#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lwo s ILE 12 N 0.00 1.91 0.29 8.89 -1.09 -1.26 -5.11 121.20 124.82 3lwo s ILE 12 Ca 0.00 -1.29 -0.12 0.00 -2.23 0.00 0.00 60.65 57.01 3lwo s ILE 12 Cb 0.00 -1.98 -0.08 0.00 -1.58 0.00 0.00 42.46 38.82 3lwo s ILE 12 CO 0.00 0.10 0.65 -0.76 -1.23 0.00 0.00 174.94 173.70 3lwo s LEU 13 N 1.26 4.09 0.33 2.97 1.02 -1.26 -4.88 118.68 122.20 3lwo s LEU 13 Ca -0.04 1.08 0.11 0.00 0.02 0.00 0.00 54.13 55.30 3lwo s LEU 13 Cb -0.18 -3.87 0.96 0.00 0.02 0.00 0.00 46.19 43.12 3lwo s LEU 13 CO -0.07 -0.16 1.70 -0.65 0.02 0.00 0.00 176.35 177.19 3lwo h PRO 14 N 2.28 0.47 -1.28 1.29 0.11 -1.99 0.26 132.00 133.14 3lwo h PRO 14 Ca -0.47 -0.03 0.37 0.00 0.11 0.00 0.00 66.00 65.98 3lwo h PRO 14 Cb 1.17 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 3lwo h PRO 14 CO 0.67 0.31 1.03 0.00 -0.21 0.00 0.00 178.00 179.80 3lwo h ALA 15 N 1.77 3.18 0.00 -0.75 0.00 -1.94 -1.69 119.26 119.83 3lwo h ALA 15 Ca 0.68 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3lwo h ALA 15 Cb 1.38 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3lwo h ALA 15 CO -0.53 -1.69 -0.47 -0.44 0.00 0.00 0.00 179.25 176.12 3lwo h ASP 16 N 0.00 0.00 -2.45 0.00 3.32 -0.84 -3.44 116.42 113.00 3lwo h ASP 16 Ca 0.61 -0.03 -0.61 0.00 0.02 0.00 0.00 57.03 57.03 3lwo h ASP 16 Cb 2.65 0.00 0.11 0.00 0.22 0.00 0.00 39.33 42.32 3lwo h ASP 16 CO -0.01 0.01 0.08 2.30 -1.72 0.00 0.00 179.24 179.90 3lwo n ILE 17 N -2.74 2.03 -2.95 0.35 -5.35 -0.64 -4.89 119.36 105.16 3lwo n ILE 17 Ca 0.02 -0.50 -0.40 0.00 -0.27 0.00 0.00 62.75 61.60 3lwo n ILE 17 Cb 0.52 -0.95 -0.05 0.00 -1.74 0.00 0.00 39.64 37.43 3lwo n ILE 17 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3lwo s LYS 18 N -1.58 4.49 -0.13 6.28 1.02 -1.26 -5.05 119.74 123.51 3lwo s LYS 18 Ca 0.59 1.07 0.03 0.00 0.02 0.00 0.00 55.97 57.68 3lwo s LYS 18 Cb -0.69 -3.41 0.01 0.00 -0.52 0.00 0.00 37.83 33.22 3lwo s LYS 18 CO 0.59 0.15 -0.22 1.03 -0.92 0.00 0.00 175.35 175.99 3lwo s ARG 19 N 0.40 2.99 0.23 1.68 0.52 -1.26 -5.07 118.95 118.44 3lwo s ARG 19 Ca 0.41 -0.84 -0.25 0.00 -0.52 0.00 0.00 55.73 54.52 3lwo s ARG 19 Cb -0.20 -2.40 -0.09 0.00 0.52 0.00 0.00 34.95 32.79 3lwo s ARG 19 CO 0.22 0.00 0.84 -1.21 0.02 0.00 0.00 175.30 175.18 3lwo s GLU 20 N 0.77 4.55 -0.37 3.54 0.41 -1.26 -4.89 118.70 121.45 3lwo s GLU 20 Ca -0.08 1.20 -0.15 0.00 -0.41 0.00 0.00 54.97 55.52 3lwo s GLU 20 Cb -0.16 -3.05 -0.00 0.00 -1.78 0.00 0.00 34.13 29.14 3lwo s GLU 20 CO -0.01 0.44 0.35 0.08 -0.49 0.00 0.00 175.26 175.64 3lwo s VAL 21 N -1.37 5.18 0.21 2.63 1.01 -1.26 -0.57 120.40 126.24 3lwo s VAL 21 Ca 0.42 -0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 3lwo s VAL 21 Cb -0.21 -3.87 -0.07 0.00 0.00 0.00 0.00 36.38 32.23 3lwo s VAL 21 CO 0.25 -0.18 0.56 -0.76 0.00 0.00 0.00 175.10 174.97 3lwo s LEU 22 N 1.95 4.21 -0.12 3.92 1.43 0.76 -4.93 118.68 125.90 3lwo s LEU 22 Ca 0.10 0.97 -0.03 0.00 -1.03 0.00 0.00 54.13 54.15 3lwo s LEU 22 Cb -0.17 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.42 3lwo s LEU 22 CO 0.12 -0.03 -0.02 -0.63 0.23 0.00 0.00 176.35 176.02 3lwo s ILE 23 N -1.73 4.12 -0.14 -0.59 -1.09 -1.26 -0.99 121.20 119.52 3lwo s ILE 23 Ca 0.45 -0.30 0.01 0.00 -2.23 0.00 0.00 60.65 58.58 3lwo s ILE 23 Cb -0.12 -2.77 -0.09 0.00 -1.58 0.00 0.00 42.46 37.90 3lwo s ILE 23 CO 0.20 0.55 -0.12 1.17 -1.23 0.00 0.00 174.94 175.51 3lwo n LYS 24 N 2.80 0.35 -3.71 2.79 4.81 0.84 -4.93 118.16 121.11 3lwo n LYS 24 Ca -0.18 0.08 -0.29 0.00 -0.87 0.00 0.00 58.31 57.05 3lwo n LYS 24 Cb 0.53 -1.28 -0.15 0.00 0.02 0.00 0.00 35.03 34.15 3lwo n LYS 24 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 3lwo s ASP 25 N -5.36 3.79 0.42 3.14 -1.08 -0.81 -5.01 116.67 111.76 3lwo s ASP 25 Ca -0.19 -1.46 0.09 0.00 -0.52 0.00 0.00 52.55 50.47 3lwo s ASP 25 Cb 0.05 -0.76 0.89 0.00 -1.46 0.00 0.00 42.92 41.64 3lwo s ASP 25 CO 0.32 -0.40 2.04 -0.33 0.52 0.00 0.00 175.17 177.32 3lwo h GLU 26 N 8.15 0.41 -0.06 4.34 3.07 -1.91 -3.23 114.58 125.34 3lwo h GLU 26 Ca -0.15 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.66 3lwo h GLU 26 Cb 1.03 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.85 3lwo h GLU 26 CO 0.45 0.32 -0.02 -0.91 -1.40 0.00 0.00 179.01 177.45 3lwo h ASN 27 N 0.42 0.13 -0.33 1.42 2.35 -1.98 -3.46 115.58 114.13 3lwo h ASN 27 Ca 0.11 -0.38 -0.28 0.00 -0.55 0.00 0.00 56.30 55.20 3lwo h ASN 27 Cb 0.04 -0.03 0.01 0.00 0.05 0.00 0.00 38.32 38.39 3lwo h ASN 27 CO -0.02 0.48 0.13 0.00 -1.65 0.00 0.00 177.43 176.37 3lwo n ALA 28 N -2.31 -0.96 -2.48 -0.83 0.00 -1.22 -4.97 120.51 107.73 3lwo n ALA 28 Ca -0.07 0.18 -0.18 0.00 0.00 0.00 0.00 53.44 53.37 3lwo n ALA 28 Cb 0.23 -0.61 -0.11 0.00 0.00 0.00 0.00 19.45 18.96 3lwo n ALA 28 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3lwo s GLU 29 N 0.53 1.04 -0.11 0.00 2.02 -1.26 -5.13 118.70 115.79 3lwo s GLU 29 Ca 0.33 -1.26 -0.01 0.00 0.02 0.00 0.00 54.97 54.05 3lwo s GLU 29 Cb -0.46 -0.92 -0.03 0.00 0.10 0.00 0.00 34.13 32.82 3lwo s GLU 29 CO 0.23 0.18 -0.07 -0.08 0.02 0.00 0.00 175.26 175.53 3lwo s THR 30 N -2.18 3.61 -0.24 3.63 -1.32 -1.26 -4.70 115.64 113.18 3lwo s THR 30 Ca 0.10 -0.49 -0.28 0.00 -1.21 0.00 0.00 61.69 59.81 3lwo s THR 30 Cb -0.05 -2.52 0.01 0.00 -1.51 0.00 0.00 72.50 68.44 3lwo s THR 30 CO 0.03 0.55 1.01 0.21 -2.21 0.00 0.00 174.62 174.21 3lwo s ASN 31 N -0.19 7.04 0.00 8.08 3.04 -1.26 -4.94 114.94 126.71 3lwo s ASN 31 Ca 0.02 1.29 0.08 0.00 0.04 0.00 0.00 52.86 54.30 3lwo s ASN 31 Cb -0.13 -2.53 0.37 0.00 -1.54 0.00 0.00 41.25 37.43 3lwo s ASN 31 CO 0.03 -0.67 1.24 -2.65 -3.04 0.00 0.00 177.10 