#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 -0.23 0.88 2.03 -3.43 -1.26 -5.15 115.29 108.13 2rqy s HIS 2 Ca 0.00 0.52 -0.11 0.00 -0.80 0.00 0.00 55.06 54.67 2rqy s HIS 2 Cb 0.00 0.08 0.12 0.00 -1.43 0.00 0.00 32.58 31.35 2rqy s HIS 2 CO 0.00 -0.19 1.14 -2.39 -2.00 0.00 0.00 174.74 171.30 2rqy n HIS 3 N 2.50 0.94 -2.81 0.38 -0.00 -1.26 -5.00 115.22 109.97 2rqy n HIS 3 Ca -0.15 0.40 -0.10 0.00 -0.00 0.00 0.00 57.72 57.86 2rqy n HIS 3 Cb 0.58 -2.03 0.07 0.00 -0.00 0.00 0.00 29.99 28.60 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 -3.86 -2.14 -4.30 -1.40 -0.00 -1.26 -5.14 115.22 97.12 2rqy n HIS 4 Ca 0.12 -2.44 -0.26 0.00 0.46 0.00 0.00 57.72 55.61 2rqy n HIS 4 Cb 0.51 1.19 -0.09 0.00 -0.12 0.00 0.00 29.99 31.49 2rqy n HIS 4 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2rqy s HIS 5 N -0.35 2.58 0.03 1.57 -0.00 -1.26 -5.16 115.29 112.70 2rqy s HIS 5 Ca 0.25 -0.61 -0.27 0.00 -0.00 0.00 0.00 55.06 54.44 2rqy s HIS 5 Cb 0.32 -1.88 0.07 0.00 -0.00 0.00 0.00 32.58 31.08 2rqy s HIS 5 CO -0.06 0.29 0.62 -3.38 -0.00 0.00 0.00 174.74 172.21 2rqy s HIS 6 N -2.63 -0.57 0.08 0.38 -3.43 -1.26 -5.17 115.29 102.69 2rqy s HIS 6 Ca 0.39 0.77 0.03 0.00 -0.80 0.00 0.00 55.06 55.45 2rqy s HIS 6 Cb 0.06 0.43 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 2rqy s HIS 6 CO 0.21 -0.67 0.07 -1.01 -2.00 0.00 0.00 174.74 171.33 2rqy s HIS 7 N -2.12 3.17 0.78 0.38 3.76 -1.26 -5.09 115.29 114.91 2rqy s HIS 7 Ca -0.07 0.07 -0.14 0.00 -0.15 0.00 0.00 55.06 54.76 2rqy s HIS 7 Cb -0.01 -1.61 0.04 0.00 1.11 0.00 0.00 32.58 32.11 2rqy s HIS 7 CO 0.01 0.52 0.97 0.44 -0.85 0.00 0.00 174.74 175.83 2rqy n ILE 8 N 0.47 2.08 -2.16 0.60 -5.35 -1.26 -2.55 119.36 111.20 2rqy n ILE 8 Ca -0.09 -0.28 -0.19 0.00 -0.27 0.00 0.00 62.75 61.91 2rqy n ILE 8 Cb 0.52 -1.06 -0.03 0.00 -1.74 0.00 0.00 39.64 37.33 2rqy n ILE 8 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2rqy n GLU 9 N -2.34 -1.50 -2.22 6.28 2.13 -1.26 -4.89 120.64 116.84 2rqy n GLU 9 Ca 0.12 1.01 -0.42 0.00 0.66 0.00 0.00 57.16 58.53 2rqy n GLU 9 Cb 0.50 -5.52 0.00 0.00 0.27 0.00 0.00 31.44 26.70 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 -0.90 4.70 3.78 8.31 0.00 -1.06 -4.54 105.19 115.48 2rqy n GLY 10 Ca -0.22 -2.00 -0.27 0.00 0.00 0.00 0.00 46.02 43.52 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 4.29 -6.48 -0.01 1.61 3.00 -1.26 -4.90 116.66 112.91 2rqy n ARG 11 Ca 0.42 0.69 -0.03 0.00 -0.01 0.00 0.00 57.85 58.92 2rqy n ARG 11 Cb 0.37 -5.64 -0.01 0.00 0.00 0.00 0.00 32.46 27.18 2rqy n ARG 11 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2rqy n HIS 12 N -4.79 0.00 -2.07 -1.55 -0.00 -1.26 -4.82 115.22 100.72 2rqy n HIS 12 Ca 0.01 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.77 2rqy n HIS 12 Cb 0.55 -0.18 -0.03 0.00 -0.12 0.00 0.00 29.99 30.21 2rqy n HIS 12 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2rqy s MET 13 N -2.07 3.97 -0.23 1.57 0.23 -1.26 -4.10 119.30 117.41 2rqy s MET 13 Ca -0.10 1.90 -0.01 0.00 -1.03 0.00 0.00 55.69 56.44 2rqy s MET 13 Cb 0.01 -4.01 0.00 0.00 -1.53 0.00 0.00 34.83 29.31 2rqy s MET 13 CO 0.15 -1.09 0.03 1.28 -2.03 0.00 0.00 175.02 173.36 2rqy n LEU 14 N 7.86 -6.77 -4.52 0.18 7.99 -1.26 -4.92 117.00 115.56 2rqy n LEU 14 Ca 0.18 1.12 -0.32 0.00 -0.01 0.00 0.00 56.01 56.98 2rqy n LEU 14 Cb 0.44 -2.86 0.15 0.00 -0.11 0.00 0.00 43.42 41.04 2rqy n LEU 14 CO 0.63 -2.68 0.25 0.54 -1.51 0.00 0.00 177.39 174.62 2rqy n ARG 15 N 0.83 -0.49 0.22 3.23 1.74 -1.26 -4.88 116.66 116.06 2rqy n ARG 15 Ca 0.00 -0.09 0.15 0.00 -0.77 0.00 0.00 57.85 57.15 2rqy n ARG 15 Cb 0.16 -2.09 0.63 0.00 -1.02 0.00 0.00 32.46 30.14 2rqy n ARG 15 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2rqy h PRO 16 N -1.77 0.00 0.00 5.56 0.13 -1.92 -3.44 132.00 130.56 2rqy h PRO 16 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2rqy h PRO 16 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2rqy h PRO 16 CO 0.38 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.56 2rqy n GLY 17 N -0.01 0.27 3.47 1.56 0.00 -1.26 -5.03 105.19 104.19 2rqy n GLY 17 Ca 0.01 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 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 -4.58 -3.65 1.61 2.03 -1.26 -5.01 116.55 105.68 2rqy n ASP 18 Ca 0.00 -0.80 -0.14 0.00 0.52 0.00 0.00 54.79 54.37 2rqy n ASP 18 Cb 0.00 -4.51 -0.08 0.00 -0.72 0.00 0.00 41.12 35.81 2rqy n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2rqy s GLU 20 N 0.07 1.92 -0.79 0.00 -1.05 -1.26 -4.64 118.70 112.95 2rqy s GLU 20 Ca -0.02 -1.84 0.00 0.00 -0.15 0.00 0.00 54.97 52.96 2rqy s GLU 20 Cb -0.04 -1.81 0.00 0.00 -0.44 0.00 0.00 34.13 31.84 2rqy s GLU 20 CO 0.02 0.16 0.00 0.28 0.95 0.00 0.00 175.26 176.67 2rqy n VAL 21 N -0.85 0.00 -4.04 1.83 0.31 -1.26 -4.25 118.33 110.08 2rqy n VAL 21 Ca -0.05 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.17 2rqy n VAL 21 Cb 0.63 -1.17 -0.05 0.00 -0.91 0.00 0.00 33.84 32.34 2rqy n VAL 21 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rqy n ILE 23 N -0.44 -0.08 -0.02 0.00 -0.00 -1.26 -4.86 119.36 112.70 2rqy n ILE 23 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 62.75 62.73 2rqy n ILE 23 Cb 0.62 -1.94 -0.00 0.00 -0.00 0.00 0.00 39.64 38.32 2rqy n ILE 23 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 2rqy h SER 24 N 0.00 0.00 0.00 4.38 0.02 -1.97 -3.34 113.55 112.64 2rqy h SER 24 Ca -0.41 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 