#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rqy n HIS 2 N 0.00 -1.61 -3.84 3.17 -0.00 -1.26 -5.19 115.22 106.49 2rqy n HIS 2 Ca 0.00 -1.16 -0.10 0.00 -0.00 0.00 0.00 57.72 56.46 2rqy n HIS 2 Cb 0.00 0.49 -0.01 0.00 -0.00 0.00 0.00 29.99 30.47 2rqy n HIS 2 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2rqy n HIS 3 N -0.32 -1.41 -4.49 4.41 -0.00 -1.26 -5.19 115.22 106.96 2rqy n HIS 3 Ca -0.04 -1.64 -0.25 0.00 -0.00 0.00 0.00 57.72 55.79 2rqy n HIS 3 Cb 0.35 0.48 -0.08 0.00 -0.00 0.00 0.00 29.99 30.74 2rqy n HIS 3 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2rqy s HIS 4 N -3.62 1.78 0.39 4.41 -0.00 -1.26 -5.18 115.29 111.81 2rqy s HIS 4 Ca 0.19 -1.39 -0.14 0.00 -0.00 0.00 0.00 55.06 53.72 2rqy s HIS 4 Cb -0.01 -1.08 0.05 0.00 -0.00 0.00 0.00 32.58 31.54 2rqy s HIS 4 CO 0.14 -0.43 0.76 -1.01 -0.00 0.00 0.00 174.74 174.20 2rqy s HIS 5 N -3.21 0.24 0.28 0.38 0.09 -1.26 -5.19 115.29 106.62 2rqy s HIS 5 Ca 0.25 -0.88 -0.20 0.00 -0.00 0.00 0.00 55.06 54.22 2rqy s HIS 5 Cb 0.01 0.75 0.02 0.00 -0.00 0.00 0.00 32.58 33.36 2rqy s HIS 5 CO 0.17 -1.55 0.69 -1.58 -0.00 0.00 0.00 174.74 172.47 2rqy s HIS 6 N -2.29 -0.10 0.23 1.40 5.04 -1.26 -5.19 115.29 113.12 2rqy s HIS 6 Ca 0.17 -0.35 -0.07 0.00 -1.54 0.00 0.00 55.06 53.28 2rqy s HIS 6 Cb -0.05 0.64 -0.02 0.00 0.04 0.00 0.00 32.58 33.19 2rqy s HIS 6 CO 0.13 -1.21 0.32 -1.01 -2.34 0.00 0.00 174.74 170.63 2rqy s HIS 7 N -3.90 0.77 0.21 3.88 0.09 -1.26 -5.10 115.29 109.99 2rqy s HIS 7 Ca 0.13 -1.06 0.00 0.00 -0.00 0.00 0.00 55.06 54.13 2rqy s HIS 7 Cb -0.05 -0.17 0.00 0.00 -0.00 0.00 0.00 32.58 32.36 2rqy s HIS 7 CO 0.07 -0.84 0.00 -0.89 -0.00 0.00 0.00 174.74 173.08 2rqy n ILE 8 N -0.35 0.02 -3.75 0.60 -0.00 -1.26 -5.04 119.36 109.58 2rqy n ILE 8 Ca 0.00 0.01 -0.27 0.00 -0.00 0.00 0.00 62.75 62.49 2rqy n ILE 8 Cb 0.64 -0.37 0.05 0.00 -0.00 0.00 0.00 39.64 39.95 2rqy n ILE 8 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2rqy n GLU 9 N -3.21 -6.65 0.07 0.38 4.71 -1.26 -4.89 120.64 109.80 2rqy n GLU 9 Ca 0.00 0.71 -0.00 0.00 -0.01 0.00 0.00 57.16 57.86 2rqy n GLU 9 Cb 0.00 -5.67 -0.05 0.00 -1.01 0.00 0.00 31.44 24.71 2rqy n GLU 9 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2rqy h GLY 10 N -2.36 0.00 -5.07 0.62 0.00 -2.02 -3.40 103.07 90.84 2rqy h GLY 10 Ca -0.58 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.45 2rqy h GLY 10 CO 0.61 0.00 -0.82 0.54 0.00 0.00 0.00 176.54 176.87 2rqy n ARG 11 N -3.05 1.14 -4.31 4.80 1.74 -1.26 -5.08 116.66 110.65 2rqy n ARG 11 Ca -0.05 -2.63 -0.20 0.00 -0.77 0.00 0.00 57.85 54.20 2rqy n ARG 11 Cb 0.82 -0.79 -0.13 0.00 -1.02 0.00 0.00 32.46 31.34 2rqy n ARG 11 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2rqy s HIS 12 N -1.58 1.34 -0.08 -1.55 3.76 -1.26 -4.94 115.29 110.98 2rqy s HIS 12 Ca 0.26 -0.40 -0.06 0.00 -0.15 0.00 0.00 55.06 54.71 2rqy s HIS 12 Cb 0.42 -0.77 0.02 0.00 1.11 0.00 0.00 32.58 33.36 2rqy s HIS 12 CO -0.02 0.07 0.12 -1.33 -0.85 0.00 0.00 174.74 172.73 2rqy n MET 13 N 1.58 -4.16 -2.73 1.40 2.81 -1.26 -4.82 117.12 109.95 2rqy n MET 13 Ca -0.19 3.15 -0.02 0.00 -1.81 0.00 0.00 57.70 58.82 2rqy n MET 13 Cb 0.54 -4.31 -0.02 0.00 -0.71 0.00 0.00 33.22 28.72 2rqy n MET 13 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2rqy n LEU 14 N 1.50 -6.75 -4.87 4.03 0.00 -1.26 -4.98 117.00 104.67 2rqy n LEU 14 Ca -0.21 1.72 -0.31 0.00 0.00 0.00 0.00 56.01 57.22 2rqy n LEU 14 Cb 0.32 -3.11 0.01 0.00 0.00 0.00 0.00 43.42 40.65 2rqy n LEU 14 CO 0.19 -3.45 0.72 -0.13 0.00 0.00 0.00 177.39 174.71 2rqy s ARG 15 N -1.09 3.52 -1.12 1.96 0.52 -1.26 -4.93 118.95 116.55 2rqy s ARG 15 Ca -0.12 0.70 -0.23 0.00 -0.52 0.00 0.00 55.73 55.56 2rqy s ARG 15 Cb 0.01 -2.08 -0.10 0.00 0.52 0.00 0.00 34.95 33.29 2rqy s ARG 15 CO 0.69 -0.61 1.93 -0.35 0.02 0.00 0.00 175.30 176.98 2rqy n PRO 16 N -2.76 1.57 0.00 3.54 -0.04 -1.26 -4.62 135.00 131.43 2rqy n PRO 16 Ca 0.06 -2.38 0.00 0.00 -0.04 0.00 0.00 63.50 61.14 2rqy n PRO 16 Cb 0.54 -3.62 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 5.61 1.58 0.22 0.55 0.00 -1.26 -4.74 105.19 107.15 2rqy n GLY 17 Ca 0.46 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.67 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 0.00 -3.49 1.61 -0.08 -1.26 -4.79 116.55 108.54 2rqy n ASP 18 Ca 0.00 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 53.01 2rqy n ASP 18 Cb 0.00 0.06 -0.13 0.00 2.34 0.00 0.00 41.12 43.38 2rqy n ASP 18 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2rqy n GLU 20 N 4.84 0.65 0.09 0.00 4.71 -1.26 -4.59 120.64 125.08 2rqy n GLU 20 Ca 0.01 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.37 2rqy n GLU 20 Cb 0.41 -1.72 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 2rqy n GLU 20 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 2rqy n VAL 21 N -2.95 0.00 -3.61 2.62 0.24 -1.26 -4.82 118.33 108.55 2rqy n VAL 21 Ca -0.21 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.03 2rqy n VAL 21 Cb 1.07 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 33.40 2rqy n VAL 21 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rqy n ILE 23 N 0.49 -8.84 -0.00 0.00 5.41 -1.26 -5.03 119.36 110.13 2rqy n ILE 23 Ca -0.04 0.67 -0.00 0.00 1.00 0.00 0.00 62.75 64.38 2rqy n ILE 23 Cb 0.58 -6.48 -0.00 0.00 -0.71 0.00 0.00 39.64 33.03 2rqy n ILE 23 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 2rqy h SER 24 N 1.50 0.00 0.00 4.38 0.87 -1.98 -3.42 113.55 114.90 2rqy h SER 24 Ca 0.00 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.25 