#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 -0.03 -0.16 3.17 -0.00 -1.26 -5.19 115.29 111.82 2rqy s HIS 2 Ca 0.00 -0.32 -0.30 0.00 -0.00 0.00 0.00 55.06 54.44 2rqy s HIS 2 Cb 0.00 0.67 0.13 0.00 -0.00 0.00 0.00 32.58 33.37 2rqy s HIS 2 CO 0.00 -0.87 0.99 -3.38 -0.00 0.00 0.00 174.74 171.48 2rqy s HIS 3 N -2.74 -0.38 0.07 0.38 0.00 -1.26 -5.19 115.29 106.17 2rqy s HIS 3 Ca 0.16 0.67 -0.06 0.00 -3.00 0.00 0.00 55.06 52.84 2rqy s HIS 3 Cb -0.02 0.44 -0.01 0.00 -4.00 0.00 0.00 32.58 28.99 2rqy s HIS 3 CO 0.04 -0.34 0.11 -3.38 -1.00 0.00 0.00 174.74 170.16 2rqy s HIS 4 N -1.04 0.27 0.38 0.38 -0.00 -1.26 -5.18 115.29 108.84 2rqy s HIS 4 Ca -0.02 -0.70 0.06 0.00 -0.00 0.00 0.00 55.06 54.40 2rqy s HIS 4 Cb -0.01 -0.17 -0.02 0.00 -0.00 0.00 0.00 32.58 32.38 2rqy s HIS 4 CO 0.01 -0.46 0.22 -1.01 -0.00 0.00 0.00 174.74 173.50 2rqy s HIS 5 N -3.60 1.78 0.32 0.38 4.02 -1.26 -5.16 115.29 111.77 2rqy s HIS 5 Ca 0.03 -1.52 -0.05 0.00 1.02 0.00 0.00 55.06 54.55 2rqy s HIS 5 Cb 0.04 -0.93 -0.05 0.00 -1.02 0.00 0.00 32.58 30.62 2rqy s HIS 5 CO -0.09 -0.62 0.60 -1.58 1.02 0.00 0.00 174.74 174.06 2rqy s HIS 6 N -3.29 3.48 -0.19 1.40 5.65 -1.26 -5.10 115.29 115.99 2rqy s HIS 6 Ca 0.31 0.69 -0.07 0.00 0.25 0.00 0.00 55.06 56.24 2rqy s HIS 6 Cb 0.02 -2.15 0.08 0.00 -1.18 0.00 0.00 32.58 29.35 2rqy s HIS 6 CO 0.22 0.10 0.41 -1.01 -0.65 0.00 0.00 174.74 173.81 2rqy s HIS 7 N -2.18 -0.73 0.76 3.88 4.02 -1.26 -5.16 115.29 114.62 2rqy s HIS 7 Ca 0.45 1.43 -0.10 0.00 1.02 0.00 0.00 55.06 57.86 2rqy s HIS 7 Cb -0.11 0.27 0.06 0.00 -1.02 0.00 0.00 32.58 31.79 2rqy s HIS 7 CO 0.31 -0.44 1.12 0.96 1.02 0.00 0.00 174.74 177.72 2rqy s ILE 8 N 2.29 2.32 0.19 0.60 -4.36 -1.26 -4.93 121.20 116.05 2rqy s ILE 8 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.36 2rqy s ILE 8 Cb -0.11 -3.08 0.00 0.00 1.25 0.00 0.00 42.46 40.52 2rqy s ILE 8 CO -0.13 -0.10 0.00 1.21 0.24 0.00 0.00 174.94 176.16 2rqy n GLU 9 N -3.16 -1.64 0.00 0.37 2.13 -1.26 -4.90 120.64 112.19 2rqy n GLU 9 Ca 0.08 1.08 0.00 0.00 0.66 0.00 0.00 57.16 58.97 2rqy n GLU 9 Cb 0.60 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.32 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 -2.42 3.01 2.17 8.31 0.00 -1.26 -4.69 105.19 110.30 2rqy n GLY 10 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 2rqy n GLY 10 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2rqy n ARG 11 N -0.69 0.93 -0.39 1.61 0.63 -1.26 -5.10 116.66 112.39 2rqy n ARG 11 Ca 0.00 -2.27 -0.30 0.00 -0.92 0.00 0.00 57.85 54.37 2rqy n ARG 11 Cb 0.00 -0.45 0.28 0.00 0.45 0.00 0.00 32.46 32.74 2rqy n ARG 11 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 2rqy s HIS 12 N -1.41 0.09 0.17 -0.14 2.46 -1.26 -4.90 115.29 110.30 2rqy s HIS 12 Ca 0.21 0.81 -0.15 0.00 0.47 0.00 0.00 55.06 56.40 2rqy s HIS 12 Cb 0.32 -2.94 0.13 0.00 -0.13 0.00 0.00 32.58 29.95 2rqy s HIS 12 CO -0.09 -4.65 1.70 0.52 -2.47 0.00 0.00 174.74 169.75 2rqy h MET 13 N -3.19 0.12 -6.31 2.88 2.86 -2.02 -3.37 114.93 105.90 2rqy h MET 13 Ca -0.51 -0.01 -0.54 0.00 -2.06 0.00 0.00 59.70 56.58 2rqy h MET 13 Cb 1.34 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.93 2rqy h MET 13 CO 0.37 0.08 1.18 -0.51 1.06 0.00 0.00 176.91 179.08 2rqy s LEU 14 N -10.50 3.41 0.38 1.22 1.43 -1.26 -4.99 118.68 108.36 2rqy s LEU 14 Ca -0.13 0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 53.48 2rqy s LEU 14 Cb 0.14 -3.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 2rqy s LEU 14 CO 0.71 -1.81 0.59 -0.13 0.23 0.00 0.00 176.35 175.95 2rqy s ARG 15 N 5.77 3.44 0.51 1.70 0.52 -1.26 -4.99 118.95 124.64 2rqy s ARG 15 Ca 0.61 -0.28 0.29 0.00 -0.52 0.00 0.00 55.73 55.83 2rqy s ARG 15 Cb -0.13 -2.61 1.23 0.00 0.52 0.00 0.00 34.95 33.95 2rqy s ARG 15 CO 0.26 0.05 1.94 -1.00 0.02 0.00 0.00 175.30 176.58 2rqy h PRO 16 N 0.64 0.00 -4.47 3.54 0.13 -1.95 -3.37 132.00 126.52 2rqy h PRO 16 Ca -0.49 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.93 2rqy h PRO 16 Cb 1.22 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.27 2rqy h PRO 16 CO 0.61 0.11 2.58 0.41 -0.23 0.00 0.00 178.00 181.47 2rqy n GLY 17 N -0.04 3.91 3.57 1.56 0.00 -1.26 -4.85 105.19 108.08 2rqy n GLY 17 Ca -0.00 -1.67 -0.07 0.00 0.00 0.00 0.00 46.02 44.28 2rqy n GLY 17 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2rqy s ASP 18 N 3.07 -0.25 0.31 1.61 -1.08 -1.26 -5.19 116.67 113.89 2rqy s ASP 18 Ca 0.47 0.12 0.00 0.00 -0.52 0.00 0.00 52.55 52.63 2rqy s ASP 18 Cb 0.09 0.23 -0.00 0.00 -1.46 0.00 0.00 42.92 41.79 2rqy s ASP 18 CO -0.02 -0.33 0.01 0.00 0.52 0.00 0.00 175.17 175.34 2rqy n GLU 20 N -0.78 1.81 -0.34 0.00 0.28 -1.26 -4.62 120.64 115.74 2rqy n GLU 20 Ca -0.13 -0.03 0.13 0.00 -0.16 0.00 0.00 57.16 56.98 2rqy n GLU 20 Cb 0.40 -1.17 0.34 0.00 1.43 0.00 0.00 31.44 32.44 2rqy n GLU 20 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 177.13 176.73 2rqy h VAL 21 N 0.00 0.73 -2.02 3.84 3.04 -1.86 -3.36 116.25 116.62 2rqy h VAL 21 Ca -0.10 -0.25 -0.53 0.00 -1.01 0.00 0.00 66.70 64.80 2rqy h VAL 21 Cb 0.96 -0.07 -0.07 0.00 -2.01 0.00 0.00 31.29 30.09 2rqy h VAL 21 CO 0.01 0.14 -0.55 0.00 -1.01 0.00 0.00 177.57 176.15 2rqy n ILE 23 N -1.11 0.00 -0.02 0.00 5.41 -1.26 -4.87 119.36 117.51 2rqy n ILE 23 Ca -0.05 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.70 2rqy n ILE 23 Cb 0.60 -1.17 -0.00 0.00 -0.71 0.00 0.00 39.64 38.36 2rqy n ILE 23 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 2rqy h SER 24 N 0.00 0.00 0.00 4.38 4.64 -1.80 -3.41 113.55 117.36 2rqy