#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g2w n GLY 2 N 0.00 -2.06 3.69 0.00 0.00 -1.26 -4.92 105.19 100.65 2g2w n GLY 2 Ca 0.00 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.28 2g2w n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g2w s VAL 3 N -2.22 2.08 0.36 1.61 0.11 -1.26 -4.86 120.40 116.22 2g2w s VAL 3 Ca 0.00 0.03 -0.28 0.00 -2.93 0.00 0.00 61.98 58.81 2g2w s VAL 3 Cb 0.00 -2.36 -0.10 0.00 -1.53 0.00 0.00 36.38 32.39 2g2w s VAL 3 CO 0.00 -0.03 1.33 -0.32 -3.33 0.00 0.00 175.10 172.76 2g2w s MET 4 N -4.26 4.19 0.12 1.54 -2.45 -1.19 -5.01 119.30 112.24 2g2w s MET 4 Ca 0.72 2.25 -0.03 0.00 -1.25 0.00 0.00 55.69 57.38 2g2w s MET 4 Cb -0.27 -2.95 -0.03 0.00 1.25 0.00 0.00 34.83 32.82 2g2w s MET 4 CO 0.52 -0.34 0.09 0.95 1.05 0.00 0.00 175.02 177.29 2g2w s THR 5 N -1.18 0.11 0.28 10.11 -4.23 -1.26 -4.44 115.64 115.03 2g2w s THR 5 Ca 0.52 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 2g2w s THR 5 Cb -0.40 -1.90 0.28 0.00 1.34 0.00 0.00 72.50 71.81 2g2w s THR 5 CO 0.53 -0.52 1.85 1.23 -0.54 0.00 0.00 174.62 177.17 2g2w h GLY 6 N 2.84 1.61 0.73 3.99 0.00 -1.93 -1.11 103.07 109.21 2g2w h GLY 6 Ca -0.34 -0.43 0.04 0.00 0.00 0.00 0.00 47.33 46.59 2g2w h GLY 6 CO 0.58 0.20 0.15 0.00 0.00 0.00 0.00 176.54 177.47 2g2w h ALA 7 N 1.52 0.45 -0.39 3.60 0.00 -1.96 -1.36 119.26 121.11 2g2w h ALA 7 Ca 0.48 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.32 2g2w h ALA 7 Cb 0.41 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2g2w h ALA 7 CO -0.24 -0.23 -0.18 0.87 0.00 0.00 0.00 179.25 179.46 2g2w h LYS 8 N 0.32 0.73 -0.92 0.00 1.57 -1.85 -0.87 116.57 115.55 2g2w h LYS 8 Ca 0.17 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2g2w h LYS 8 Cb 0.12 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 2g2w h LYS 8 CO -0.15 0.86 0.60 0.35 -0.57 0.00 0.00 179.45 180.54 2g2w h PHE 9 N 0.65 1.17 -0.01 -1.35 3.57 -0.83 -1.86 116.94 118.27 2g2w h PHE 9 Ca 0.10 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.41 2g2w h PHE 9 Cb 0.67 -0.39 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 2g2w h PHE 9 CO 0.03 0.75 -0.89 1.15 -2.23 0.00 0.00 178.31 177.12 2g2w h THR 10 N 1.25 1.43 -0.82 4.41 2.02 -0.95 -3.13 112.91 117.12 2g2w h THR 10 Ca 0.34 -2.45 0.02 0.00 0.77 0.00 0.00 66.41 65.09 2g2w h THR 10 Cb -0.12 2.38 -0.05 0.00 -1.74 0.00 0.00 68.15 68.63 2g2w h THR 10 CO -0.07 0.73 0.53 -0.61 0.37 0.00 0.00 175.52 176.47 2g2w h GLN 11 N 0.20 1.02 -6.65 6.66 4.15 -0.85 -3.42 115.11 116.23 2g2w h GLN 11 Ca -0.06 -0.06 -0.52 0.00 0.77 0.00 0.00 58.65 58.77 2g2w h GLN 11 Cb 1.51 -0.23 0.03 0.00 0.21 0.00 0.00 27.48 28.99 2g2w h GLN 11 CO 0.15 0.68 0.63 0.42 -1.93 0.00 0.00 178.83 178.77 2g2w s ILE 12 N -6.11 3.38 0.11 2.39 1.01 -0.73 -5.02 121.20 116.23 2g2w s ILE 12 Ca -0.13 1.12 0.09 0.00 0.00 0.00 0.00 60.65 61.72 2g2w s ILE 12 Cb 0.16 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 2g2w s ILE 12 CO 0.79 0.16 -0.17 -1.10 0.00 0.00 0.00 174.94 174.61 2g2w s GLN 13 N 0.06 1.85 0.36 2.79 -1.52 -1.26 -4.95 119.66 116.98 2g2w s GLN 13 Ca 0.56 -1.14 -0.26 0.00 -1.95 0.00 0.00 55.36 52.57 2g2w s GLN 13 Cb -0.35 -2.14 -0.12 0.00 -0.22 0.00 0.00 33.01 30.18 2g2w s GLN 13 CO 0.36 0.49 1.07 1.19 -0.25 0.00 0.00 175.29 178.15 2g2w n PHE 14 N 0.86 1.46 0.00 0.91 3.01 -1.26 -2.30 117.46 120.14 2g2w n PHE 14 Ca -0.15 0.61 0.00 0.00 1.01 0.00 0.00 57.45 58.91 2g2w n PHE 14 Cb 0.53 -2.28 0.00 0.00 -0.01 0.00 0.00 39.48 37.72 2g2w n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g2w n GLY 15 N 1.10 1.35 3.82 1.37 0.00 -0.27 -4.90 105.19 107.66 2g2w n GLY 15 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2g2w n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2g2w s MET 16 N -0.74 3.60 0.72 1.61 -1.94 -0.97 -4.41 119.30 117.17 2g2w s MET 16 Ca 0.00 1.12 -0.10 0.00 -1.71 0.00 0.00 55.69 55.01 2g2w s MET 16 Cb 0.00 -2.08 0.04 0.00 2.01 0.00 0.00 34.83 34.80 2g2w s MET 16 CO 0.00 -0.57 1.07 0.95 -0.01 0.00 0.00 175.02 176.46 2g2w s THR 17 N -2.48 2.83 0.28 2.05 -4.23 -1.26 -0.55 115.64 112.28 2g2w s THR 17 Ca 0.62 0.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.24 2g2w s THR 17 Cb -0.14 -3.23 0.26 0.00 1.34 0.00 0.00 72.50 70.73 2g2w s THR 17 CO 0.33 -0.28 1.80 0.03 -0.54 0.00 0.00 174.62 175.95 2g2w h ARG 18 N -0.68 0.78 -0.39 3.99 3.08 -1.79 -1.26 114.38 118.12 2g2w h ARG 18 Ca -0.45 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.44 2g2w h ARG 18 Cb 1.29 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2g2w h ARG 18 CO 0.63 0.52 -0.21 0.37 -1.07 0.00 0.00 179.97 180.21 2g2w h GLN 19 N 0.81 0.76 -0.60 0.04 5.75 -1.93 -1.09 115.11 118.85 2g2w h GLN 19 Ca 0.49 -0.30 -0.08 0.00 -0.15 0.00 0.00 58.65 58.61 2g2w h GLN 19 Cb 0.61 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 2g2w h GLN 19 CO -0.32 0.91 0.04 1.96 -2.65 0.00 0.00 178.83 178.77 2g2w h GLN 20 N 0.67 1.01 -0.01 1.69 4.20 -1.76 -0.66 115.11 120.25 2g2w h GLN 20 Ca 0.10 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 2g2w h GLN 20 Cb 0.71 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 2g2w h GLN 20 CO 0.05 0.97 0.00 0.28 -0.67 0.00 0.00 178.83 179.46 2g2w h VAL 21 N 0.93 1.24 -0.87 -0.54 2.07 -0.97 -2.37 116.25 115.75 2g2w h VAL 21 Ca 0.18 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.99 2g2w h VAL 21 Cb 0.49 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2g2w h VAL 21 CO 