2rqy h SER 24 Cb 0.75 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.65 2rqy h SER 24 CO 0.15 0.01 -2.16 0.00 -0.53 0.00 0.00 176.83 174.29 2rqy n TYR 25 N -2.23 0.00 -0.19 2.24 9.36 -1.26 -4.43 117.16 120.65 2rqy n TYR 25 Ca -0.00 0.00 0.30 0.00 3.32 0.00 0.00 57.90 61.52 2rqy n TYR 25 Cb 0.00 -0.79 0.72 0.00 -0.63 0.00 0.00 39.34 38.64 2rqy n TYR 25 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2rqy h LEU 26 N 0.00 0.00 -0.93 2.98 -0.00 -1.94 0.28 115.31 115.69 2rqy h LEU 26 Ca -0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.38 2rqy h LEU 26 Cb 1.75 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 42.38 2rqy h LEU 26 CO -0.06 0.00 0.23 1.23 -0.00 0.00 0.00 178.44 179.84 2rqy h GLY 27 N 0.00 1.08 1.66 0.83 0.00 -1.81 -1.12 103.07 103.71 2rqy h GLY 27 Ca 0.45 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2rqy h GLY 27 CO -0.00 0.57 -0.24 0.54 0.00 0.00 0.00 176.54 177.40 2rqy n ARG 28 N -4.28 0.23 -0.06 4.80 3.00 0.93 -3.40 116.66 117.88 2rqy n ARG 28 Ca 0.06 0.14 -0.01 0.00 -0.01 0.00 0.00 57.85 58.02 2rqy n ARG 28 Cb 0.20 -1.72 -0.00 0.00 0.00 0.00 0.00 32.46 30.94 2rqy n ARG 28 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 2rqy h PHE 29 N 0.00 0.00 -0.63 -1.55 3.57 -0.89 -3.35 116.94 114.09 2rqy h PHE 29 Ca 0.00 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.68 2rqy h PHE 29 Cb 0.70 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.42 2rqy h PHE 29 CO 0.00 0.00 0.45 0.10 -2.23 0.00 0.00 178.31 176.63 2rqy h TYR 30 N -1.00 0.02 -0.75 0.41 -0.00 -1.38 0.40 116.97 114.67 2rqy h TYR 30 Ca -0.00 0.00 0.19 0.00 -0.00 0.00 0.00 58.73 58.92 2rqy h TYR 30 Cb 0.16 -0.01 -0.04 0.00 -0.00 0.00 0.00 36.73 36.84 2rqy h TYR 30 CO -0.06 0.01 0.52 0.37 -0.00 0.00 0.00 178.16 178.99 2rqy h GLN 31 N 0.02 0.19 0.24 0.10 4.15 -1.69 0.08 115.11 118.19 2rqy h GLN 31 Ca 0.30 -0.01 -0.34 0.00 0.77 0.00 0.00 58.65 59.37 2rqy h GLN 31 Cb 1.17 -0.04 0.03 0.00 0.21 0.00 0.00 27.48 28.85 2rqy h GLN 31 CO -0.01 0.12 -1.54 -0.44 -1.93 0.00 0.00 178.83 175.04 2rqy h ASP 32 N 0.19 0.78 -0.77 -0.69 5.19 -1.08 -2.87 116.42 117.18 2rqy h ASP 32 Ca 0.37 -0.90 -0.01 0.00 -0.62 0.00 0.00 57.03 55.87 2rqy h ASP 32 Cb 1.16 -0.25 -0.04 0.00 0.18 0.00 0.00 39.33 40.38 2rqy h ASP 32 CO -0.07 1.72 0.44 -0.07 -3.12 0.00 0.00 179.24 178.14 2rqy h LEU 33 N 0.14 0.95 -0.14 1.55 3.38 -1.07 -1.56 115.31 118.55 2rqy h LEU 33 Ca -0.27 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2rqy h LEU 33 Cb 2.15 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.66 2rqy h LEU 33 CO 0.25 0.75 0.00 1.17 0.09 0.00 0.00 178.44 180.71 2rqy n LYS 34 N -4.46 0.25 -0.83 1.13 4.81 -0.15 -3.21 118.16 115.70 2rqy n LYS 34 Ca 0.07 0.25 -0.11 0.00 -0.87 0.00 0.00 58.31 57.66 2rqy n LYS 34 Cb 0.08 -1.81 -0.02 0.00 0.02 0.00 0.00 35.03 33.29 2rqy n LYS 34 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2rqy n ASP 35 N -2.25 5.85 -3.52 3.14 2.03 -0.60 -4.75 116.55 116.45 2rqy n ASP 35 Ca 0.05 -2.74 -0.24 0.00 0.52 0.00 0.00 54.79 52.38 2rqy n ASP 35 Cb 0.39 -1.16 -0.02 0.00 -0.72 0.00 0.00 41.12 39.61 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 1.19 -2.72 -0.02 -0.67 0.63 -1.24 -4.77 116.66 109.06 2rqy n ARG 36 Ca 0.23 0.32 0.01 0.00 -0.92 0.00 0.00 57.85 57.49 2rqy n ARG 36 Cb 0.60 -4.96 -0.08 0.00 0.45 0.00 0.00 32.46 28.46 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 -2.21 2.48 -3.77 6.15 -0.08 -1.16 -5.03 116.55 112.93 2rqy n ASP 37 Ca 0.02 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.17 2rqy n ASP 37 Cb 0.51 1.22 -0.09 0.00 2.34 0.00 0.00 41.12 45.10 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 -2.57 0.05 0.17 5.18 1.01 -1.20 -4.94 120.40 118.10 2rqy s VAL 38 Ca -0.04 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 2rqy s VAL 38 Cb 0.06 -0.58 -0.07 0.00 0.00 0.00 0.00 36.38 35.78 2rqy s VAL 38 CO 0.44 -0.23 0.63 -0.89 0.00 0.00 0.00 175.10 175.05 2rqy s THR 39 N -1.10 4.72 -1.34 3.92 2.01 -1.26 -4.58 115.64 118.01 2rqy s THR 39 Ca -0.12 1.06 -0.10 0.00 0.31 0.00 0.00 61.69 62.85 2rqy s THR 39 Cb -0.05 -3.81 -0.07 0.00 0.01 0.00 0.00 72.50 68.59 2rqy s THR 39 CO 0.04 0.26 2.56 0.49 -0.69 0.00 0.00 174.62 177.28 2rqy n PHE 40 N 0.87 2.16 -4.20 4.92 3.72 -1.26 -4.21 117.46 119.45 2rqy n PHE 40 Ca -0.05 -2.65 -0.17 0.00 -0.05 0.00 0.00 57.45 54.53 2rqy n PHE 40 Cb 0.51 -2.20 -0.11 0.00 -0.94 0.00 0.00 39.48 36.75 2rqy n PHE 40 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2rqy s SER 41 N 2.83 1.75 -0.78 4.37 1.04 -1.26 -4.28 113.70 117.37 2rqy s SER 41 Ca 0.57 -0.75 -0.08 0.00 0.48 0.00 0.00 55.95 56.17 2rqy s SER 41 Cb 0.15 -0.04 -0.06 0.00 0.10 0.00 0.00 66.02 66.16 2rqy s SER 41 CO -0.04 -0.16 1.95 -0.81 0.98 0.00 0.00 173.24 175.16 2rqy n PRO 42 N 0.76 1.74 0.04 4.02 -0.04 -1.26 -3.36 135.00 136.91 2rqy n PRO 42 Ca -0.17 -1.40 0.00 0.00 -0.04 0.00 0.00 63.50 61.89 2rqy n PRO 42 Cb 0.56 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 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 4.83 0.00 0.31 0.55 0.00 -1.26 -4.90 120.51 120.04 2rqy n ALA 43 Ca 0.40 0.00 0.21 0.00 0.00 0.00 0.00 53.44 54.05 2rqy n ALA 43 Cb 0.16 0.00 1.09 0.00 0.00 0.00 0.00 19.45 20.70 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 0.00 0.05 0.00 2.02 -1.81 -1.03 112.91 112.13 2rqy h THR 44 Ca 0.00 -0.03 -0.35 0.00 0.77 0.00 0.00 66.41 66.80 2rqy h THR 44 Cb 0.00 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 2rqy h THR 44 CO 0.00 