 102 Cb 0.08 -1.34 1.46 0.00 1.01 0.00 0.00 42.92 44.12 2rqy s ASP 102 CO 0.27 -0.18 2.00 0.77 0.21 0.00 0.00 175.17 178.24 2rqy h SER 103 N 6.05 0.00 0.54 0.27 4.64 -1.68 -2.23 113.55 121.15 2rqy h SER 103 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2rqy h SER 103 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2rqy h SER 103 CO 0.61 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.57 2rqy n GLN 104 N -2.98 0.01 -0.27 4.77 0.00 -1.26 -3.28 117.38 114.38 2rqy n GLN 104 Ca 0.00 0.24 0.06 0.00 0.00 0.00 0.00 57.00 57.31 2rqy n GLN 104 Cb 0.26 -1.52 0.20 0.00 0.00 0.00 0.00 30.24 29.19 2rqy n GLN 104 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.06 178.03 2rqy h ILE 105 N 0.00 0.66 0.00 -0.39 2.10 -1.80 0.62 117.51 118.70 2rqy h ILE 105 Ca 0.00 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 65.78 2rqy h ILE 105 Cb 0.27 0.14 0.00 0.00 -1.09 0.00 0.00 36.82 36.14 2rqy h ILE 105 CO 0.00 0.09 0.00 0.00 -1.08 0.00 0.00 178.15 177.16 2rqy h GLU 107 N 0.00 -0.49 -4.47 0.00 4.39 -1.68 -3.48 114.58 108.85 2rqy h GLU 107 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2rqy h GLU 107 Cb 0.00 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 2rqy h GLU 107 CO 0.00 -0.33 -0.32 -0.11 -1.16 0.00 0.00 179.01 177.09 2rqy n LEU 108 N -5.44 -5.84 -0.11 1.33 0.00 0.22 -4.83 117.00 102.32 2rqy n LEU 108 Ca -0.05 0.35 -0.15 0.00 0.00 0.00 0.00 56.01 56.16 2rqy n LEU 108 Cb 0.36 -2.55 -0.12 0.00 0.00 0.00 0.00 43.42 41.10 2rqy n LEU 108 CO 0.14 -1.52 -1.25 1.17 0.00 0.00 0.00 177.39 175.93 2rqy n LYS 109 N -0.38 0.69 0.00 1.96 4.81 -1.26 -4.69 118.16 119.29 2rqy n LYS 109 Ca 0.08 0.10 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 2rqy n LYS 109 Cb 0.30 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.86 2rqy n LYS 109 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 2rqy n TYR 110 N -3.07 0.00 -0.76 5.64 9.36 -1.26 -4.91 117.16 122.15 2rqy n TYR 110 Ca -0.40 -0.05 0.00 0.00 3.32 0.00 0.00 57.90 60.77 2rqy n TYR 110 Cb 1.00 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 39.71 2rqy n TYR 110 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2rqy n ASP 111 N -0.05 -0.26 -4.54 2.98 2.03 -1.26 -4.84 116.55 110.60 2rqy n ASP 111 Ca 0.00 -0.76 -0.38 0.00 0.52 0.00 0.00 54.79 54.17 2rqy n ASP 111 Cb 0.46 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.80 2rqy n ASP 111 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2rqy n LYS 112 N -1.02 0.86 -4.26 -0.67 0.00 -1.26 -4.91 118.16 106.90 2rqy n LYS 112 Ca 0.00 0.02 -0.17 0.00 0.00 0.00 0.00 58.31 58.16 2rqy n LYS 112 Cb 0.00 -3.03 -0.11 0.00 0.00 0.00 0.00 35.03 31.89 2rqy n LYS 112 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2rqy s GLN 113 N 8.33 1.08 0.36 1.64 -2.07 -1.26 -5.11 119.66 122.63 2rqy s GLN 113 Ca 1.06 -1.35 -0.26 0.00 -1.82 0.00 0.00 55.36 52.99 2rqy s GLN 113 Cb -0.41 -0.85 -0.09 0.00 -1.09 0.00 0.00 33.01 30.56 2rqy s GLN 113 CO 0.31 0.15 1.09 -1.50 -1.32 0.00 0.00 175.29 174.02 2rqy s ILE 114 N -2.59 3.51 -1.15 3.63 -1.16 -1.26 -4.92 121.20 117.26 2rqy s ILE 114 Ca 0.13 