0.02 0.19 0.58 -0.07 0.02 0.00 0.00 177.57 178.31 2g2w h LEU 22 N -0.29 0.99 -0.82 2.57 3.38 -1.17 0.11 115.31 120.08 2g2w h LEU 22 Ca 0.00 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.02 2g2w h LEU 22 Cb 0.31 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 2g2w h LEU 22 CO 0.00 0.71 0.49 -0.78 0.09 0.00 0.00 178.44 178.95 2g2w h ASP 23 N 1.17 0.73 0.12 -0.43 -0.00 -1.02 0.94 116.42 117.93 2g2w h ASP 23 Ca 0.33 0.03 -0.16 0.00 -0.00 0.00 0.00 57.03 57.22 2g2w h ASP 23 Cb -0.11 -0.12 0.02 0.00 -0.00 0.00 0.00 39.33 39.12 2g2w h ASP 23 CO -0.08 0.45 -0.72 0.40 -0.00 0.00 0.00 179.24 179.30 2g2w h ILE 24 N 0.86 1.55 -0.22 2.25 2.04 -1.05 -3.37 117.51 119.56 2g2w h ILE 24 Ca 0.37 -2.51 -0.16 0.00 1.00 0.00 0.00 64.86 63.57 2g2w h ILE 24 Cb 0.25 3.21 -0.01 0.00 -0.74 0.00 0.00 36.82 39.53 2g2w h ILE 24 CO -0.20 0.70 -0.51 0.00 0.00 0.00 0.00 178.15 178.14 2g2w h ALA 25 N 0.08 0.69 -0.13 1.87 0.00 -0.75 -3.43 119.26 117.59 2g2w h ALA 25 Ca -0.12 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2g2w h ALA 25 Cb 1.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2g2w h ALA 25 CO 0.13 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.47 2g2w n GLY 26 N 0.20 0.54 0.33 0.00 0.00 0.32 -4.54 105.19 102.04 2g2w n GLY 26 Ca -0.03 -0.98 0.20 0.00 0.00 0.00 0.00 46.02 45.21 2g2w n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g2w h ALA 27 N 0.00 1.24 0.00 4.61 0.00 -1.88 -0.94 119.26 122.29 2g2w h ALA 27 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g2w h ALA 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2g2w h ALA 27 CO 0.00 -0.06 0.00 1.05 0.00 0.00 0.00 179.25 180.24 2g2w h GLU 28 N 0.00 0.00 0.00 0.00 9.09 -1.91 -2.65 114.58 119.11 2g2w h GLU 28 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 2g2w h GLU 28 Cb 0.11 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.21 2g2w h GLU 28 CO -0.00 0.00 -0.58 0.09 0.05 0.00 0.00 179.01 178.57 2g2w n ASN 29 N -2.64 0.56 -4.51 3.06 3.02 -0.36 -5.01 115.26 109.38 2g2w n ASN 29 Ca 0.02 -0.24 -0.25 0.00 -0.03 0.00 0.00 54.58 54.08 2g2w n ASN 29 Cb 0.32 0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 39.71 2g2w n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g2w s GLU 31 N -3.24 0.66 0.22 0.00 -1.05 0.20 -4.98 118.70 110.51 2g2w s GLU 31 Ca 0.27 -0.53 -0.00 0.00 -0.15 0.00 0.00 54.97 54.56 2g2w s GLU 31 Cb -0.07 0.28 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 2g2w s GLU 31 CO 0.15 -0.19 0.13 -0.08 0.95 0.00 0.00 175.26 176.22 2g2w s THR 32 N -2.21 0.10 0.00 1.83 -1.32 -1.26 -0.91 115.64 111.87 2g2w s THR 32 Ca -0.08 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.40 2g2w s THR 32 Cb -0.03 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.44 2g2w s THR 32 CO -0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 2g2w n GLY 33 N -0.33 -1.81 7.00 6.08 0.00 0.60 -4.91 105.19 111.82 2g2w n GLY 33 Ca 0.02 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2g2w n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g2w n GLY 34 N 0.00 3.43 0.32 -0.02 0.00 -1.26 -1.44 105.19 106.21 2g2w n GLY 34 Ca 0.00 -0.05 0.21 0.00 0.00 0.00 0.00 46.02 46.18 2g2w n GLY 34 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2g2w h SER 35 N 0.00 0.00 -0.11 1.61 0.02 -2.02 -3.08 113.55 109.98 2g2w h SER 35 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2g2w h SER 35 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2g2w h SER 35 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 2g2w n PHE 36 N -3.09 0.12 0.00 3.45 3.01 -0.52 -5.06 117.46 115.37 2g2w n PHE 36 Ca -0.02 -0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2g2w n PHE 36 Cb 0.15 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 2g2w n PHE 36 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g2w n GLY 37 N 1.02 3.37 1.30 1.37 0.00 -1.17 -1.27 105.19 109.81 2g2w n GLY 37 Ca 0.12 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.16 2g2w n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2g2w n ASP 38 N 4.15 3.81 -4.89 1.61 5.68 -1.26 -0.29 116.55 125.35 2g2w n ASP 38 Ca 0.00 -2.31 -0.29 0.00 -0.50 0.00 0.00 54.79 51.68 2g2w n ASP 38 Cb 0.00 -0.50 0.05 0.00 -1.14 0.00 0.00 41.12 39.53 2g2w n ASP 38 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2g2w s SER 39 N -0.83 5.33 -0.17 -1.12 0.01 -0.40 -4.72 113.70 111.79 2g2w s SER 39 Ca 0.41 1.00 -0.01 0.00 1.31 0.00 0.00 55.95 58.66 2g2w s SER 39 Cb 0.26 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.70 2g2w s SER 39 CO 0.21 -1.38 -0.13 -0.63 0.41 0.00 0.00 173.24 171.71 2g2w s ILE 40 N -3.33 2.74 -0.21 1.44 1.01 -0.13 -4.33 121.20 118.39 2g2w s ILE 40 Ca 0.58 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 60.45 2g2w s ILE 40 Cb -0.11 -2.18 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 2g2w s ILE 40 CO 0.50 0.50 -0.01 -2.28 0.00 0.00 0.00 174.94 173.65 2g2w s HIS 41 N 1.03 3.02 -0.10 3.97 5.65 -0.09 -0.01 115.29 128.77 2g2w s HIS 41 Ca -0.01 -0.56 0.04 0.00 0.25 0.00 0.00 55.06 54.78 2g2w s HIS 41 Cb -0.15 -2.09 -0.00 0.00 -1.18 0.00 0.00 32.58 29.16 2g2w s HIS 41 CO -0.03 -0.31 -0.22 0.00 -0.65 0.00 0.00 174.74 173.53 2g2w s ARG 43 N 0.27 3.88 0.00 0.00 0.52 0.74 -1.17 118.95 123.17 2g2w s ARG 43 Ca -0.15 -0.15 0.00 0.00 -0.52 0.00 0.00 55.73 54.90 2g2w s ARG 43 Cb -0.17 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 31.98 2g2w s ARG 43 CO 0.08 0.51 