0.00 -2.08 -0.38 0.37 0.00 0.00 175.52 173.43 2rqy n ILE 45 N -2.93 1.62 0.28 3.11 5.41 -1.21 -4.08 119.36 121.56 2rqy n ILE 45 Ca -0.02 -0.71 0.16 0.00 1.00 0.00 0.00 62.75 63.17 2rqy n ILE 45 Cb 0.08 -1.29 0.55 0.00 -0.71 0.00 0.00 39.64 38.27 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 0.03 0.00 0.00 0.38 -0.00 -1.60 -0.77 114.58 112.62 2rqy h GLU 46 Ca -0.44 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 58.79 2rqy h GLU 46 Cb 2.04 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 30.77 2rqy h GLU 46 CO 0.04 0.00 -0.64 1.05 -0.00 0.00 0.00 179.01 179.46 2rqy h GLU 47 N 0.00 0.00 0.00 1.06 4.11 -1.37 -2.95 114.58 115.43 2rqy h GLU 47 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.13 2rqy h GLU 47 Cb 0.61 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 2rqy h GLU 47 CO 0.00 0.64 -1.70 0.39 0.07 0.00 0.00 179.01 178.40 2rqy n GLU 48 N -3.39 0.56 -0.34 1.06 -0.58 -1.08 -4.32 120.64 112.56 2rqy n GLU 48 Ca 0.01 0.43 0.10 0.00 -0.42 0.00 0.00 57.16 57.28 2rqy n GLU 48 Cb 0.74 -1.63 0.28 0.00 -0.57 0.00 0.00 31.44 30.26 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 -1.00 0.73 -0.87 -4.62 5.85 -1.29 -0.37 115.31 113.75 2rqy h LEU 49 Ca -0.45 0.09 0.18 0.00 0.84 0.00 0.00 57.88 58.53 2rqy h LEU 49 Cb 1.36 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 42.24 2rqy h LEU 49 CO -0.27 0.30 0.42 -0.29 -0.34 0.00 0.00 178.44 178.26 2rqy h ILE 50 N 0.76 0.63 -0.60 4.05 2.10 -1.72 0.83 117.51 123.57 2rqy h ILE 50 Ca 0.53 -0.18 -0.09 0.00 1.08 0.00 0.00 64.86 66.19 2rqy h ILE 50 Cb 0.75 0.05 -0.02 0.00 -1.09 0.00 0.00 36.82 36.51 2rqy h ILE 50 CO -0.36 0.10 -0.00 0.11 -1.08 0.00 0.00 178.15 176.92 2rqy h LYS 51 N 0.53 1.04 -0.61 2.19 1.57 -1.26 -2.12 116.57 117.92 2rqy h LYS 51 Ca 0.50 -0.33 -0.06 0.00 -1.87 0.00 0.00 60.65 58.90 2rqy h LYS 51 Cb 0.81 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 2rqy h LYS 51 CO -0.43 1.02 0.15 0.74 -0.57 0.00 0.00 179.45 180.36 2rqy h PHE 52 N 0.95 0.99 0.30 -1.35 -1.00 -0.70 0.25 116.94 116.38 2rqy h PHE 52 Ca 0.17 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 2rqy h PHE 52 Cb 0.55 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 39.83 2rqy h PHE 52 CO 0.04 0.82 -0.14 0.00 -1.61 0.00 0.00 178.31 177.41 2rqy h ARG 54 N -0.73 0.00 -0.48 0.00 3.08 -1.34 -2.28 114.38 112.63 2rqy h ARG 54 Ca -0.04 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 2rqy h ARG 54 Cb 0.49 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.48 2rqy h ARG 54 CO 0.07 0.22 0.09 -1.91 -1.07 0.00 0.00 179.97 177.36 2rqy n GLU 55 N -3.81 3.24 -2.51 0.04 2.13 0.86 -5.00 120.64 115.59 2rqy n GLU 55 Ca -0.02 -3.02 -0.29 0.00 0.66 0.00 0.00 57.16 54.49 2rqy n GLU 55 Cb 0.32 -2.02 -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 -2.96 3.29 -0.23 4.31 0.00 0.11 -4.89 121.76 121.40 2rqy s ALA 56 Ca 0.49 -0.26 -0.03 0.00 0.00 0.00 0.00 51.96 52.15 2rqy s ALA 56 Cb 0.40 -2.78 0.12 0.00 0.00 0.00 0.00 23.12 20.86 2rqy s ALA 56 CO 0.10 -0.31 0.33 0.50 0.00 0.00 0.00 175.76 176.38 2rqy s ARG 57 N -4.50 0.30 2.40 0.00 3.52 -1.26 -4.72 118.95 114.68 2rqy s ARG 57 Ca 0.51 0.46 0.00 0.00 -0.13 0.00 0.00 55.73 56.57 2rqy s ARG 57 Cb -0.10 -0.66 0.00 0.00 -1.56 0.00 0.00 34.95 32.63 2rqy s ARG 57 CO 0.41 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.69 2rqy n GLY 58 N 5.35 0.70 0.33 8.12 0.00 -1.26 -3.96 105.19 114.47 2rqy n GLY 58 Ca -0.04 -1.16 0.19 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.95 0.26 116.57 118.59 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 0.93 -2.00 0.00 0.00 179.45 178.38 2rqy h GLU 60 N 0.00 0.00 0.01 0.07 5.08 -1.96 -3.13 114.58 114.66 2rqy h GLU 60 Ca 0.01 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.00 2rqy h GLU 60 Cb 0.18 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 2rqy h GLU 60 CO -0.00 0.00 -2.34 -1.71 -1.00 0.00 0.00 179.01 173.96 2rqy n ASN 61 N -2.32 1.31 0.25 1.42 2.85 0.86 -4.18 115.26 115.45 2rqy n ASN 61 Ca 0.05 -0.02 0.17 0.00 -0.11 0.00 0.00 54.58 54.67 2rqy n ASN 61 Cb 0.40 -0.00 0.76 0.00 1.24 0.00 0.00 39.78 42.17 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 0.01 0.00 0.07 1.20 0.11 -1.43 -3.06 114.38 111.28 2rqy h ARG 62 Ca -0.53 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.54 2rqy h ARG 62 Cb 2.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.11 2rqy h ARG 62 CO -0.02 0.00 -0.03 -0.07 0.10 0.00 0.00 179.97 179.95 2rqy h LEU 63 N 0.00 -0.07 -1.82 0.08 4.07 -1.72 -3.08 115.31 112.77 2rqy h LEU 63 Ca 0.00 -0.53 0.23 0.00 0.08 0.00 0.00 57.88 57.66 2rqy h LEU 63 Cb 0.33 0.02 -0.05 0.00 1.08 0.00 0.00 40.66 42.04 2rqy h LEU 63 CO 0.00 0.62 0.61 0.00 -1.08 0.00 0.00 178.44 178.59 2rqy h TYR 65 N 0.15 0.84 0.00 0.00 3.20 -1.60 0.85 116.97 120.42 2rqy h TYR 65 Ca 0.43 -0.29 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 2rqy h TYR 65 Cb 1.46 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.57 2rqy h TYR 65 CO -0.00 1.05 -0.00 -0.92 -1.64 0.00 0.00 178.16 176.65 2rqy h TYR 66 N 0.52 -0.01 0.00 -3.82 5.03 -0.49 -3.33 116.97 114.88 2rqy h TYR 66 Ca 0.02 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 2rqy h TYR 66 Cb 1.09 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.36 2rqy h TYR 66 CO 0.05 0.57 -0.15 0.82 -1.32 0.00 0.00 178.16 178.14 2rqy h ILE 67 N -1.00 0.93 -3.39 1.81 2.04 -0.46 -3.47 117.51 113.97 2rqy h ILE 67 Ca -0.00 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 2rqy h ILE 67 Cb 0.58 1.30 0.01 