1.30 -0.21 0.00 -0.51 0.00 0.00 60.65 61.36 2rqy s ILE 114 Cb -0.02 -3.74 -0.06 0.00 0.61 0.00 0.00 42.46 39.25 2rqy s ILE 114 CO 0.03 0.15 1.91 0.47 -2.81 0.00 0.00 174.94 174.68 2rqy n ASP 115 N 0.39 3.45 -0.03 4.50 8.00 -1.26 -4.50 116.55 127.10 2rqy n ASP 115 Ca 0.03 -2.76 -0.05 0.00 0.71 0.00 0.00 54.79 52.72 2rqy n ASP 115 Cb 0.47 -1.61 -0.02 0.00 -0.02 0.00 0.00 41.12 39.94 2rqy n ASP 115 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2rqy n LEU 116 N 11.06 1.39 -2.68 0.64 7.94 -1.26 -5.02 117.00 129.08 2rqy n LEU 116 Ca 0.47 0.22 -0.05 0.00 -1.11 0.00 0.00 56.01 55.54 2rqy n LEU 116 Cb 0.45 -0.55 0.08 0.00 0.53 0.00 0.00 43.42 43.93 2rqy n LEU 116 CO 0.79 -0.46 0.55 -1.20 -1.11 0.00 0.00 177.39 175.95 2rqy n SER 117 N -3.86 -1.55 0.00 1.96 7.64 -1.26 -4.96 113.62 111.59 2rqy n SER 117 Ca -0.07 -2.05 0.00 0.00 1.01 0.00 0.00 58.87 57.75 2rqy n SER 117 Cb 0.27 0.94 0.00 0.00 -1.01 0.00 0.00 64.21 64.42 2rqy n SER 117 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2rqy n THR 118 N 1.41 0.00 -3.47 0.44 -1.04 -1.26 -4.73 114.28 105.64 2rqy n THR 118 Ca 0.02 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.70 2rqy n THR 118 Cb 0.70 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.16 2rqy n THR 118 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2rqy s VAL 119 N 0.00 4.98 0.00 12.58 1.01 -1.26 -4.97 120.40 132.74 2rqy s VAL 119 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.45 2rqy s VAL 119 Cb 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.74 2rqy s VAL 119 CO 0.00 0.06 0.00 0.47 0.00 0.00 0.00 175.10 175.63 2rqy n ASP 120 N 0.24 0.30 0.08 3.32 8.00 -1.26 -4.56 116.55 122.67 2rqy n ASP 120 Ca -0.02 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 2rqy n ASP 120 Cb 0.52 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.49 2rqy n ASP 120 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2rqy h LEU 121 N 0.00 0.23 0.00 0.64 6.46 -1.89 -2.88 115.31 117.86 2rqy h LEU 121 Ca 0.00 -0.25 -0.28 0.00 -0.12 0.00 0.00 57.88 57.23 2rqy h LEU 121 Cb 0.09 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 39.90 2rqy h LEU 121 CO 0.00 1.20 -1.76 1.17 -0.62 0.00 0.00 178.44 178.43 2rqy n LYS 122 N -3.43 0.64 -0.18 1.25 4.81 -1.26 -3.92 118.16 116.06 2rqy n LYS 122 Ca -0.06 0.23 0.06 0.00 -0.87 0.00 0.00 58.31 57.68 2rqy n LYS 122 Cb 0.99 -1.75 0.16 0.00 0.02 0.00 0.00 35.03 34.45 2rqy n LYS 122 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2rqy n LYS 123 N -2.96 1.82 -1.79 1.64 5.02 -1.25 -4.71 118.16 115.92 2rqy n LYS 123 Ca -0.18 -1.27 -0.38 0.00 -2.02 0.00 0.00 58.31 54.45 2rqy n LYS 123 Cb 1.02 -1.28 -0.04 0.00 -0.02 0.00 0.00 35.03 34.72 2rqy n LYS 123 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2rqy n LEU 124 N 0.54 4.41 -3.10 -0.35 7.94 -1.09 -2.73 117.00 122.62 2rqy n LEU 124 Ca 0.12 -3.38 0.06 0.00 -1.11 0.00 0.00 56.01 51.69 2rqy n LEU 124 Cb 0.30 -1.51 0.00 0.00 0.53 0.00 0.00 43.42 42.74 2rqy n LEU 124 CO 0.08 -0.47 0.64 -0.60 -1.11 0.00 0.00 177.39 175.93 2rqy s ARG 125 N 5.00 0.01 0.00 1.96 3.52 -1.26 -4.95 118.95 123.23 