2rqy h SER 24 Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 2rqy h SER 24 CO 0.58 0.19 -0.14 0.22 -1.14 0.00 0.00 176.83 176.54 2rqy h TYR 25 N -0.28 0.00 -0.61 3.45 3.20 -1.91 -3.28 116.97 117.54 2rqy h TYR 25 Ca 0.00 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.05 2rqy h TYR 25 Cb 0.10 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2rqy h TYR 25 CO -0.04 0.60 0.56 -0.07 -1.64 0.00 0.00 178.16 177.56 2rqy h LEU 26 N -1.00 0.00 -0.53 2.82 -0.00 -1.97 0.28 115.31 114.92 2rqy h LEU 26 Ca -0.03 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.69 2rqy h LEU 26 Cb 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.27 2rqy h LEU 26 CO -0.02 0.00 -0.65 1.23 -0.00 0.00 0.00 178.44 179.01 2rqy h GLY 27 N 0.00 0.39 1.29 0.83 0.00 -1.69 -2.53 103.07 101.36 2rqy h GLY 27 Ca 0.29 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2rqy h GLY 27 CO -0.00 0.46 -0.45 -0.96 0.00 0.00 0.00 176.54 175.58 2rqy n ARG 28 N -3.87 0.16 -0.07 4.80 1.85 0.86 -3.44 116.66 116.94 2rqy n ARG 28 Ca -0.03 0.06 -0.11 0.00 -1.00 0.00 0.00 57.85 56.76 2rqy n ARG 28 Cb 0.65 -1.61 -0.08 0.00 -1.05 0.00 0.00 32.46 30.36 2rqy n ARG 28 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 2rqy h PHE 29 N 0.00 0.00 -0.03 2.89 3.04 -1.08 -3.35 116.94 118.41 2rqy h PHE 29 Ca 0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2rqy h PHE 29 Cb 0.64 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.14 2rqy h PHE 29 CO 0.00 0.76 -0.05 0.10 -2.02 0.00 0.00 178.31 177.10 2rqy h TYR 30 N -1.00 0.04 -0.25 0.41 -0.00 -1.61 -1.58 116.97 112.97 2rqy h TYR 30 Ca -0.08 -0.00 0.07 0.00 -0.00 0.00 0.00 58.73 58.73 2rqy h TYR 30 Cb 0.77 -0.01 -0.01 0.00 -0.00 0.00 0.00 36.73 37.48 2rqy h TYR 30 CO 0.12 0.09 0.18 0.37 -0.00 0.00 0.00 178.16 178.92 2rqy h GLN 31 N 0.04 0.00 0.19 0.10 4.15 -1.69 -0.97 115.11 116.94 2rqy h GLN 31 Ca 0.01 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.12 2rqy h GLN 31 Cb 0.11 0.00 0.03 0.00 0.21 0.00 0.00 27.48 27.82 2rqy h GLN 31 CO 0.01 0.00 -1.36 -0.44 -1.93 0.00 0.00 178.83 175.10 2rqy h ASP 32 N 0.00 0.70 -0.48 -0.69 5.19 -1.42 -2.94 116.42 116.78 2rqy h ASP 32 Ca 0.12 -0.73 -0.04 0.00 -0.62 0.00 0.00 57.03 55.76 2rqy h ASP 32 Cb 0.49 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 2rqy h ASP 32 CO -0.00 1.56 0.14 -0.07 -3.12 0.00 0.00 179.24 177.75 2rqy h LEU 33 N 0.14 0.70 -0.44 1.55 3.38 -1.20 -2.18 115.31 117.26 2rqy h LEU 33 Ca -0.20 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2rqy h LEU 33 Cb 2.06 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.63 2rqy h LEU 33 CO 0.25 0.73 0.00 0.29 0.09 0.00 0.00 178.44 179.80 2rqy n LYS 34 N -4.51 0.21 -0.79 1.13 4.76 -0.48 -3.18 118.16 115.30 2rqy n LYS 34 Ca 0.01 0.34 -0.10 0.00 -2.87 0.00 0.00 58.31 55.69 2rqy n LYS 34 Cb 0.20 -1.83 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 2rqy n LYS 34 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2rqy n ASP 35 N -2.21 5.94 -3.43 4.39 2.03 -0.83 -4.76 116.55 117.69 2rqy n ASP 35 Ca 0.03 -2.77 -0.23 0.00 0.52 0.00 0.00 54.79 52.34 2rqy n ASP 35 Cb 0.30 -1.13 -0.02 0.00 -0.72 0.00 0.00 41.12 39.55 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 1.00 -2.81 -0.01 -0.67 0.00 -1.22 -4.77 116.66 108.18 2rqy n ARG 36 Ca 0.20 0.34 0.05 0.00 -0.00 0.00 0.00 57.85 58.45 2rqy n ARG 36 Cb 0.57 -4.99 -0.09 0.00 0.00 0.00 0.00 32.46 27.95 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 -2.19 2.36 -3.75 6.15 -0.08 -1.19 -5.02 116.55 112.84 2rqy n ASP 37 Ca 0.01 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.16 2rqy n ASP 37 Cb 0.52 1.49 -0.09 0.00 2.34 0.00 0.00 41.12 45.38 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 -2.78 0.03 0.41 5.18 1.01 -1.19 -4.94 120.40 118.13 2rqy s VAL 38 Ca -0.04 -0.27 -0.24 0.00 0.00 0.00 0.00 61.98 61.42 2rqy s VAL 38 Cb 0.07 -0.58 -0.08 0.00 0.00 0.00 0.00 36.38 35.78 2rqy s VAL 38 CO 0.48 -0.15 1.11 -0.89 0.00 0.00 0.00 175.10 175.65 2rqy s THR 39 N -0.72 3.42 -1.07 3.92 2.01 -1.26 -4.63 115.64 117.31 2rqy s THR 39 Ca -0.08 1.11 -0.08 0.00 0.31 0.00 0.00 61.69 62.94 2rqy s THR 39 Cb -0.04 -3.58 -0.14 0.00 0.01 0.00 0.00 72.50 68.75 2rqy s THR 39 CO 0.03 0.03 3.16 0.49 -0.69 0.00 0.00 174.62 177.63 2rqy n PHE 40 N -0.14 1.63 -4.28 4.92 3.72 -1.26 -4.25 117.46 117.80 2rqy n PHE 40 Ca 0.05 -2.55 -0.23 0.00 -0.05 0.00 0.00 57.45 54.67 2rqy n PHE 40 Cb 0.48 -2.16 -0.12 0.00 -0.94 0.00 0.00 39.48 36.74 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 2.01 2.50 0.00 4.37 0.01 -1.26 -4.67 113.70 116.66 2rqy s SER 41 Ca 0.68 -0.70 0.15 0.00 1.31 0.00 0.00 55.95 57.39 2rqy s SER 41 Cb 0.23 -0.13 0.70 0.00 0.21 0.00 0.00 66.02 67.03 2rqy s SER 41 CO -0.05 0.04 1.42 -0.81 0.41 0.00 0.00 173.24 174.26 2rqy n PRO 42 N 1.03 0.15 -0.01 12.44 -0.04 -1.26 -1.14 135.00 146.16 2rqy n PRO 42 Ca -0.19 0.18 0.05 0.00 -0.04 0.00 0.00 63.50 63.50 2rqy n PRO 42 Cb 0.54 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.35 2.41 0.03 0.55 0.00 -1.26 -3.90 120.51 116.98 2rqy n ALA 43 Ca 0.06 -0.34 0.11 0.00 0.00 0.00 0.00 53.44 53.26 2rqy n ALA 43 Cb 0.13 -0.40 -0.11 0.00 0.00 0.00 0.00 19.45 19.07 2rqy n ALA 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2rqy n THR 44 N -1.98 0.27 -0.03 0.00 -1.04 -0.99 -3.84 114.28 106.67 2rqy n THR 44 Ca -0.04 -0.53 -0.17 0.00 -2.04 0.00 0.00 64.05 61.27 2rqy n THR 44 Cb 0.38 -0.14 -0.14 0.00 -1.82 0.00 0.00 70.33 68.61 2rqy n THR 44 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2rqy n ILE 45 N -2.43 1.68 0.24 12.58 5.41 -0.29 -4.10 119.36 132.44 2rqy n ILE 45 Ca -0.03 -0.69 0.12 0.00 1.00 0.00 0.00 62.75 63.14 2rqy n ILE 45 Cb 0.58 -1.44 0.55 0.00 -0.71 0.00 0.00 39.64 38.63 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 -1.76 -0.91 114.58 116.44 2rqy h GLU 46 Ca -0.42 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.94 2rqy h GLU 46 Cb 2.