h SER 24 Ca -0.15 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.83 2rqy h SER 24 Cb 0.89 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.92 2rqy h SER 24 CO 0.22 0.16 -2.29 0.00 -0.87 0.00 0.00 176.83 174.05 2rqy n TYR 25 N -2.77 0.00 -0.24 4.77 9.36 -1.26 -4.40 117.16 122.63 2rqy n TYR 25 Ca -0.01 0.00 0.31 0.00 3.32 0.00 0.00 57.90 61.52 2rqy n TYR 25 Cb 0.05 -0.87 0.74 0.00 -0.63 0.00 0.00 39.34 38.62 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 -0.06 0.00 -0.26 2.98 4.07 -1.94 0.22 115.31 120.31 2rqy h LEU 26 Ca -0.51 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.25 2rqy h LEU 26 Cb 1.76 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.51 2rqy h LEU 26 CO -0.10 0.00 -0.64 1.23 -1.08 0.00 0.00 178.44 177.85 2rqy h GLY 27 N 0.00 0.91 2.00 0.83 0.00 -1.79 -3.03 103.07 101.98 2rqy h GLY 27 Ca 0.48 -1.14 0.00 0.00 0.00 0.00 0.00 47.33 46.67 2rqy h GLY 27 CO -0.01 1.02 0.00 0.07 0.00 0.00 0.00 176.54 177.62 2rqy h ARG 28 N 0.61 0.00 0.10 4.80 0.11 -0.84 -3.17 114.38 116.00 2rqy h ARG 28 Ca -0.01 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 2rqy h ARG 28 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2rqy h ARG 28 CO 0.14 0.00 -0.05 0.35 0.10 0.00 0.00 179.97 180.51 2rqy h PHE 29 N 0.00 -0.13 -0.69 4.08 3.04 -1.06 -3.31 116.94 118.88 2rqy h PHE 29 Ca 0.00 -0.00 0.20 0.00 3.98 0.00 0.00 57.97 62.15 2rqy h PHE 29 Cb 0.68 0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.21 2rqy h PHE 29 CO 0.00 -0.08 0.51 0.10 -2.02 0.00 0.00 178.31 176.82 2rqy h TYR 30 N -0.40 0.00 -0.82 0.41 -0.00 -1.66 0.64 116.97 115.13 2rqy h TYR 30 Ca -0.01 0.00 0.20 0.00 0.00 0.00 0.00 58.73 58.91 2rqy h TYR 30 Cb 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 36.78 2rqy h TYR 30 CO 0.04 0.00 0.56 0.37 -0.00 0.00 0.00 178.16 179.13 2rqy h GLN 31 N 0.00 0.27 0.22 0.10 4.15 -1.63 -0.28 115.11 117.94 2rqy h GLN 31 Ca 0.33 -0.02 -0.34 0.00 0.77 0.00 0.00 58.65 59.39 2rqy h GLN 31 Cb 1.34 -0.06 0.03 0.00 0.21 0.00 0.00 27.48 29.00 2rqy h GLN 31 CO -0.00 0.18 -1.53 -0.44 -1.93 0.00 0.00 178.83 175.10 2rqy h ASP 32 N 0.27 0.74 -0.82 -0.69 3.32 -0.98 -2.73 116.42 115.54 2rqy h ASP 32 Ca 0.41 -0.86 0.05 0.00 0.02 0.00 0.00 57.03 56.66 2rqy h ASP 32 Cb 1.20 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.46 2rqy h ASP 32 CO -0.11 1.69 0.54 -0.07 -1.72 0.00 0.00 179.24 179.57 2rqy h LEU 33 N 0.13 0.82 0.00 1.55 3.38 -1.06 -0.47 115.31 119.66 2rqy h LEU 33 Ca -0.27 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2rqy h LEU 33 Cb 2.13 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.71 2rqy h LEU 33 CO 0.24 0.54 -0.45 1.17 0.09 0.00 0.00 178.44 180.04 2rqy n LYS 34 N -4.47 0.27 -0.85 1.13 3.00 -0.53 -3.39 118.16 113.32 2rqy n LYS 34 Ca 0.12 0.12 -0.10 0.00 -0.00 0.00 0.00 58.31 58.44 2rqy n LYS 34 Cb 0.17 -1.71 -0.06 0.00 0.00 0.00 0.00 35.03 33.44 2rqy n LYS 34 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2rqy n ASP 35 N -2.12 5.61 -3.80 3.14 2.03 -0.19 -4.73 116.55 116.49 2rqy n ASP 35 Ca 0.04 -2.62 -0.29 0.00 0.52 0.00 0.00 54.79 52.44 2rqy n ASP 35 Cb 0.43 -1.23 -0.03 0.00 -0.72 0.00 0.00 41.12 39.56 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 1.61 -2.40 -0.06 -0.67 3.00 -1.26 -4.77 116.66 112.12 2rqy n ARG 36 Ca 0.25 0.27 -0.07 0.00 -0.00 0.00 0.00 57.85 58.30 2rqy n ARG 36 Cb 0.67 -4.91 -0.08 0.00 0.00 0.00 0.00 32.46 28.14 2rqy n ARG 36 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2rqy n ASP 37 N -2.29 2.54 -3.86 6.15 2.03 -1.16 -5.06 116.55 114.89 2rqy n ASP 37 Ca 0.05 -0.02 -0.09 0.00 0.52 0.00 0.00 54.79 55.25 2rqy n ASP 37 Cb 0.49 0.47 -0.08 0.00 -0.72 0.00 0.00 41.12 41.29 2rqy n ASP 37 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2rqy s VAL 38 N -2.26 0.13 -0.02 5.18 1.01 -1.22 -4.97 120.40 118.24 2rqy s VAL 38 Ca -0.09 -1.08 -0.06 0.00 0.00 0.00 0.00 61.98 60.74 2rqy s VAL 38 Cb 0.04 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2rqy s VAL 38 CO 0.40 -0.60 0.23 -0.89 0.00 0.00 0.00 175.10 174.25 2rqy s THR 39 N -3.25 5.36 -1.07 3.92 2.01 -1.26 -4.54 115.64 116.80 2rqy s THR 39 Ca 0.00 0.16 -0.17 0.00 0.31 0.00 0.00 61.69 62.00 2rqy s THR 39 Cb 0.02 -3.53 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 2rqy s THR 39 CO -0.08 0.43 2.12 0.49 -0.69 0.00 0.00 174.62 176.89 2rqy n PHE 40 N 1.33 2.41 -4.40 4.92 3.01 -1.26 -4.34 117.46 119.13 2rqy n PHE 40 Ca -0.13 -2.30 -0.24 0.00 1.01 0.00 0.00 57.45 55.78 2rqy n PHE 40 Cb 0.53 -2.04 -0.13 0.00 -0.01 0.00 0.00 39.48 37.83 2rqy n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2rqy s SER 41 N 4.03 2.50 -0.79 4.37 1.04 -1.26 -4.20 113.70 119.39 2rqy s SER 41 Ca 0.53 -0.63 -0.06 0.00 0.48 0.00 0.00 55.95 56.27 2rqy s SER 41 Cb 0.14 -0.16 -0.05 0.00 0.10 0.00 0.00 66.02 66.05 2rqy s SER 41 CO 0.02 0.09 1.96 -0.81 0.98 0.00 0.00 173.24 175.48 2rqy n PRO 42 N 1.34 1.79 0.00 4.02 -0.04 -1.25 -3.36 135.00 137.50 2rqy n PRO 42 Ca -0.19 -1.35 0.00 0.00 -0.04 0.00 0.00 63.50 61.93 2rqy n PRO 42 Cb 0.53 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 4.44 0.00 -0.24 0.55 0.00 -1.26 -4.95 120.51 119.05 2rqy n ALA 43 Ca 0.39 0.00 0.28 0.00 0.00 0.00 0.00 53.44 54.11 2rqy n ALA 43 Cb 0.12 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.25 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 0.53 -0.19 0.00 2.02 -1.86 0.29 112.91 113.69 2rqy h THR 44 Ca 0.00 -0.03 -0.19 0.00 0.77 0.00 0.00 66.41 66.96 2rqy h THR 44 Cb 0.00 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 