0.00 0.41 0.02 0.00 0.00 175.30 176.31 2g2w n GLY 44 N 2.84 -0.11 3.68 -3.53 0.00 0.54 -3.16 105.19 105.44 2g2w n GLY 44 Ca -0.17 -1.50 -0.45 0.00 0.00 0.00 0.00 46.02 43.89 2g2w n GLY 44 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2g2w n HIS 45 N -0.04 2.37 -2.07 1.61 -0.00 -1.26 -4.77 115.22 111.05 2g2w n HIS 45 Ca 0.00 0.24 -0.36 0.00 -0.00 0.00 0.00 57.72 57.60 2g2w n HIS 45 Cb 0.00 -2.56 -0.04 0.00 -0.00 0.00 0.00 29.99 27.39 2g2w n HIS 45 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2g2w n ALA 46 N 3.40 2.80 1.08 1.57 0.00 -1.26 -4.39 120.51 123.71 2g2w n ALA 46 Ca 0.16 -3.37 0.13 0.00 0.00 0.00 0.00 53.44 50.37 2g2w n ALA 46 Cb 0.30 -3.54 0.47 0.00 0.00 0.00 0.00 19.45 16.68 2g2w n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g2w n ALA 47 N 11.09 2.90 0.00 0.00 0.00 -1.26 -5.04 120.51 128.20 2g2w n ALA 47 Ca 0.47 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2g2w n ALA 47 Cb 0.45 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2g2w n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g2w n GLY 48 N 1.46 1.00 3.67 0.00 0.00 -1.26 -4.98 105.19 105.07 2g2w n GLY 48 Ca 0.08 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 2g2w n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2g2w n ASP 49 N 0.00 2.25 -2.17 1.61 9.92 -1.26 -3.16 116.55 123.73 2g2w n ASP 49 Ca 0.00 1.16 -0.16 0.00 -0.53 0.00 0.00 54.79 55.26 2g2w n ASP 49 Cb 0.00 -1.43 0.02 0.00 -0.64 0.00 0.00 41.12 39.07 2g2w n ASP 49 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2g2w n TYR 50 N 0.09 -1.35 -1.98 1.24 4.01 -1.26 -4.98 117.16 112.93 2g2w n TYR 50 Ca 0.07 0.34 -0.38 0.00 -0.16 0.00 0.00 57.90 57.77 2g2w n TYR 50 Cb 0.36 -3.48 0.02 0.00 -0.31 0.00 0.00 39.34 35.93 2g2w n TYR 50 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2g2w s TYR 51 N -2.97 2.55 0.49 -0.72 -0.85 -1.19 -4.98 117.35 109.68 2g2w s TYR 51 Ca 0.20 1.43 -0.22 0.00 -0.52 0.00 0.00 57.07 57.96 2g2w s TYR 51 Cb -0.09 -3.64 -0.06 0.00 0.38 0.00 0.00 41.96 38.54 2g2w s TYR 51 CO 0.25 -2.33 1.21 0.00 -1.52 0.00 0.00 175.55 173.16 2g2w s ALA 52 N -1.38 2.90 0.20 9.51 0.00 -1.26 -4.88 121.76 126.84 2g2w s ALA 52 Ca 0.67 1.02 -0.21 0.00 0.00 0.00 0.00 51.96 53.44 2g2w s ALA 52 Cb -0.36 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 19.38 2g2w s ALA 52 CO 0.44 -0.86 0.61 1.52 0.00 0.00 0.00 175.76 177.47 2g2w s TYR 53 N -1.50 -0.35 0.14 0.00 -0.85 -0.69 -0.34 117.35 113.77 2g2w s TYR 53 Ca 0.67 0.04 0.08 0.00 -0.52 0.00 0.00 57.07 57.34 2g2w s TYR 53 Cb -0.31 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.54 2g2w s TYR 53 CO 0.37 -0.96 -0.19 0.00 -1.52 0.00 0.00 175.55 173.25 2g2w s ALA 54 N -3.82 1.92 -0.05 9.51 0.00 -0.32 -1.78 121.76 127.22 2g2w s ALA 54 Ca 0.05 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.62 2g2w s ALA 54 Cb -0.02 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.92 2g2w s ALA 54 CO -0.06 0.27 -0.07 0.99 0.00 0.00 0.00 175.76 176.89 2g2w s THR 55 N -1.79 0.70 -0.16 0.00 2.01 0.15 -0.70 115.64 115.85 2g2w s THR 55 Ca 0.13 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 2g2w s THR 55 Cb -0.07 -0.69 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 2g2w s THR 55 CO 0.06 0.26 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.76 2g2w s PHE 56 N 0.84 2.83 0.07 4.92 0.08 0.99 -1.08 117.98 126.62 2g2w s PHE 56 Ca -0.12 -0.95 0.02 0.00 0.12 0.00 0.00 56.93 56.01 2g2w s PHE 56 Cb -0.15 -1.92 -0.04 0.00 -0.57 0.00 0.00 43.02 40.34 2g2w s PHE 56 CO 0.01 -0.44 0.08 0.20 -0.10 0.00 0.00 175.22 174.97 2g2w s GLY 57 N 0.84 2.02 0.22 4.36 0.00 -0.20 -0.96 107.32 113.61 2g2w s GLY 57 Ca -0.04 -0.99 0.09 0.00 0.00 0.00 0.00 44.72 43.78 2g2w s GLY 57 CO -0.00 -0.95 -0.17 -1.36 0.00 0.00 0.00 173.10 170.62 2g2w s PHE 58 N -1.36 1.90 0.44 1.90 0.40 -1.26 -1.50 117.98 118.50 2g2w s PHE 58 Ca 0.28 -0.49 0.12 0.00 -0.60 0.00 0.00 56.93 56.25 2g2w s PHE 58 Cb -0.12 -0.87 0.96 0.00 0.51 0.00 0.00 43.02 43.51 2g2w s PHE 58 CO 0.21 0.46 2.01 1.79 0.70 0.00 0.00 175.22 180.39 2g2w h THR 59 N 2.56 1.12 -2.46 0.64 1.35 -1.44 -3.45 112.91 111.23 2g2w h THR 59 Ca -0.39 -0.49 -0.01 0.00 -0.55 0.00 0.00 66.41 64.96 2g2w h THR 59 Cb 1.23 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2g2w h THR 59 CO 0.60 0.15 0.14 -1.54 -0.25 0.00 0.00 175.52 174.62 2g2w n SER 60 N -4.37 -1.09 -0.02 5.36 3.41 -1.26 -5.01 113.62 110.64 2g2w n SER 60 Ca -0.01 -1.75 0.14 0.00 -0.26 0.00 0.00 58.87 56.99 2g2w n SER 60 Cb 0.20 1.81 0.69 0.00 -0.26 0.00 0.00 64.21 66.64 2g2w n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g2w n ALA 61 N -1.85 2.55 -1.75 7.33 0.00 -1.26 -4.74 120.51 120.79 2g2w n ALA 61 Ca -0.08 -0.17 -0.38 0.00 0.00 0.00 0.00 53.44 52.82 2g2w n ALA 61 Cb 0.28 -1.44 0.03 0.00 0.00 0.00 0.00 19.45 18.32 2g2w n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g2w s ALA 62 N -2.65 2.79 0.44 0.00 0.00 -1.26 -4.90 121.76 116.19 2g2w s ALA 62 Ca 0.25 1.21 0.11 0.00 0.00 0.00 0.00 51.96 53.53 2g2w s ALA 62 Cb 0.20 -3.52 1.01 0.00 0.00 0.00 0.00 23.12 20.82 2g2w s ALA 62 CO 0.49 -1.22 2.06 0.00 0.00 0.00 0.00 175.76 177.08 2g2w h ALA 63 N 1.45 1.88 -0.21 0.00 0.00 -2.06 -1.17 119.26 119.15 2g2w h ALA 63 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2g2w h ALA 63 Cb 1.