2rqy s ARG 125 Ca 0.58 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 56.19 2rqy s ARG 125 Cb 0.08 0.00 0.00 0.00 -1.56 0.00 0.00 34.95 33.47 2rqy s ARG 125 CO 0.08 -0.02 0.00 0.28 -0.81 0.00 0.00 175.30 174.84 2rqy n VAL 126 N 4.85 0.00 0.08 7.11 0.31 -1.26 -4.22 118.33 125.19 2rqy n VAL 126 Ca 0.10 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.58 2rqy n VAL 126 Cb 0.60 0.00 0.65 0.00 -0.91 0.00 0.00 33.84 34.17 2rqy n VAL 126 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2rqy h LYS 127 N 0.00 0.05 -0.07 5.55 1.57 -1.96 0.10 116.57 121.82 2rqy h LYS 127 Ca 0.00 -0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2rqy h LYS 127 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2rqy h LYS 127 CO 0.00 0.04 -0.72 1.05 -0.57 0.00 0.00 179.45 179.25 2rqy h GLU 128 N 0.06 0.34 0.03 3.15 -0.00 -1.69 -2.45 114.58 114.02 2rqy h GLU 128 Ca 0.17 -0.28 -0.11 0.00 -0.00 0.00 0.00 59.36 59.15 2rqy h GLU 128 Cb 0.61 0.06 0.01 0.00 -0.00 0.00 0.00 28.75 29.43 2rqy h GLU 128 CO -0.01 0.92 -0.44 1.25 -0.00 0.00 0.00 179.01 180.72 2rqy h LEU 129 N 0.23 0.34 -0.57 3.06 5.85 -1.35 0.30 115.31 123.17 2rqy h LEU 129 Ca -0.03 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 57.86 2rqy h LEU 129 Cb 1.28 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2rqy h LEU 129 CO 0.12 1.13 0.00 2.29 -0.34 0.00 0.00 178.44 181.64 2rqy n LYS 130 N -4.35 0.12 -0.06 1.25 -0.00 0.17 -1.71 118.16 113.56 2rqy n LYS 130 Ca -0.11 0.42 -0.08 0.00 -0.00 0.00 0.00 58.31 58.54 2rqy n LYS 130 Cb 0.62 -1.75 -0.03 0.00 -0.00 0.00 0.00 35.03 33.87 2rqy n LYS 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2rqy n LYS 131 N -1.98 0.42 -0.03 -1.58 4.76 -0.92 -4.29 118.16 114.55 2rqy n LYS 131 Ca 0.02 0.17 0.23 0.00 -2.87 0.00 0.00 58.31 55.86 2rqy n LYS 131 Cb 0.16 -1.24 0.72 0.00 -1.84 0.00 0.00 35.03 32.83 2rqy n LYS 131 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2rqy h ILE 132 N -0.79 0.54 -0.18 -0.18 2.04 -0.45 0.29 117.51 118.78 2rqy h ILE 132 Ca -0.03 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.70 2rqy h ILE 132 Cb 0.83 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 2rqy h ILE 132 CO -0.02 0.00 -0.43 0.25 0.00 0.00 0.00 178.15 177.95 2rqy h LEU 133 N 0.00 0.45 0.13 1.44 6.46 -1.51 -3.04 115.31 119.24 2rqy h LEU 133 Ca 0.29 -0.20 -0.28 0.00 -0.12 0.00 0.00 57.88 57.56 2rqy h LEU 133 Cb 1.27 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 2rqy h LEU 133 CO -0.00 0.83 -1.34 -0.78 -0.62 0.00 0.00 178.44 176.53 2rqy h ASP 134 N 0.35 0.42 0.01 1.25 1.82 -0.69 -3.34 116.42 116.24 2rqy h ASP 134 Ca 0.03 -0.48 0.03 0.00 -0.39 0.00 0.00 57.03 56.22 2rqy h ASP 134 Cb 0.90 -0.14 -0.05 0.00 0.68 0.00 0.00 39.33 40.73 2rqy h ASP 134 CO 0.08 1.38 -0.30 -0.78 -1.61 0.00 0.00 179.24 178.02 2rqy h ASP 135 N 0.07 -0.88 -0.75 2.28 3.58 -1.08 -0.34 116.42 119.32 2rqy h ASP 135 Ca -0.17 0.12 0.22 0.00 0.42 0.00 0.00 57.03 57.61 2rqy h ASP 135 Cb 1.99 0.35 -0.03 0.00 1.72 0.00 0.00 39.33 43.36 2rqy h ASP 135 CO 0.19 -0.36 0.55 -0.50 -2.88 0.00 0.00 179.24 176.24 2rqy h TRP 136 N -0.45 