172.01 3lwo n PRO 32 N 6.33 0.03 0.16 0.43 -0.02 -1.26 -1.72 135.00 138.95 3lwo n PRO 32 Ca 0.11 0.32 0.04 0.00 -2.02 0.00 0.00 63.50 61.95 3lwo n PRO 32 Cb 0.46 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.64 3lwo n PRO 32 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3lwo h ASP 33 N 0.00 0.00 -2.70 2.55 5.19 -2.00 -3.46 116.42 116.00 3lwo h ASP 33 Ca 0.00 0.00 -0.67 0.00 -0.62 0.00 0.00 57.03 55.74 3lwo h ASP 33 Cb 0.13 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.57 3lwo h ASP 33 CO 0.00 0.45 -0.49 0.26 -3.12 0.00 0.00 179.24 176.34 3lwo s TRP 34 N -3.31 3.57 0.02 4.55 0.51 -0.70 -5.01 118.94 118.57 3lwo s TRP 34 Ca 0.02 0.49 0.00 0.00 -2.12 0.00 0.00 56.10 54.49 3lwo s TRP 34 Cb 0.10 -1.92 0.00 0.00 -0.81 0.00 0.00 33.47 30.84 3lwo s TRP 34 CO 0.71 0.71 0.00 0.41 -0.51 0.00 0.00 176.95 178.28 3lwo n GLY 35 N 1.85 -1.52 2.53 0.98 0.00 -1.07 -4.89 105.19 103.06 3lwo n GLY 35 Ca -0.19 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 3lwo n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3lwo s PHE 36 N -1.39 0.74 0.36 1.61 0.40 -1.26 -5.09 117.98 113.35 3lwo s PHE 36 Ca 0.00 -1.41 -0.25 0.00 -0.60 0.00 0.00 56.93 54.67 3lwo s PHE 36 Cb 0.00 -1.05 -0.12 0.00 0.51 0.00 0.00 43.02 42.36 3lwo s PHE 36 CO 0.00 -0.83 0.92 -2.30 0.70 0.00 0.00 175.22 173.71 3lwo n PRO 37 N 4.53 1.18 -0.31 0.24 -0.02 -1.26 -4.81 135.00 134.55 3lwo n PRO 37 Ca 0.04 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 62.08 3lwo n PRO 37 Cb 0.39 -1.84 0.31 0.00 -0.02 0.00 0.00 33.50 32.34 3lwo n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3lwo h PRO 38 N 1.57 0.35 -2.05 0.52 0.11 -1.89 -0.15 132.00 130.46 3lwo h PRO 38 Ca -0.41 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.07 3lwo h PRO 38 Cb 1.35 -0.08 -0.20 0.00 0.11 0.00 0.00 31.00 32.18 3lwo h PRO 38 CO 0.57 0.23 0.74 0.39 -0.21 0.00 0.00 178.00 179.72 3lwo n GLU 39 N -5.08 2.75 -0.19 1.05 -0.58 -1.26 -3.47 120.64 113.85 3lwo n GLU 39 Ca 0.22 -2.82 0.00 0.00 -0.42 0.00 0.00 57.16 54.14 3lwo n GLU 39 Cb 0.68 -2.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.33 3lwo n GLU 39 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3lwo n LYS 40 N 0.51 0.00 -3.92 3.49 4.81 -0.07 -5.10 118.16 117.88 3lwo n LYS 40 Ca 0.51 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.60 3lwo n LYS 40 Cb 0.43 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 35.37 3lwo n LYS 40 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3lwo s ARG 41 N 0.00 3.76 0.11 1.64 0.52 -1.22 -4.78 118.95 118.99 3lwo s ARG 41 Ca 0.00 -0.44 -0.35 0.00 -0.52 0.00 0.00 55.73 54.42 3lwo s ARG 41 Cb 0.00 -3.24 -0.17 0.00 0.52 0.00 0.00 34.95 32.06 3lwo s ARG 41 CO 0.00 0.01 1.19 -2.30 0.02 0.00 0.00 175.30 174.22 3lwo n PRO 42 N 4.32 0.92 -0.23 3.54 -0.02 -1.26 -4.42 135.00 137.84 3lwo n PRO 42 Ca -0.16 0.33 0.19 0.00 -2.02 0.00 0.00 63.50 61.83 3lwo n PRO 42 Cb 0.52 -1.86 0.35 0.00 -0.02 0.00 0.00 33.50 32.49 3lwo n PRO 42 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 3lwo n ILE 43 N 1.82 -0.29 -0.04 4.25 0.13 -1.26 0.08 119.36 124.05 3lwo n ILE 43 Ca 0.17 1.45 -0.11 0.00 -1.10 0.00 0.00 62.75 63.17 3lwo n ILE 43 Cb 0.20 -2.28 -0.04 0.00 -0.84 0.00 0.00 39.64 36.67 3lwo n ILE 43 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 3lwo h GLU 44 N 0.00 0.24 0.00 9.51 3.07 -2.01 -1.62 114.58 123.78 3lwo h GLU 44 Ca 0.54 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 59.28 3lwo h GLU 44 Cb 1.35 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 3lwo h GLU 44 CO -0.57 0.25 -0.43 1.98 -1.40 0.00 0.00 179.01 178.84 3lwo h MET 45 N 0.17 0.00 -0.56 2.33 1.85 -0.67 -2.29 114.93 115.76 3lwo h MET 45 Ca 0.06 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 59.12 3lwo h MET 45 Cb 0.08 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 32.08 3lwo h MET 45 CO -0.01 0.43 0.23 1.25 -0.40 0.00 0.00 176.91 178.41 3lwo h HIS 46 N 0.00 0.79 0.14 1.39 6.17 -0.54 -1.91 115.15 121.20 3lwo h HIS 46 Ca -0.00 -0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.03 3lwo h HIS 46 Cb 0.91 -0.25 0.00 0.00 2.52 0.00 0.00 27.41 30.60 3lwo h HIS 46 CO 0.00 0.61 -0.07 0.82 0.71 0.00 0.00 177.93 180.00 3lwo h ILE 47 N 0.79 0.97 -1.25 6.26 2.04 -0.99 -2.55 117.51 122.78 3lwo h ILE 47 Ca 0.19 -1.12 0.36 0.00 1.00 0.00 0.00 64.86 65.29 3lwo h ILE 47 Cb 0.14 1.59 -0.08 0.00 -0.74 0.00 0.00 36.82 37.72 3lwo h ILE 47 CO -0.02 0.24 0.85 1.56 0.00 0.00 0.00 178.15 180.78 3lwo h GLN 48 N -0.78 0.14 -1.50 2.37 1.08 -1.25 0.24 115.11 115.41 3lwo h GLN 48 Ca -0.02 -0.01 -0.60 0.00 -1.45 0.00 0.00 58.65 56.57 3lwo h GLN 48 Cb 0.54 -0.03 -0.41 0.00 -0.05 0.00 0.00 27.48 27.52 3lwo h GLN 48 CO 0.03 0.10 -0.61 1.19 -0.95 0.00 0.00 178.83 178.59 3lwo n PHE 49 N -4.42 3.35 -4.44 2.96 3.72 -0.73 -1.09 117.46 116.81 3lwo n PHE 49 Ca 0.30 -3.01 -0.22 0.00 -0.05 0.00 0.00 57.45 54.46 3lwo n PHE 49 Cb 1.24 -0.18 -0.10 0.00 -0.94 0.00 0.00 39.48 39.51 3lwo n PHE 49 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3lwo s GLY 50 N -3.37 1.76 0.00 1.37 0.00 0.07 -1.27 107.32 105.89 3lwo s GLY 50 Ca 0.49 -1.82 0.02 0.00 0.00 0.00 0.00 44.72 43.41 3lwo s GLY 50 CO -0.19 -1.91 -0.07 0.14 0.00 0.00 0.00 173.10 171.07 3lwo s VAL 51 N -2.65 0.53 -0.25 1.40 1.01 0.21 -0.94 120.40 119.71 3lwo s VAL 51 Ca 0.28 -0.37 -0.08 0.00 0.00 0.00 0.00 61.98 61.81 3lwo s VAL 51 Cb -0.04 -0.46 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 3lwo s VAL 51 CO 0.13 0.09 0.09 -0.63 0.00 0.00 0.00 175.10 174.77 3lwo s ILE 52 N -0.29 4.45 -1.22 2.22 1.01 0.11 -0.11 121.20 127.36 3lwo s ILE 52 Ca 0.01 -0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.36 3lwo s ILE 52 Cb -0.03 -3.09 0.10 0.00 0.01 0.00 0.00 42.46 39.44 3lwo s ILE 52 CO -0.00 0.32 1.59 0.21 0.00 0.00 0.00 174.94 177.06 3lwo s ASN 53 N 1.63 6.85 0.10 3.58 3.04 -1.26 -0.33 114.94 128.56 3lwo s ASN 53 Ca 0.06 -2.46 -0.23 0.00 0.04 0.00 0.00 52.86 50.27 3lwo s ASN 53 Cb -0.15 -2.52 -0.07 0.00 -1.54 0.00 0.00 41.25 36.97 3lwo s ASN 53 CO 0.05 -1.09 0.70 -0.22 -3.04 0.00 0.00 177.10 173.50 3lwo s LEU 54 N 3.51 4.53 -0.94 3.21 2.96 -1.03 -1.86 118.68 129.06 3lwo s LEU 54 Ca 0.49 1.46 -0.14 0.00 -0.22 0.00 0.00 54.13 55.71 3lwo s LEU 54 Cb 0.01 -3.14 0.20 0.00 0.50 0.00 0.00 46.19 43.76 3lwo s LEU 54 CO 0.03 0.17 0.99 -0.62 -1.32 0.00 0.00 176.35 175.60 3lwo s ASP 55 N -0.81 6.85 0.05 3.68 -1.08 -0.69 0.50 116.67 125.17 3lwo s ASP 55 Ca 0.34 -2.70 -0.36 0.00 -0.52 0.00 0.00 52.55 49.32 3lwo s ASP 55 Cb -0.21 -2.28 -0.15 0.00 -1.46 0.00 0.00 42.92 38.82 3lwo s ASP 55 CO 0.23 -0.68 1.56 1.17 0.52 0.00 0.00 175.17 177.97 3lwo n LYS 56 N 4.63 1.70 -1.48 4.34 4.81 -0.07 -4.44 118.16 127.64 3lwo n LYS 56 Ca 0.21 0.61 -0.31 0.00 -0.87 0.00 0.00 58.31 57.95 3lwo n LYS 56 Cb 0.46 -2.34 0.07 0.00 0.02 0.00 0.00 35.03 33.23 3lwo n LYS 56 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3lwo s PRO 57 N 1.52 2.63 0.56 1.64 0.04 -1.26 -2.00 135.00 138.13 3lwo s PRO 57 Ca 0.85 0.97 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 3lwo s PRO 57 Cb -0.82 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 31.71 3lwo s PRO 57 CO 0.46 -1.32 1.05 -2.14 0.04 0.00 0.00 177.00 175.10 3lwo s PRO 58 N -5.02 3.46 0.00 0.56 0.02 -1.26 -4.50 135.00 128.26 3lwo s PRO 58 Ca 0.59 1.26 0.00 0.00 0.02 0.00 0.00 61.00 62.87 3lwo s PRO 58 Cb -0.15 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.32 3lwo s PRO 58 CO 0.55 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.93 3lwo n GLY 59 N -0.75 2.30 3.76 0.52 0.00 -0.74 -5.02 105.19 105.26 3lwo n GLY 59 Ca 0.09 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 3lwo n GLY 59 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3lwo s PRO 60 N 0.00 2.31 0.38 1.61 0.02 -1.26 -4.59 135.00 133.47 3lwo s PRO 60 Ca 0.00 1.34 -0.22 0.00 0.02 0.00 0.00 61.00 62.14 3lwo s PRO 60 Cb 0.00 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.52 3lwo s PRO 60 CO 0.00 -1.62 0.92 0.95 -0.33 0.00 0.00 177.00 176.91 3lwo s THR 61 N -2.60 4.38 0.51 0.99 -4.23 -1.26 -4.23 115.64 109.20 3lwo s THR 61 Ca 0.65 1.51 0.24 0.00 -1.18 0.00 0.00 61.69 62.91 3lwo s THR 61 Cb -0.20 -3.72 0.39 0.00 1.34 0.00 0.00 72.50 70.32 3lwo s THR 61 CO 0.50 -0.16 1.98 0.28 -0.54 0.00 0.00 174.62 176.68 3lwo h SER 62 N 2.34 0.07 -0.44 3.99 0.02 -1.88 -1.24 113.55 116.41 3lwo h SER 62 Ca -0.48 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.34 3lwo h SER 62 Cb 1.18 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 3lwo h SER 62 CO 0.63 0.04 -0.22 0.45 -1.14 0.00 0.00 176.83 176.59 3lwo h HIS 63 N 0.08 1.08 -0.68 3.45 3.86 -1.92 -2.79 115.15 118.23 3lwo h HIS 63 Ca 0.28 -0.27 -0.07 0.00 -1.16 0.00 0.00 60.37 59.15 3lwo h HIS 63 Cb 1.01 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 3lwo h HIS 63 CO -0.00 1.07 0.14 0.93 0.86 0.00 0.00 177.93 180.93 3lwo h GLU 64 N 0.77 1.11 0.22 2.45 5.08 -1.63 -2.60 114.58 119.99 3lwo h GLU 64 Ca 0.10 -0.28 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 3lwo h GLU 64 Cb 0.79 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 3lwo h GLU 64 CO 0.07 1.00 -0.39 0.28 -1.00 0.00 0.00 179.01 178.96 3lwo h VAL 65 N 1.04 0.20 -0.02 3.13 2.07 -1.27 -0.52 116.25 120.88 3lwo h VAL 65 Ca 0.21 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.74 3lwo h VAL 65 Cb 0.41 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3lwo h VAL 65 CO 0.01 0.00 0.02 0.58 0.02 0.00 0.00 177.57 178.19 3lwo h VAL 66 N -0.69 0.80 -0.27 2.57 2.07 -1.50 -0.79 116.25 118.43 3lwo h VAL 66 Ca 0.00 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.38 3lwo h VAL 66 Cb 0.68 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3lwo h VAL 66 CO -0.17 0.00 -0.43 0.00 0.02 0.00 0.00 177.57 177.00 3lwo h ALA 67 N 1.99 0.74 0.00 1.67 0.00 -0.92 -1.63 119.26 121.12 3lwo h ALA 67 Ca 0.01 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 3lwo h ALA 67 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3lwo h ALA 67 CO -0.00 0.66 -0.36 -1.49 0.00 0.00 0.00 179.25 178.06 3lwo h TRP 68 N 0.54 0.00 0.03 0.00 6.55 0.29 -2.89 115.95 120.48 3lwo h TRP 68 Ca 0.04 0.00 -0.24 0.00 0.95 0.00 0.00 58.89 59.64 3lwo h TRP 68 Cb 0.96 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 29.28 3lwo h TRP 68 CO 0.05 0.36 -0.95 0.82 -1.05 0.00 0.00 178.44 177.66 3lwo h ILE 69 N 0.00 1.33 -0.05 1.49 2.04 -1.08 -2.21 117.51 119.03 3lwo h ILE 69 Ca -0.00 -2.25 -0.04 0.00 1.00 0.00 0.00 64.86 63.57 3lwo h ILE 69 Cb 0.67 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 39.27 3lwo h ILE 69 CO 0.05 0.68 -0.16 0.11 0.00 0.00 0.00 178.15 178.83 3lwo h LYS 70 N 0.21 0.07 0.00 2.37 1.57 -1.24 0.81 116.57 120.36 3lwo h LYS 70 Ca -0.13 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.44 3lwo h LYS 70 Cb 1.63 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.90 3lwo h LYS 70 CO 0.19 0.23 -1.28 1.57 -0.57 0.00 0.00 179.45 179.59 3lwo h LYS 71 N 0.07 0.00 0.05 3.15 5.09 -1.49 0.19 116.57 123.63 3lwo h LYS 71 Ca 0.01 0.00 -0.31 0.00 0.09 0.00 0.00 60.65 60.44 3lwo h LYS 71 Cb 0.32 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 32.62 3lwo h LYS 71 CO 0.02 0.47 -1.76 0.82 -2.09 0.00 0.00 179.45 176.92 3lwo h ILE 72 N 0.00 0.84 -0.01 0.07 