0.00 -0.74 0.00 0.00 36.82 37.97 2rqy h ILE 67 CO 0.00 0.14 -0.04 0.61 0.00 0.00 0.00 178.15 178.87 2rqy n GLY 68 N -0.97 -0.18 0.05 5.37 0.00 0.22 -4.48 105.19 105.20 2rqy n GLY 68 Ca -0.02 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.30 2.66 -2.50 4.61 0.00 -0.75 -4.14 120.51 119.09 2rqy n ALA 69 Ca -0.00 -0.42 -0.32 0.00 0.00 0.00 0.00 53.44 52.70 2rqy n ALA 69 Cb 0.51 -0.89 -0.15 0.00 0.00 0.00 0.00 19.45 18.92 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 -3.43 2.35 -0.74 0.00 -1.32 -1.26 -4.61 115.64 106.63 2rqy s THR 70 Ca -0.05 -0.98 0.17 0.00 -1.21 0.00 0.00 61.69 59.62 2rqy s THR 70 Cb 0.12 -1.86 0.17 0.00 -1.51 0.00 0.00 72.50 69.42 2rqy s THR 70 CO 0.86 0.58 1.54 0.47 -2.21 0.00 0.00 174.62 175.86 2rqy n ASP 71 N 2.59 0.31 0.10 8.08 8.00 -1.26 -1.83 116.55 132.54 2rqy n ASP 71 Ca -0.17 0.58 0.07 0.00 0.71 0.00 0.00 54.79 55.99 2rqy n ASP 71 Cb 0.52 -0.65 -0.01 0.00 -0.02 0.00 0.00 41.12 40.96 2rqy n ASP 71 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2rqy h ASP 72 N 0.00 0.00 0.00 -2.24 5.19 -1.97 -3.28 116.42 114.11 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 0.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2rqy h ASP 72 CO 0.00 0.22 0.00 0.00 -3.12 0.00 0.00 179.24 176.34 2rqy n ALA 73 N -2.24 0.00 0.00 3.45 0.00 -0.76 -4.88 120.51 116.08 2rqy n ALA 73 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2rqy n ALA 73 Cb 0.65 0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.18 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 -0.70 0.00 0.00 0.00 0.00 -1.26 -5.01 120.51 113.54 2rqy n ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2rqy n ALA 74 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 -3.06 0.00 5.66 -1.26 -5.05 114.28 110.58 2rqy n THR 75 Ca 0.00 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.82 2rqy n THR 75 Cb 0.00 -0.17 0.04 0.00 -1.55 0.00 0.00 70.33 68.65 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 -1.22 -4.77 -3.35 1.09 4.81 -1.24 -4.99 118.16 108.49 2rqy n LYS 76 Ca 0.00 0.66 0.02 0.00 -0.87 0.00 0.00 58.31 58.13 2rqy n LYS 76 Cb 0.11 -5.08 -0.04 0.00 0.02 0.00 0.00 35.03 30.03 2rqy n LYS 76 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 2rqy s ILE 77 N -3.12 -0.27 -0.85 3.15 1.10 -1.26 -4.91 121.20 115.04 2rqy s ILE 77 Ca 0.33 0.00 0.25 0.00 -0.51 0.00 0.00 60.65 60.71 2rqy s ILE 77 Cb -0.14 -1.00 0.02 0.00 0.15 0.00 0.00 42.46 41.48 2rqy s ILE 77 CO 0.40 0.00 1.37 0.00 -2.11 0.00 0.00 174.94 174.60 2rqy n ILE 78 N 4.60 0.13 0.07 2.00 3.06 -1.26 -4.00 119.36 123.97 2rqy n ILE 78 Ca -0.09 -0.11 0.21 0.00 -2.50 0.00 0.00 62.75 60.25 2rqy n ILE 78 Cb 0.54 0.09 0.74 0.00 0.54 0.00 0.00 39.64 41.55 2rqy n ILE 78 CO 0.00 0.00 0.00 -1.13 -2.50 0.00 0.00 176.55 172.92 2rqy h ASN 79 N 0.00 0.00 -0.06 9.51 -1.24 -1.95 0.27 115.58 122.11 2rqy h ASN 79 Ca 0.00 0.00 0.02 0.00 0.71 0.00 0.00 56.30 57.03 2rqy h ASN 79 Cb 0.60 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.65 2rqy h ASN 79 CO 0.00 0.00 0.06 -0.33 -1.29 0.00 0.00 177.43 175.87 2rqy h GLU 80 N 0.00 0.00 -0.11 6.67 5.08 -1.82 0.31 114.58 124.71 2rqy h GLU 80 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2rqy h GLU 80 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2rqy h GLU 80 CO -0.00 0.00 0.00 1.55 -1.00 0.00 0.00 179.01 179.56 2rqy n VAL 81 N -3.90 1.08 -0.02 3.13 3.14 0.90 -4.59 118.33 118.06 2rqy n VAL 81 Ca -0.01 -1.09 -0.04 0.00 -2.96 0.00 0.00 64.34 60.24 2rqy n VAL 81 Cb 0.16 0.44 -0.01 0.00 -1.06 0.00 0.00 33.84 33.37 2rqy n VAL 81 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2rqy n SER 82 N -0.25 1.02 0.32 6.55 2.88 -0.42 -4.21 113.62 119.50 2rqy n SER 82 Ca 0.05 0.03 -0.18 0.00 -1.33 0.00 0.00 58.87 57.44 2rqy n SER 82 Cb 0.34 -0.10 -0.10 0.00 -0.75 0.00 0.00 64.21 63.60 2rqy n SER 82 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2rqy h LYS 83 N -0.11 -1.00 -0.32 -1.46 1.79 -0.71 0.24 116.57 114.99 2rqy h LYS 83 Ca -0.10 0.07 -0.15 0.00 -2.18 0.00 0.00 60.65 58.29 2rqy h LYS 83 Cb 1.10 0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 31.97 2rqy h LYS 83 CO -0.05 -0.67 -0.40 -1.00 -1.08 0.00 0.00 179.45 176.25 2rqy h PRO 84 N -1.04 0.78 0.00 3.15 0.13 -1.81 -2.81 132.00 130.39 2rqy h PRO 84 Ca -0.07 -0.41 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2rqy h PRO 84 Cb 0.89 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2rqy h PRO 84 CO -0.03 1.04 0.00 -0.11 -0.23 0.00 0.00 178.00 178.66 2rqy n LEU 85 N -4.04 0.63 -0.04 1.56 7.94 -1.17 -1.84 117.00 120.04 2rqy n LEU 85 Ca -0.02 0.66 -0.12 0.00 -1.11 0.00 0.00 56.01 55.42 2rqy n LEU 85 Cb 0.54 -0.57 -0.10 0.00 0.53 0.00 0.00 43.42 43.82 2rqy n LEU 85 CO 0.47 -0.54 0.39 0.00 -1.11 0.00 0.00 177.39 176.60 2rqy h ALA 86 N 2.28 -0.03 0.14 1.96 0.00 -0.25 -3.38 119.26 119.98 2rqy h ALA 86 Ca 0.00 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 2rqy h ALA 86 Cb 0.