0.00 0.00 0.28 -0.00 -1.67 -3.45 115.95 110.66 2rqy h TRP 136 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.95 2rqy h TRP 136 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.69 2rqy h TRP 136 CO -0.32 0.00 0.00 0.41 -0.00 0.00 0.00 178.44 178.53 2rqy n GLY 137 N -1.68 1.42 3.26 1.49 0.00 -0.14 -5.16 105.19 104.39 2rqy n GLY 137 Ca 0.15 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 2rqy n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rqy s GLU 138 N -0.32 1.08 -0.28 1.61 2.02 -1.24 -5.00 118.70 116.57 2rqy s GLU 138 Ca 0.00 -1.32 -0.04 0.00 0.02 0.00 0.00 54.97 53.63 2rqy s GLU 138 Cb 0.00 0.32 0.10 0.00 0.10 0.00 0.00 34.13 34.65 2rqy s GLU 138 CO 0.00 -0.36 0.15 -1.64 0.02 0.00 0.00 175.26 173.43 2rqy s MET 139 N -4.02 0.20 -0.62 1.61 -1.94 -1.26 -4.95 119.30 108.33 2rqy s MET 139 Ca 0.22 -0.40 -0.05 0.00 -1.71 0.00 0.00 55.69 53.74 2rqy s MET 139 Cb 0.05 -1.15 0.16 0.00 2.01 0.00 0.00 34.83 35.90 2rqy s MET 139 CO 0.02 -0.98 0.46 0.00 -0.01 0.00 0.00 175.02 174.51 2rqy s LYS 141 N 0.26 3.52 -0.15 0.00 1.02 -1.26 -3.69 119.74 119.44 2rqy s LYS 141 Ca 0.15 0.20 -0.01 0.00 0.02 0.00 0.00 55.97 56.33 2rqy s LYS 141 Cb -0.20 -3.99 0.00 0.00 -0.52 0.00 0.00 37.83 33.12 2rqy s LYS 141 CO -0.04 -1.53 0.13 0.41 -0.92 0.00 0.00 175.35 173.40 2rqy n GLY 142 N 5.02 0.71 3.64 -3.33 0.00 -1.26 -5.06 105.19 104.91 2rqy n GLY 142 Ca 0.08 -0.54 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 2rqy n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rqy s ALA 144 N 0.85 -3.83 -0.03 0.00 0.00 -1.26 -4.75 121.76 112.74 2rqy s ALA 144 Ca -0.03 1.34 -0.16 0.00 0.00 0.00 0.00 51.96 53.10 2rqy s ALA 144 Cb -0.04 -2.78 0.03 0.00 0.00 0.00 0.00 23.12 20.33 2rqy s ALA 144 CO -0.11 -2.01 0.36 -1.21 0.00 0.00 0.00 175.76 172.78 2rqy s GLU 145 N 2.94 0.69 0.57 0.00 2.02 -1.26 -5.01 118.70 118.65 2rqy s GLU 145 Ca 0.23 -0.08 0.27 0.00 0.02 0.00 0.00 54.97 55.42 2rqy s GLU 145 Cb -0.03 0.31 1.54 0.00 0.10 0.00 0.00 34.13 36.05 2rqy s GLU 145 CO -0.22 -0.19 2.05 1.57 0.02 0.00 0.00 175.26 178.49 2rqy h LYS 146 N 3.92 0.00 0.00 1.61 2.10 -1.99 0.25 116.57 122.46 2rqy h LYS 146 Ca -0.29 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.27 2rqy h LYS 146 Cb 1.17 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.49 2rqy h LYS 146 CO 0.39 0.00 -0.52 0.77 -2.00 0.00 0.00 179.45 178.09 2rqy h SER 147 N 0.00 0.00 1.35 7.07 0.02 -2.00 -2.68 113.55 117.32 2rqy h SER 147 Ca 0.14 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.96 2rqy h SER 147 Cb 0.67 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 2rqy h SER 147 CO -0.00 0.38 -0.60 -0.78 -1.14 0.00 0.00 176.83 174.69 2rqy h ASP 148 N 0.00 0.00 0.08 3.07 1.82 -0.92 -3.25 116.42 117.22 2rqy h ASP 148 Ca -0.02 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.41 2rqy h ASP 148 Cb 1.31 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.31 2rqy h ASP 148 CO 0.05 0.60 -1.07 1.88 -1.61 0.00 0.00 179.24 179.09 2rqy h TYR 149 N 0.00 0.30 -0.92 0.28 0.05 -1.42 -2.92 116.97 112.34 2rqy h TYR 149 Ca -0.01 -0.22 0.22 0.00 0.05 0.00 