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.27 2rqy h GLU 46 CO 0.06 0.17 -0.32 1.05 0.07 0.00 0.00 179.01 180.03 2rqy h GLU 47 N 0.00 0.00 0.00 1.06 4.11 -1.71 -2.74 114.58 115.29 2rqy h GLU 47 Ca -0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.14 2rqy h GLU 47 Cb 0.63 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2rqy h GLU 47 CO 0.02 0.32 -1.70 0.39 0.07 0.00 0.00 179.01 178.11 2rqy n GLU 48 N -3.41 0.56 -0.34 1.06 -0.58 -0.98 -4.37 120.64 112.59 2rqy n GLU 48 Ca 0.00 0.40 0.12 0.00 -0.42 0.00 0.00 57.16 57.27 2rqy n GLU 48 Cb 0.51 -1.60 0.31 0.00 -0.57 0.00 0.00 31.44 30.09 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 0.71 -0.83 -4.62 5.85 -1.29 -0.14 115.31 113.99 2rqy h LEU 49 Ca -0.43 0.10 0.18 0.00 0.84 0.00 0.00 57.88 58.57 2rqy h LEU 49 Cb 1.33 -0.02 -0.11 0.00 0.37 0.00 0.00 40.66 42.23 2rqy h LEU 49 CO -0.26 0.24 0.34 -0.29 -0.34 0.00 0.00 178.44 178.14 2rqy h ILE 50 N 0.71 0.57 -0.46 4.05 2.10 -1.69 0.26 117.51 123.05 2rqy h ILE 50 Ca 0.56 -0.15 -0.01 0.00 1.08 0.00 0.00 64.86 66.34 2rqy h ILE 50 Cb 0.89 0.10 -0.02 0.00 -1.09 0.00 0.00 36.82 36.69 2rqy h ILE 50 CO -0.39 0.08 0.23 0.11 -1.08 0.00 0.00 178.15 177.10 2rqy h LYS 51 N 0.43 0.66 -0.84 2.19 1.79 -1.22 -2.35 116.57 117.23 2rqy h LYS 51 Ca 0.49 -0.09 -0.00 0.00 -2.18 0.00 0.00 60.65 58.86 2rqy h LYS 51 Cb 0.83 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.31 2rqy h LYS 51 CO -0.47 0.55 0.52 0.74 -1.08 0.00 0.00 179.45 179.72 2rqy h PHE 52 N 0.61 1.09 0.75 -1.35 -1.00 -0.91 0.13 116.94 116.26 2rqy h PHE 52 Ca 0.16 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.91 2rqy h PHE 52 Cb 0.10 -0.36 0.00 0.00 3.61 0.00 0.00 35.95 39.30 2rqy h PHE 52 CO -0.01 0.72 -0.40 0.00 -1.61 0.00 0.00 178.31 177.00 2rqy h ARG 54 N -1.06 0.00 -0.49 0.00 3.08 -1.38 -1.18 114.38 113.35 2rqy h ARG 54 Ca -0.10 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.75 2rqy h ARG 54 Cb 0.83 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.76 2rqy h ARG 54 CO 0.14 0.02 0.10 -1.91 -1.07 0.00 0.00 179.97 177.25 2rqy n GLU 55 N -3.23 2.38 -4.10 0.04 2.13 0.44 -4.99 120.64 113.30 2rqy n GLU 55 Ca -0.02 -3.07 -0.27 0.00 0.66 0.00 0.00 57.16 54.46 2rqy n GLU 55 Cb 0.14 -1.93 -0.06 0.00 0.27 0.00 0.00 31.44 29.86 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 -3.14 3.49 -0.23 4.31 0.00 0.13 -4.87 121.76 121.45 2rqy s ALA 56 Ca 0.47 -1.22 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 2rqy s ALA 56 Cb 0.41 -1.30 0.12 0.00 0.00 0.00 0.00 23.12 22.35 2rqy s ALA 56 CO 0.05 0.53 0.34 0.50 0.00 0.00 0.00 175.76 177.18 2rqy s ARG 57 N -2.98 0.30 0.00 0.00 3.52 -1.26 -4.70 118.95 113.83 2rqy s ARG 57 Ca 0.30 0.47 0.00 0.00 -0.13 0.00 0.00 55.73 56.37 2rqy s ARG 57 Cb -0.10 -0.64 0.00 0.00 -1.56 0.00 0.00 34.95 32.65 2rqy s ARG 57 CO 0.22 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.49 2rqy n GLY 58 N 5.35 0.59 0.22 8.12 0.00 -1.26 -4.44 105.19 113.77 2rqy n GLY 58 Ca -0.04 -1.62 0.15 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.98 0.02 116.57 118.32 2rqy h LYS 59 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 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 -0.23 0.93 -2.00 0.00 0.00 179.45 178.15 2rqy h GLU 60 N 0.00 0.00 0.02 0.07 5.08 -1.93 -3.22 114.58 114.60 2rqy h GLU 60 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 2rqy h GLU 60 Cb 0.10 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 2rqy h GLU 60 CO 0.00 0.09 -2.00 -1.71 -1.00 0.00 0.00 179.01 174.39 2rqy n ASN 61 N -3.07 0.98 0.24 1.42 2.85 -0.07 -3.93 115.26 113.68 2rqy n ASN 61 Ca 0.03 0.23 0.16 0.00 -0.11 0.00 0.00 54.58 54.89 2rqy n ASN 61 Cb 0.57 0.03 0.69 0.00 1.24 0.00 0.00 39.78 42.31 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 0.00 1.20 0.11 -1.48 -2.65 114.38 111.57 2rqy h ARG 62 Ca -0.40 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.68 2rqy h ARG 62 Cb 2.07 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 33.15 2rqy h ARG 62 CO 0.05 0.00 -0.02 -0.07 0.10 0.00 0.00 179.97 180.04 2rqy h LEU 63 N 0.00 0.00 -1.35 0.08 4.07 -1.69 -3.08 115.31 113.33 2rqy h LEU 63 Ca 0.00 -0.21 0.14 0.00 0.08 0.00 0.00 57.88 57.89 2rqy h LEU 63 Cb 0.39 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.07 2rqy h LEU 63 CO 0.00 0.62 0.56 0.00 -1.08 0.00 0.00 178.44 178.53 2rqy h TYR 65 N 0.63 0.85 -0.10 0.00 3.20 -1.60 0.26 116.97 120.21 2rqy h TYR 65 Ca 0.43 -0.13 -0.21 0.00 3.14 0.00 0.00 58.73 61.96 2rqy h TYR 65 Cb 0.74 -0.23 0.01 0.00 1.54 0.00 0.00 36.73 38.79 2rqy h TYR 65 CO -0.00 0.81 -0.74 -0.92 -1.64 0.00 0.00 178.16 175.67 2rqy h TYR 66 N 0.73 0.94 -0.04 -3.82 3.20 -0.88 -3.23 116.97 113.85 2rqy h TYR 66 Ca 0.13 -0.44 -0.14 0.00 3.14 0.00 0.00 58.73 61.42 2rqy h TYR 66 Cb 0.51 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 2rqy h TYR 66 CO 0.03 1.26 -0.63 0.82 -1.64 0.00 0.00 178.16 178.00 2rqy h ILE 67 N 0.35 1.41 -2.85 1.81 2.04 -0.88 -3.49 117.51 115.90 