2rqy h THR 44 CO 0.00 0.02 -0.64 0.40 0.37 0.00 0.00 175.52 175.66 2rqy h ILE 45 N 0.10 1.30 0.00 3.11 2.04 -1.75 -2.92 117.51 119.39 2rqy h ILE 45 Ca 0.49 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.47 2rqy h ILE 45 Cb 1.76 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 2rqy h ILE 45 CO -0.06 0.59 0.00 1.05 0.00 0.00 0.00 178.15 179.73 2rqy h GLU 46 N 0.52 0.00 0.00 2.37 -0.00 -0.71 -1.34 114.58 115.42 2rqy h GLU 46 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 59.36 59.20 2rqy h GLU 46 Cb 1.24 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.97 2rqy h GLU 46 CO 0.13 0.00 -0.69 0.93 -0.00 0.00 0.00 179.01 179.38 2rqy h GLU 47 N 0.00 0.00 0.04 1.06 4.39 -1.24 -2.51 114.58 116.32 2rqy h GLU 47 Ca 0.00 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.34 2rqy h GLU 47 Cb 0.31 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 2rqy h GLU 47 CO 0.00 0.69 -2.03 0.39 -1.16 0.00 0.00 179.01 176.90 2rqy n GLU 48 N -3.60 0.65 -0.18 2.33 -0.58 -0.87 -4.25 120.64 114.15 2rqy n GLU 48 Ca -0.01 0.32 0.02 0.00 -0.42 0.00 0.00 57.16 57.07 2rqy n GLU 48 Cb 0.70 -1.63 0.29 0.00 -0.57 0.00 0.00 31.44 30.23 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 -0.43 0.77 -0.70 -4.62 5.85 -1.38 -2.23 115.31 112.57 2rqy h LEU 49 Ca -0.50 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.29 2rqy h LEU 49 Cb 1.73 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.51 2rqy h LEU 49 CO -0.13 0.55 0.36 -0.29 -0.34 0.00 0.00 178.44 178.58 2rqy h ILE 50 N 0.90 0.88 -0.54 4.05 2.10 -1.64 -0.29 117.51 122.97 2rqy h ILE 50 Ca 0.26 -0.21 -0.08 0.00 1.08 0.00 0.00 64.86 65.91 2rqy h ILE 50 Cb -0.05 0.20 -0.02 0.00 -1.09 0.00 0.00 36.82 35.86 2rqy h ILE 50 CO -0.06 0.11 0.02 0.11 -1.08 0.00 0.00 178.15 177.26 2rqy h LYS 51 N 0.63 0.94 -0.83 2.19 1.79 -1.59 -2.50 116.57 117.20 2rqy h LYS 51 Ca 0.34 -0.29 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 2rqy h LYS 51 Cb 0.32 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.84 2rqy h LYS 51 CO -0.25 0.94 0.43 0.74 -1.08 0.00 0.00 179.45 180.23 2rqy h PHE 52 N 0.82 1.16 0.68 -1.35 0.04 -1.03 0.20 116.94 117.47 2rqy h PHE 52 Ca 0.16 -0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.85 2rqy h PHE 52 Cb 0.50 -0.37 0.01 0.00 2.20 0.00 0.00 35.95 38.29 2rqy h PHE 52 CO 0.04 0.82 -0.33 0.00 -0.60 0.00 0.00 178.31 178.24 2rqy h ARG 54 N -1.06 0.00 -0.45 0.00 2.47 -1.38 -1.74 114.38 112.22 2rqy h ARG 54 Ca -0.09 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.54 2rqy h ARG 54 Cb 0.73 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.00 2rqy h ARG 54 CO 0.15 0.08 0.07 -1.91 0.56 0.00 0.00 179.97 178.92 2rqy n GLU 55 N -3.46 3.27 -3.30 0.04 2.13 0.71 -4.99 120.64 115.03 2rqy n GLU 55 Ca -0.02 -3.01 -0.23 0.00 0.66 0.00 0.00 57.16 54.57 2rqy n GLU 55 Cb 0.22 -2.01 -0.00 0.00 0.27 0.00 0.00 31.44 29.92 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 -2.93 3.78 -0.14 4.31 0.00 0.13 -4.90 121.76 122.01 2rqy s ALA 56 Ca 0.48 -1.03 -0.08 0.00 0.00 0.00 0.00 51.96 51.34 2rqy s ALA 56 Cb 0.39 -2.06 0.05 0.00 0.00 0.00 0.00 23.12 21.51 2rqy s ALA 56 CO 0.10 -0.12 0.33 1.03 0.00 0.00 0.00 175.76 177.10 2rqy s ARG 57 N -4.36 0.31 6.33 0.00 0.52 -1.26 -4.65 118.95 115.85 2rqy s ARG 57 Ca 0.43 0.65 0.00 0.00 -0.52 0.00 0.00 55.73 56.29 2rqy s ARG 57 Cb -0.10 -0.06 0.00 0.00 0.52 0.00 0.00 34.95 35.32 2rqy s ARG 57 CO 0.36 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.93 2rqy n GLY 58 N 4.17 1.26 0.33 -3.53 0.00 -1.26 -2.93 105.19 103.24 2rqy n GLY 58 Ca -0.24 -0.55 0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.96 0.25 116.57 118.57 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 0.00 0.07 5.08 -1.90 -3.15 114.58 114.68 2rqy h GLU 60 Ca 0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.03 2rqy h GLU 60 Cb 0.17 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 2rqy h GLU 60 CO -0.00 0.00 -2.16 -1.71 -1.00 0.00 0.00 179.01 174.14 2rqy n ASN 61 N -2.73 0.38 0.15 1.42 2.85 0.80 -4.14 115.26 113.99 2rqy n ASN 61 Ca 0.05 0.14 0.13 0.00 -0.11 0.00 0.00 54.58 54.78 2rqy n ASN 61 Cb 0.48 0.58 0.47 0.00 1.24 0.00 0.00 39.78 42.55 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 0.04 1.20 0.11 -1.37 -3.22 114.38 111.14 2rqy h ARG 62 Ca -0.46 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.62 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 0.04 0.00 -0.02 -0.07 0.10 0.00 0.00 179.97 180.02 2rqy h LEU 63 N 0.00 -0.05 -2.39 0.08 4.07 -1.70 -2.52 115.31 112.81 2rqy h LEU 63 Ca 0.00 -0.63 0.03 0.00 0.08 0.00 0.00 57.88 57.36 2rqy h LEU 63 Cb 0.53 0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 2rqy h LEU 63 CO 0.00 0.67 0.13 0.00 -1.08 0.00 0.00 178.44 178.16 2rqy h TYR 65 N 0.00 0.30 0.00 0.00 3.20 -1.57 0.32 116.97 119.23 2rqy h TYR 65 Ca 0.04 -0.22 -0.11 0.00 3.14 0.00 0.00 58.73 61.58 2rqy h TYR 65 Cb 0.30 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 2rqy h TYR 65 CO 0.00 1.22 -0.55 -0.92 -1.64 0.00 0.00 178.16 176.27 2rqy h TYR 66 N 0.05 0.00 0.00 -3.82 3.20 -0.61 -3.33 116.97 112.46 2rqy h TYR 66 Ca -0.16 0.00 -0.37 0.00 3.14 0.00 0.00 58.73 61.33 2rqy h TYR 66 Cb 1.94 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 40.15 2rqy h TYR 66 CO 0.04 0.53 -2.39 -0.89 -1.64 0.00 0.00 178.16 173.81 2rqy n ILE 67 N -3.23 1.43 -1.40 1.81 5.41 0.27 -5.07 119.36 118.59 2rqy n ILE 67 Ca 0.02 -0.78 0.00 0.00 1.00 0.00 0.00 62.75 62.99 2rqy n ILE 67 Cb 0.75 -0.76 0.00 0.00 -0.71 0.00 0.00 39.64 