0.00 58.73 58.77 2rqy h TYR 149 Cb 1.44 -0.01 -0.07 0.00 1.01 0.00 0.00 36.73 39.10 2rqy h TYR 149 CO 0.00 1.42 0.61 0.97 -1.05 0.00 0.00 178.16 180.11 2rqy h ILE 150 N -0.56 0.64 0.00 -2.88 6.09 -1.59 0.31 117.51 119.52 2rqy h ILE 150 Ca -0.24 -0.12 -0.14 0.00 -1.37 0.00 0.00 64.86 62.99 2rqy h ILE 150 Cb 1.53 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 39.06 2rqy h ILE 150 CO 0.01 0.06 -1.02 -0.09 -3.07 0.00 0.00 178.15 174.04 2rqy h ARG 151 N 0.36 0.00 0.31 2.19 2.43 -1.68 -3.10 114.38 114.88 2rqy h ARG 151 Ca 0.48 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.64 2rqy h ARG 151 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2rqy h ARG 151 CO -0.17 0.39 -0.15 0.87 -1.51 0.00 0.00 179.97 179.40 2rqy h LYS 152 N 0.00 -0.40 -0.65 0.20 1.79 -0.31 -3.26 116.57 113.95 2rqy h LYS 152 Ca -0.09 0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.42 2rqy h LYS 152 Cb 1.49 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 32.20 2rqy h LYS 152 CO 0.06 -0.15 0.43 0.82 -1.08 0.00 0.00 179.45 179.52 2rqy h ILE 153 N -1.05 1.14 -0.88 1.86 1.08 -1.06 -1.72 117.51 116.89 2rqy h ILE 153 Ca -0.04 -0.29 0.22 0.00 -0.39 0.00 0.00 64.86 64.35 2rqy h ILE 153 Cb 0.43 0.22 -0.06 0.00 -3.07 0.00 0.00 36.82 34.34 2rqy h ILE 153 CO 0.07 0.15 0.60 0.78 -0.69 0.00 0.00 178.15 179.06 2rqy h ASN 154 N 0.84 0.29 0.62 1.72 -0.26 -1.62 0.35 115.58 117.52 2rqy h ASN 154 Ca 0.25 0.03 -0.20 0.00 -0.56 0.00 0.00 56.30 55.82 2rqy h ASN 154 Cb -0.04 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 2rqy h ASN 154 CO -0.06 0.11 -0.89 -0.08 -1.06 0.00 0.00 177.43 175.45 2rqy h GLU 155 N 0.29 0.17 -0.61 0.81 4.81 -1.35 -3.16 114.58 115.53 2rqy h GLU 155 Ca 0.45 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.40 2rqy h GLU 155 Cb 1.30 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 30.69 2rqy h GLU 155 CO -0.13 0.95 0.10 1.28 -0.73 0.00 0.00 179.01 180.48 2rqy n LEU 156 N -3.63 5.75 0.29 1.64 4.32 0.85 -4.62 117.00 121.60 2rqy n LEU 156 Ca -0.03 -3.06 -0.17 0.00 -0.02 0.00 0.00 56.01 52.72 2rqy n LEU 156 Cb 0.82 -0.70 -0.09 0.00 -1.62 0.00 0.00 43.42 41.82 2rqy n LEU 156 CO 0.48 0.71 0.52 0.24 -1.22 0.00 0.00 177.39 178.12 2rqy h MET 157 N 3.33 -0.95 0.00 3.23 2.86 -0.48 -1.33 114.93 121.60 2rqy h MET 157 Ca 0.10 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2rqy h MET 157 Cb 2.08 0.21 0.00 0.00 0.06 0.00 0.00 31.60 33.96 2rqy h MET 157 CO 0.57 -0.63 0.00 -0.35 1.06 0.00 0.00 176.91 177.56 2rqy n PRO 158 N -5.36 0.07 -0.06 -0.22 -0.04 -1.25 -0.24 135.00 127.89 2rqy n PRO 158 Ca -0.12 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.52 2rqy n PRO 158 Cb 0.44 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 2rqy n PRO 158 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2rqy h LYS 159 N 0.00 0.00 -0.42 0.54 1.57 -1.64 -3.32 116.57 113.29 2rqy h LYS 159 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 2rqy h LYS 159 Cb 0.21 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.43 2rqy h LYS 159 CO 0.00 0.23 0.06 0.66 -0.57 0.00 0.00 179.45 179.83 2rqy n TYR 160 N -4.72 1.39 -2.66 -1.35 4.01 -0.58 -4.69 117.16 108.56 2rqy n TYR 160 Ca -0.04 -1.29 -0.04 0.00 -0.16 0.00 0.00 57.90 56.37 2rqy n TYR 160 Cb 0.14 -0.49 0.09 0.00 -0.31 0.00 0.00 39.34 38.77 2rqy n TYR 160 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rqy n ALA 161 N -0.76 -3.69 -1.16 -0.72 0.00 0.66 -5.02 120.51 109.82 2rqy n ALA 161 Ca 0.32 -0.22 -0.29 0.00 0.00 0.00 0.00 53.44 53.25 2rqy n ALA 161 Cb 1.09 -3.40 0.18 0.00 0.00 0.00 0.00 19.45 17.32 2rqy n ALA 161 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2rqy s PRO 162 N 0.04 0.41 -1.34 0.00 0.04 -1.22 -3.86 135.00 129.06 2rqy s PRO 162 Ca 0.24 0.52 -0.03 0.00 0.04 0.00 0.00 61.00 61.77 2rqy s PRO 162 Cb 0.23 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 33.03 2rqy s PRO 162 CO -0.10 -2.74 0.42 1.63 0.04 0.00 0.00 177.00 176.25 2rqy n LYS 163 N -4.18 -3.64 -0.88 4.56 4.76 -1.26 -4.86 118.16 112.66 2rqy n LYS 163 Ca 0.05 0.78 -0.01 0.00 -2.87 0.00 0.00 58.31 56.27 2rqy n LYS 163 Cb 0.57 -5.32 -0.01 0.00 -1.84 0.00 0.00 35.03 28.42 2rqy n LYS 163 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2rqy n ALA 164 N -3.02 2.56 0.01 7.82 0.00 -1.26 -4.27 120.51 122.37 2rqy n ALA 164 Ca -0.12 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.33 2rqy n ALA 164 Cb 0.61 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2rqy n ALA 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rqy n ALA 165 N 0.12 1.88 0.11 0.00 0.00 -1.26 -4.69 120.51 116.67 2rqy n ALA 165 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.36 2rqy n ALA 165 Cb 0.76 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.23 2rqy n ALA 165 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2rqy h SER 166 N 0.00 0.00 0.42 0.00 0.02 -1.98 -3.26 113.55 108.75 2rqy h SER 166 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2rqy h SER 166 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2rqy h SER 166 CO 0.00 0.74 -1.62 0.00 -1.14 0.00 0.00 176.83 174.81 2rqy n ALA 167 N -2.32 2.50 -1.61 3.77 0.00 -1.26 -4.85 120.51 116.74 2rqy n ALA 167 Ca 0.00 -0.49 -0.31 0.00 0.00 0.00 0.00 53.44 52.64 2rqy n ALA 167 Cb 0.78 -0.85 0.05 0.00 0.00 0.00 0.00 19.45 19.43 2rqy n ALA 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2rqy s ARG 168 N -3.31 2.92 -1.28 0.00 3.52 -1.23 -4.92 118.95 114.64 2rqy s ARG 168 Ca -0.05 0.88 -0.17 0.00 -0.13 0.00 0.00 55.73 56.26 2rqy s ARG 168 Cb 0.11 -1.99 0.01 0.00 -1.56 0.00 0.00 34.95 31.52 2rqy s ARG 168 CO 0.85 -1.09 2.00 2.41 -0.81 0.00 0.00 175.30 178.66 2rqy n THR 169 N -3.12 3.21 0.00 4.11 -1.04 -1.26 -3.85 114.28 112.34 2rqy n THR 169 Ca 0.07 -3.05 0.00 0.00 -2.04 0.00 0.00 64.05 59.04 2rqy n THR 169 Cb 0.54 -2.44 0.00 0.00 -1.82 0.00 0.00 70.33 66.61 2rqy n THR 169 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2rqy n ASP 170 N 7.86 0.00 0.00 8.00 8.00 -1.26 -5.19 116.55 133.96 2rqy n ASP 170 Ca 0.50 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.00 2rqy n ASP 170 Cb 0.42 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 2rqy n ASP 170 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70