2rqy h ILE 67 Ca -0.06 -2.07 0.00 0.00 1.00 0.00 0.00 64.86 63.72 2rqy h ILE 67 Cb 1.39 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 2rqy h ILE 67 CO 0.15 0.60 0.00 0.61 0.00 0.00 0.00 178.15 179.52 2rqy n GLY 68 N 0.30 -0.15 0.07 5.37 0.00 0.89 -4.65 105.19 107.03 2rqy n GLY 68 Ca -0.02 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.99 1.68 -2.14 4.61 0.00 -1.10 -3.71 120.51 118.86 2rqy n ALA 69 Ca 0.00 -0.64 -0.21 0.00 0.00 0.00 0.00 53.44 52.60 2rqy n ALA 69 Cb 0.48 0.15 0.02 0.00 0.00 0.00 0.00 19.45 20.10 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 -2.30 3.26 0.26 0.00 -1.32 -1.26 -4.70 115.64 109.58 2rqy s THR 70 Ca -0.20 -0.72 0.02 0.00 -1.21 0.00 0.00 61.69 59.59 2rqy s THR 70 Cb 0.05 -3.18 0.04 0.00 -1.51 0.00 0.00 72.50 67.90 2rqy s THR 70 CO 0.35 -0.11 1.67 -0.78 -2.21 0.00 0.00 174.62 173.54 2rqy h ASP 71 N 0.36 0.47 -0.11 8.08 3.58 -1.96 -2.66 116.42 124.18 2rqy h ASP 71 Ca -0.43 -0.19 0.03 0.00 0.42 0.00 0.00 57.03 56.86 2rqy h ASP 71 Cb 1.28 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 42.19 2rqy h ASP 71 CO 0.52 0.78 0.17 0.44 -2.88 0.00 0.00 179.24 178.27 2rqy h ASP 72 N 0.39 0.00 0.40 2.28 3.32 -2.01 0.12 116.42 120.92 2rqy h ASP 72 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2rqy h ASP 72 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2rqy h ASP 72 CO 0.06 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.58 2rqy n ALA 73 N -2.23 1.39 -3.33 3.45 0.00 -1.00 -4.86 120.51 113.92 2rqy n ALA 73 Ca -0.00 0.12 -0.18 0.00 0.00 0.00 0.00 53.44 53.38 2rqy n ALA 73 Cb 0.27 -1.34 0.06 0.00 0.00 0.00 0.00 19.45 18.44 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 -1.75 -1.06 0.00 0.00 0.00 0.42 -4.90 120.51 113.22 2rqy n ALA 74 Ca 0.01 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2rqy n ALA 74 Cb 0.14 -4.19 0.00 0.00 0.00 0.00 0.00 19.45 15.40 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 -4.36 0.00 -2.39 0.00 5.66 -1.26 -5.04 114.28 106.89 2rqy n THR 75 Ca -0.01 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.85 2rqy n THR 75 Cb 0.55 -0.53 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 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 -2.00 -1.66 -4.13 1.09 4.81 -1.26 -5.00 118.16 110.01 2rqy n LYS 76 Ca 0.00 0.63 -0.14 0.00 -0.87 0.00 0.00 58.31 57.93 2rqy n LYS 76 Cb 0.38 -4.85 -0.06 0.00 0.02 0.00 0.00 35.03 30.51 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 -2.74 0.00 0.00 3.15 -5.25 -1.26 -5.07 121.20 110.03 2rqy s ILE 77 Ca 0.06 -1.72 0.00 0.00 -0.99 0.00 0.00 60.65 57.99 2rqy s ILE 77 Cb -0.02 -2.50 0.00 0.00 2.95 0.00 0.00 42.46 42.89 2rqy s ILE 77 CO 0.07 0.00 0.67 0.00 -1.79 0.00 0.00 174.94 173.89 2rqy n ILE 78 N -0.47 0.00 0.99 8.37 3.06 -1.24 -3.98 119.36 126.09 2rqy n ILE 78 Ca 0.02 0.00 0.05 0.00 -2.50 0.00 0.00 62.75 60.32 2rqy n ILE 78 Cb 0.63 0.20 0.14 0.00 0.54 0.00 0.00 39.64 41.14 2rqy n ILE 78 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 2rqy n ASN 79 N 0.00 1.70 -0.24 9.51 4.13 -1.26 -3.20 115.26 125.91 2rqy n ASN 79 Ca -0.11 -2.02 0.11 0.00 1.68 0.00 0.00 54.58 54.24 2rqy n ASN 79 Cb 0.56 -0.22 -0.00 0.00 -1.54 0.00 0.00 39.78 38.57 2rqy n ASN 79 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2rqy n GLU 80 N 0.40 0.60 0.00 3.52 -0.58 -1.26 -3.74 120.64 119.58 2rqy n GLU 80 Ca 0.10 -0.48 0.00 0.00 -0.42 0.00 0.00 57.16 56.36 2rqy n GLU 80 Cb 0.28 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2rqy n GLU 80 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 2rqy n VAL 81 N -0.78 0.10 0.06 2.62 3.14 -1.23 -4.84 118.33 117.41 2rqy n VAL 81 Ca 0.07 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 2rqy n VAL 81 Cb 0.39 1.26 0.00 0.00 -1.06 0.00 0.00 33.84 34.43 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 -0.05 0.81 -0.07 6.55 7.64 -1.19 -4.37 113.62 122.93 2rqy n SER 82 Ca 0.00 0.18 -0.13 0.00 1.01 0.00 0.00 58.87 59.93 2rqy n SER 82 Cb 0.37 -0.19 -0.08 0.00 -1.01 0.00 0.00 64.21 63.29 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 0.00 -0.46 -0.34 1.43 3.64 -1.78 0.28 116.57 119.33 2rqy h LYS 83 Ca 0.00 0.03 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 2rqy h LYS 83 Cb 0.00 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2rqy h LYS 83 CO 0.00 -0.30 -0.34 -1.00 -2.27 0.00 0.00 179.45 175.54 2rqy h PRO 84 N -0.47 0.83 -0.66 1.90 0.13 -1.89 -2.80 132.00 129.04 2rqy h PRO 84 Ca 0.07 -0.44 0.07 0.00 -0.87 0.00 0.00 66.00 64.83 2rqy h PRO 84 Cb 0.64 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 31.74 2rqy h PRO 84 CO -0.51 1.08 0.44 -0.07 -0.23 0.00 0.00 178.00 178.71 2rqy h LEU 85 N 0.62 0.56 0.00 1.56 -0.00 -1.64 0.11 115.31 116.51 2rqy h LEU 85 Ca 0.05 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 2rqy h LEU 85 Cb 0.92 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.47 2rqy h LEU 85 CO 0.08 0.35 -0.13 0.00 -0.00 0.00 0.00 178.44 178.75 2rqy n ALA 86 N -2.47 2.44 -0.54 1.53 0.00 0.93 -3.43 120.51 118.96 2rqy n ALA 86 Ca 0.10 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.34 2rqy n ALA 86 Cb 0.27 -1.41 0.17 0.00 0.00 0.00 0.00 19.45 18.48 2rqy n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rqy n HIS 87 N -2.14 2.04 -2.43 0.00 8.25 0.37 -4.87 115.22 116.45 2rqy n HIS 87 Ca 0.05 -1.25 -0.08 0.00 -0.26 0.00 0.00 57.72 56.19 2rqy n HIS 87 Cb 0.42 -0.67 0.04 0.00 1.12 0.00 0.00 29.99 30.90 2rqy n HIS 87 