38.92 2rqy n ILE 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2rqy n GLY 68 N 1.89 -0.39 0.01 7.39 0.00 0.11 -4.81 105.19 109.39 2rqy n GLY 68 Ca -0.36 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.72 2.45 -2.56 4.61 0.00 -0.90 -3.91 120.51 119.48 2rqy n ALA 69 Ca 0.00 -0.37 -0.27 0.00 0.00 0.00 0.00 53.44 52.80 2rqy n ALA 69 Cb 0.26 -0.44 -0.10 0.00 0.00 0.00 0.00 19.45 19.17 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 -2.91 3.15 -0.07 0.00 -1.32 -1.26 -4.83 115.64 108.39 2rqy s THR 70 Ca -0.05 -1.62 0.28 0.00 -1.21 0.00 0.00 61.69 59.09 2rqy s THR 70 Cb 0.08 -2.54 0.34 0.00 -1.51 0.00 0.00 72.50 68.87 2rqy s THR 70 CO 0.57 -0.07 1.82 0.44 -2.21 0.00 0.00 174.62 175.17 2rqy h ASP 71 N 3.06 0.00 -0.21 8.08 5.19 -1.91 -2.70 116.42 127.93 2rqy h ASP 71 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2rqy h ASP 71 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 2rqy h ASP 71 CO 0.53 0.06 0.00 0.47 -3.12 0.00 0.00 179.24 177.18 2rqy n ASP 72 N -3.14 1.40 -1.56 6.45 9.92 -1.26 -3.81 116.55 124.55 2rqy n ASP 72 Ca 0.02 -1.83 0.02 0.00 -0.53 0.00 0.00 54.79 52.47 2rqy n ASP 72 Cb 0.41 -0.14 0.27 0.00 -0.64 0.00 0.00 41.12 41.03 2rqy n ASP 72 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2rqy n ALA 73 N 0.20 3.68 -1.88 2.24 0.00 -1.02 -4.87 120.51 118.87 2rqy n ALA 73 Ca 0.12 -1.48 -0.17 0.00 0.00 0.00 0.00 53.44 51.92 2rqy n ALA 73 Cb 0.25 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 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 0.29 -0.37 -2.58 0.00 0.00 -1.25 -4.92 120.51 111.67 2rqy n ALA 74 Ca 0.23 0.21 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 2rqy n ALA 74 Cb 0.99 -1.82 -0.11 0.00 0.00 0.00 0.00 19.45 18.52 2rqy n ALA 74 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2rqy s THR 75 N -2.73 0.61 -0.19 0.00 -1.32 -1.26 -5.05 115.64 105.69 2rqy s THR 75 Ca 0.00 -1.42 0.12 0.00 -1.21 0.00 0.00 61.69 59.18 2rqy s THR 75 Cb 0.00 -1.04 0.40 0.00 -1.51 0.00 0.00 72.50 70.35 2rqy s THR 75 CO 0.00 -0.58 1.21 2.29 -2.21 0.00 0.00 174.62 175.33 2rqy n LYS 76 N 0.86 1.49 -2.63 7.08 0.00 -1.26 -4.43 118.16 119.27 2rqy n LYS 76 Ca -0.19 -3.17 -0.09 0.00 -0.00 0.00 0.00 58.31 54.87 2rqy n LYS 76 Cb 0.57 -1.55 -0.01 0.00 -0.00 0.00 0.00 35.03 34.04 2rqy n LYS 76 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84 2rqy n ILE 77 N -1.10 0.00 0.00 0.58 -6.64 -1.26 -5.04 119.36 105.90 2rqy n ILE 77 Ca 0.18 -0.66 0.00 0.00 -1.77 0.00 0.00 62.75 60.50 2rqy n ILE 77 Cb 0.70 0.03 0.00 0.00 -1.44 0.00 0.00 39.64 38.93 2rqy n ILE 77 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2rqy n ILE 78 N -0.46 0.00 0.31 7.28 3.06 -1.25 -4.65 119.36 123.65 2rqy n ILE 78 Ca -0.05 0.00 0.19 0.00 -2.50 0.00 0.00 62.75 60.39 2rqy n ILE 78 Cb 0.18 0.00 0.97 0.00 0.54 0.00 0.00 39.64 41.33 2rqy n ILE 78 CO 0.00 0.00 0.00 0.78 -2.50 0.00 0.00 176.55 174.83 2rqy h ASN 79 N 0.00 0.00 -0.08 9.51 2.35 -1.96 -0.57 115.58 124.84 2rqy h ASN 79 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2rqy h ASN 79 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 2rqy h ASN 79 CO 0.00 0.00 0.22 -0.33 -1.65 0.00 0.00 177.43 175.67 2rqy h GLU 80 N 0.00 0.00 0.00 0.81 5.08 -1.89 0.34 114.58 118.92 2rqy h GLU 80 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2rqy h GLU 80 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 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 -3.25 0.55 -0.03 3.13 3.14 -0.24 -4.70 118.33 116.94 2rqy n VAL 81 Ca -0.01 -0.60 -0.04 0.00 -2.96 0.00 0.00 64.34 60.74 2rqy n VAL 81 Cb 0.30 0.78 -0.02 0.00 -1.06 0.00 0.00 33.84 33.83 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 -0.28 3.56 0.40 6.55 2.88 -0.33 -4.21 113.62 122.19 2rqy n SER 82 Ca 0.00 -0.03 -0.17 0.00 -1.33 0.00 0.00 58.87 57.34 2rqy n SER 82 Cb 0.30 -0.09 -0.08 0.00 -0.75 0.00 0.00 64.21 63.60 2rqy n SER 82 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2rqy h LYS 83 N -0.00 -1.00 0.00 -1.46 3.11 -0.66 -2.12 116.57 114.44 2rqy h LYS 83 Ca -0.12 0.07 -0.07 0.00 -2.81 0.00 0.00 60.65 57.72 2rqy h LYS 83 Cb 1.18 0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 32.63 2rqy h LYS 83 CO -0.02 -0.65 -0.31 -1.00 -2.81 0.00 0.00 179.45 174.66 2rqy h PRO 84 N -1.22 0.00 -0.07 1.90 0.13 -1.84 -2.49 132.00 128.41 2rqy h PRO 84 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 2rqy h PRO 84 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2rqy h PRO 84 CO 0.17 0.31 0.00 -0.11 -0.23 0.00 0.00 178.00 178.15 2rqy n LEU 85 N -3.64 0.76 -0.01 1.56 7.94 -1.20 -1.97 117.00 120.43 2rqy n LEU 85 Ca -0.01 -0.31 0.10 0.00 -1.11 0.00 0.00 56.01 54.68 2rqy n LEU 85 Cb 0.43 -0.04 -0.15 0.00 0.53 0.00 0.00 43.42 44.19 2rqy n LEU 85 CO 0.35 0.16 -0.73 0.00 -1.11 0.00 0.00 177.39 176.07 2rqy n ALA 86 N -0.29 2.70 -0.04 1.96 0.00 -0.80 -4.51 120.51 119.53 2rqy n ALA 86 Ca 0.15 -0.45 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 2rqy n ALA 86 Cb 0.19 -0.65 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 2rqy n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2rqy h HIS 87 N 0.00 0.00 0.00 0.00 3.86 -1.60 -3.41 115.15 114.00 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 0.87 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.34 2rqy h HIS 87 CO 0.00 0.00 0.00 -2.39 0.86 0.00 0.00 177.93 176.40 2rqy n HIS 88 N -3.82 0.00 -3.88 2.45 -0.00 -1.23 -5.08 115.22 103.66 2rqy n HIS 88 Ca -0.04 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.40 2rqy n HIS 88 