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2g2w h ALA 63 CO 0.57 0.07 0.00 -0.40 0.00 0.00 0.00 179.25 179.49 2g2w n ASP 64 N -4.48 1.50 -4.71 0.00 5.75 -1.26 -4.48 116.55 108.86 2g2w n ASP 64 Ca 0.04 -1.80 -0.34 0.00 -0.01 0.00 0.00 54.79 52.68 2g2w n ASP 64 Cb 0.16 -0.13 0.10 0.00 -1.03 0.00 0.00 41.12 40.22 2g2w n ASP 64 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2g2w s ALA 65 N -1.73 2.03 0.07 2.12 0.00 -0.44 -4.92 121.76 118.88 2g2w s ALA 65 Ca 0.27 0.86 0.08 0.00 0.00 0.00 0.00 51.96 53.17 2g2w s ALA 65 Cb 0.14 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 2g2w s ALA 65 CO 0.21 -2.01 -0.19 0.15 0.00 0.00 0.00 175.76 173.91 2g2w s LYS 66 N -4.00 1.93 0.00 0.00 1.02 -1.26 -4.14 119.74 113.30 2g2w s LYS 66 Ca 0.74 -1.07 -0.30 0.00 0.02 0.00 0.00 55.97 55.36 2g2w s LYS 66 Cb -0.29 -2.14 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 2g2w s LYS 66 CO 0.47 0.52 2.00 0.28 -0.92 0.00 0.00 175.35 177.69 2g2w n VAL 67 N 1.32 0.72 0.09 3.17 0.31 0.29 -1.09 118.33 123.14 2g2w n VAL 67 Ca -0.16 -0.17 0.01 0.00 -0.01 0.00 0.00 64.34 64.01 2g2w n VAL 67 Cb 0.52 -2.32 0.02 0.00 -0.91 0.00 0.00 33.84 31.15 2g2w n VAL 67 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2g2w n ASP 68 N 7.89 1.39 -3.69 4.52 5.68 -0.56 -1.11 116.55 130.67 2g2w n ASP 68 Ca 0.21 -1.25 -0.11 0.00 -0.50 0.00 0.00 54.79 53.14 2g2w n ASP 68 Cb 0.40 -0.01 -0.11 0.00 -1.14 0.00 0.00 41.12 40.26 2g2w n ASP 68 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2g2w s SER 69 N -0.35 -0.30 -0.10 -1.12 0.15 -1.08 -0.98 113.70 109.92 2g2w s SER 69 Ca 0.04 0.79 0.00 0.00 0.70 0.00 0.00 55.95 57.48 2g2w s SER 69 Cb 0.02 0.79 0.02 0.00 -1.71 0.00 0.00 66.02 65.14 2g2w s SER 69 CO 0.04 -0.20 -0.08 -0.54 1.20 0.00 0.00 173.24 173.66 2g2w s LYS 70 N 1.72 1.46 0.06 5.44 1.02 -0.66 -1.03 119.74 127.75 2g2w s LYS 70 Ca -0.07 -0.25 0.07 0.00 0.02 0.00 0.00 55.97 55.74 2g2w s LYS 70 Cb -0.10 -1.48 -0.03 0.00 -0.52 0.00 0.00 37.83 35.70 2g2w s LYS 70 CO -0.11 -0.21 -0.18 -1.12 -0.92 0.00 0.00 175.35 172.80 2g2w s SER 71 N 1.52 2.17 -0.02 2.83 0.01 -0.24 -1.79 113.70 118.18 2g2w s SER 71 Ca 0.01 -0.55 -0.18 0.00 1.31 0.00 0.00 55.95 56.54 2g2w s SER 71 Cb -0.13 -0.14 0.03 0.00 0.21 0.00 0.00 66.02 65.99 2g2w s SER 71 CO -0.06 0.08 0.39 0.00 0.41 0.00 0.00 173.24 174.05 2g2w s GLN 72 N -1.39 0.76 -0.03 12.44 1.03 -0.16 -0.68 119.66 131.63 2g2w s GLN 72 Ca 0.05 -0.12 0.03 0.00 0.04 0.00 0.00 55.36 55.35 2g2w s GLN 72 Cb -0.09 0.34 0.00 0.00 0.03 0.00 0.00 33.01 33.30 2g2w s GLN 72 CO 0.02 -0.22 -0.12 -1.21 -2.54 0.00 0.00 175.29 171.23 2g2w s GLU 73 N -1.39 1.24 -1.00 9.60 2.02 -0.73 -4.58 118.70 123.85 2g2w s GLU 73 Ca -0.12 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.46 2g2w s GLU 73 Cb -0.04 -1.12 0.00 0.00 0.10 0.00 0.00 34.13 33.07 2g2w s GLU 73 CO 0.05 0.15 0.00 1.63 0.02 0.00 0.00 175.26 177.11 2g2w n LYS 74 N 3.27 -0.90 -0.06 1.61 5.02 -1.26 -1.70 118.16 124.13 2g2w n LYS 74 Ca -0.18 0.79 -0.02 0.00 -2.02 0.00 0.00 58.31 56.87 2g2w n LYS 74 Cb 0.54 -4.76 -0.16 0.00 -0.02 0.00 0.00 35.03 30.63 2g2w n LYS 74 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2g2w n LEU 75 N -1.07 0.00 -4.23 -0.35 4.77 -1.26 -4.80 117.00 110.05 2g2w n LEU 75 Ca -0.09 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.57 2g2w n LEU 75 Cb 0.37 0.30 -0.17 0.00 -2.33 0.00 0.00 43.42 41.60 2g2w n LEU 75 CO 0.14 0.30 -0.56 -0.76 -1.33 0.00 0.00 177.39 175.19 2g2w s LEU 76 N -5.08 2.06 0.11 2.23 1.43 -1.26 -3.26 118.68 114.92 2g2w s LEU 76 Ca -0.09 -0.52 -0.09 0.00 -1.03 0.00 0.00 54.13 52.39 2g2w s LEU 76 Cb 0.09 -1.36 -0.06 0.00 0.03 0.00 0.00 46.19 44.88 2g2w s LEU 76 CO 0.83 0.19 0.42 0.00 0.23 0.00 0.00 176.35 178.03 2g2w s ALA 77 N 0.11 3.71 0.48 4.21 0.00 -1.26 -4.95 121.76 124.06 2g2w s ALA 77 Ca -0.12 -0.38 -0.23 0.00 0.00 0.00 0.00 51.96 51.24 2g2w s ALA 77 Cb -0.16 -2.28 -0.07 0.00 0.00 0.00 0.00 23.12 20.61 2g2w s ALA 77 CO 0.06 0.57 1.24 -1.25 0.00 0.00 0.00 175.76 176.38 2g2w s PRO 78 N -2.16 3.61 0.16 0.00 0.04 -1.26 -4.94 135.00 130.45 2g2w s PRO 78 Ca 0.37 1.95 0.08 0.00 0.04 0.00 0.00 61.00 63.43 2g2w s PRO 78 Cb -0.13 -2.41 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 2g2w s PRO 78 CO 0.20 -0.73 1.36 0.66 0.04 0.00 0.00 177.00 178.53 2g2w h SER 79 N 1.96 0.01 -0.83 6.66 4.64 -1.77 -3.41 113.55 120.81 2g2w h SER 79 Ca -0.50 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 60.60 2g2w h SER 79 Cb 1.26 -0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.17 2g2w h SER 79 CO 0.60 0.91 -0.54 0.00 -0.87 0.00 0.00 176.83 176.92 2g2w n ALA 80 N -2.37 -1.28 -2.31 5.18 0.00 0.26 -5.01 120.51 114.97 2g2w n ALA 80 Ca -0.00 -1.36 -0.43 0.00 0.00 0.00 0.00 53.44 51.65 2g2w n ALA 80 Cb 0.86 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 2g2w n ALA 80 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2g2w s PRO 81 N 0.69 4.18 -0.02 0.00 0.04 -1.17 -3.46 135.00 135.27 2g2w s PRO 81 Ca 0.31 1.77 0.02 0.00 0.04 0.00 0.00 61.00 63.14 2g2w s PRO 81 Cb 0.08 -3.84 0.04 0.00 0.04 0.00 0.00 34.50 30.82 2g2w s PRO 81 CO -0.12 -0.79 0.97 0.25 0.04 0.00 0.00 177.00 177.35 2g2w n THR 82 N 5.49 0.25 -1.71 1.26 -2.24 -1.14 -3.38 114.28 112.81 2g2w n THR 82 Ca 0.15 -0.29 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 2g2w n THR 82 Cb 0.44 0.46 -0.02 0.00 -2.10 0.00 0.00 70.33 69.11 2g2w n THR 82 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2g2w n LEU 83 N -0.18 3.75 -4.46 3.22 7.94 -0.74 -4.90 117.00 121.63 2g2w n LEU 83 