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2rqy h ALA 86 CO 0.00 -0.08 -0.14 0.45 0.00 0.00 0.00 179.25 179.47 2rqy h HIS 87 N -0.90 -0.40 0.00 0.00 3.86 -1.54 -3.39 115.15 112.78 2rqy h HIS 87 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2rqy h HIS 87 Cb 0.74 0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.37 2rqy h HIS 87 CO 0.19 -0.19 0.00 1.58 0.86 0.00 0.00 177.93 180.37 2rqy n HIS 88 N -3.18 0.00 -3.50 2.45 -0.00 -1.21 -5.05 115.22 104.74 2rqy n HIS 88 Ca -0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.36 2rqy n HIS 88 Cb 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 30.05 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 2.95 -0.04 3.57 5.41 -0.77 -4.89 119.36 125.60 2rqy n ILE 89 Ca 0.00 -5.26 -0.13 0.00 1.00 0.00 0.00 62.75 58.36 2rqy n ILE 89 Cb 0.00 -2.20 -0.08 0.00 -0.71 0.00 0.00 39.64 36.65 2rqy n ILE 89 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2rqy h PRO 90 N 5.13 0.25 0.00 0.38 0.13 -1.84 -3.30 132.00 132.75 2rqy h PRO 90 Ca 0.18 -0.13 -0.03 0.00 -0.87 0.00 0.00 66.00 65.15 2rqy h PRO 90 Cb 0.71 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.80 2rqy h PRO 90 CO 0.91 0.66 -0.23 1.55 -0.23 0.00 0.00 178.00 180.67 2rqy n VAL 91 N -4.65 0.00 0.09 1.56 3.14 -1.26 -4.87 118.33 112.34 2rqy n VAL 91 Ca -0.07 -0.07 0.02 0.00 -2.96 0.00 0.00 64.34 61.26 2rqy n VAL 91 Cb 0.33 0.26 -0.03 0.00 -1.06 0.00 0.00 33.84 33.34 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 0.07 0.00 0.00 1.45 4.81 -1.91 -3.33 114.58 115.67 2rqy h GLU 92 Ca -0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2rqy h GLU 92 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2rqy h GLU 92 CO -0.04 0.37 -1.44 1.17 -0.73 0.00 0.00 179.01 178.33 2rqy n LYS 93 N -3.03 0.57 -0.18 1.92 0.00 -1.26 -0.10 118.16 116.07 2rqy n LYS 93 Ca -0.03 -0.10 0.29 0.00 0.00 0.00 0.00 58.31 58.47 2rqy n LYS 93 Cb 0.77 -1.45 0.73 0.00 0.00 0.00 0.00 35.03 35.07 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 0.50 0.00 3.15 1.08 -1.90 -3.02 117.51 117.33 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 0.70 0.53 0.00 0.00 -3.07 0.00 0.00 36.82 34.98 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 0.37 0.01 0.00 4.57 -1.76 0.31 114.58 118.09 2rqy h GLU 96 Ca 0.00 -0.02 -0.24 0.00 -1.18 0.00 0.00 59.36 57.92 2rqy h GLU 96 Cb 0.00 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 2rqy h GLU 96 CO 0.00 0.25 -1.28 -0.22 -1.18 0.00 0.00 179.01 176.58 2rqy h LYS 97 N 0.38 0.02 -0.68 1.92 3.11 -0.69 -3.36 116.57 117.27 2rqy h LYS 97 Ca 0.35 -0.04 0.20 0.00 -2.81 0.00 0.00 60.65 58.35 2rqy h LYS 97 Cb 0.49 0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.71 2rqy h LYS 97 CO -0.37 1.02 0.54 1.25 -2.81 0.00 0.00 179.45 179.08 2rqy h LEU 98 N -0.91 0.00 -1.75 5.20 6.46 -1.47 0.14 115.31 122.97 2rqy h LEU 98 Ca -0.34 0.00 0.16 0.00 -0.12 0.00 0.00 57.88 57.58 2rqy h LEU 98 Cb 1.36 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.25 2rqy h LEU 98 CO -0.18 0.00 0.47 0.11 -0.62 0.00 0.00 178.44 178.23 2rqy h LYS 99 N 0.00 0.23 0.00 1.25 1.57 -0.52 0.43 116.57 119.53 2rqy h LYS 99 Ca 0.32 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2rqy h LYS 99 Cb 1.41 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2rqy h LYS 99 CO -0.00 0.16 0.00 -0.22 -0.57 0.00 0.00 179.45 178.81 2rqy h LYS 100 N 0.24 0.00 0.00 3.15 3.11 -0.94 -2.92 116.57 119.21 2rqy h LYS 100 Ca 0.34 0.00 -0.13 0.00 -2.81 0.00 0.00 60.65 58.05 2rqy h LYS 100 Cb 0.98 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.19 2rqy h LYS 100 CO -0.07 0.00 -1.30 1.17 -2.81 0.00 0.00 179.45 176.44 2rqy n LYS 101 N -2.79 0.19 -3.54 1.90 4.81 0.11 -4.94 118.16 113.91 2rqy n LYS 101 Ca -0.02 0.08 -0.28 0.00 -0.87 0.00 0.00 58.31 57.22 2rqy n LYS 101 Cb 0.08 -0.82 -0.12 0.00 0.02 0.00 0.00 35.03 34.20 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 -5.84 2.75 0.46 3.14 1.01 0.89 -4.95 116.67 114.12 2rqy s ASP 102 Ca -0.12 -2.76 0.31 0.00 0.71 0.00 0.00 52.55 50.70 2rqy s ASP 102 Cb 0.04 -0.67 1.50 0.00 1.01 0.00 0.00 42.92 44.80 2rqy s ASP 102 CO 0.15 -0.23 1.94 -1.28 0.21 0.00 0.00 175.17 175.97 2rqy h SER 103 N 6.31 0.00 0.56 0.27 0.87 -1.69 -1.51 113.55 118.35 2rqy h SER 103 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2rqy h SER 103 Cb 0.92 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 2rqy h SER 103 CO 0.39 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.69 2rqy n GLN 104 N -2.69 0.03 -0.27 2.24 10.64 -1.26 -3.57 117.38 122.51 2rqy n GLN 104 Ca -0.00 0.20 0.04 0.00 -1.83 0.00 0.00 57.00 55.41 2rqy n GLN 104 Cb 0.17 -1.50 0.14 0.00 -0.86 0.00 0.00 30.24 28.19 2rqy n GLN 104 CO 0.00 0.00 0.00 0.97 -1.83 0.00 0.00 177.06 176.20 2rqy h ILE 105 N 0.00 0.28 0.00 -0.39 2.10 -1.66 0.64 117.51 118.48 2rqy h ILE 105 Ca 0.00 -0.02 -0.10 0.00 1.08 0.00 0.00 64.86 65.82 2rqy h ILE 105 Cb 0.28 0.22 -0.01 0.00 -1.09 0.00 0.00 36.82 36.21 2rqy h ILE 105 CO 0.00 0.01 -0.68 0.00 -1.08 0.00 0.00 178.15 176.40 2rqy h GLU 107 N -1.00 -0.45 -2.74 0.00 5.08 -1.64 -3.48 114.58 110.35 2rqy h GLU 107 Ca -0.15 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2rqy h GLU 107 Cb 0.85 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2rqy h GLU 107 CO -0.09 -0.30 -0.52 1.28 -1.00 0.00 0.00 179.01 178.38 2rqy n LEU 108 N -4.20 -4.24 0.00 1.33 4.77 0.22 -4.52 117.00 110.36 2rqy n LEU 108 Ca -0.05 1.78 0.00 0.00 -0.03 0.00 0.00 56.01 57.70 2rqy n LEU 108 Cb 0.25 -2.05 0.00 0.00 -2.33 0.00 0.00 43.42 39.28 2rqy n LEU 108 CO 0.10 -0.88 0.00 0.29 -1.33 0.00 0.00 177.39 175.58 2rqy n LYS 109 N 0.91 0.00 -1.00 3.23 5.02 -1.26 -2.96 118.16 122.10 2rqy n LYS 109 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 2rqy n LYS 109 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 2rqy n LYS 109 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2rqy n TYR 110 N -0.28 1.80 -2.95 2.13 4.19 -1.26 -4.90 117.16 115.90 2rqy n TYR 110 Ca 0.00 -2.46 -0.41 0.00 3.31 0.00 0.00 57.90 58.34 2rqy n TYR 110 Cb 0.00 -2.04 -0.04 0.00 0.49 0.00 0.00 39.34 37.75 2rqy