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2rqy n HIS 88 N -0.42 -1.25 -3.19 4.41 -0.00 -1.21 -5.02 115.22 108.53 2rqy n HIS 88 Ca 0.38 0.44 -0.23 0.00 -0.00 0.00 0.00 57.72 58.31 2rqy n HIS 88 Cb 1.25 -3.36 -0.06 0.00 -0.00 0.00 0.00 29.99 27.82 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 -2.41 -0.53 -2.04 1.59 5.41 -1.12 -5.01 119.36 115.25 2rqy n ILE 89 Ca -0.05 -4.15 -0.38 0.00 1.00 0.00 0.00 62.75 59.18 2rqy n ILE 89 Cb 0.56 -1.65 -0.03 0.00 -0.71 0.00 0.00 39.64 37.82 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 -1.44 2.62 -0.71 0.38 0.04 -1.26 -3.75 135.00 130.88 2rqy s PRO 90 Ca 0.36 0.57 -0.07 0.00 0.04 0.00 0.00 61.00 61.90 2rqy s PRO 90 Cb 0.20 -4.42 0.07 0.00 0.04 0.00 0.00 34.50 30.40 2rqy s PRO 90 CO -0.10 -2.76 0.21 1.55 0.04 0.00 0.00 177.00 175.94 2rqy n VAL 91 N 7.24 -0.17 -0.05 -0.36 3.14 -1.26 -4.75 118.33 122.12 2rqy n VAL 91 Ca 0.21 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.52 2rqy n VAL 91 Cb 0.52 -0.48 -0.14 0.00 -1.06 0.00 0.00 33.84 32.67 2rqy n VAL 91 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2rqy n GLU 92 N -3.06 0.66 -0.00 1.45 2.13 -1.25 -4.27 120.64 116.29 2rqy n GLU 92 Ca 0.02 0.14 0.09 0.00 0.66 0.00 0.00 57.16 58.08 2rqy n GLU 92 Cb 0.50 -1.67 -0.13 0.00 0.27 0.00 0.00 31.44 30.41 2rqy n GLU 92 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2rqy n LYS 93 N -2.88 0.63 -0.36 5.31 4.81 -1.26 0.01 118.16 124.42 2rqy n LYS 93 Ca -0.22 -0.07 0.09 0.00 -0.87 0.00 0.00 58.31 57.24 2rqy n LYS 93 Cb 1.06 -1.43 0.27 0.00 0.02 0.00 0.00 35.03 34.95 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 0.84 0.00 3.15 5.03 -1.91 -3.07 117.51 121.54 2rqy h ILE 94 Ca 0.00 -0.31 0.00 0.00 -0.12 0.00 0.00 64.86 64.43 2rqy h ILE 94 Cb 0.62 -0.15 0.00 0.00 -3.03 0.00 0.00 36.82 34.26 2rqy h ILE 94 CO 0.00 0.17 0.00 0.00 -0.68 0.00 0.00 178.15 177.64 2rqy h GLU 96 N 0.00 -0.40 -0.14 0.00 4.22 -1.78 0.34 114.58 116.83 2rqy h GLU 96 Ca 0.00 0.03 -0.06 0.00 0.08 0.00 0.00 59.36 59.41 2rqy h GLU 96 Cb 0.00 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2rqy h GLU 96 CO 0.00 -0.27 -0.15 -0.22 -2.18 0.00 0.00 179.01 176.19 2rqy h LYS 97 N -0.41 0.34 -0.93 1.92 1.63 -0.62 -3.02 116.57 115.48 2rqy h LYS 97 Ca 0.02 -0.19 0.27 0.00 -0.85 0.00 0.00 60.65 59.90 2rqy h LYS 97 Cb 0.46 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.06 2rqy h LYS 97 CO -0.27 0.74 0.67 1.25 -3.45 0.00 0.00 179.45 178.39 2rqy h LEU 98 N -0.04 0.00 -1.70 5.20 6.46 -1.42 0.87 115.31 124.67 2rqy h LEU 98 Ca 0.02 0.00 0.29 0.00 -0.12 0.00 0.00 57.88 58.07 2rqy h LEU 98 Cb 0.69 -0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.55 2rqy h LEU 98 CO 0.04 0.00 0.73 0.50 -0.62 0.00 0.00 178.44 179.09 2rqy h LYS 99 N 0.00 0.18 -0.88 1.25 1.63 -0.19 0.33 116.57 118.89 2rqy h LYS 99 Ca 0.44 -0.01 0.19 0.00 -0.85 0.00 0.00 60.65 60.42 2rqy h LYS 99 Cb 1.77 -0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 33.29 2rqy h LYS 99 CO -0.01 0.12 0.58 -0.22 -3.45 0.00 0.00 179.45 176.47 2rqy h LYS 100 N 0.19 0.45 0.00 1.90 3.11 -1.01 -1.85 116.57 119.36 2rqy h LYS 100 Ca 0.55 -0.03 -0.26 0.00 -2.81 0.00 0.00 60.65 58.10 2rqy h LYS 100 Cb 1.80 -0.10 -0.04 0.00 -1.00 0.00 0.00 32.23 32.89 2rqy h LYS 100 CO -0.14 0.30 -1.72 1.17 -2.81 0.00 0.00 179.45 176.25 2rqy n LYS 101 N -4.53 0.56 -3.86 1.90 4.81 0.10 -4.81 118.16 112.33 2rqy n LYS 101 Ca 0.18 0.34 -0.29 0.00 -0.87 0.00 0.00 58.31 57.68 2rqy n LYS 101 Cb 0.63 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 34.01 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 -6.81 4.28 0.45 3.14 1.01 -0.33 -4.91 116.67 113.50 2rqy s ASP 102 Ca -0.32 -3.34 0.31 0.00 0.71 0.00 0.00 52.55 49.90 2rqy s ASP 102 Cb 0.09 -1.49 1.29 0.00 1.01 0.00 0.00 42.92 43.83 2rqy s ASP 102 CO 0.47 -0.17 1.91 -1.28 0.21 0.00 0.00 175.17 176.31 2rqy h SER 103 N 5.99 0.00 0.50 0.27 0.87 -1.56 -2.44 113.55 117.18 2rqy h SER 103 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2rqy h SER 103 Cb 0.84 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2rqy h SER 103 CO 0.66 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.96 2rqy n GLN 104 N -2.78 0.11 -0.32 2.24 10.64 -1.26 -2.65 117.38 123.35 2rqy n GLN 104 Ca 0.01 0.41 -0.04 0.00 -1.83 0.00 0.00 57.00 55.54 2rqy n GLN 104 Cb 0.26 -1.74 0.08 0.00 -0.86 0.00 0.00 30.24 27.98 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 1.26 0.00 -0.39 2.10 -1.83 0.25 117.51 118.89 2rqy h ILE 105 Ca 0.00 -0.69 0.00 0.00 1.08 0.00 0.00 64.86 65.25 2rqy h ILE 105 Cb 0.25 0.11 0.00 0.00 -1.09 0.00 0.00 36.82 36.09 2rqy h ILE 105 CO 0.00 0.30 -0.10 0.00 -1.08 0.00 0.00 178.15 177.28 2rqy h GLU 107 N -0.55 0.09 -2.74 0.00 4.57 -1.66 -3.37 114.58 110.92 2rqy h GLU 107 Ca 0.00 -0.01 0.33 0.00 -1.18 0.00 0.00 59.36 58.50 2rqy h GLU 107 Cb 0.10 -0.02 -0.09 0.00 -0.16 0.00 0.00 28.75 28.57 2rqy h GLU 107 CO 0.00 0.06 -0.51 -0.11 -1.18 0.00 0.00 179.01 177.27 2rqy n LEU 108 N -5.24 -0.63 -4.80 1.64 7.94 0.86 -4.40 117.00 112.38 2rqy n LEU 108 Ca 0.05 1.39 -0.36 0.00 -1.11 0.00 0.00 56.01 55.98 2rqy n LEU 108 Cb 0.25 -3.74 -0.07 0.00 0.53 0.00 0.00 43.42 40.39 2rqy n LEU 108 CO 0.16 -3.15 -0.21 -0.54 -1.11 0.00 0.00 177.39 172.54 2rqy s LYS 109 N -2.25 3.46 -1.17 1.96 1.02 -1.26 -4.37 119.74 117.13 2rqy s LYS 109 Ca 0.00 -0.22 -0.03 0.00 0.02 0.00 0.00 55.97 55.73 2rqy s LYS 109 Cb 0.00 -3.12 0.02 0.00 -0.52 0.00 0.00 37.83 34.21 2rqy s LYS 