Cb 0.14 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.01 2rqy n HIS 88 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2rqy s ILE 89 N 0.00 2.79 -0.01 0.61 1.01 -0.83 -4.93 121.20 119.84 2rqy s ILE 89 Ca 0.00 -4.19 -0.25 0.00 0.00 0.00 0.00 60.65 56.21 2rqy s ILE 89 Cb 0.00 -2.84 -0.19 0.00 0.01 0.00 0.00 42.46 39.44 2rqy s ILE 89 CO 0.00 -1.01 1.28 1.55 0.00 0.00 0.00 174.94 176.77 2rqy h PRO 90 N 5.44 0.08 0.00 2.79 0.13 -1.88 -3.33 132.00 135.23 2rqy h PRO 90 Ca 0.14 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.14 2rqy h PRO 90 Cb 0.76 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.79 2rqy h PRO 90 CO 0.70 0.55 -0.28 1.55 -0.23 0.00 0.00 178.00 180.29 2rqy n VAL 91 N -4.79 0.00 0.06 1.56 3.14 -1.26 -4.86 118.33 112.19 2rqy n VAL 91 Ca -0.08 -0.09 0.04 0.00 -2.96 0.00 0.00 64.34 61.25 2rqy n VAL 91 Cb 0.28 0.40 -0.05 0.00 -1.06 0.00 0.00 33.84 33.40 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 0.09 0.00 0.00 1.45 4.81 -1.92 -3.35 114.58 115.65 2rqy h GLU 92 Ca -0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2rqy h GLU 92 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 2rqy h GLU 92 CO -0.15 0.18 -1.31 1.17 -0.73 0.00 0.00 179.01 178.17 2rqy n LYS 93 N -2.81 0.76 -0.23 1.92 4.81 -1.26 -0.03 118.16 121.31 2rqy n LYS 93 Ca -0.06 -0.08 -0.02 0.00 -0.87 0.00 0.00 58.31 57.28 2rqy n LYS 93 Cb 0.73 -1.41 0.09 0.00 0.02 0.00 0.00 35.03 34.46 2rqy n LYS 93 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 2rqy h ILE 94 N 0.00 1.01 0.00 3.15 1.08 -1.91 -2.62 117.51 118.23 2rqy h ILE 94 Ca 0.00 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 2rqy h ILE 94 Cb 0.63 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 2rqy h ILE 94 CO 0.00 0.13 0.00 0.00 -0.69 0.00 0.00 178.15 177.59 2rqy h GLU 96 N 0.00 0.05 0.02 0.00 4.81 -1.77 0.34 114.58 118.02 2rqy h GLU 96 Ca 0.00 -0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.00 2rqy h GLU 96 Cb 0.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2rqy h GLU 96 CO 0.00 0.03 -1.24 -0.22 -0.73 0.00 0.00 179.01 176.85 2rqy h LYS 97 N 0.05 0.03 -1.00 1.92 1.63 -0.63 -3.36 116.57 115.21 2rqy h LYS 97 Ca 0.27 -0.06 0.28 0.00 -0.85 0.00 0.00 60.65 60.30 2rqy h LYS 97 Cb 0.43 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.03 2rqy h LYS 97 CO -0.52 1.03 0.70 1.25 -3.45 0.00 0.00 179.45 178.46 2rqy h LEU 98 N -0.88 0.11 -1.67 5.20 6.46 -1.40 0.19 115.31 123.32 2rqy h LEU 98 Ca -0.33 0.02 0.26 0.00 -0.12 0.00 0.00 57.88 57.71 2rqy h LEU 98 Cb 1.37 -0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 41.23 2rqy h LEU 98 CO -0.16 0.03 0.67 0.11 -0.62 0.00 0.00 178.44 178.47 2rqy h LYS 99 N 0.11 0.22 -0.75 1.25 1.57 -0.46 0.33 116.57 118.83 2rqy h LYS 99 Ca 0.50 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 59.43 2rqy h LYS 99 Cb 1.78 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 34.00 2rqy h LYS 99 CO -0.07 0.15 0.51 -0.22 -0.57 0.00 0.00 179.45 179.25 2rqy h LYS 100 N 0.23 0.28 0.00 3.15 3.11 -0.84 -2.10 116.57 120.40 2rqy h LYS 100 Ca 0.51 -0.02 -0.24 0.00 -2.81 0.00 0.00 60.65 58.09 2rqy h LYS 100 Cb 1.59 -0.06 -0.04 0.00 -1.00 0.00 0.00 32.23 32.72 2rqy h LYS 100 CO -0.14 0.19 -1.73 1.17 -2.81 0.00 0.00 179.45 176.13 2rqy n LYS 101 N -4.44 0.56 -3.88 1.90 4.81 0.98 -4.83 118.16 113.26 2rqy n LYS 101 Ca 0.15 0.28 -0.29 0.00 -0.87 0.00 0.00 58.31 57.58 2rqy n LYS 101 Cb 0.62 -1.50 -0.13 0.00 0.02 0.00 0.00 35.03 34.04 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 -6.73 4.35 0.55 3.14 1.11 -0.20 -4.92 116.67 113.97 2rqy s ASP 102 Ca -0.33 -3.37 0.33 0.00 0.18 0.00 0.00 52.55 49.36 2rqy s ASP 102 Cb 0.09 -1.52 1.47 0.00 1.07 0.00 0.00 42.92 44.03 2rqy s ASP 102 CO 0.46 -0.16 2.03 0.77 1.18 0.00 0.00 175.17 179.45 2rqy h SER 103 N 5.97 0.00 0.25 0.27 4.64 -1.60 -2.40 113.55 120.69 2rqy h SER 103 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2rqy h SER 103 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2rqy h SER 103 CO 0.67 0.06 0.00 1.56 -0.87 0.00 0.00 176.83 178.25 2rqy h GLN 104 N 0.00 0.00 -0.87 4.77 4.20 -1.91 -2.73 115.11 118.57 2rqy h GLN 104 Ca -0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 2rqy h GLN 104 Cb 0.44 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.14 2rqy h GLN 104 CO 0.01 0.00 0.48 0.97 -0.67 0.00 0.00 178.83 179.61 2rqy h ILE 105 N 0.00 0.79 0.11 2.54 2.10 -1.77 -0.01 117.51 121.28 2rqy h ILE 105 Ca 0.00 -0.24 -0.23 0.00 1.08 0.00 0.00 64.86 65.46 2rqy h ILE 105 Cb 0.13 0.02 0.00 0.00 -1.09 0.00 0.00 36.82 35.88 2rqy h ILE 105 CO 0.00 0.13 -1.16 0.00 -1.08 0.00 0.00 178.15 176.04 2rqy h GLU 107 N -0.38 -0.36 -5.57 0.00 5.08 -1.49 -3.35 114.58 108.51 2rqy h GLU 107 Ca -0.24 0.02 -0.22 0.00 -1.00 0.00 0.00 59.36 57.93 2rqy h GLU 107 Cb 1.67 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.99 2rqy h GLU 107 CO 0.07 -0.24 0.63 -0.51 -1.00 0.00 0.00 179.01 177.96 2rqy s LEU 108 N -7.33 3.08 0.00 1.33 1.43 -0.05 -4.82 118.68 112.32 2rqy s LEU 108 Ca -0.08 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2rqy s LEU 108 Cb 0.03 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.70 2rqy s LEU 108 CO 0.28 -3.23 0.34 0.29 0.23 0.00 0.00 176.35 174.26 2rqy n LYS 109 N 8.90 0.00 0.11 1.70 5.02 -1.26 -4.30 118.16 128.33 2rqy n LYS 109 Ca 0.40 0.30 -0.01 0.00 -2.02 0.00 0.00 58.31 56.99 2rqy n LYS 109 Cb 0.47 -1.01 -0.01 0.00 -0.02 0.00 0.00 35.03 34.46 2rqy n LYS 109 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 2rqy h TYR 110 N 