Ca 0.02 1.16 -0.22 0.00 -1.11 0.00 0.00 56.01 55.86 2g2w n LEU 83 Cb 0.67 -1.51 -0.10 0.00 0.53 0.00 0.00 43.42 43.00 2g2w n LEU 83 CO 0.00 -0.21 -0.26 0.42 -1.11 0.00 0.00 177.39 176.23 2g2w s THR 84 N -0.27 1.13 0.21 1.96 -4.23 -1.26 -3.85 115.64 109.33 2g2w s THR 84 Ca 0.64 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.09 2g2w s THR 84 Cb -0.57 -2.75 0.07 0.00 1.34 0.00 0.00 72.50 70.60 2g2w s THR 84 CO 0.52 0.00 1.67 0.25 -0.54 0.00 0.00 174.62 176.53 2g2w h LEU 85 N 2.09 0.92 -0.56 4.79 5.85 -1.17 -0.11 115.31 127.11 2g2w h LEU 85 Ca -0.40 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.04 2g2w h LEU 85 Cb 1.25 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 2g2w h LEU 85 CO 0.69 1.00 0.29 0.00 -0.34 0.00 0.00 178.44 180.07 2g2w h ALA 86 N 1.09 0.72 -0.50 1.25 0.00 -1.97 0.16 119.26 120.01 2g2w h ALA 86 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2g2w h ALA 86 Cb 0.57 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2g2w h ALA 86 CO 0.03 0.26 0.26 0.87 0.00 0.00 0.00 179.25 180.68 2g2w h LYS 87 N 0.75 0.71 -0.92 0.00 1.57 -1.83 -2.57 116.57 114.27 2g2w h LYS 87 Ca 0.19 -0.09 0.07 0.00 -1.87 0.00 0.00 60.65 58.95 2g2w h LYS 87 Cb 0.09 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.20 2g2w h LYS 87 CO -0.03 0.57 0.58 0.35 -0.57 0.00 0.00 179.45 180.35 2g2w h PHE 88 N 0.66 1.08 0.00 -1.35 3.57 -0.65 -1.80 116.94 118.46 2g2w h PHE 88 Ca 0.17 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2g2w h PHE 88 Cb 0.08 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.46 2g2w h PHE 88 CO -0.01 0.55 0.00 -0.91 -2.23 0.00 0.00 178.31 175.70 2g2w h ASN 89 N 1.06 0.00 1.30 0.41 -0.26 -0.73 -2.44 115.58 114.91 2g2w h ASN 89 Ca 0.40 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.14 2g2w h ASN 89 Cb 0.18 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.44 2g2w h ASN 89 CO -0.18 0.00 -0.18 0.00 -1.06 0.00 0.00 177.43 176.01 2g2w n GLN 90 N -3.08 0.27 -2.73 0.81 6.02 -0.69 -4.78 117.38 113.20 2g2w n GLN 90 Ca 0.00 0.18 -0.41 0.00 -0.01 0.00 0.00 57.00 56.76 2g2w n GLN 90 Cb 0.29 -1.77 -0.04 0.00 1.02 0.00 0.00 30.24 29.73 2g2w n GLN 90 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2g2w s VAL 91 N -3.12 4.62 0.02 5.09 1.01 -0.92 -5.06 120.40 122.03 2g2w s VAL 91 Ca 0.09 2.05 0.04 0.00 0.00 0.00 0.00 61.98 64.16 2g2w s VAL 91 Cb 0.13 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 2g2w s VAL 91 CO 0.63 0.27 -0.13 0.42 0.00 0.00 0.00 175.10 176.30 2g2w s THR 92 N 0.29 0.98 0.26 3.92 -4.23 -1.26 -5.03 115.64 110.57 2g2w s THR 92 Ca 0.48 -0.75 -0.31 0.00 -1.18 0.00 0.00 61.69 59.93 2g2w s THR 92 Cb -0.23 -0.87 -0.13 0.00 1.34 0.00 0.00 72.50 72.62 2g2w s THR 92 CO 0.29 0.11 1.40 0.52 -0.54 0.00 0.00 174.62 176.40 2g2w n VAL 93 N 2.32 1.09 0.00 2.29 0.31 -1.26 -1.95 118.33 121.12 2g2w n VAL 93 Ca -0.16 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2g2w n VAL 93 Cb 0.55 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 2g2w n VAL 93 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g2w n GLY 94 N 1.98 2.31 3.76 2.92 0.00 -0.16 -5.00 105.19 111.00 2g2w n GLY 94 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 2g2w n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2g2w s MET 95 N -0.27 3.33 0.66 1.61 1.00 -0.82 -4.56 119.30 120.25 2g2w s MET 95 Ca 0.00 2.24 -0.12 0.00 0.00 0.00 0.00 55.69 57.81 2g2w s MET 95 Cb 0.00 -2.37 -0.01 0.00 0.00 0.00 0.00 34.83 32.45 2g2w s MET 95 CO 0.00 -1.04 1.06 0.95 0.00 0.00 0.00 175.02 175.99 2g2w s THR 96 N -1.30 3.93 0.22 2.05 -4.23 -1.26 -0.18 115.64 114.87 2g2w s THR 96 Ca 0.68 0.72 -0.10 0.00 -1.18 0.00 0.00 61.69 61.81 2g2w s THR 96 Cb -0.40 -3.38 0.21 0.00 1.34 0.00 0.00 72.50 70.27 2g2w s THR 96 CO 0.49 -0.73 1.67 -0.09 -0.54 0.00 0.00 174.62 175.41 2g2w h ARG 97 N -0.35 0.14 -0.52 3.99 2.43 -1.61 -0.23 114.38 118.24 2g2w h ARG 97 Ca -0.45 -0.01 0.10 0.00 -0.81 0.00 0.00 59.98 58.81 2g2w h ARG 97 Cb 1.21 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 30.65 2g2w h ARG 97 CO 0.57 0.09 0.05 0.00 -1.51 0.00 0.00 179.97 179.17 2g2w h ALA 98 N 1.57 0.54 -0.35 2.80 0.00 -1.93 -1.48 119.26 120.42 2g2w h ALA 98 Ca 0.34 0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.29 2g2w h ALA 98 Cb 0.56 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2g2w h ALA 98 CO -0.53 -0.35 -0.19 1.96 0.00 0.00 0.00 179.25 180.15 2g2w h GLN 99 N 0.18 0.65 0.15 0.00 4.20 -1.64 -2.43 115.11 116.22 2g2w h GLN 99 Ca 0.26 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2g2w h GLN 99 Cb 0.39 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2g2w h GLN 99 CO -0.39 0.79 -0.07 0.28 -0.67 0.00 0.00 178.83 178.77 2g2w h VAL 100 N 0.58 0.86 -0.42 -0.54 2.07 -0.35 -2.45 116.25 116.00 2g2w h VAL 100 Ca 0.09 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 2g2w h VAL 100 Cb 0.64 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2g2w h VAL 100 CO 0.05 0.01 0.06 -0.07 0.02 0.00 0.00 177.57 177.64 2g2w h LEU 101 N -0.22 0.60 -1.66 2.57 3.38 -1.19 0.10 115.31 118.88 2g2w h LEU 101 Ca -0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2g2w h LEU 101 Cb 0.17 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2g2w h LEU 101 CO 0.03 0.62 -0.05 0.00 0.09 0.00 0.00 178.44 179.14 2g2w h ALA 102 N 1.46 1.73 0.06 1.53 0.00 -1.35 -0.48 119.26 122.21 2g2w h ALA 102 Ca 0.14 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2g2w h ALA 102 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2g2w h ALA 102 CO 0.00 0.21 -0.68 1.15 0.00 0.00 0.00 179.25 179.93 2g2w h THR 103 N 0.15 1.45 0.00 0.00 2.02 -0.57 -3.39 112.91 112.57 2g2w h THR 103 Ca 0.04 -2.39 0.00 0.00 0.77 0.00 0.00 66.41 64.83 2g2w h THR 103 Cb 0.19 3.