n TYR 110 CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 2rqy s ASP 111 N 2.79 6.98 -0.40 2.98 1.11 -1.15 -4.97 116.67 124.01 2rqy s ASP 111 Ca 0.54 1.19 -0.29 0.00 0.18 0.00 0.00 52.55 54.16 2rqy s ASP 111 Cb 0.14 -2.44 -0.09 0.00 1.07 0.00 0.00 42.92 41.61 2rqy s ASP 111 CO -0.04 -0.28 2.32 0.29 1.18 0.00 0.00 175.17 178.64 2rqy n LYS 112 N 4.60 1.28 -2.36 8.23 4.76 -1.26 -4.84 118.16 128.56 2rqy n LYS 112 Ca 0.02 0.25 -0.36 0.00 -2.87 0.00 0.00 58.31 55.35 2rqy n LYS 112 Cb 0.50 -2.98 -0.03 0.00 -1.84 0.00 0.00 35.03 30.68 2rqy n LYS 112 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2rqy s GLN 113 N 7.17 3.32 0.03 1.97 -2.07 -1.26 -3.82 119.66 124.99 2rqy s GLN 113 Ca 1.05 -1.48 0.07 0.00 -1.82 0.00 0.00 55.36 53.18 2rqy s GLN 113 Cb -0.49 -5.38 -0.03 0.00 -1.09 0.00 0.00 33.01 26.02 2rqy s GLN 113 CO 0.37 -2.92 -0.20 -1.50 -1.32 0.00 0.00 175.29 169.71 2rqy s ILE 114 N 7.07 2.62 -0.88 3.63 2.07 -1.26 -5.08 121.20 129.38 2rqy s ILE 114 Ca 0.59 -1.18 -0.00 0.00 -1.41 0.00 0.00 60.65 58.65 2rqy s ILE 114 Cb 0.01 -2.07 0.23 0.00 0.13 0.00 0.00 42.46 40.77 2rqy s ILE 114 CO 0.07 0.39 0.85 0.47 -1.91 0.00 0.00 174.94 174.81 2rqy n ASP 115 N 1.73 4.36 0.00 4.50 8.00 -1.26 -4.83 116.55 129.05 2rqy n ASP 115 Ca -0.16 -3.22 0.00 0.00 0.71 0.00 0.00 54.79 52.12 2rqy n ASP 115 Cb 0.52 -1.01 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 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 1.94 0.00 0.00 0.64 7.94 -1.26 -5.17 117.00 121.09 2rqy n LEU 116 Ca 0.23 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 55.15 2rqy n LEU 116 Cb 0.37 -0.02 0.00 0.00 0.53 0.00 0.00 43.42 44.30 2rqy n LEU 116 CO 0.41 -0.19 0.30 -0.24 -1.11 0.00 0.00 177.39 176.56 2rqy n SER 117 N -1.61 -0.25 0.00 1.96 2.88 -1.26 -5.14 113.62 110.19 2rqy n SER 117 Ca 0.00 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 2rqy n SER 117 Cb 0.00 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 2rqy n SER 117 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2rqy n THR 118 N -0.25 0.00 -3.85 2.46 5.66 -1.26 -4.18 114.28 112.86 2rqy n THR 118 Ca 0.02 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.66 2rqy n THR 118 Cb 0.14 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 68.79 2rqy n THR 118 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2rqy s VAL 119 N 0.00 3.46 -0.01 1.08 -7.23 -1.26 -4.51 120.40 111.92 2rqy s VAL 119 Ca 0.00 -0.85 -0.02 0.00 -1.81 0.00 0.00 61.98 59.30 2rqy s VAL 119 Cb 0.00 -2.77 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 2rqy s VAL 119 CO 0.00 0.13 -0.04 0.47 -0.31 0.00 0.00 175.10 175.35 2rqy n ASP 120 N 4.77 0.46 0.17 4.85 9.92 -1.26 -4.26 116.55 131.20 2rqy n ASP 120 Ca -0.15 0.07 -0.14 0.00 -0.53 0.00 0.00 54.79 54.04 2rqy n ASP 120 Cb 0.47 -0.17 -0.08 0.00 -0.64 0.00 0.00 41.12 40.71 2rqy n ASP 120 CO 0.00 0.00 0.00 0.17 0.13 0.00 0.00 177.20 177.50 2rqy h LEU 121 N -0.12 -0.36 -1.11 0.64 8.10 -1.83 -2.82 115.31 117.81 2rqy h LEU 121 Ca -0.07 -0.13 -0.05 0.00 0.11 0.00 0.00 57.88 57.74 2rqy h LEU 121 Cb 0.86 0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 41.16 2rqy h LEU 121 CO -0.04 -0.06 -0.23 0.50 -4.11 0.00 0.00 178.44 174.50 2rqy h LYS 122 N -0.67 0.00 -1.10 0.17 3.11 -1.86 -2.96 116.57 113.26 2rqy h LYS 122 Ca -0.04 0.00 -0.46 0.00 -2.81 0.00 0.00 60.65 57.34 2rqy h LYS 122 Cb 0.47 0.00 -0.23 0.00 -1.00 0.00 0.00 32.23 31.46 2rqy h LYS 122 CO 0.07 0.23 0.59 1.17 -2.81 0.00 0.00 179.45 178.70 2rqy n LYS 123 N -3.40 2.13 -2.05 1.90 4.81 -1.14 -4.88 118.16 115.52 2rqy n LYS 123 Ca 0.00 -2.44 -0.27 0.00 -0.87 0.00 0.00 58.31 54.73 2rqy n LYS 123 Cb 0.43 -1.96 -0.06 0.00 0.02 0.00 0.00 35.03 33.47 2rqy n LYS 123 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2rqy s LEU 124 N -2.75 3.07 -0.30 3.14 2.96 -1.08 -3.14 118.68 120.58 2rqy s LEU 124 Ca 0.47 -1.36 -0.14 0.00 -0.22 0.00 0.00 54.13 52.88 2rqy s LEU 124 Cb 0.38 -2.58 0.19 0.00 0.50 0.00 0.00 46.19 44.68 2rqy s LEU 124 CO 0.04 -3.02 1.15 -0.60 -1.32 0.00 0.00 176.35 172.60 2rqy s ARG 125 N 6.67 0.03 0.00 1.98 3.52 -1.26 -4.97 118.95 124.92 2rqy s ARG 125 Ca 0.69 -0.00 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 2rqy s ARG 125 Cb -0.03 0.01 0.00 0.00 -1.56 0.00 0.00 34.95 33.37 2rqy s ARG 125 CO 0.09 -0.04 0.00 0.28 -0.81 0.00 0.00 175.30 174.82 2rqy n VAL 126 N 3.92 0.00 -0.21 7.11 0.31 -1.26 -4.32 118.33 123.87 2rqy n VAL 126 Ca 0.06 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.41 2rqy n VAL 126 Cb 0.63 0.00 0.13 0.00 -0.91 0.00 0.00 33.84 33.69 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 0.28 -0.19 5.55 6.56 -1.96 0.50 116.57 127.31 2rqy h LYS 127 Ca 0.00 -0.02 0.06 0.00 -1.06 0.00 0.00 60.65 59.63 2rqy h LYS 127 Cb 0.00 -0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 31.59 2rqy h LYS 127 CO 0.00 0.19 0.45 1.05 -2.06 0.00 0.00 179.45 179.08 2rqy h GLU 128 N 0.29 0.00 0.00 3.15 4.11 -1.73 0.21 114.58 120.61 2rqy h GLU 128 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.77 2rqy h GLU 128 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2rqy h GLU 128 CO -0.42 0.00 -0.59 -0.11 0.07 0.00 0.00 179.01 177.96 2rqy n LEU 129 N -3.19 1.29 0.44 3.06 7.94 0.11 -4.19 117.00 122.47 2rqy n LEU 129 Ca 0.03 0.21 -0.18 0.00 -1.11 0.00 0.00 56.01 54.96 2rqy n LEU 129 Cb 0.55 -0.59 -0.09 0.00 0.53 0.00 0.00 43.42 43.82 2rqy n LEU 129 CO 0.18 -0.40 0.53 0.50 -1.11 0.00 0.00 177.39 177.09 2rqy h LYS 130 N -0.59 -1.11 -0.80 1.96 3.64 -0.13 0.33 