2.04 -1.13 -3.31 117.51 116.00 3lwo h ILE 72 Ca -0.15 -2.62 0.00 0.00 1.00 0.00 0.00 64.86 63.09 3lwo h ILE 72 Cb 1.69 2.50 0.00 0.00 -0.74 0.00 0.00 36.82 40.27 3lwo h ILE 72 CO 0.07 0.67 -0.19 0.18 0.00 0.00 0.00 178.15 178.88 3lwo n LEU 73 N -3.24 1.37 -3.41 1.44 7.99 0.25 -4.98 117.00 116.43 3lwo n LEU 73 Ca -0.21 -0.42 -0.15 0.00 -0.01 0.00 0.00 56.01 55.22 3lwo n LEU 73 Cb 1.05 -0.07 0.02 0.00 -0.11 0.00 0.00 43.42 44.31 3lwo n LEU 73 CO 0.45 0.24 0.07 0.59 -1.51 0.00 0.00 177.39 177.23 3lwo n ASN 74 N -0.24 -6.38 -4.55 -1.43 3.02 -0.96 -5.03 115.26 99.68 3lwo n ASN 74 Ca 0.14 -0.59 -0.24 0.00 -0.03 0.00 0.00 54.58 53.86 3lwo n ASN 74 Cb 0.37 -4.00 -0.09 0.00 -0.61 0.00 0.00 39.78 35.46 3lwo n ASN 74 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3lwo s LEU 75 N -5.02 2.88 0.00 3.41 1.43 0.64 -5.03 118.68 116.99 3lwo s LEU 75 Ca 0.18 -0.83 0.08 0.00 -1.03 0.00 0.00 54.13 52.53 3lwo s LEU 75 Cb -0.05 -1.41 -0.08 0.00 0.03 0.00 0.00 46.19 44.67 3lwo s LEU 75 CO 0.81 0.03 0.34 -0.62 0.23 0.00 0.00 176.35 177.14 3lwo n GLU 76 N -0.68 4.35 -3.70 1.70 1.02 -1.26 -4.70 120.64 117.37 3lwo n GLU 76 Ca -0.06 -0.01 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 3lwo n GLU 76 Cb 0.59 -0.87 -0.09 0.00 -0.02 0.00 0.00 31.44 31.05 3lwo n GLU 76 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3lwo s LYS 77 N -1.73 0.61 -0.30 3.49 2.20 -1.26 -5.06 119.74 117.69 3lwo s LYS 77 Ca 0.03 0.61 -0.16 0.00 -0.36 0.00 0.00 55.97 56.09 3lwo s LYS 77 Cb 0.06 0.29 0.17 0.00 -1.51 0.00 0.00 37.83 36.84 3lwo s LYS 77 CO 0.32 -0.09 1.05 0.00 -0.36 0.00 0.00 175.35 176.27 3lwo s ALA 78 N 0.09 -2.71 -0.10 3.13 0.00 -1.26 -0.94 121.76 119.97 3lwo s ALA 78 Ca -0.01 2.04 0.03 0.00 0.00 0.00 0.00 51.96 54.01 3lwo s ALA 78 Cb -0.03 -2.02 0.01 0.00 0.00 0.00 0.00 23.12 21.08 3lwo s ALA 78 CO 0.01 -0.78 -0.19 0.20 0.00 0.00 0.00 175.76 175.00 3lwo s GLY 79 N 2.05 1.13 0.44 0.00 0.00 -0.66 -4.95 107.32 105.33 3lwo s GLY 79 Ca -0.04 -0.79 -0.09 0.00 0.00 0.00 0.00 44.72 43.80 3lwo s GLY 79 CO -0.16 -0.08 0.79 -2.38 0.00 0.00 0.00 173.10 171.27 3lwo s HIS 80 N 0.59 3.50 0.00 1.90 -3.43 -1.26 -1.46 115.29 115.13 3lwo s HIS 80 Ca -0.14 1.01 0.00 0.00 -0.80 0.00 0.00 55.06 55.13 3lwo s HIS 80 Cb -0.17 -2.43 0.00 0.00 -1.43 0.00 0.00 32.58 28.55 3lwo s HIS 80 CO 0.05 -0.18 0.00 0.41 -2.00 0.00 0.00 174.74 173.02 3lwo n GLY 81 N -1.60 -0.54 3.69 -1.38 0.00 -0.56 -4.87 105.19 99.93 3lwo n GLY 81 Ca 0.02 -1.20 -0.59 0.00 0.00 0.00 0.00 46.02 44.25 3lwo n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lwo n GLY 82 N 3.41 0.70 3.58 -0.02 0.00 -1.26 -4.79 105.19 106.81 3lwo n GLY 82 Ca 0.00 0.95 -0.40 0.00 0.00 0.00 0.00 46.02 46.58 3lwo n GLY 82 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lwo s THR 83 N 3.81 3.04 0.14 2.61 2.01 -1.26 -4.96 115.64 121.04 3lwo s THR 83 Ca 1.01 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 62.74 3lwo s THR 83 Cb -1.14 -3.08 -0.08 0.00 0.01 0.00 0.00 72.50 68.21 3lwo s THR 83 CO 0.68 -0.07 1.27 -0.76 -0.69 0.00 0.00 174.62 175.05 3lwo s LEU 84 N 10.00 4.40 0.81 4.42 1.43 -1.26 -5.02 118.68 133.47 3lwo s LEU 84 Ca 0.97 2.24 -0.13 0.00 -1.03 0.00 0.00 54.13 56.18 3lwo s LEU 84 Cb -0.25 -3.59 0.09 0.00 0.03 0.00 0.00 46.19 42.47 3lwo s LEU 84 CO 0.30 -0.50 1.18 -1.81 0.23 0.00 0.00 176.35 175.75 3lwo s ASP 85 N 0.67 3.61 0.20 2.29 -0.00 -1.26 -3.77 116.67 118.41 3lwo s ASP 85 Ca 0.58 2.29 -0.18 0.00 -0.00 0.00 0.00 52.55 55.24 3lwo s ASP 85 Cb -0.34 -2.58 0.17 0.00 -0.00 0.00 0.00 42.92 40.18 3lwo s ASP 85 CO 0.33 -2.65 1.59 -0.65 -0.00 0.00 0.00 175.17 173.80 3lwo h PRO 86 N -1.03 -0.11 0.00 8.23 0.11 -1.86 -1.69 132.00 135.66 3lwo h PRO 86 Ca -0.46 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3lwo h PRO 86 Cb 1.28 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3lwo h PRO 86 CO 0.46 -0.07 0.00 1.63 -0.21 0.00 0.00 178.00 179.81 3lwo n LYS 87 N -5.45 0.07 -3.40 1.05 5.02 -1.26 -1.79 118.16 112.40 3lwo n LYS 87 Ca 0.06 0.09 -0.38 0.00 -2.02 0.00 0.00 58.31 56.06 3lwo n LYS 87 Cb 0.36 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 3lwo n LYS 87 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3lwo s VAL 88 N -2.91 4.89 0.40 -0.18 1.01 -0.64 -4.63 120.40 118.35 3lwo s VAL 88 Ca 0.14 1.01 0.08 0.00 0.00 0.00 0.00 61.98 63.20 3lwo s VAL 88 Cb 0.15 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 3lwo s VAL 88 CO 0.41 0.56 0.18 -0.94 0.00 0.00 0.00 175.10 175.31 3lwo s SER 89 N -1.11 4.48 0.00 3.32 1.04 -1.17 -4.49 113.70 115.76 3lwo s SER 89 Ca 0.26 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.68 3lwo s SER 89 Cb -0.18 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.42 3lwo s SER 89 CO 0.16 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.49 3lwo n GLY 90 N -1.22 -0.07 3.62 7.32 0.00 -0.85 -0.30 105.19 113.68 3lwo n GLY 90 Ca -0.01 -2.22 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 3lwo n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lwo s VAL 91 N 0.00 3.18 -0.32 1.61 1.01 0.80 -0.89 120.40 125.79 3lwo s VAL 91 Ca 0.00 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.19 3lwo s VAL 91 Cb 0.00 -3.21 0.10 0.00 0.00 0.00 0.00 36.38 33.27 3lwo s VAL 91 CO 0.00 -0.11 0.08 -0.22 0.00 0.00 0.00 175.10 174.85 3lwo s LEU 92 N 6.93 3.30 -0.03 3.92 2.96 0.18 -4.82 118.68 131.12 3lwo s LEU 92 Ca 0.91 -1.85 -0.30 0.00 -0.22 0.00 0.00 54.13 52.67 3lwo s LEU 92 Cb -0.32 -1.19 -0.05 0.00 0.50 0.00 0.00 46.19 45.14 3lwo s LEU 92 CO 0.35 -0.40 1.39 -2.84 -1.32 0.00 0.00 176.35 173.53 3lwo s PRO 93 N 1.32 4.28 -0.31 0.98 0.02 -1.26 -2.46 135.00 