109 CO 0.00 0.66 0.20 0.98 -0.92 0.00 0.00 175.35 176.27 2rqy n TYR 110 N 2.33 -1.57 -1.51 3.18 4.19 -1.26 -4.91 117.16 117.61 2rqy n TYR 110 Ca -0.19 0.18 -0.33 0.00 3.31 0.00 0.00 57.90 60.88 2rqy n TYR 110 Cb 0.54 -2.97 0.08 0.00 0.49 0.00 0.00 39.34 37.47 2rqy n TYR 110 CO 0.00 0.00 0.00 0.16 0.91 0.00 0.00 176.86 177.93 2rqy s ASP 111 N -2.29 4.59 0.68 2.98 -4.77 -1.26 -4.96 116.67 111.63 2rqy s ASP 111 Ca 0.14 2.08 -0.17 0.00 -3.30 0.00 0.00 52.55 51.31 2rqy s ASP 111 Cb -0.07 -2.56 -0.01 0.00 -1.09 0.00 0.00 42.92 39.19 2rqy s ASP 111 CO 0.18 -1.98 0.99 0.29 0.70 0.00 0.00 175.17 175.35 2rqy n LYS 112 N -2.82 0.67 -3.49 2.11 4.76 -1.26 -5.00 118.16 113.13 2rqy n LYS 112 Ca 0.11 0.28 -0.28 0.00 -2.87 0.00 0.00 58.31 55.55 2rqy n LYS 112 Cb 0.52 -2.23 -0.11 0.00 -1.84 0.00 0.00 35.03 31.37 2rqy n LYS 112 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2rqy s GLN 113 N -3.17 1.08 -0.08 1.97 -0.21 -1.26 -4.90 119.66 113.09 2rqy s GLN 113 Ca 0.75 -2.15 -0.13 0.00 0.02 0.00 0.00 55.36 53.85 2rqy s GLN 113 Cb -0.37 -1.73 0.03 0.00 1.00 0.00 0.00 33.01 31.95 2rqy s GLN 113 CO 0.48 -1.33 0.33 -1.50 -2.12 0.00 0.00 175.29 171.15 2rqy s ILE 114 N 0.03 0.03 -1.32 1.08 -1.16 -1.26 -5.08 121.20 113.52 2rqy s ILE 114 Ca 0.29 -0.21 -0.16 0.00 -0.51 0.00 0.00 60.65 60.05 2rqy s ILE 114 Cb -0.03 -0.54 0.08 0.00 0.61 0.00 0.00 42.46 42.58 2rqy s ILE 114 CO -0.15 -0.12 1.81 0.47 -2.81 0.00 0.00 174.94 174.15 2rqy n ASP 115 N 2.17 4.76 -0.01 4.50 9.92 -1.26 -4.62 116.55 132.02 2rqy n ASP 115 Ca -0.17 -2.92 -0.01 0.00 -0.53 0.00 0.00 54.79 51.17 2rqy n ASP 115 Cb 0.57 -1.70 -0.00 0.00 -0.64 0.00 0.00 41.12 39.34 2rqy n ASP 115 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 2rqy n LEU 116 N 7.47 0.24 0.00 0.64 7.94 -1.26 -5.05 117.00 126.99 2rqy n LEU 116 Ca 0.48 0.04 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 2rqy n LEU 116 Cb 0.44 -0.40 0.00 0.00 0.53 0.00 0.00 43.42 43.99 2rqy n LEU 116 CO 0.78 -0.49 0.00 -1.20 -1.11 0.00 0.00 177.39 175.38 2rqy n SER 117 N -2.74 0.00 0.00 1.96 7.64 -1.26 -4.97 113.62 114.25 2rqy n SER 117 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 2rqy n SER 117 Cb 0.05 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 2rqy n SER 117 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2rqy n THR 118 N -1.71 0.00 -4.39 0.44 -2.24 -1.26 -5.11 114.28 100.01 2rqy n THR 118 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 2rqy n THR 118 Cb 0.00 -0.21 -0.10 0.00 -2.10 0.00 0.00 70.33 67.93 2rqy n THR 118 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2rqy s VAL 119 N -0.53 3.91 0.00 2.28 1.01 -1.26 -4.63 120.40 121.18 2rqy s VAL 119 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2rqy s VAL 119 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.67 2rqy s VAL 119 CO 0.00 0.41 0.00 -0.67 0.00 0.00 0.00 175.10 174.84 2rqy n ASP 120 N 1.57 0.06 0.20 3.32 -0.08 -1.26 -4.32 116.55 116.04 2rqy n ASP 120 Ca -0.15 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.18 2rqy n ASP 120 Cb 0.53 0.00 0.41 0.00 2.34 0.00 0.00 41.12 44.40 2rqy n ASP 120 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2rqy h LEU 121 N 0.00 0.00 0.00 -2.67 6.46 -1.94 -1.45 115.31 115.71 2rqy h LEU 121 Ca 0.00 0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.54 2rqy h LEU 121 Cb 0.40 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.29 2rqy h LEU 121 CO 0.00 0.34 -2.14 1.17 -0.62 0.00 0.00 178.44 177.19 2rqy n LYS 122 N -3.82 0.86 -0.51 1.25 3.00 -1.26 -4.29 118.16 113.39 2rqy n LYS 122 Ca -0.01 -0.07 0.06 0.00 -0.00 0.00 0.00 58.31 58.29 2rqy n LYS 122 Cb 0.41 -1.47 0.27 0.00 0.00 0.00 0.00 35.03 34.24 2rqy n LYS 122 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2rqy n LYS 123 N -2.51 3.23 -2.01 1.64 5.02 -1.18 -4.55 118.16 117.80 2rqy n LYS 123 Ca -0.21 -2.11 -0.34 0.00 -2.02 0.00 0.00 58.31 53.63 2rqy n LYS 123 Cb 0.90 -1.83 -0.04 0.00 -0.02 0.00 0.00 35.03 34.03 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 0.64 3.82 -2.96 -0.35 7.94 -0.55 -2.92 117.00 122.61 2rqy n LEU 124 Ca 0.19 -3.34 0.04 0.00 -1.11 0.00 0.00 56.01 51.80 2rqy n LEU 124 Cb 0.76 -1.64 0.00 0.00 0.53 0.00 0.00 43.42 43.08 2rqy n LEU 124 CO 0.19 -1.03 0.62 -0.60 -1.11 0.00 0.00 177.39 175.47 2rqy s ARG 125 N 5.59 0.00 0.00 1.96 3.52 -1.26 -4.96 118.95 123.81 2rqy s ARG 125 Ca 0.62 0.00 0.00 0.00 -0.13 0.00 0.00 55.73 56.23 2rqy s ARG 125 Cb 0.04 0.00 0.00 0.00 -1.56 0.00 0.00 34.95 33.43 2rqy s ARG 125 CO 0.11 -0.01 0.00 0.28 -0.81 0.00 0.00 175.30 174.87 2rqy n VAL 126 N 4.43 0.00 -0.06 7.11 0.31 -1.26 -4.21 118.33 124.65 2rqy n VAL 126 Ca 0.08 0.00 0.23 0.00 -0.01 0.00 0.00 64.34 64.65 2rqy n VAL 126 Cb 0.61 0.00 0.71 0.00 -0.91 0.00 0.00 33.84 34.25 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 0.00 -0.08 5.55 3.64 -1.96 0.25 116.57 123.97 2rqy h LYS 127 Ca 0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 2rqy h LYS 127 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2rqy h LYS 127 CO 0.00 0.00 -0.67 1.05 -2.27 0.00 0.00 179.45 177.56 2rqy h GLU 128 N 0.00 0.34 0.00 1.90 -0.00 -1.70 -2.41 114.58 112.72 2rqy h GLU 128 Ca 0.32 -0.26 -0.03 0.00 -0.00 0.00 0.00 59.36 59.38 2rqy h GLU 128 Cb 1.28 0.05 0.00 0.00 -0.00 0.00 0.00 28.75 30.08 2rqy h GLU 128 CO -0.00 0.89 -0.13 1.25 -0.00 0.00 0.00 179.01 181.02 2rqy h LEU 129 N 0.24 0.11 -1.16 3.06 5.85 -0.91 0.33 115.31 122.82 2rqy h LEU 129 Ca -0.02 -0.81 0.00 0.00 0.84 0.00 0.00 57.88 57.89 2rqy h LEU 129 Cb 1.22 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2rqy h LEU 129 CO 0.11 0.90 0.00 0.07 -0.34 0.00 0.00 178.44 179.18 2rqy h LYS 130 N -0.68 0.00 0.00 1.25 5.09 -1.15 -1.15 116.57 119.93 2rqy h LYS 130 Ca -0.02 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.69 2rqy h LYS 130 Cb 0.92 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.25 2rqy h LYS 130 CO 0.02 0.00 -1.06 1.63 -2.09 0.00 0.00 179.45 177.96 2rqy n LYS 131 N -2.31 0.51 0.04 0.07 4.76 -0.91 -4.25 118.16 116.07 2rqy n LYS 131 Ca 0.00 0.20 0.21 0.00 -2.87 0.00 0.00 58.31 55.85 2rqy n LYS 131 Cb 0.13 -1.38 0.73 0.00 -1.84 0.00 0.00 35.03 32.67 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 -0.95 0.55 -0.07 -0.18 2.04 -0.35 0.27 117.51 118.82 2rqy h ILE 132 Ca -0.05 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.71 2rqy h ILE 132 Cb 0.99 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 2rqy h ILE 132 CO -0.03 0.00 -0.44 0.25 0.00 0.00 0.00 178.15 177.93 2rqy h LEU 133 N 0.00 0.17 0.08 1.44 6.46 -1.39 -3.05 115.31 119.03 2rqy h LEU 133 Ca 0.23 -0.07 -0.27 0.00 -0.12 0.00 0.00 57.88 57.64 2rqy h LEU 133 Cb 1.05 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2rqy h LEU 133 CO -0.00 0.59 -1.35 -0.78 -0.62 0.00 0.00 178.44 176.28 2rqy h ASP 134 N 0.14 0.27 -0.63 1.25 3.58 -0.69 -3.28 116.42 117.05 2rqy h ASP 134 Ca 0.01 -0.33 0.11 0.00 0.42 0.00 0.00 57.03 57.24 2rqy h ASP 134 Cb 0.83 -0.09 -0.08 0.00 1.72 0.00 0.00 39.33 41.71 2rqy h ASP 134 CO 0.06 1.27 0.18 -0.78 -2.88 0.00 0.00 179.24 177.09 2rqy h ASP 135 N 0.05 0.09 -0.15 2.28 3.58 -1.17 -0.50 116.42 120.60 2rqy h ASP 135 Ca -0.16 0.10 -0.10 0.00 0.42 0.00 0.00 57.03 57.29 2rqy h ASP 135 Cb 1.95 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 43.11 2rqy h ASP 135 CO 0.16 0.05 -0.24 -0.50 -2.88 0.00 0.00 179.24 175.83 2rqy h TRP 136 N 0.32 0.68 0.00 0.28 -0.00 -1.67 -3.47 115.95 112.09 2rqy h TRP 136 Ca 0.33 -0.15 0.00 0.00 -0.00 0.00 0.00 58.89 59.07 2rqy h TRP 136 Cb 0.48 -0.16 0.00 0.00 -0.00 0.00 0.00 29.16 29.47 2rqy h TRP 136 CO -0.22 0.79 0.00 0.41 -0.00 0.00 0.00 178.44 179.42 2rqy n GLY 137 N -0.32 1.55 3.36 1.49 0.00 -0.20 -5.16 105.19 105.91 2rqy n GLY 137 Ca -0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.07 0.55 0.27 1.61 0.41 -1.23 -4.93 118.70 115.30 2rqy s GLU 138 Ca 0.00 0.62 -0.21 0.00 -0.41 0.00 0.00 54.97 54.96 2rqy s GLU 138 Cb 0.00 0.27 0.02 0.00 -1.78 0.00 0.00 34.13 32.64 2rqy s GLU 138 CO 0.00 -0.07 0.73 0.00 -0.49 0.00 0.00 175.26 175.43 2rqy s MET 139 N 0.19 1.75 0.02 1.61 0.23 -1.26 -4.75 119.30 117.09 2rqy s MET 139 Ca -0.00 -0.96 -0.10 0.00 -1.03 0.00 0.00 55.69 53.60 2rqy s MET 139 Cb -0.03 0.60 0.03 0.00 -1.53 0.00 0.00 34.83 33.90 2rqy s MET 139 CO 0.01 -0.80 0.45 0.00 -2.03 0.00 0.00 175.02 172.65 2rqy n LYS 141 N -0.32 0.49 -3.26 0.00 5.02 -1.26 -4.86 118.16 113.97 2rqy n LYS 141 Ca 0.01 0.45 -0.23 0.00 -2.02 0.00 0.00 58.31 56.51 2rqy n LYS 141 Cb 0.22 -1.63 -0.08 0.00 -0.02 0.00 0.00 35.03 33.52 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 1.54 1.98 2.91 0.72 0.00 -1.26 -5.11 105.19 105.97 2rqy n GLY 142 Ca -0.14 -1.15 -0.11 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.43 -3.84 -0.23 0.00 0.00 -1.26 -5.00 121.76 111.00 2rqy s ALA 144 Ca -0.05 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.14 2rqy s ALA 144 Cb -0.03 -2.78 0.09 0.00 0.00 0.00 0.00 23.12 20.39 2rqy s ALA 144 CO -0.00 -2.02 0.53 -1.21 0.00 0.00 0.00 175.76 173.06 2rqy s GLU 145 N 2.94 0.50 0.40 0.00 2.02 -1.26 -5.03 118.70 118.27 2rqy s GLU 145 Ca 0.24 1.10 0.13 0.00 0.02 0.00 0.00 54.97 56.46 2rqy s GLU 145 Cb -0.03 0.28 0.96 0.00 0.10 0.00 0.00 34.13 35.44 2rqy s GLU 145 CO -0.22 -0.19 1.90 -0.22 0.02 0.00 0.00 175.26 176.55 2rqy h LYS 146 N 7.52 0.51 0.00 1.61 3.64 -2.01 0.24 116.57 128.09 2rqy h LYS 146 Ca -0.26 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.03 2rqy h LYS 146 Cb 1.16 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 2rqy h LYS 146 CO 0.18 0.34 -0.27 0.66 -2.27 0.00 0.00 179.45 178.09 2rqy h SER 147 N 0.53 0.00 0.98 4.20 4.64 -1.99 -1.96 113.55 119.95 2rqy h SER 147 Ca 0.39 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.63 2rqy h SER 147 Cb 0.77 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.85 2rqy h SER 147 CO -0.15 0.27 -0.41 -0.78 -0.87 0.00 0.00 176.83 174.89 2rqy h ASP 148 N 0.00 0.00 0.01 4.97 3.58 -0.93 -2.95 116.42 121.09 2rqy h ASP 148 Ca -0.00 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.28 2rqy h ASP 148 Cb 0.73 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.76 2rqy h ASP 148 CO 0.04 0.41 -0.92 1.88 -2.88 0.00 0.00 179.24 177.76 2rqy h TYR 149 N 0.00 0.03 -0.32 0.28 0.05 -1.22 -3.02 116.97 112.77 2rqy h TYR 149 Ca -0.00 -0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.85 2rqy h TYR 149 Cb 1.01 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.74 2rqy h TYR 149 CO 0.00 1.36 0.33 0.97 -1.05 0.00 0.00 178.16 179.77 2rqy h ILE 150 N -0.95 0.47 0.00 -2.88 6.09 -1.45 0.28 117.51 119.06 2rqy h ILE 150 Ca -0.25 0.00 -0.17 0.00 -1.37 0.00 0.00 64.86 63.07 2rqy h ILE 150 Cb 1.25 0.74 -0.03 0.00 0.47 0.00 0.00 36.82 39.25 2rqy h ILE 150 CO -0.14 0.00 -1.33 0.03 -3.07 0.00 0.00 178.15 173.65 2rqy h ARG 151 N 0.00 0.00 0.00 2.19 2.47 -1.65 -3.04 114.38 114.35 2rqy h ARG 151 Ca 0.15 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.87 