116.57 119.88 2rqy h LYS 130 Ca 0.00 0.08 0.23 0.00 -1.27 0.00 0.00 60.65 59.69 2rqy h LYS 130 Cb 0.59 0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.63 2rqy h LYS 130 CO 0.00 -0.74 0.58 -0.22 -2.27 0.00 0.00 179.45 176.80 2rqy h LYS 131 N -1.15 0.00 0.06 1.90 1.63 -0.74 0.33 116.57 118.60 2rqy h LYS 131 Ca -0.11 0.00 -0.24 0.00 -0.85 0.00 0.00 60.65 59.44 2rqy h LYS 131 Cb 0.90 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.51 2rqy h LYS 131 CO 0.16 0.00 -1.15 0.82 -3.45 0.00 0.00 179.45 175.83 2rqy h ILE 132 N 0.00 1.58 -0.04 2.00 5.03 -1.10 -3.23 117.51 121.75 2rqy h ILE 132 Ca 0.38 -3.23 -0.15 0.00 -0.12 0.00 0.00 64.86 61.74 2rqy h ILE 132 Cb 1.54 2.88 -0.01 0.00 -3.03 0.00 0.00 36.82 38.20 2rqy h ILE 132 CO -0.00 0.92 -0.67 0.25 -0.68 0.00 0.00 178.15 177.97 2rqy h LEU 133 N 0.03 0.22 -1.30 1.44 5.85 0.34 -2.98 115.31 118.92 2rqy h LEU 133 Ca -0.08 -0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.45 2rqy h LEU 133 Cb 1.87 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.83 2rqy h LEU 133 CO 0.16 0.82 -0.26 -0.78 -0.34 0.00 0.00 178.44 178.04 2rqy h ASP 134 N 0.13 0.00 -0.36 1.25 3.58 -1.12 -2.63 116.42 117.27 2rqy h ASP 134 Ca -0.01 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.28 2rqy h ASP 134 Cb 1.19 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.24 2rqy h ASP 134 CO 0.10 0.26 -0.38 -0.78 -2.88 0.00 0.00 179.24 175.56 2rqy h ASP 135 N 0.00 0.95 0.76 2.28 3.58 -1.54 -3.05 116.42 119.40 2rqy h ASP 135 Ca -0.00 -0.47 -0.11 0.00 0.42 0.00 0.00 57.03 56.86 2rqy h ASP 135 Cb 0.67 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.44 2rqy h ASP 135 CO 0.03 1.23 -0.52 -0.50 -2.88 0.00 0.00 179.24 176.60 2rqy h TRP 136 N 0.69 0.00 0.00 0.28 -0.00 -1.53 -3.48 115.95 111.90 2rqy h TRP 136 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.94 2rqy h TRP 136 Cb 0.97 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.13 2rqy h TRP 136 CO 0.07 0.52 0.00 0.41 -0.00 0.00 0.00 178.44 179.44 2rqy n GLY 137 N 0.32 1.61 3.19 1.49 0.00 -1.01 -5.14 105.19 105.65 2rqy n GLY 137 Ca -0.01 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 2rqy n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rqy s GLU 138 N -0.58 0.51 0.09 1.61 -6.30 -1.25 -4.97 118.70 107.82 2rqy s GLU 138 Ca 0.00 -0.01 -0.27 0.00 -2.50 0.00 0.00 54.97 52.19 2rqy s GLU 138 Cb 0.00 0.23 0.08 0.00 0.00 0.00 0.00 34.13 34.44 2rqy s GLU 138 CO 0.00 -0.12 0.96 0.00 0.02 0.00 0.00 175.26 176.12 2rqy s MET 139 N -0.79 1.02 -0.05 4.30 0.23 -1.26 -4.89 119.30 117.85 2rqy s MET 139 Ca -0.09 -0.51 -0.20 0.00 -1.03 0.00 0.00 55.69 53.86 2rqy s MET 139 Cb -0.04 0.38 0.06 0.00 -1.53 0.00 0.00 34.83 33.70 2rqy s MET 139 CO 0.02 -0.46 0.87 0.00 -2.03 0.00 0.00 175.02 173.43 2rqy h LYS 141 N 0.00 0.00 0.00 0.00 1.57 -2.10 -3.43 116.57 112.61 2rqy h LYS 141 Ca -0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2rqy h LYS 141 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 2rqy h LYS 141 CO 0.19 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.66 2rqy n GLY 142 N -0.43 -0.63 3.34 3.86 0.00 -1.26 -5.17 105.19 104.89 2rqy n GLY 142 Ca -0.01 0.69 -0.29 0.00 0.00 0.00 0.00 46.02 46.41 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 -0.88 -3.85 -0.30 0.00 0.00 -1.26 -5.07 121.76 110.40 2rqy s ALA 144 Ca 0.11 1.33 0.01 0.00 0.00 0.00 0.00 51.96 53.41 2rqy s ALA 144 Cb -0.10 -2.79 0.19 0.00 0.00 0.00 0.00 23.12 20.42 2rqy s ALA 144 CO 0.03 -2.04 0.61 -1.21 0.00 0.00 0.00 175.76 173.16 2rqy s GLU 145 N 2.94 0.55 0.56 0.00 2.02 -1.26 -5.01 118.70 118.51 2rqy s GLU 145 Ca 0.25 0.85 0.28 0.00 0.02 0.00 0.00 54.97 56.36 2rqy s GLU 145 Cb -0.03 0.45 1.48 0.00 0.10 0.00 0.00 34.13 36.14 2rqy s GLU 145 CO -0.23 -0.74 1.97 -0.22 0.02 0.00 0.00 175.26 176.07 2rqy h LYS 146 N 7.99 0.00 0.00 1.61 3.64 -2.00 0.27 116.57 128.08 2rqy h LYS 146 Ca -0.16 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.03 2rqy h LYS 146 Cb 1.17 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 2rqy h LYS 146 CO 0.21 0.00 -1.17 0.66 -2.27 0.00 0.00 179.45 176.88 2rqy h SER 147 N 0.00 0.00 -0.15 4.20 4.64 -2.02 -3.33 113.55 116.90 2rqy h SER 147 Ca 0.22 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.36 2rqy h SER 147 Cb 1.03 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2rqy h SER 147 CO -0.00 0.75 -0.60 -0.78 -0.87 0.00 0.00 176.83 175.33 2rqy h ASP 148 N 0.00 0.79 -0.08 4.97 3.58 -0.93 -3.12 116.42 121.63 2rqy h ASP 148 Ca -0.12 -0.62 0.02 0.00 0.42 0.00 0.00 57.03 56.74 2rqy h ASP 148 Cb 1.67 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 42.49 2rqy h ASP 148 CO 0.08 1.27 0.06 1.88 -2.88 0.00 0.00 179.24 179.65 2rqy h TYR 149 N 0.35 0.00 -0.10 0.28 0.05 -1.31 -2.44 116.97 113.80 2rqy h TYR 149 Ca -0.03 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.79 2rqy h TYR 149 Cb 1.23 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.91 2rqy h TYR 149 CO 0.10 0.00 -0.31 0.82 -1.05 0.00 0.00 178.16 177.71 2rqy h ILE 150 N 0.00 0.30 -0.32 -2.88 1.08 -1.64 0.12 117.51 114.16 2rqy h ILE 150 Ca 0.04 0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 64.33 2rqy h ILE 150 Cb 0.16 0.30 -0.00 0.00 -3.07 0.00 0.00 36.82 34.20 2rqy h ILE 150 CO -0.00 0.00 -0.50 -0.09 -0.69 0.00 0.00 178.15 176.87 2rqy h ARG 151 N -0.40 0.90 0.35 2.37 2.43 -1.63 -1.52 114.38 116.87 2rqy h ARG 151 Ca 0.09 -0.54 -0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2rqy h ARG 151 Cb 0.54 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2rqy