137.56 3lwo s PRO 93 Ca 0.10 1.92 -0.03 0.00 0.02 0.00 0.00 61.00 63.01 3lwo s PRO 93 Cb -0.18 -3.62 0.04 0.00 0.02 0.00 0.00 34.50 30.76 3lwo s PRO 93 CO -0.18 -0.60 0.03 0.08 -0.33 0.00 0.00 177.00 176.01 3lwo s VAL 94 N 2.62 3.27 0.12 3.83 1.01 0.55 -1.50 120.40 130.31 3lwo s VAL 94 Ca 0.63 -1.28 -0.28 0.00 0.00 0.00 0.00 61.98 61.06 3lwo s VAL 94 Cb -0.30 -2.86 -0.07 0.00 0.00 0.00 0.00 36.38 33.16 3lwo s VAL 94 CO 0.25 -0.12 0.86 0.00 0.00 0.00 0.00 175.10 176.09 3lwo s ALA 95 N 1.31 3.34 -0.08 5.51 0.00 -0.53 0.05 121.76 131.36 3lwo s ALA 95 Ca -0.04 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.35 3lwo s ALA 95 Cb -0.20 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 3lwo s ALA 95 CO 0.00 0.11 0.03 -0.51 0.00 0.00 0.00 175.76 175.38 3lwo s LEU 96 N -0.45 3.70 0.00 0.00 1.43 -0.11 -1.66 118.68 121.59 3lwo s LEU 96 Ca 0.41 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.69 3lwo s LEU 96 Cb -0.23 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.09 3lwo s LEU 96 CO 0.27 0.37 0.00 -0.62 0.23 0.00 0.00 176.35 176.60 3lwo n GLU 97 N 1.99 0.00 0.08 1.70 -0.58 -0.12 0.44 120.64 124.16 3lwo n GLU 97 Ca -0.18 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.68 3lwo n GLU 97 Cb 0.54 0.00 0.45 0.00 -0.57 0.00 0.00 31.44 31.86 3lwo n GLU 97 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3lwo n LYS 98 N 2.58 0.16 -0.30 3.49 5.02 -0.25 -2.11 118.16 126.74 3lwo n LYS 98 Ca 0.00 0.27 0.10 0.00 -2.02 0.00 0.00 58.31 56.67 3lwo n LYS 98 Cb 0.00 -1.74 0.28 0.00 -0.02 0.00 0.00 35.03 33.54 3lwo n LYS 98 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3lwo n ALA 99 N -1.70 2.40 -0.32 7.82 0.00 0.17 -4.58 120.51 124.31 3lwo n ALA 99 Ca 0.04 -1.08 0.06 0.00 0.00 0.00 0.00 53.44 52.46 3lwo n ALA 99 Cb 0.30 -0.95 0.22 0.00 0.00 0.00 0.00 19.45 19.02 3lwo n ALA 99 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3lwo h THR 100 N 3.73 0.83 0.00 0.00 2.02 -1.31 -2.15 112.91 116.02 3lwo h THR 100 Ca 0.00 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3lwo h THR 100 Cb 0.85 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3lwo h THR 100 CO 0.00 0.14 0.00 0.54 0.37 0.00 0.00 175.52 176.57 3lwo n ARG 101 N -4.76 0.77 0.24 6.66 1.74 -1.26 -2.69 116.66 117.35 3lwo n ARG 101 Ca 0.17 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.38 3lwo n ARG 101 Cb 0.38 -1.38 0.44 0.00 -1.02 0.00 0.00 32.46 30.88 3lwo n ARG 101 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3lwo h VAL 102 N 0.00 0.17 0.00 1.55 -1.51 -1.75 -3.03 116.25 111.67 3lwo h VAL 102 Ca 0.00 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 3lwo h VAL 102 Cb 0.00 1.77 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 3lwo h VAL 102 CO 0.00 0.08 0.47 -0.37 -1.23 0.00 0.00 177.57 176.52 3lwo h VAL 103 N 0.00 0.00 0.00 7.19 -1.51 -1.73 0.75 116.25 120.94 3lwo h VAL 103 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3lwo h VAL 103 Cb 0.77 0.34 0.00 0.00 -2.13 0.00 0.00 31.29 30.27 3lwo h VAL 103 CO 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 3lwo n GLN 104 N -2.37 0.06 0.05 5.19 10.64 -1.15 -0.89 117.38 128.91 3lwo n GLN 104 Ca -0.01 0.16 0.12 0.00 -1.83 0.00 0.00 57.00 55.43 3lwo n GLN 104 Cb 0.49 -1.59 0.08 0.00 -0.86 0.00 0.00 30.24 28.36 3lwo n GLN 104 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3lwo n ALA 105 N -1.57 3.05 -0.04 2.61 0.00 0.26 -4.63 120.51 120.18 3lwo n ALA 105 Ca 0.05 -0.32 -0.04 0.00 0.00 0.00 0.00 53.44 53.14 3lwo n ALA 105 Cb 0.29 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 3lwo n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3lwo n LEU 106 N -2.14 1.06 -0.21 0.00 4.32 -0.07 -4.27 117.00 115.70 3lwo n LEU 106 Ca 0.02 0.35 0.16 0.00 -0.02 0.00 0.00 56.01 56.53 3lwo n LEU 106 Cb 0.46 -0.68 0.31 0.00 -1.62 0.00 0.00 43.42 41.88 3lwo n LEU 106 CO 0.39 -0.44 0.61 0.18 -1.22 0.00 0.00 177.39 176.91 3lwo n LEU 107 N -3.61 0.12 0.17 2.23 4.77 -0.14 0.21 117.00 120.75 3lwo n LEU 107 Ca -0.06 1.05 0.04 0.00 -0.03 0.00 0.00 56.01 57.02 3lwo n LEU 107 Cb 0.21 -0.47 0.27 0.00 -2.33 0.00 0.00 43.42 41.10 3lwo n LEU 107 CO 0.09 -1.14 0.62 -0.65 -1.33 0.00 0.00 177.39 174.98 3lwo h PRO 108 N 0.00 0.00 -7.13 3.23 0.11 -1.82 -3.44 132.00 122.95 3lwo h PRO 108 Ca 0.48 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 66.07 3lwo h PRO 108 Cb 1.20 0.00 0.11 0.00 0.11 0.00 0.00 31.00 32.42 3lwo h PRO 108 CO -0.52 0.43 0.43 0.00 -0.21 0.00 0.00 178.00 178.13 3lwo s ALA 109 N -3.47 2.49 0.69 -0.75 0.00 0.56 -4.20 121.76 117.08 3lwo s ALA 109 Ca 0.01 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 52.66 3lwo s ALA 109 Cb 0.10 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.83 3lwo s ALA 109 CO 0.70 -1.22 1.22 0.41 0.00 0.00 0.00 175.76 176.88 3lwo n GLY 110 N 0.22 0.27 3.39 0.00 0.00 -1.26 -4.12 105.19 103.69 3lwo n GLY 110 Ca 0.13 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 3lwo n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lwo s LYS 111 N -3.51 1.45 0.02 1.61 -0.14 -0.44 -1.01 119.74 117.72 3lwo s LYS 111 Ca 0.79 -1.62 0.05 0.00 -1.36 0.00 0.00 55.97 53.83 3lwo s LYS 111 Cb -0.36 -1.40 -0.02 0.00 -1.68 0.00 0.00 37.83 34.37 3lwo s LYS 111 CO 0.44 0.26 -0.15 -2.00 -0.76 0.00 0.00 175.35 173.14 3lwo s GLU 112 N -3.44 1.06 0.09 1.68 2.12 0.42 -0.73 118.70 119.91 3lwo s GLU 112 Ca 0.24 -0.70 0.04 0.00 0.36 0.00 0.00 54.97 54.91 3lwo s GLU 112 Cb -0.03 -1.07 -0.03 0.00 0.26 0.00 0.00 34.13 33.26 3lwo s GLU 112 CO 0.10 0.28 -0.11 0.71 -0.54 0.00 0.00 175.26 175.69 3lwo s TYR 113 N -0.67 1.11 -0.17 5.30 1.51 0.52 -1.49 117.35 123.46 3lwo