0.00 0.00 -6.69 2.13 -0.00 -1.95 -3.45 116.97 107.01 2rqy h TYR 110 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 58.73 58.27 2rqy h TYR 110 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 36.73 36.74 2rqy h TYR 110 CO 0.06 0.69 -1.14 -0.40 -0.00 0.00 0.00 178.16 177.37 2rqy n ASP 111 N -3.30 -5.04 -4.51 0.10 5.75 -1.26 -4.80 116.55 103.49 2rqy n ASP 111 Ca 0.01 -0.71 -0.44 0.00 -0.01 0.00 0.00 54.79 53.65 2rqy n ASP 111 Cb 0.80 -1.64 -0.00 0.00 -1.03 0.00 0.00 41.12 39.25 2rqy n ASP 111 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2rqy s LYS 112 N -4.14 4.02 0.22 0.11 2.20 -1.26 -4.97 119.74 115.92 2rqy s LYS 112 Ca 0.13 -2.29 0.10 0.00 -0.36 0.00 0.00 55.97 53.55 2rqy s LYS 112 Cb -0.01 -5.23 -0.04 0.00 -1.51 0.00 0.00 37.83 31.03 2rqy s LYS 112 CO 0.89 -1.95 -0.12 -0.65 -0.36 0.00 0.00 175.35 173.16 2rqy s GLN 113 N 2.67 1.96 0.39 4.03 -0.21 -1.26 -5.06 119.66 122.18 2rqy s GLN 113 Ca 0.46 -1.44 -0.24 0.00 0.02 0.00 0.00 55.36 54.16 2rqy s GLN 113 Cb -0.00 -2.04 -0.09 0.00 1.00 0.00 0.00 33.01 31.88 2rqy s GLN 113 CO 0.02 0.39 1.04 -1.50 -2.12 0.00 0.00 175.29 173.13 2rqy s ILE 114 N -2.00 3.76 -1.32 1.08 -1.16 -1.26 -4.95 121.20 115.35 2rqy s ILE 114 Ca 0.27 1.37 -0.16 0.00 -0.51 0.00 0.00 60.65 61.61 2rqy s ILE 114 Cb -0.07 -3.72 0.08 0.00 0.61 0.00 0.00 42.46 39.36 2rqy s ILE 114 CO 0.15 0.03 1.81 -0.67 -2.81 0.00 0.00 174.94 173.46 2rqy n ASP 115 N 0.03 4.76 0.00 4.50 2.03 -1.26 -4.55 116.55 122.06 2rqy n ASP 115 Ca 0.04 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.43 2rqy n ASP 115 Cb 0.49 -1.69 0.00 0.00 -0.72 0.00 0.00 41.12 39.20 2rqy n ASP 115 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2rqy n LEU 116 N 7.29 0.00 0.00 -2.67 7.94 -1.26 -5.14 117.00 123.16 2rqy n LEU 116 Ca 0.48 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.38 2rqy n LEU 116 Cb 0.44 -0.08 0.00 0.00 0.53 0.00 0.00 43.42 44.31 2rqy n LEU 116 CO 0.78 -0.48 0.00 -0.24 -1.11 0.00 0.00 177.39 176.34 2rqy n SER 117 N -2.44 0.64 0.22 1.96 2.88 -1.26 -5.03 113.62 110.59 2rqy n SER 117 Ca 0.00 -1.00 0.10 0.00 -1.33 0.00 0.00 58.87 56.64 2rqy n SER 117 Cb 0.00 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 63.92 2rqy n SER 117 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2rqy h THR 118 N 1.00 0.57 -3.54 2.46 1.35 -2.01 -3.38 112.91 109.37 2rqy h THR 118 Ca 0.00 -1.11 -0.67 0.00 -0.55 0.00 0.00 66.41 64.08 2rqy h THR 118 Cb 0.00 1.75 -0.38 0.00 -1.73 0.00 0.00 68.15 67.79 2rqy h THR 118 CO 0.00 0.22 -0.60 0.68 -0.25 0.00 0.00 175.52 175.58 2rqy s VAL 119 N -3.67 2.84 -0.19 6.82 -7.23 -1.26 -4.90 120.40 112.81 2rqy s VAL 119 Ca 0.00 -2.65 -0.06 0.00 -1.81 0.00 0.00 61.98 57.47 2rqy s VAL 119 Cb 0.10 -2.98 -0.09 0.00 0.56 0.00 0.00 36.38 33.97 2rqy s VAL 119 CO 0.64 -0.72 -0.22 0.47 -0.31 0.00 0.00 175.10 174.95 2rqy n ASP 120 N 3.90 1.75 0.03 4.85 8.00 -1.26 -3.91 116.55 129.91 2rqy n ASP 120 Ca 0.03 0.13 -0.08 0.00 0.71 0.00 0.00 54.79 55.58 2rqy n ASP 120 Cb 0.38 -0.48 -0.13 0.00 -0.02 0.00 0.00 41.12 40.88 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 -0.47 0.03 0.00 0.64 7.12 -1.94 -3.35 115.31 117.35 2rqy h LEU 121 Ca -0.46 -0.04 -0.00 0.00 0.13 0.00 0.00 57.88 57.50 2rqy h LEU 121 Cb 1.49 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 41.61 2rqy h LEU 121 CO -0.22 1.04 -0.00 0.50 -0.13 0.00 0.00 178.44 179.62 2rqy h LYS 122 N 0.01 -0.00 -2.73 1.25 3.64 -1.94 -3.36 116.57 113.43 2rqy h LYS 122 Ca -0.12 0.00 -0.73 0.00 -1.27 0.00 0.00 60.65 58.52 2rqy h LYS 122 Cb 1.87 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 33.59 2rqy h LYS 122 CO 0.12 0.83 2.58 1.63 -2.27 0.00 0.00 179.45 182.33 2rqy n LYS 123 N -4.65 4.42 -2.49 1.90 5.02 -1.25 -4.70 118.16 116.40 2rqy n LYS 123 Ca -0.09 -3.31 -0.33 0.00 -2.02 0.00 0.00 58.31 52.57 2rqy n LYS 123 Cb 0.40 -2.68 0.00 0.00 -0.02 0.00 0.00 35.03 32.74 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 2.12 5.84 0.02 -0.35 7.94 -1.25 -2.82 117.00 128.49 2rqy n LEU 124 Ca 0.63 -5.28 0.00 0.00 -1.11 0.00 0.00 56.01 50.25 2rqy n LEU 124 Cb 0.25 -0.77 0.00 0.00 0.53 0.00 0.00 43.42 43.44 2rqy n LEU 124 CO 0.72 2.12 0.00 -1.14 -1.11 0.00 0.00 177.39 177.98 2rqy n ARG 125 N -0.36 0.00 0.00 1.96 0.63 -1.26 -4.97 116.66 112.66 2rqy n ARG 125 Ca 0.42 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.35 2rqy n ARG 125 Cb 0.41 -0.02 0.00 0.00 0.45 0.00 0.00 32.46 33.30 2rqy n ARG 125 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2rqy n VAL 126 N -2.63 0.00 -0.35 5.15 0.31 -1.26 -4.70 118.33 114.85 2rqy n VAL 126 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 2rqy n VAL 126 Cb 0.00 -0.77 0.22 0.00 -0.91 0.00 0.00 33.84 32.38 2rqy n VAL 126 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2rqy h LYS 127 N 0.00 1.02 -0.95 5.55 1.63 -1.96 0.98 116.57 122.84 2rqy h LYS 127 Ca 0.00 -0.06 0.09 0.00 -0.85 0.00 0.00 60.65 59.82 2rqy h LYS 127 Cb 0.94 -0.23 -0.07 0.00 -0.60 0.00 0.00 32.23 32.27 2rqy h LYS 127 CO 0.00 0.68 0.61 1.05 -3.45 0.00 0.00 179.45 178.34 2rqy h GLU 128 N 1.05 0.99 0.23 1.90 4.11 -1.81 0.30 114.58 121.35 2rqy h GLU 128 Ca 0.45 -0.06 -0.33 0.00 0.07 0.00 0.00 59.36 59.49 2rqy h GLU 128 Cb 0.33 -0.22 0.03 0.00 0.50 0.00 0.00 28.75 29.38 2rqy h GLU 128 CO -0.20 0.66 -1.46 1.25 0.07 0.00 0.00 179.01 179.32 2rqy h LEU 129 N 1.02 0.76 0.00 3.06 5.85 -1.48 0.13 115.31 124.65 2rqy h LEU 129 Ca 0.43 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2rqy h LEU 129 Cb 0.31 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2rqy