h ARG 151 CO -0.33 1.18 -0.50 0.87 -1.51 0.00 0.00 179.97 179.68 2rqy h LYS 152 N 0.70 -0.86 -0.15 0.20 1.79 -0.98 -2.15 116.57 115.12 2rqy h LYS 152 Ca 0.03 0.06 -0.07 0.00 -2.18 0.00 0.00 60.65 58.49 2rqy h LYS 152 Cb 1.10 0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.93 2rqy h LYS 152 CO 0.11 -0.57 -0.20 0.82 -1.08 0.00 0.00 179.45 178.53 2rqy h ILE 153 N -0.89 1.22 -0.89 1.86 1.08 -0.86 -2.70 117.51 116.33 2rqy h ILE 153 Ca -0.03 -0.99 0.15 0.00 -0.39 0.00 0.00 64.86 63.59 2rqy h ILE 153 Cb 0.82 1.33 -0.07 0.00 -3.07 0.00 0.00 36.82 35.82 2rqy h ILE 153 CO -0.15 0.30 0.58 0.78 -0.69 0.00 0.00 178.15 178.97 2rqy h ASN 154 N 0.24 0.65 1.04 1.72 -0.26 -0.67 0.36 115.58 118.66 2rqy h ASN 154 Ca 0.04 0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.77 2rqy h ASN 154 Cb 0.49 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 2rqy h ASN 154 CO 0.03 0.32 -0.25 -0.08 -1.06 0.00 0.00 177.43 176.39 2rqy h GLU 155 N 0.68 0.00 -0.31 0.81 4.22 -1.06 -2.94 114.58 115.98 2rqy h GLU 155 Ca 0.45 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.88 2rqy h GLU 155 Cb 0.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 2rqy h GLU 155 CO -0.21 0.25 0.01 1.28 -2.18 0.00 0.00 179.01 178.16 2rqy n LEU 156 N -3.36 4.15 0.51 1.64 7.99 0.90 -4.70 117.00 124.12 2rqy n LEU 156 Ca 0.01 -3.06 -0.20 0.00 -0.01 0.00 0.00 56.01 52.75 2rqy n LEU 156 Cb 0.47 -0.57 -0.09 0.00 -0.11 0.00 0.00 43.42 43.12 2rqy n LEU 156 CO 0.34 0.70 0.54 0.24 -1.51 0.00 0.00 177.39 177.70 2rqy h MET 157 N 2.00 -1.25 0.00 3.23 2.86 -0.36 -1.56 114.93 119.86 2rqy h MET 157 Ca 0.02 0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2rqy h MET 157 Cb 1.54 0.28 0.00 0.00 0.06 0.00 0.00 31.60 33.48 2rqy h MET 157 CO 0.27 -0.83 0.00 -0.35 1.06 0.00 0.00 176.91 177.06 2rqy n PRO 158 N -5.47 0.07 -0.07 -0.22 -0.04 -1.25 -0.12 135.00 127.90 2rqy n PRO 158 Ca -0.16 0.22 -0.07 0.00 -0.04 0.00 0.00 63.50 63.45 2rqy n PRO 158 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 2rqy n PRO 158 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2rqy h LYS 159 N 0.00 0.00 -0.43 0.54 1.63 -1.77 -3.31 116.57 113.22 2rqy h LYS 159 Ca 0.00 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 2rqy h LYS 159 Cb 0.21 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 31.77 2rqy h LYS 159 CO 0.00 0.37 0.07 0.66 -3.45 0.00 0.00 179.45 177.10 2rqy n TYR 160 N -4.66 1.45 -2.66 1.91 4.01 -0.62 -4.68 117.16 111.91 2rqy n TYR 160 Ca -0.08 -1.17 -0.04 0.00 -0.16 0.00 0.00 57.90 56.45 2rqy n TYR 160 Cb 0.26 -0.48 0.09 0.00 -0.31 0.00 0.00 39.34 38.90 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 -0.57 -3.69 -2.06 -0.72 0.00 0.83 -5.02 120.51 109.28 2rqy n ALA 161 Ca 0.31 -0.22 -0.27 0.00 0.00 0.00 0.00 53.44 53.25 2rqy n ALA 161 Cb 1.09 -3.40 -0.06 0.00 0.00 0.00 0.00 19.45 17.08 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 2.52 -0.03 0.00 0.04 -1.22 -3.88 135.00 132.47 2rqy s PRO 162 Ca 0.24 -0.78 0.04 0.00 0.04 0.00 0.00 61.00 60.54 2rqy s PRO 162 Cb 0.23 -5.16 -0.06 0.00 0.04 0.00 0.00 34.50 29.54 2rqy s PRO 162 CO -0.10 -3.72 0.05 1.63 0.04 0.00 0.00 177.00 174.89 2rqy n LYS 163 N 8.53 1.95 0.15 4.56 5.02 -1.26 -4.49 118.16 132.63 2rqy n LYS 163 Ca 0.43 -0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.63 2rqy n LYS 163 Cb 0.47 -1.11 -0.03 0.00 -0.02 0.00 0.00 35.03 34.34 2rqy n LYS 163 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rqy h ALA 164 N 0.29 -0.61 -0.39 7.82 0.00 -1.92 0.24 119.26 124.69 2rqy h ALA 164 Ca -0.06 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.87 2rqy h ALA 164 Cb 0.80 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2rqy h ALA 164 CO 0.00 -0.58 0.36 0.00 0.00 0.00 0.00 179.25 179.04 2rqy h ALA 165 N -1.49 2.14 0.07 0.00 0.00 -1.90 0.31 119.26 118.39 2rqy h ALA 165 Ca -0.04 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.57 2rqy h ALA 165 Cb 0.32 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2rqy h ALA 165 CO 0.07 -0.56 -1.47 1.03 0.00 0.00 0.00 179.25 178.31 2rqy h SER 166 N 0.00 0.22 -0.71 0.00 0.87 -1.78 0.14 113.55 112.29 2rqy h SER 166 Ca 0.18 -0.31 -0.27 0.00 -1.23 0.00 0.00 61.79 60.16 2rqy h SER 166 Cb 0.91 -0.07 -0.16 0.00 -0.44 0.00 0.00 62.40 62.64 2rqy h SER 166 CO -0.00 1.26 0.29 0.00 -0.53 0.00 0.00 176.83 177.86 2rqy n ALA 167 N -2.58 4.67 -3.22 6.23 0.00 0.84 -4.17 120.51 122.27 2rqy n ALA 167 Ca -0.14 -2.60 -0.24 0.00 0.00 0.00 0.00 53.44 50.46 2rqy n ALA 167 Cb 1.02 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 2rqy n ALA 167 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2rqy n ARG 168 N -0.58 1.13 -1.81 0.00 0.63 0.84 -4.89 116.66 111.98 2rqy n ARG 168 Ca 0.43 -3.53 -0.18 0.00 -0.92 0.00 0.00 57.85 53.64 2rqy n ARG 168 Cb 1.37 -1.49 -0.06 0.00 0.45 0.00 0.00 32.46 32.74 2rqy n ARG 168 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2rqy n THR 169 N 1.09 -0.27 -3.06 5.15 -1.04 -1.26 -3.47 114.28 111.42 2rqy n THR 169 Ca 0.23 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 62.10 2rqy n THR 169 Cb 0.53 -2.03 0.02 0.00 -1.82 0.00 0.00 70.33 67.02 2rqy n THR 169 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2rqy n ASP 170 N -1.37 -7.10 0.00 8.00 2.03 -1.20 -5.08 116.55 111.83 2rqy n ASP 170 Ca -0.20 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.59 2rqy n ASP 170 Cb 0.63 -3.86 0.00 0.00 -0.72 0.00 0.00 41.12 37.17 2rqy n ASP 170 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17