s TYR 113 Ca 0.04 -0.60 -0.05 0.00 -1.01 0.00 0.00 57.07 55.44 3lwo s TYR 113 Cb -0.07 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.14 3lwo s TYR 113 CO 0.01 0.02 0.01 0.08 -1.11 0.00 0.00 175.55 174.56 3lwo s VAL 114 N -2.18 4.31 0.04 0.71 1.01 0.41 0.03 120.40 124.74 3lwo s VAL 114 Ca 0.04 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.86 3lwo s VAL 114 Cb -0.05 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 3lwo s VAL 114 CO 0.01 0.48 -0.15 0.00 0.00 0.00 0.00 175.10 175.44 3lwo s ALA 115 N 0.33 1.23 -0.27 5.51 0.00 0.35 -1.62 121.76 127.30 3lwo s ALA 115 Ca -0.01 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.05 3lwo s ALA 115 Cb -0.13 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.82 3lwo s ALA 115 CO 0.02 0.23 -0.01 -1.17 0.00 0.00 0.00 175.76 174.83 3lwo s LEU 116 N -1.24 3.44 -0.12 0.00 2.96 0.31 -1.64 118.68 122.39 3lwo s LEU 116 Ca 0.02 -0.82 -0.05 0.00 -0.22 0.00 0.00 54.13 53.06 3lwo s LEU 116 Cb -0.08 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 3lwo s LEU 116 CO 0.01 -0.15 0.04 -0.32 -1.32 0.00 0.00 176.35 174.61 3lwo s MET 117 N 1.38 3.40 -0.28 1.98 -2.45 -0.31 -1.13 119.30 121.89 3lwo s MET 117 Ca 0.01 -0.34 -0.06 0.00 -1.25 0.00 0.00 55.69 54.05 3lwo s MET 117 Cb -0.17 -3.00 0.01 0.00 1.25 0.00 0.00 34.83 32.92 3lwo s MET 117 CO -0.02 0.57 0.04 -1.58 1.05 0.00 0.00 175.02 175.08 3lwo s HIS 118 N -0.48 3.11 0.20 4.11 2.46 0.12 -1.11 115.29 123.70 3lwo s HIS 118 Ca 0.10 -1.03 -0.30 0.00 0.47 0.00 0.00 55.06 54.29 3lwo s HIS 118 Cb -0.12 -2.21 -0.08 0.00 -0.13 0.00 0.00 32.58 30.05 3lwo s HIS 118 CO 0.02 -0.58 1.08 -0.51 -2.47 0.00 0.00 174.74 172.28 3lwo s LEU 119 N 1.48 4.51 0.00 8.88 1.43 0.21 -1.89 118.68 133.30 3lwo s LEU 119 Ca 0.03 2.10 0.30 0.00 -1.03 0.00 0.00 54.13 55.52 3lwo s LEU 119 Cb -0.17 -3.61 1.40 0.00 0.03 0.00 0.00 46.19 43.85 3lwo s LEU 119 CO 0.01 -0.17 2.00 1.41 0.23 0.00 0.00 176.35 179.82 3lwo n HIS 120 N 2.12 0.00 -4.04 0.29 8.25 -0.46 -4.89 115.22 116.49 3lwo n HIS 120 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 3lwo n HIS 120 Cb 0.46 -0.36 -0.06 0.00 1.12 0.00 0.00 29.99 31.15 3lwo n HIS 120 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3lwo s GLY 121 N -2.73 0.81 0.16 -1.41 0.00 -1.26 -4.98 107.32 97.91 3lwo s GLY 121 Ca 0.23 -1.10 -0.29 0.00 0.00 0.00 0.00 44.72 43.57 3lwo s GLY 121 CO 0.49 -0.79 0.91 0.99 0.00 0.00 0.00 173.10 174.70 3lwo s ASP 122 N -3.07 7.51 -0.07 1.64 1.01 -1.26 -4.94 116.67 117.49 3lwo s ASP 122 Ca 0.26 1.80 -0.05 0.00 0.71 0.00 0.00 52.55 55.27 3lwo s ASP 122 Cb 0.00 -2.57 0.03 0.00 1.01 0.00 0.00 42.92 41.39 3lwo s ASP 122 CO 0.11 0.05 0.18 -0.69 0.21 0.00 0.00 175.17 175.03 3lwo s VAL 123 N -0.56 -0.02 0.46 -1.27 1.01 -1.26 -4.98 120.40 113.77 3lwo s VAL 123 Ca 0.43 0.07 -0.25 0.00 0.00 0.00 0.00 61.98 62.23 3lwo s VAL 123 Cb -0.24 -0.27 -0.08 0.00 0.00 0.00 0.00 36.38 35.79 3lwo s VAL 123 CO 0.30 0.03 1.31 -2.65 0.00 0.00 0.00 175.10 174.08 3lwo n PRO 124 N 3.51 1.92 0.21 2.72 -0.02 -1.26 -4.88 135.00 137.19 3lwo n PRO 124 Ca -0.18 0.69 0.15 0.00 -2.02 0.00 0.00 63.50 62.13 3lwo n PRO 124 Cb 0.56 -2.46 0.78 0.00 -0.02 0.00 0.00 33.50 32.36 3lwo n PRO 124 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3lwo h GLU 125 N 1.96 0.00 -0.16 -0.52 5.08 -2.01 -2.49 114.58 116.45 3lwo h GLU 125 Ca -0.49 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.80 3lwo h GLU 125 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 3lwo h GLU 125 CO 0.59 0.00 -0.16 0.38 -1.00 0.00 0.00 179.01 178.83 3lwo h ASP 126 N 0.00 0.41 0.09 1.42 3.04 -2.01 -3.07 116.42 116.31 3lwo h ASP 126 Ca 0.07 -0.48 0.02 0.00 -3.24 0.00 0.00 57.03 53.40 3lwo h ASP 126 Cb 0.35 -0.12 -0.04 0.00 -1.04 0.00 0.00 39.33 38.48 3lwo h ASP 126 CO -0.00 0.81 -0.28 0.11 -2.04 0.00 0.00 179.24 177.83 3lwo h LYS 127 N 0.02 -0.46 -0.69 4.15 1.79 -1.82 -0.95 116.57 118.61 3lwo h LYS 127 Ca 0.03 0.03 0.14 0.00 -2.18 0.00 0.00 60.65 58.67 3lwo h LYS 127 Cb 0.69 0.11 -0.13 0.00 -1.58 0.00 0.00 32.23 31.32 3lwo h LYS 127 CO 0.04 -0.31 -0.15 0.82 -1.08 0.00 0.00 179.45 178.77 3lwo h ILE 128 N -0.48 0.32 0.18 1.86 2.04 -1.59 0.34 117.51 120.17 3lwo h ILE 128 Ca 0.04 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 3lwo h ILE 128 Cb 0.52 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3lwo h ILE 128 CO -0.18 0.00 -0.08 0.40 0.00 0.00 0.00 178.15 178.28 3lwo h ILE 129 N 0.01 0.94 -0.46 -0.67 2.04 -1.40 -0.56 117.51 117.41 3lwo h ILE 129 Ca 0.34 -0.87 0.09 0.00 1.00 0.00 0.00 64.86 65.42 3lwo h ILE 129 Cb 0.53 1.43 -0.10 0.00 -0.74 0.00 0.00 36.82 37.94 3lwo h ILE 129 CO -0.70 0.19 -0.29 -0.61 0.00 0.00 0.00 178.15 176.74 3lwo h GLN 130 N -0.68 -0.18 -0.43 2.37 4.15 -0.79 -0.68 115.11 118.86 3lwo h GLN 130 Ca -0.02 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 3lwo h GLN 130 Cb 0.49 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.20 3lwo h GLN 130 CO 0.04 -0.12 0.07 0.28 -1.93 0.00 0.00 178.83 177.17 3lwo h VAL 131 N -0.19 1.24 -0.32 2.39 2.07 -0.34 -2.81 116.25 118.29 3lwo h VAL 131 Ca 0.20 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 3lwo h VAL 131 Cb 0.52 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 3lwo h VAL 131 CO -0.57 0.31 0.06 0.24 0.02 0.00 0.00 177.57 177.63 3lwo h MET 132 N 0.56 0.47 -0.02 1.57 2.86 -0.74 -1.16 114.93 118.48 3lwo h MET 132 Ca 0.13 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3lwo h MET 132 Cb 0.37 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 3lwo h MET 132 CO 0.01 0.45 0.01 -0.22 1.06 0.00 0.00 176.91 178.22 3lwo h LYS 133 N 0.47 0.00 0.00 