h LEU 129 CO -0.19 1.65 0.00 0.29 -0.34 0.00 0.00 178.44 179.86 2rqy n LYS 130 N -3.67 0.14 -0.04 1.25 5.02 0.21 -2.66 118.16 118.41 2rqy n LYS 130 Ca -0.16 0.13 -0.08 0.00 -2.02 0.00 0.00 58.31 56.18 2rqy n LYS 130 Cb 1.09 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.57 2rqy n LYS 130 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2rqy n LYS 131 N -1.40 0.25 -0.17 1.97 4.76 0.10 -4.49 118.16 119.18 2rqy n LYS 131 Ca 0.07 0.10 0.28 0.00 -2.87 0.00 0.00 58.31 55.89 2rqy n LYS 131 Cb 0.20 -0.93 0.71 0.00 -1.84 0.00 0.00 35.03 33.17 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 -0.45 0.57 -0.45 -0.18 2.04 -0.84 0.29 117.51 118.49 2rqy h ILE 132 Ca -0.14 -0.01 -0.10 0.00 1.00 0.00 0.00 64.86 65.61 2rqy h ILE 132 Cb 0.82 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 2rqy h ILE 132 CO -0.09 0.00 -0.13 0.25 0.00 0.00 0.00 178.15 178.19 2rqy h LEU 133 N 0.02 0.82 -0.16 1.44 5.85 -1.71 -3.00 115.31 118.57 2rqy h LEU 133 Ca 0.42 -0.26 -0.22 0.00 0.84 0.00 0.00 57.88 58.66 2rqy h LEU 133 Cb 1.65 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.45 2rqy h LEU 133 CO -0.02 0.96 -0.96 -0.78 -0.34 0.00 0.00 178.44 177.30 2rqy h ASP 134 N 0.74 0.46 -0.80 1.25 1.82 -0.71 -3.03 116.42 116.14 2rqy h ASP 134 Ca 0.12 -0.38 0.23 0.00 -0.39 0.00 0.00 57.03 56.61 2rqy h ASP 134 Cb 0.63 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 2rqy h ASP 134 CO 0.04 1.19 0.57 -0.78 -1.61 0.00 0.00 179.24 178.66 2rqy h ASP 135 N 0.18 0.01 0.42 2.28 3.58 -1.10 0.51 116.42 122.30 2rqy h ASP 135 Ca -0.08 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 57.07 2rqy h ASP 135 Cb 1.61 -0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.62 2rqy h ASP 135 CO 0.16 0.00 -1.71 -0.50 -2.88 0.00 0.00 179.24 174.31 2rqy h TRP 136 N 0.01 0.20 -0.14 0.28 -0.00 -1.55 -3.51 115.95 111.24 2rqy h TRP 136 Ca 0.38 -0.14 0.00 0.00 -0.00 0.00 0.00 58.89 59.13 2rqy h TRP 136 Cb 1.52 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 30.67 2rqy h TRP 136 CO -0.00 1.27 0.00 0.41 -0.00 0.00 0.00 178.44 180.12 2rqy n GLY 137 N 1.67 0.59 2.29 1.49 0.00 0.17 -5.14 105.19 106.25 2rqy n GLY 137 Ca -0.20 -1.01 -0.19 0.00 0.00 0.00 0.00 46.02 44.62 2rqy n GLY 137 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2rqy n GLU 138 N 2.77 1.15 -3.63 1.61 -0.58 -1.26 -5.01 120.64 115.69 2rqy n GLU 138 Ca 0.00 -2.24 -0.05 0.00 -0.42 0.00 0.00 57.16 54.45 2rqy n GLU 138 Cb 0.00 0.48 -0.06 0.00 -0.57 0.00 0.00 31.44 31.29 2rqy n GLU 138 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2rqy s MET 139 N -3.23 0.25 0.01 3.49 0.23 -1.26 -5.14 119.30 113.65 2rqy s MET 139 Ca 0.07 0.17 -0.04 0.00 -1.03 0.00 0.00 55.69 54.86 2rqy s MET 139 Cb -0.01 0.12 0.01 0.00 -1.53 0.00 0.00 34.83 33.43 2rqy s MET 139 CO 0.04 -0.06 0.19 0.00 -2.03 0.00 0.00 175.02 173.17 2rqy n LYS 141 N -0.14 4.32 -2.35 0.00 5.02 -1.26 -4.80 118.16 118.96 2rqy n LYS 141 Ca 0.00 -4.57 -0.05 0.00 -2.02 0.00 0.00 58.31 51.68 2rqy n LYS 141 Cb 0.09 -2.49 0.01 0.00 -0.02 0.00 0.00 35.03 32.62 2rqy n LYS 141 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rqy n GLY 142 N 1.27 -1.35 3.25 0.72 0.00 -1.26 -5.08 105.19 102.74 2rqy n GLY 142 Ca 0.26 0.71 -0.13 0.00 0.00 0.00 0.00 46.02 46.86 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 -0.98 -3.83 0.03 0.00 0.00 -1.26 -5.00 121.76 110.73 2rqy s ALA 144 Ca -0.10 1.33 -0.17 0.00 0.00 0.00 0.00 51.96 53.02 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 0.04 -2.02 0.38 -1.21 0.00 0.00 0.00 175.76 172.95 2rqy s GLU 145 N 2.94 0.87 0.08 0.00 2.02 -1.26 -5.05 118.70 118.30 2rqy s GLU 145 Ca 0.24 -0.36 -0.33 0.00 0.02 0.00 0.00 54.97 54.54 2rqy s GLU 145 Cb -0.03 0.38 -0.17 0.00 0.10 0.00 0.00 34.13 34.41 2rqy s GLU 145 CO -0.22 -0.29 1.61 -0.22 0.02 0.00 0.00 175.26 176.16 2rqy h LYS 146 N 3.17 -0.87 -0.72 1.61 3.64 -2.00 -1.97 116.57 119.42 2rqy h LYS 146 Ca -0.31 0.06 0.21 0.00 -1.27 0.00 0.00 60.65 59.34 2rqy h LYS 146 Cb 1.20 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 33.19 2rqy h LYS 146 CO 0.44 -0.58 0.53 0.66 -2.27 0.00 0.00 179.45 178.22 2rqy h SER 147 N -0.91 0.00 -0.46 4.20 4.64 -2.00 0.98 113.55 120.01 2rqy h SER 147 Ca -0.07 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.16 2rqy h SER 147 Cb 0.74 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 2rqy h SER 147 CO 0.06 0.00 -0.06 -0.78 -0.87 0.00 0.00 176.83 175.19 2rqy h ASP 148 N 0.00 0.84 -0.29 4.97 3.58 -1.78 -3.05 116.42 120.68 2rqy h ASP 148 Ca 0.34 -0.34 -0.13 0.00 0.42 0.00 0.00 57.03 57.32 2rqy h ASP 148 Cb 1.39 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 2rqy h ASP 148 CO -0.00 0.98 -0.29 1.88 -2.88 0.00 0.00 179.24 178.92 2rqy h TYR 149 N 0.68 0.93 0.00 0.28 0.05 -0.38 -2.42 116.97 116.12 2rqy h TYR 149 Ca 0.12 -0.24 0.00 0.00 0.05 0.00 0.00 58.73 58.66 2rqy h TYR 149 Cb 0.58 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.11 2rqy h TYR 149 CO 0.04 1.00 0.00 -0.89 -1.05 0.00 0.00 178.16 177.26 2rqy n ILE 150 N -4.08 0.00 0.11 -2.88 2.08 -0.78 -0.25 119.36 113.56 2rqy n ILE 150 Ca -0.01 1.39 0.18 0.00 0.56 0.00 0.00 62.75 64.87 2rqy n ILE 150 Cb 0.48 -2.18 0.74 0.00 -0.75 0.00 0.00 39.64 37.93 2rqy n ILE 150 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2rqy h ARG 151 N 0.00 0.00 0.78 0.38 2.47 -1.65 0.13 114.38 116.49 2rqy h ARG 151 Ca 0.00 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.68 2rqy h ARG 151 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2rqy