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.65 2g2w h THR 103 CO 0.01 0.62 -0.69 1.33 0.37 0.00 0.00 175.52 177.15 2g2w n VAL 104 N -4.32 0.11 0.00 3.16 0.24 0.17 -4.87 118.33 112.83 2g2w n VAL 104 Ca -0.17 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2g2w n VAL 104 Cb 0.69 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 2g2w n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2g2w n GLY 105 N 1.44 3.13 0.25 7.63 0.00 -0.20 -3.67 105.19 113.76 2g2w n GLY 105 Ca 0.04 -1.31 0.11 0.00 0.00 0.00 0.00 46.02 44.86 2g2w n GLY 105 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2g2w h GLN 106 N 0.00 0.00 -0.33 1.61 1.08 -1.84 -1.91 115.11 113.71 2g2w h GLN 106 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2g2w h GLN 106 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2g2w h GLN 106 CO 0.00 0.14 0.00 0.41 -0.95 0.00 0.00 178.83 178.43 2g2w n GLY 107 N -0.65 3.79 0.07 3.46 0.00 -1.26 -4.64 105.19 105.96 2g2w n GLY 107 Ca -0.02 -1.01 0.12 0.00 0.00 0.00 0.00 46.02 45.12 2g2w n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2g2w n SER 108 N -0.23 0.71 -4.41 1.61 7.64 -0.72 -0.58 113.62 117.64 2g2w n SER 108 Ca 0.23 0.25 -0.27 0.00 1.01 0.00 0.00 58.87 60.09 2g2w n SER 108 Cb 0.96 -0.14 -0.12 0.00 -1.01 0.00 0.00 64.21 63.90 2g2w n SER 108 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2g2w s THR 110 N -1.61 1.62 -0.39 0.00 -4.23 0.62 -4.72 115.64 106.93 2g2w s THR 110 Ca 0.19 -2.11 -0.19 0.00 -1.18 0.00 0.00 61.69 58.41 2g2w s THR 110 Cb -0.08 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.25 2g2w s THR 110 CO 0.09 -0.25 0.56 -0.89 -0.54 0.00 0.00 174.62 173.59 2g2w s THR 111 N -3.02 4.95 -0.08 3.99 2.01 -1.26 -0.98 115.64 121.23 2g2w s THR 111 Ca 0.31 0.20 -0.20 0.00 0.31 0.00 0.00 61.69 62.30 2g2w s THR 111 Cb 0.05 -4.07 -0.16 0.00 0.01 0.00 0.00 72.50 68.32 2g2w s THR 111 CO 0.13 -0.38 0.71 -0.25 -0.69 0.00 0.00 174.62 174.14 2g2w h TRP 112 N 8.64 -0.10 -3.29 4.92 2.91 -0.99 -3.41 115.95 124.64 2g2w h TRP 112 Ca -0.27 -0.00 -0.14 0.00 1.13 0.00 0.00 58.89 59.61 2g2w h TRP 112 Cb 1.11 0.03 -0.22 0.00 -0.51 0.00 0.00 29.16 29.58 2g2w h TRP 112 CO 0.71 0.44 -0.41 -1.54 -1.03 0.00 0.00 178.44 176.61 2g2w s SER 113 N -5.72 -0.10 -0.22 2.65 1.04 -0.86 -0.98 113.70 109.51 2g2w s SER 113 Ca -0.13 0.03 -0.08 0.00 0.48 0.00 0.00 55.95 56.25 2g2w s SER 113 Cb -0.01 0.30 0.09 0.00 0.10 0.00 0.00 66.02 66.51 2g2w s SER 113 CO 0.47 -0.33 0.47 -0.70 0.98 0.00 0.00 173.24 174.13 2g2w s GLU 114 N -1.04 0.39 -0.02 4.02 2.12 -0.74 -0.34 118.70 123.09 2g2w s GLU 114 Ca -0.11 1.10 0.01 0.00 0.36 0.00 0.00 54.97 56.33 2g2w s GLU 114 Cb -0.06 0.39 0.01 0.00 0.26 0.00 0.00 34.13 34.74 2g2w s GLU 114 CO 0.02 -0.23 -0.03 -0.47 -0.54 0.00 0.00 175.26 174.01 2g2w s TYR 115 N 2.50 0.43 -0.53 5.30 6.04 -0.59 -1.65 117.35 128.85 2g2w s TYR 115 Ca -0.04 -0.08 -0.01 0.00 0.04 0.00 0.00 57.07 56.98 2g2w s TYR 115 Cb -0.11 -0.35 0.14 0.00 -1.04 0.00 0.00 41.96 40.59 2g2w s TYR 115 CO -0.14 -0.06 0.32 0.71 -1.54 0.00 0.00 175.55 174.83 2g2w s TYR 116 N 0.32 3.45 0.11 4.97 1.51 -0.15 -1.43 117.35 126.14 2g2w s TYR 116 Ca -0.03 -2.72 0.32 0.00 -1.01 0.00 0.00 57.07 53.63 2g2w s TYR 116 Cb -0.07 -3.13 1.62 0.00 -0.11 0.00 0.00 41.96 40.27 2g2w s TYR 116 CO -0.00 -0.87 1.98 -1.00 -1.11 0.00 0.00 175.55 174.55 2g2w h PRO 117 N 7.27 0.00 0.00 -1.71 0.13 -1.82 -2.03 132.00 133.84 2g2w h PRO 117 Ca -0.06 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2g2w h PRO 117 Cb 0.97 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.10 2g2w h PRO 117 CO 0.69 0.00 -0.27 0.00 -0.23 0.00 0.00 178.00 178.20 2g2w n ALA 118 N -1.95 2.97 -1.52 -0.56 0.00 -1.26 -5.08 120.51 113.12 2g2w n ALA 118 Ca -0.01 -2.96 -0.59 0.00 0.00 0.00 0.00 53.44 49.88 2g2w n ALA 118 Cb 0.13 -0.37 -0.08 0.00 0.00 0.00 0.00 19.45 19.14 2g2w n ALA 118 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2g2w n TYR 119 N -1.25 0.76 1.02 0.00 4.19 -0.77 -1.03 117.16 120.09 2g2w n TYR 119 Ca 0.17 1.03 0.14 0.00 3.31 0.00 0.00 57.90 62.55 2g2w n TYR 119 Cb 0.67 -2.12 0.53 0.00 0.49 0.00 0.00 39.34 38.91 2g2w n TYR 119 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2g2w n PRO 120 N 1.70 0.03 -1.80 2.98 -0.05 -1.26 -5.09 135.00 131.51 2g2w n PRO 120 Ca 0.20 -0.01 -0.39 0.00 -0.05 0.00 0.00 63.50 63.26 2g2w n PRO 120 Cb 0.08 -1.50 0.03 0.00 -0.05 0.00 0.00 33.50 32.07 2g2w n PRO 120 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 2g2w s SER 121 N -2.97 5.44 0.00 3.54 0.15 -0.19 -4.93 113.70 114.74 2g2w s SER 121 Ca 0.14 2.79 0.27 0.00 0.70 0.00 0.00 55.95 59.85 2g2w s SER 121 Cb 0.19 -2.64 0.91 0.00 -1.71 0.00 0.00 66.02 62.76 2g2w s SER 121 CO 0.57 -1.46 1.66 0.35 1.20 0.00 0.00 173.24 175.56 2g2w n THR 122 N -0.81 0.01 -1.68 6.45 -2.24 -1.26 -4.31 114.28 110.44 2g2w n THR 122 Ca 0.09 -0.29 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 2g2w n THR 122 Cb 0.44 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 2g2w n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2g2w n ALA 123 N 0.37 1.90 -0.95 6.98 0.00 -1.26 -1.59 120.51 125.97 2g2w n ALA 123 Ca 0.18 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2g2w n ALA 123 Cb 0.39 -2.60 0.00 0.00 0.00 0.00 0.00 19.45 17.24 2g2w n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g2w n GLY 124 N 4.30 0.73 3.59 0.00 0.00 -1.26 -4.10 105.19 108.44 2g2w n GLY 124 Ca 0.19 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.70 2g2w n GLY 124 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2g2w n VAL 125 N -2.52 0.24 -4.52 1.61 3.14 -0.62 -4.61 118.33 111.05 2g2w n VAL 125 Ca 0.00 -0.06 -0.33 0.00 -2.96 0.00 0.00 64.34 60.99 2g2w n VAL 125 Cb 0.00 -0.83 -0.11 0.00 -1.06 0.00 0.00 33.84 31.84 2g2w n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 2g2w s THR 126 N 0.31 3.64 -0.07 1.55 -4.23 -0.51 -0.84 115.64 115.49 2g2w s THR 126 Ca 0.81 -0.68 -0.03 0.00 -1.18 0.00 0.00 61.69 60.61 2g2w s THR 126 Cb -0.92 -2.55 0.04 0.00 1.34 0.00 0.00 72.50 70.40 2g2w s THR 126 CO 0.48 0.46 0.13 -0.22 -0.54 0.00 0.00 174.62 174.93 2g2w s LEU 127 N -1.21 0.43 -0.18 4.79 2.96 -0.56 -1.55 118.68 123.35 2g2w s LEU 127 Ca 0.15 0.27 -0.04 0.00 -0.22 0.00 0.00 54.13 54.29 2g2w s LEU 127 Cb -0.11 0.25 -0.02 0.00 0.50 0.00 0.00 46.19 46.81 2g2w s LEU 127 CO 0.05 -0.19 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.42 2g2w s SER 128 N 1.63 4.55 -0.05 3.68 0.01 0.53 0.02 113.70 124.08 2g2w s SER 128 Ca -0.04 -0.26 -0.03 0.00 1.31 0.00 0.00 55.95 56.93 2g2w s SER 128 Cb -0.12 -1.76 -0.04 0.00 0.21 0.00 0.00 66.02 64.31 2g2w s SER 128 CO -0.05 0.08 0.12 -0.76 0.41 0.00 0.00 173.24 173.04 2g2w s LEU 129 N 0.89 4.16 -0.17 2.44 1.43 0.79 -0.42 118.68 127.80 2g2w s LEU 129 Ca -0.00 0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.33 2g2w s LEU 129 Cb -0.15 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 2g2w s LEU 129 CO 0.01 0.32 0.07 -0.94 0.23 0.00 0.00 176.35 176.04 2g2w s SER 130 N -1.53 5.75 0.12 2.29 1.04 -0.16 -1.36 113.70 119.85 2g2w s SER 130 Ca 0.21 0.16 0.08 0.00 0.48 0.00 0.00 55.95 56.88 2g2w s SER 130 Cb -0.12 -1.94 -0.04 0.00 0.10 0.00 0.00 66.02 64.02 2g2w s SER 130 CO 0.12 0.23 -0.19 0.00 0.98 0.00 0.00 173.24 174.38 2g2w s PHE 132 N -1.53 0.29 1.22 0.00 0.40 -0.31 -0.30 117.98 117.75 2g2w s PHE 132 Ca 0.09 -0.12 -0.20 0.00 -0.60 0.00 0.00 56.93 56.09 2g2w s PHE 132 Cb -0.08 -0.19 0.30 0.00 0.51 0.00 0.00 43.02 43.56 2g2w s PHE 132 CO 0.05 -0.02 1.12 0.34 0.70 0.00 0.00 175.22 177.40 2g2w s ASP 133 N -0.29 0.78 0.40 1.36 -1.08 -0.46 -1.79 116.67 115.59 2g2w s ASP 133 Ca -0.01 0.54 0.10 0.00 -0.52 0.00 0.00 52.55 52.65 2g2w s ASP 133 Cb -0.02 -0.71 0.90 0.00 -1.46 0.00 0.00 42.92 41.62 2g2w s ASP 133 CO -0.00 -4.20 1.99 1.62 0.52 0.00 0.00 175.17 175.09 2g2w h VAL 134 N -2.64 0.98 -0.33 1.11 3.04 -1.64 -1.13 116.25 115.64 2g2w h VAL 134 Ca -0.43 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 2g2w h VAL 134 Cb 1.28 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.94 2g2w h VAL 134 CO 0.31 0.10 0.00 0.47 -1.01 0.00 0.00 177.57 177.44 2g2w n ASP 135 N -4.48 3.99 0.15 3.17 8.00 0.35 -4.70 116.55 123.04 2g2w n ASP 135 Ca 0.09 -2.84 0.00 0.00 0.71 0.00 0.00 54.79 52.75 2g2w n ASP 135 Cb 0.26 -0.52 0.24 0.00 -0.02 0.00 0.00 41.12 41.08 2g2w n ASP 135 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2g2w h GLY 136 N 2.18 0.00 0.24 0.44 0.00 -0.79 -3.16 103.07 101.98 2g2w h GLY 136 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2g2w h GLY 136 CO 0.22 0.00 -1.91 2.98 0.00 0.00 0.00 176.54 177.83 2g2w n TYR 137 N -3.88 0.23 0.00 5.60 9.36 -1.26 -4.86 117.16 122.35 2g2w n TYR 137 Ca -0.01 0.07 0.00 0.00 3.32 0.00 0.00 57.90 61.28 2g2w n TYR 137 Cb 0.55 -0.74 0.00 0.00 -0.63 0.00 0.00 39.34 38.51 2g2w n TYR 137 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 2g2w n SER 138 N -2.50 0.00 -1.74 2.98 7.64 -1.19 -5.10 113.62 113.70 2g2w n SER 138 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2g2w n SER 138 Cb 0.74 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 2g2w n SER 138 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2g2w n THR 140 N 0.00 -9.29 0.00 0.44 -2.24 -1.26 -5.01 114.28 96.92 2g2w n THR 140 Ca 0.00 2.68 0.00 0.00 -2.27 0.00 0.00 64.05 64.46 2g2w n THR 140 Cb 0.00 -4.29 0.00 0.00 -2.10 0.00 0.00 70.33 63.94 2g2w n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g2w n GLY 141 N 1.14 3.36 0.21 3.38 0.00 -1.26 -4.86 105.19 107.17 2g2w n GLY 141 Ca 0.00 -1.89 -0.18 0.00 0.00 0.00 0.00 46.02 43.95 2g2w n GLY 141 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2g2w h PHE 142 N 0.00 1.03 -1.27 1.61 3.57 -2.00 -3.39 116.94 116.49 2g2w h PHE 142 Ca 0.00 -0.50 -0.72 0.00 3.53 0.00 0.00 57.97 60.29 2g2w h PHE 142 Cb 0.00 -0.14 -0.12 0.00 2.79 0.00 0.00 35.95 38.48 2g2w h PHE 142 CO 0.00 1.33 2.02 0.66 -2.23 0.00 0.00 178.31 180.09 2g2w n TYR 143 N -3.94 4.37 0.12 0.41 4.01 -1.26 -4.75 117.16 116.13 2g2w n TYR 143 Ca -0.09 -3.04 0.11 0.00 -0.16 0.00 0.00 57.90 54.73 2g2w n TYR 143 Cb 0.79 -2.37 0.27 0.00 -0.31 0.00 0.00 39.34 37.72 2g2w n TYR 143 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 2g2w n ARG 144 N 6.46 2.50 -1.88 -0.72 0.00 -1.26 -0.50 116.66 121.26 2g2w n ARG 144 Ca 0.44 -2.30 -0.38 0.00 -0.00 0.00 0.00 57.85 55.60 2g2w n ARG 144 Cb 0.42 -1.52 0.03 0.00 -0.00 0.00 0.00 32.46 31.39 2g2w n ARG 144 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2g2w s GLY 145 N -1.24 2.88 0.16 2.89 0.00 -1.23 -4.49 107.32 106.29 2g2w s GLY 145 Ca 0.42 1.28 -0.04 0.00 0.00 0.00 0.00 44.72 46.38 2g2w s GLY 145 CO 0.31 1.82 0.17 -1.35 0.00 0.00 0.00 173.10 174.05 2g2w s SER 146 N -0.93 0.16 0.06 1.64 1.04 -0.42 -1.36 113.70 113.91 2g2w s SER 146 Ca 0.67 -1.12 -0.05 0.00 0.48 0.00 0.00 55.95 55.93 2g2w s SER 146 Cb -0.39 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.09 2g2w s SER 146 CO 0.47 -0.83 0.09 0.00 0.98 0.00 0.00 173.24 173.95 2g2w s ALA 147 N -4.04 0.07 -0.19 5.32 0.00 0.59 -0.90 121.76 122.61 2g2w s ALA 147 Ca 0.25 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2g2w s ALA 147 Cb 0.05 0.36 0.02 0.00 0.00 0.00 0.00 23.12 23.55 2g2w s ALA 147 CO 0.04 -0.42 -0.18 -1.58 0.00 0.00 0.00 175.76 173.62 2g2w s HIS 148 N -3.59 2.81 -0.10 0.00 5.04 0.15 -0.98 115.29 118.63 2g2w s HIS 148 Ca 0.03 -1.56 0.04 0.00 -1.54 0.00 0.00 55.06 52.03 2g2w s HIS 148 Cb 0.05 -1.95 0.00 0.00 0.04 0.00 0.00 32.58 30.72 2g2w s HIS 148 CO -0.09 -0.77 -0.23 -0.51 -2.34 0.00 0.00 174.74 170.79 2g2w s LEU 149 N 1.31 2.06 -0.01 8.88 1.43 -0.46 -1.42 118.68 130.48 2g2w s LEU 149 Ca 0.05 -0.54 0.06 0.00 -1.03 0.00 0.00 54.13 52.66 2g2w s LEU 149 Cb -0.13 -1.37 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 2g2w s LEU 149 CO -0.12 0.16 -0.18 -1.66 0.23 0.00 0.00 176.35 174.78 2g2w s TRP 150 N 0.33 1.60 0.09 0.29 -2.14 -0.90 -0.15 118.94 118.07 2g2w s TRP 150 Ca -0.18 -0.31 0.07 0.00 2.66 0.00 0.00 56.10 58.34 2g2w s TRP 150 Cb -0.18 -1.02 -0.03 0.00 -3.10 0.00 0.00 33.47 29.14 2g2w s TRP 150 CO 0.08 -0.01 -0.17 -0.06 -2.66 0.00 0.00 176.95 174.13 2g2w s PHE 151 N -0.47 1.49 -0.08 1.66 0.40 0.10 -0.48 117.98 120.60 2g2w s PHE 151 Ca 0.07 -0.45 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 2g2w s PHE 151 Cb -0.07 -0.82 0.01 0.00 0.51 0.00 0.00 43.02 42.65 2g2w s PHE 151 CO -0.00 0.14 -0.13 0.99 0.70 0.00 0.00 175.22 176.91 2g2w s THR 152 N -1.34 1.25 -1.49 0.64 2.01 -0.71 -1.50 115.64 114.49 2g2w s THR 152 Ca 0.03 -0.53 -0.12 0.00 0.31 0.00 0.00 61.69 61.38 2g2w s THR 152 Cb -0.09 -1.14 0.07 0.00 0.01 0.00 0.00 72.50 71.34 2g2w s THR 152 CO 0.03 0.38 0.98 0.47 -0.69 0.00 0.00 174.62 175.80 2g2w n ASP 153 N 3.94 -5.17 -0.86 3.53 8.00 -0.02 -2.19 116.55 123.77 2g2w n ASP 153 Ca -0.21 -0.68 -0.11 0.00 0.71 0.00 0.00 54.79 54.49 2g2w n ASP 153 Cb 0.52 -4.12 -0.05 0.00 -0.02 0.00 0.00 41.12 37.45 2g2w n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g2w n GLY 154 N -1.72 1.17 3.05 0.44 0.00 -1.26 -5.01 105.19 101.86 2g2w n GLY 154 Ca 0.03 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 2g2w n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g2w s VAL 155 N -2.42 1.30 0.06 1.61 1.01 -0.93 -1.38 120.40 119.65 2g2w s VAL 155 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 2g2w s VAL 155 Cb 0.00 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 35.12 2g2w s VAL 155 CO 0.00 0.39 1.77 -0.22 0.00 0.00 0.00 175.10 177.04 2g2w s LEU 156 N 0.68 4.38 -0.05 3.92 2.96 0.74 -1.74 118.68 129.58 2g2w s LEU 156 Ca -0.14 2.56 0.20 0.00 -0.22 0.00 0.00 54.13 56.53 2g2w s LEU 156 Cb -0.16 -3.55 -0.30 0.00 0.50 0.00 0.00 46.19 42.68 2g2w s LEU 156 CO 0.04 -0.96 0.39 0.00 -1.32 0.00 0.00 176.35 174.49 2g2w n GLN 157 N 6.30 0.66 -3.69 1.98 1.13 0.37 -0.99 117.38 123.14 2g2w n GLN 157 Ca 0.17 -0.16 0.04 0.00 -1.94 0.00 0.00 57.00 55.12 2g2w n GLN 157 Cb 0.40 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.28 2g2w n GLN 157 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2g2w s GLY 158 N -4.45 -0.43 0.07 1.08 0.00 -1.19 -4.95 107.32 97.44 2g2w s GLY 158 Ca -0.08 0.75 -0.18 0.00 0.00 0.00 0.00 44.72 45.22 2g2w s GLY 158 CO 0.83 2.06 0.42 -1.59 0.00 0.00 0.00 173.10 174.81 2g2w s LYS 159 N -2.01 0.97 -0.04 2.90 -2.85 -1.26 -2.11 119.74 115.34 2g2w s LYS 159 Ca 0.20 -0.45 -0.15 0.00 -1.00 0.00 0.00 55.97 54.57 2g2w s LYS 159 Cb 0.06 0.43 0.03 0.00 -2.06 0.00 0.00 37.83 36.29 2g2w s LYS 159 CO -0.06 -0.35 0.34 0.50 0.10 0.00 0.00 175.35 175.88 2g2w s ARG 160 N -2.83 0.64 0.12 1.78 3.52 -0.51 -5.00 118.95 116.67 2g2w s ARG 160 Ca -0.03 -0.05 0.03 0.00 -0.13 0.00 0.00 55.73 55.55 2g2w s ARG 160 Cb -0.00 0.29 -0.04 0.00 -1.56 0.00 0.00 34.95 33.64 2g2w s ARG 160 CO -0.05 -0.17 -0.09 1.14 -0.81 0.00 0.00 175.30 175.32 2g2w s GLN 161 N -1.06 0.96 -0.03 5.12 1.03 -1.26 -0.68 119.66 123.75 2g2w s GLN 161 Ca -0.11 -1.37 0.02 0.00 0.04 0.00 0.00 55.36 53.93 2g2w s GLN 161 Cb -0.05 -0.48 0.01 0.00 0.03 0.00 0.00 33.01 32.53 2g2w s GLN 161 CO 0.04 0.05 -0.06 -1.58 -2.54 0.00 0.00 175.29 171.20 2g2w s TRP 162 N -3.29 0.71 -0.43 9.60 0.51 -0.07 -4.92 118.94 121.05 2g2w s TRP 162 Ca 0.13 -0.17 0.00 0.00 -2.12 0.00 0.00 56.10 53.95 2g2w s TRP 162 Cb 0.03 -0.56 0.00 0.00 -0.81 0.00 0.00 33.47 32.13 2g2w s TRP 162 CO -0.01 -0.11 0.00 -0.25 -0.51 0.00 0.00 176.95 176.07 2g2w n ASP 163 N 3.54 -5.24 -4.78 2.95 8.00 -1.26 -1.30 116.55 118.45 2g2w n ASP 163 Ca -0.20 0.10 -0.36 0.00 0.71 0.00 0.00 54.79 55.03 2g2w n ASP 163 Cb 0.54 -3.10 -0.04 0.00 -0.02 0.00 0.00 41.12 38.49 2g2w n ASP 163 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2g2w s LEU 164 N -0.92 4.12 0.00 0.64 1.43 -1.26 -3.51 118.68 119.19 2g2w s LEU 164 Ca 0.00 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.10 2g2w s LEU 164 Cb 0.00 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 42.00 2g2w s LEU 164 CO 0.00 -0.48 0.34 1.33 0.23 0.00 0.00 176.35 177.78