2rqy h ARG 151 Cb 0.80 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 2rqy h ARG 151 CO -0.00 0.34 -0.00 -0.22 0.56 0.00 0.00 179.97 180.65 2rqy h LYS 152 N 0.00 -0.00 -0.21 0.04 1.63 -0.52 -3.34 116.57 114.17 2rqy h LYS 152 Ca -0.15 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.56 2rqy h LYS 152 Cb 1.60 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.21 2rqy h LYS 152 CO 0.05 0.99 -0.23 0.82 -3.45 0.00 0.00 179.45 177.63 2rqy h ILE 153 N -1.00 1.25 -0.84 2.00 1.08 -0.79 -2.74 117.51 116.47 2rqy h ILE 153 Ca -0.00 -1.18 0.20 0.00 -0.39 0.00 0.00 64.86 63.49 2rqy h ILE 153 Cb 0.99 1.35 -0.05 0.00 -3.07 0.00 0.00 36.82 36.03 2rqy h ILE 153 CO 0.00 0.37 0.57 0.78 -0.69 0.00 0.00 178.15 179.18 2rqy h ASN 154 N 0.35 0.26 0.55 1.72 -0.26 -1.65 0.34 115.58 116.90 2rqy h ASN 154 Ca 0.06 0.03 -0.18 0.00 -0.56 0.00 0.00 56.30 55.64 2rqy h ASN 154 Cb 0.61 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.83 2rqy h ASN 154 CO 0.04 0.11 -0.79 -0.08 -1.06 0.00 0.00 177.43 175.65 2rqy h GLU 155 N 0.27 0.18 -0.58 0.81 4.22 -1.60 -3.14 114.58 114.73 2rqy h GLU 155 Ca 0.42 -0.17 -0.15 0.00 0.08 0.00 0.00 59.36 59.54 2rqy h GLU 155 Cb 1.24 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 30.45 2rqy h GLU 155 CO -0.11 0.88 0.15 1.28 -2.18 0.00 0.00 179.01 179.03 2rqy n LEU 156 N -3.71 5.39 0.18 1.64 4.32 0.84 -4.68 117.00 120.99 2rqy n LEU 156 Ca -0.03 -3.22 -0.16 0.00 -0.02 0.00 0.00 56.01 52.58 2rqy n LEU 156 Cb 0.75 -0.69 -0.09 0.00 -1.62 0.00 0.00 43.42 41.77 2rqy n LEU 156 CO 0.46 0.82 0.52 0.24 -1.22 0.00 0.00 177.39 178.21 2rqy h MET 157 N 2.42 -0.78 0.00 3.23 2.86 -0.47 -0.99 114.93 121.20 2rqy h MET 157 Ca 0.18 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2rqy h MET 157 Cb 2.05 0.18 0.00 0.00 0.06 0.00 0.00 31.60 33.89 2rqy h MET 157 CO 0.57 -0.52 0.00 -0.35 1.06 0.00 0.00 176.91 177.67 2rqy n PRO 158 N -5.32 0.05 0.02 -0.22 -0.04 -1.25 -0.38 135.00 127.85 2rqy n PRO 158 Ca -0.09 0.23 -0.04 0.00 -0.04 0.00 0.00 63.50 63.55 2rqy n PRO 158 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.15 -0.30 0.54 3.64 -1.52 -3.34 116.57 115.44 2rqy h LYS 159 Ca 0.00 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.25 2rqy h LYS 159 Cb 0.22 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.99 2rqy h LYS 159 CO 0.00 0.00 -0.09 0.66 -2.27 0.00 0.00 179.45 177.75 2rqy n TYR 160 N -4.87 0.95 -2.66 1.91 4.02 -0.79 -4.73 117.16 111.00 2rqy n TYR 160 Ca -0.03 -1.47 -0.04 0.00 -0.01 0.00 0.00 57.90 56.35 2rqy n TYR 160 Cb 0.11 -0.44 0.09 0.00 -0.02 0.00 0.00 39.34 39.08 2rqy n TYR 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2rqy n ALA 161 N -1.05 -3.66 -1.00 -0.72 0.00 0.48 -5.03 120.51 109.52 2rqy n ALA 161 Ca 0.30 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2rqy n ALA 161 Cb 0.98 -3.37 0.00 0.00 0.00 0.00 0.00 19.45 17.06 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 1.29 0.00 -1.19 0.00 -0.04 -1.22 -3.85 135.00 129.99 2rqy n PRO 162 Ca -0.01 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.51 2rqy n PRO 162 Cb 0.72 -0.46 -0.03 0.00 -0.04 0.00 0.00 33.50 33.69 2rqy n PRO 162 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2rqy n LYS 163 N -0.20 -2.99 -2.45 0.54 4.01 -1.26 -4.74 118.16 111.07 2rqy n LYS 163 Ca 0.00 2.37 -0.12 0.00 -0.51 0.00 0.00 58.31 60.05 2rqy n LYS 163 Cb 0.00 -3.12 -0.01 0.00 -0.51 0.00 0.00 35.03 31.40 2rqy n LYS 163 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2rqy n ALA 164 N -2.99 -0.78 0.00 7.82 0.00 -1.26 -4.22 120.51 119.08 2rqy n ALA 164 Ca -0.03 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2rqy n ALA 164 Cb 0.45 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.40 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 -2.23 0.00 -0.20 0.00 0.00 -1.26 -4.78 120.51 112.04 2rqy n ALA 165 Ca -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.24 2rqy n ALA 165 Cb 0.61 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.17 2rqy n ALA 165 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2rqy h SER 166 N 0.00 0.94 0.00 0.00 0.87 -1.89 -3.31 113.55 110.16 2rqy h SER 166 Ca 0.00 -0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 60.36 2rqy h SER 166 Cb 0.00 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.71 2rqy h SER 166 CO 0.00 0.91 -1.21 0.00 -0.53 0.00 0.00 176.83 176.00 2rqy n ALA 167 N -2.46 2.10 0.00 6.23 0.00 -1.26 -5.02 120.51 120.09 2rqy n ALA 167 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2rqy n ALA 167 Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 -1.76 0.00 -0.04 0.00 0.00 -1.25 -4.54 116.66 109.07 2rqy n ARG 168 Ca -0.02 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.88 2rqy n ARG 168 Cb 0.23 0.00 0.26 0.00 0.00 0.00 0.00 32.46 32.94 2rqy n ARG 168 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 2rqy n THR 169 N 0.00 0.11 -3.07 5.15 5.66 -1.26 -4.67 114.28 116.20 2rqy n THR 169 Ca 0.00 -0.13 -0.10 0.00 -3.05 0.00 0.00 64.05 60.77 2rqy n THR 169 Cb 0.00 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 68.83 2rqy n THR 169 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2rqy n ASP 170 N -0.30 -6.60 0.00 1.09 2.03 -1.26 -5.02 116.55 106.49 2rqy n ASP 170 Ca 0.09 -0.50 0.04 0.00 0.52 0.00 0.00 54.79 54.94 2rqy n ASP 170 Cb 0.12 -4.90 0.22 0.00 -0.72 0.00 0.00 41.12 35.84 2rqy n ASP 170 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17