h ARG 151 CO 0.00 0.00 -0.37 0.87 0.56 0.00 0.00 179.97 181.03 2rqy h LYS 152 N 0.00 -1.01 -0.52 0.04 1.79 -0.84 -2.43 116.57 113.60 2rqy h LYS 152 Ca 0.16 0.07 -0.10 0.00 -2.18 0.00 0.00 60.65 58.60 2rqy h LYS 152 Cb 0.74 0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.60 2rqy h LYS 152 CO -0.00 -0.67 -0.09 0.82 -1.08 0.00 0.00 179.45 178.43 2rqy h ILE 153 N -1.24 1.26 -0.25 1.86 1.08 -0.16 -2.59 117.51 117.46 2rqy h ILE 153 Ca -0.11 -1.21 0.07 0.00 -0.39 0.00 0.00 64.86 63.22 2rqy h ILE 153 Cb 0.80 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 2rqy h ILE 153 CO 0.18 0.43 0.24 0.78 -0.69 0.00 0.00 178.15 179.08 2rqy h ASN 154 N 0.85 0.00 1.62 1.72 -0.26 -0.78 0.36 115.58 119.08 2rqy h ASN 154 Ca 0.14 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.80 2rqy h ASN 154 Cb 0.62 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.87 2rqy h ASN 154 CO 0.04 0.00 -0.39 -0.08 -1.06 0.00 0.00 177.43 175.95 2rqy h GLU 155 N 0.00 0.00 -0.19 0.81 4.57 -1.02 -3.24 114.58 115.51 2rqy h GLU 155 Ca 0.12 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 2rqy h GLU 155 Cb 0.60 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2rqy h GLU 155 CO -0.00 0.36 0.00 1.28 -1.18 0.00 0.00 179.01 179.46 2rqy n LEU 156 N -3.18 3.34 0.14 1.64 4.32 0.85 -4.76 117.00 119.35 2rqy n LEU 156 Ca 0.02 -2.94 -0.16 0.00 -0.02 0.00 0.00 56.01 52.92 2rqy n LEU 156 Cb 0.68 -0.48 -0.09 0.00 -1.62 0.00 0.00 43.42 41.91 2rqy n LEU 156 CO 0.39 0.68 0.51 0.24 -1.22 0.00 0.00 177.39 177.99 2rqy h MET 157 N 1.27 -0.72 0.00 3.23 2.86 -0.52 0.44 114.93 121.49 2rqy h MET 157 Ca 0.00 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2rqy h MET 157 Cb 1.25 0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.07 2rqy h MET 157 CO 0.14 -0.48 0.00 -0.35 1.06 0.00 0.00 176.91 177.28 2rqy n PRO 158 N -5.25 0.07 -0.06 -0.22 -0.04 -1.25 -0.27 135.00 127.97 2rqy n PRO 158 Ca -0.09 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.55 2rqy n PRO 158 Cb 0.39 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.33 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 -0.56 0.54 3.64 -1.47 -3.30 116.57 115.42 2rqy h LYS 159 Ca 0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2rqy h LYS 159 Cb 0.21 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.95 2rqy h LYS 159 CO 0.00 0.15 0.13 0.66 -2.27 0.00 0.00 179.45 178.12 2rqy n TYR 160 N -4.68 1.91 -2.66 1.91 4.01 -0.00 -4.62 117.16 113.02 2rqy n TYR 160 Ca -0.06 -1.09 -0.04 0.00 -0.16 0.00 0.00 57.90 56.55 2rqy n TYR 160 Cb 0.19 -0.55 0.09 0.00 -0.31 0.00 0.00 39.34 38.75 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 -0.22 -3.69 -1.93 -0.72 0.00 0.62 -5.01 120.51 109.56 2rqy n ALA 161 Ca 0.34 -0.22 -0.30 0.00 0.00 0.00 0.00 53.44 53.26 2rqy n ALA 161 Cb 1.21 -3.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.18 2rqy n ALA 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2rqy n PRO 162 N 1.21 1.58 -3.04 0.00 -0.04 -1.22 -3.90 135.00 129.59 2rqy n PRO 162 Ca -0.02 -2.38 -0.17 0.00 -0.04 0.00 0.00 63.50 60.89 2rqy n PRO 162 Cb 0.73 -3.61 0.01 0.00 -0.04 0.00 0.00 33.50 30.59 2rqy n PRO 162 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2rqy s LYS 163 N 6.26 2.85 0.00 0.54 2.20 -1.26 -4.22 119.74 126.11 2rqy s LYS 163 Ca 0.67 -1.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.05 2rqy s LYS 163 Cb 0.02 -2.76 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 2rqy s LYS 163 CO 0.14 -0.25 0.00 0.00 -0.36 0.00 0.00 175.35 174.88 2rqy n ALA 164 N -1.84 0.00 -0.02 3.13 0.00 -1.26 -4.34 120.51 116.18 2rqy n ALA 164 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 2rqy n ALA 164 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.99 2rqy n ALA 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rqy h ALA 165 N 0.00 -0.44 0.00 0.00 0.00 -1.89 0.26 119.26 117.18 2rqy h ALA 165 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2rqy h ALA 165 Cb 0.00 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2rqy h ALA 165 CO 0.00 -0.85 -0.59 1.03 0.00 0.00 0.00 179.25 178.85 2rqy h SER 166 N -0.42 0.00 0.87 0.00 0.87 -1.76 -3.11 113.55 110.01 2rqy h SER 166 Ca 0.10 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2rqy h SER 166 Cb 0.58 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 2rqy h SER 166 CO -0.40 0.59 -0.07 0.00 -0.53 0.00 0.00 176.83 176.41 2rqy h ALA 167 N 1.41 1.03 -1.76 6.23 0.00 -1.59 -3.44 119.26 121.15 2rqy h ALA 167 Ca -0.01 -0.06 -0.44 0.00 0.00 0.00 0.00 54.91 54.40 2rqy h ALA 167 Cb 1.32 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.11 2rqy h ALA 167 CO 0.08 0.09 -0.34 1.03 0.00 0.00 0.00 179.25 180.11 2rqy s ARG 168 N -3.75 3.07 0.48 0.00 1.81 0.82 -4.95 118.95 116.44 2rqy s ARG 168 Ca 0.00 -1.05 0.23 0.00 -1.72 0.00 0.00 55.73 53.18 2rqy s ARG 168 Cb 0.10 -2.80 1.27 0.00 -0.45 0.00 0.00 34.95 33.07 2rqy s ARG 168 CO 0.56 0.03 1.93 1.15 -0.68 0.00 0.00 175.30 178.29 2rqy h THR 169 N 0.88 0.71 -1.18 0.02 2.02 -1.85 -3.38 112.91 110.13 2rqy h THR 169 Ca -0.45 -0.06 -0.30 0.00 0.77 0.00 0.00 66.41 66.36 2rqy h THR 169 Cb 1.26 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2rqy h THR 169 CO 0.52 0.03 1.02 -1.81 0.37 0.00 0.00 175.52 175.65 2rqy s ASP 170 N -5.94 4.38 0.00 4.18 1.01 -1.26 -5.09 116.67 113.95 2rqy s ASP 170 Ca -0.06 0.55 0.00 0.00 0.71 0.00 0.00 52.55 53.75 2rqy s ASP 170 Cb 0.21 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.61 2rqy s ASP 170 CO 0.76 -3.16 0.00 0.00 0.21 0.00 0.00 175.17 172.98