1.72 3.64 -0.87 -1.99 116.57 119.54 3lwo h LYS 133 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3lwo h LYS 133 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3lwo h LYS 133 CO -0.00 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.57 3lwo n GLU 134 N -4.24 0.02 0.01 1.90 1.02 -0.44 -3.09 120.64 115.83 3lwo n GLU 134 Ca -0.03 0.20 0.11 0.00 -0.02 0.00 0.00 57.16 57.43 3lwo n GLU 134 Cb 0.10 -1.54 0.08 0.00 -0.02 0.00 0.00 31.44 30.06 3lwo n GLU 134 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3lwo n PHE 135 N -1.59 0.06 -0.94 -0.32 3.72 -0.75 -4.87 117.46 112.78 3lwo n PHE 135 Ca 0.04 0.02 -0.33 0.00 -0.05 0.00 0.00 57.45 57.13 3lwo n PHE 135 Cb 0.22 -0.22 0.13 0.00 -0.94 0.00 0.00 39.48 38.68 3lwo n PHE 135 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3lwo n GLU 136 N -1.61 -0.08 0.00 -1.08 1.02 -1.18 -4.65 120.64 113.05 3lwo n GLU 136 Ca 0.04 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 3lwo n GLU 136 Cb 0.36 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.58 3lwo n GLU 136 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lwo n GLY 137 N 0.86 0.55 3.91 0.62 0.00 -0.37 -4.94 105.19 105.81 3lwo n GLY 137 Ca 0.11 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 3lwo n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3lwo s GLU 138 N 0.00 3.59 0.00 1.61 2.02 -1.26 -0.58 118.70 124.07 3lwo s GLU 138 Ca 0.00 -0.16 -0.04 0.00 0.02 0.00 0.00 54.97 54.79 3lwo s GLU 138 Cb 0.00 -2.85 -0.00 0.00 0.10 0.00 0.00 34.13 31.38 3lwo s GLU 138 CO 0.00 0.45 0.08 0.96 0.02 0.00 0.00 175.26 176.77 3lwo s ILE 139 N -1.71 0.08 -0.08 -1.63 -4.36 -0.78 -4.94 121.20 107.77 3lwo s ILE 139 Ca 0.40 -0.63 -0.02 0.00 -0.26 0.00 0.00 60.65 60.14 3lwo s ILE 139 Cb -0.12 -0.33 -0.03 0.00 1.25 0.00 0.00 42.46 43.23 3lwo s ILE 139 CO 0.26 -0.35 0.02 -0.63 0.24 0.00 0.00 174.94 174.48 3lwo s ILE 140 N -1.15 4.43 0.19 8.37 1.01 -1.26 -1.25 121.20 131.55 3lwo s ILE 140 Ca -0.12 -0.22 -0.18 0.00 0.00 0.00 0.00 60.65 60.12 3lwo s ILE 140 Cb -0.07 -2.88 0.03 0.00 0.01 0.00 0.00 42.46 39.55 3lwo s ILE 140 CO 0.01 0.59 0.53 0.00 0.00 0.00 0.00 174.94 176.07 3lwo s GLN 141 N -0.96 1.37 0.34 2.79 -2.07 0.12 -4.98 119.66 116.27 3lwo s GLN 141 Ca 0.14 -0.83 -0.02 0.00 -1.82 0.00 0.00 55.36 52.83 3lwo s GLN 141 Cb -0.11 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.33 3lwo s GLN 141 CO 0.03 -0.58 0.46 0.50 -1.32 0.00 0.00 175.29 174.38 3lwo s ARG 142 N -3.86 1.88 -0.20 9.60 3.52 -1.26 -0.18 118.95 128.45 3lwo s ARG 142 Ca 0.08 -1.75 -0.02 0.00 -0.13 0.00 0.00 55.73 53.91 3lwo s ARG 142 Cb -0.01 0.44 -0.00 0.00 -1.56 0.00 0.00 34.95 33.81 3lwo s ARG 142 CO -0.04 -0.77 -0.10 -1.17 -0.81 0.00 0.00 175.30 172.41 3lwo s LEU 153 N -3.23 2.65 0.02 -0.88 2.96 -1.26 -5.13 118.68 113.81 3lwo s LEU 153 Ca 0.31 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 3lwo s LEU 153 Cb -0.00 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 3lwo s LEU 153 CO 0.20 0.00 -0.06 0.00 -1.32 0.00 0.00 176.35 175.17 3lwo s ARG 154 N 1.31 0.47 -0.14 1.98 1.70 0.75 -5.15 118.95 119.87 3lwo s ARG 154 Ca 0.04 -0.52 -0.07 0.00 -0.47 0.00 0.00 55.73 54.70 3lwo s ARG 154 Cb -0.14 -0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 33.89 3lwo s ARG 154 CO -0.05 0.07 0.11 -0.08 -1.08 0.00 0.00 175.30 174.27 3lwo s THR 155 N -0.89 5.25 -0.00 4.99 -1.32 -1.26 -0.70 115.64 121.71 3lwo s THR 155 Ca -0.06 0.12 -0.07 0.00 -1.21 0.00 0.00 61.69 60.47 3lwo s THR 155 Cb -0.07 -3.32 0.00 0.00 -1.51 0.00 0.00 72.50 67.61 3lwo s THR 155 CO 0.00 0.56 0.14 -0.60 -2.21 0.00 0.00 174.62 172.50 3lwo s ARG 156 N -0.50 0.45 -0.15 7.08 6.06 -0.38 -4.98 118.95 126.53 3lwo s ARG 156 Ca 0.12 -0.33 -0.13 0.00 -2.50 0.00 0.00 55.73 52.89 3lwo s ARG 156 Cb -0.12 0.19 -0.05 0.00 0.06 0.00 0.00 34.95 35.03 3lwo s ARG 156 CO 0.02 -0.10 0.26 0.21 -2.50 0.00 0.00 175.30 173.19 3lwo s LYS 157 N -1.22 4.12 -0.41 5.12 2.20 -1.26 -1.87 119.74 126.42 3lwo s LYS 157 Ca -0.13 0.05 -0.15 0.00 -0.36 0.00 0.00 55.97 55.38 3lwo s LYS 157 Cb -0.07 -3.38 0.02 0.00 -1.51 0.00 0.00 37.83 32.89 3lwo s LYS 157 CO 0.01 0.36 0.31 0.08 -0.36 0.00 0.00 175.35 175.75 3lwo s VAL 158 N 0.12 5.24 -0.03 4.02 1.01 0.25 -0.40 120.40 130.61 3lwo s VAL 158 Ca 0.16 -0.59 -0.23 0.00 0.00 0.00 0.00 61.98 61.31 3lwo s VAL 158 Cb -0.13 -3.93 -0.23 0.00 0.00 0.00 0.00 36.38 32.09 3lwo s VAL 158 CO 0.04 -0.30 1.06 1.88 0.00 0.00 0.00 175.10 177.78 3lwo h TYR 159 N 8.63 0.36 -3.42 5.22 -1.99 -0.79 -0.97 116.97 124.01 3lwo h TYR 159 Ca -0.27 -0.19 -0.07 0.00 2.00 0.00 0.00 58.73 60.19 3lwo h TYR 159 Cb 1.12 -0.04 -0.15 0.00 2.00 0.00 0.00 36.73 39.66 3lwo h TYR 159 CO 0.57 0.99 -0.20 1.52 -0.00 0.00 0.00 178.16 181.04 3lwo s TYR 160 N -3.20 -0.10 -0.04 4.88 1.13 -1.21 -4.77 117.35 114.05 3lwo s TYR 160 Ca -0.15 -0.16 -0.00 0.00 -1.41 0.00 0.00 57.07 55.34 3lwo s TYR 160 Cb 0.02 0.13 0.03 0.00 -1.10 0.00 0.00 41.96 41.04 3lwo s TYR 160 CO 0.76 -0.59 0.02 0.42 -2.51 0.00 0.00 175.55 173.65 3lwo s ILE 161 N -3.31 0.10 -0.15 -3.49 1.01 -1.26 -1.71 121.20 112.39 3lwo s ILE 161 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.85 3lwo s ILE 161 Cb 0.02 -0.25 0.03 0.00 0.01 0.00 0.00 42.46 42.27 3lwo s ILE 161 CO -0.08 0.16 -0.11 -0.70 0.00 0.00 0.00 174.94 174.21 3lwo s GLU 162 N 1.43 1.98 0.01 2.79 2.12 -0.60 -4.91 118.70 121.52 3lwo s GLU 162 Ca -0.04 -0.53 -0.30 0.00 0.36 0.00 0.00 54.97 54.46 3lwo s GLU 162 Cb -0.13 -2.02 -0.04 0.00 0.26 0.00 0.00 34.13 32.20 3lwo s GLU 162 CO -0.03 -0.30 1.07 0.08 -0.54 0.00 0.00 175.26 175.55 3lwo s VAL 163 N 1.54 4.54 -0.22 3.70 1.01 -1.26 -0.57 120.40 129.13 3lwo s VAL 163 Ca 0.04 1.82 -0.16 0.00 0.00 0.00 0.00 61.98 63.68 3lwo s VAL 163 Cb -0.14 -4.17 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 3lwo s VAL 163 CO -0.09 0.12 -0.21 0.18 0.00 0.00 0.00 175.10 175.10 3lwo n LEU 164 N 4.06 1.91 -3.81 3.92 4.77 0.35 -4.95 117.00 123.26 3lwo n LEU 164 Ca 0.07 0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 56.33 3lwo n LEU 164 Cb 0.49 -0.84 -0.12 0.00 -2.33 0.00 0.00 43.42 40.62 3lwo n LEU 164 CO 0.53 0.17 -0.14 -1.61 -1.33 0.00 0.00 177.39 175.02 3lwo s GLU 165 N -2.54 0.27 -0.20 3.23 2.02 -0.97 -5.00 118.70 115.51 3lwo s GLU 165 Ca -0.31 0.21 0.01 0.00 0.02 0.00 0.00 54.97 54.90 3lwo s GLU 165 Cb 0.09 0.13 0.04 0.00 0.10 0.00 0.00 34.13 34.49 3lwo s GLU 165 CO 0.46 -0.04 -0.12 0.42 0.02 0.00 0.00 175.26 176.00 3lwo s ILE 166 N -0.06 1.82 -0.62 -1.63 1.01 -1.26 0.06 121.20 120.52 3lwo s ILE 166 Ca -0.02 -1.10 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 3lwo s ILE 166 Cb -0.02 -1.84 0.16 0.00 0.01 0.00 0.00 42.46 40.77 3lwo s ILE 166 CO 0.00 0.22 0.44 -1.61 0.00 0.00 0.00 174.94 173.99 3lwo s GLU 167 N 1.32 2.56 4.19 2.79 2.02 -0.07 -4.98 118.70 126.54 3lwo s GLU 167 Ca -0.01 -2.52 0.00 0.00 0.02 0.00 0.00 54.97 52.46 3lwo s GLU 167 Cb -0.16 -3.74 0.00 0.00 0.10 0.00 0.00 34.13 30.33 3lwo s GLU 167 CO -0.09 -1.17 0.00 0.41 0.02 0.00 0.00 175.26 174.43 3lwo n GLY 168 N 3.51 0.93 0.42 -1.39 0.00 -1.26 -1.84 105.19 105.56 3lwo n GLY 168 Ca 0.08 0.39 0.11 0.00 0.00 0.00 0.00 46.02 46.60 3lwo n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lwo n ARG 169 N 0.00 1.03 -3.69 1.61 1.74 -1.26 -4.82 116.66 111.27 3lwo n ARG 169 Ca 0.00 -0.84 -0.36 0.00 -0.77 0.00 0.00 57.85 55.89 3lwo n ARG 169 Cb 0.00 -1.48 -0.08 0.00 -1.02 0.00 0.00 32.46 29.87 3lwo n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3lwo s ASP 170 N -2.55 6.20 -0.18 0.55 -0.00 -0.76 -0.62 116.67 119.31 3lwo s ASP 170 Ca 0.17 0.22 0.01 0.00 -0.00 0.00 0.00 52.55 52.95 3lwo s ASP 170 Cb 0.18 -2.10 0.03 0.00 -0.00 0.00 0.00 42.92 41.02 3lwo s ASP 170 CO 0.61 0.13 -0.16 -0.69 -0.00 0.00 0.00 175.17 175.06 3lwo s VAL 171 N 0.60 1.85 -0.16 -1.27 1.01 -0.27 -0.89 120.40 121.28 3lwo s VAL 171 Ca 0.09 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.09 3lwo s VAL 171 Cb -0.12 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 3lwo s VAL 171 CO 0.01 0.41 0.06 -0.22 0.00 0.00 0.00 175.10 175.36 3lwo s LEU 172 N 1.36 3.87 -0.02 3.92 2.96 0.11 -1.16 118.68 129.71 3lwo s LEU 172 Ca 0.03 0.15 -0.25 0.00 -0.22 0.00 0.00 54.13 53.84 3lwo s LEU 172 Cb -0.14 -1.96 0.05 0.00 0.50 0.00 0.00 46.19 44.65 3lwo s LEU 172 CO -0.11 0.24 0.56 0.72 -1.32 0.00 0.00 176.35 176.44 3lwo s PHE 173 N -0.03 -0.50 0.30 5.38 -0.12 -0.65 -0.50 117.98 121.86 3lwo s PHE 173 Ca 0.06 0.79 -0.13 0.00 -0.05 0.00 0.00 56.93 57.61 3lwo s PHE 173 Cb -0.12 0.32 -0.08 0.00 -0.63 0.00 0.00 43.02 42.50 3lwo s PHE 173 CO 0.01 -0.56 0.68 1.03 -0.05 0.00 0.00 175.22 176.33 3lwo s ARG 174 N -1.44 3.93 -0.07 1.99 0.52 0.26 -0.49 118.95 123.65 3lwo s ARG 174 Ca -0.11 0.54 -0.06 0.00 -0.52 0.00 0.00 55.73 55.58 3lwo s ARG 174 Cb -0.01 -2.49 0.02 0.00 0.52 0.00 0.00 34.95 32.98 3lwo s ARG 174 CO 0.07 0.20 0.19 0.54 0.02 0.00 0.00 175.30 176.31 3lwo s VAL 175 N -1.94 -0.00 -0.12 3.52 0.11 0.10 -1.56 120.40 120.50 3lwo s VAL 175 Ca 0.52 0.02 -0.00 0.00 -2.93 0.00 0.00 61.98 59.58 3lwo s VAL 175 Cb -0.10 -0.27 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 3lwo s VAL 175 CO 0.19 0.01 -0.11 -0.83 -3.33 0.00 0.00 175.10 171.02 3lwo s GLY 176 N 0.20 1.58 0.07 6.54 0.00 -0.69 -0.36 107.32 114.66 3lwo s GLY 176 Ca -0.01 -0.89 -0.00 0.00 0.00 0.00 0.00 44.72 43.82 3lwo s GLY 176 CO -0.00 -0.27 -0.03 -1.34 0.00 0.00 0.00 173.10 171.46 3lwo s VAL 177 N 0.15 0.31 0.92 1.40 -7.23 0.09 -0.11 120.40 115.94 3lwo s VAL 177 Ca -0.06 -1.85 -0.11 0.00 -1.81 0.00 0.00 61.98 58.15 3lwo s VAL 177 Cb -0.15 -1.62 0.15 0.00 0.56 0.00 0.00 36.38 35.32 3lwo s VAL 177 CO 0.04 -0.91 1.10 -0.70 -0.31 0.00 0.00 175.10 174.32 3lwo s GLU 178 N -3.92 1.00 0.41 4.82 2.12 0.46 -1.33 118.70 122.27 3lwo s GLU 178 Ca 0.10 1.12 -0.26 0.00 0.36 0.00 0.00 54.97 56.30 3lwo s GLU 178 Cb 0.07 -1.76 -0.08 0.00 0.26 0.00 0.00 34.13 32.62 3lwo s GLU 178 CO -0.07 -2.51 1.28 0.00 -0.54 0.00 0.00 175.26 173.42 3lwo s ALA 179 N -2.76 3.21 0.00 6.30 0.00 -1.26 -3.33 121.76 123.92 3lwo s ALA 179 Ca 0.65 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.80 3lwo s ALA 179 Cb -0.20 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.44 3lwo s ALA 179 CO 0.58 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.95 3lwo n GLY 180 N 0.66 0.66 3.75 0.00 0.00 -1.26 -4.98 105.19 104.02 3lwo n GLY 180 Ca 0.04 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3lwo n GLY 180 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lwo s THR 181 N -2.00 4.66 -0.44 2.61 2.01 -1.21 -5.03 115.64 116.24 3lwo s THR 181 Ca 0.00 1.61 -0.17 0.00 0.31 0.00 0.00 61.69 63.44 3lwo s THR 181 Cb 0.00 -4.10 0.04 0.00 0.01 0.00 0.00 72.50 68.44 3lwo s THR 181 CO 0.00 0.41 0.44 -0.31 -0.69 0.00 0.00 174.62 174.47 3lwo s TYR 182 N -0.32 3.17 0.06 4.92 4.12 -1.26 -4.94 117.35 123.11 3lwo s TYR 182 Ca 0.37 -0.53 -0.18 0.00 0.02 0.00 0.00 57.07 56.76 3lwo s TYR 182 Cb -0.21 -3.00 -0.13 0.00 -1.52 0.00 0.00 41.96 37.10 3lwo s TYR 182 CO 0.23 -0.76 1.36 0.82 0.02 0.00 0.00 175.55 177.22 3lwo h ILE 183 N 5.74 1.33 -0.99 2.71 1.08 -1.99 -2.36 117.51 123.03 3lwo h ILE 183 Ca -0.27 -1.43 0.20 0.00 -0.39 0.00 0.00 64.86 62.96 3lwo h ILE 183 Cb 1.11 1.81 -0.10 0.00 -3.07 0.00 0.00 36.82 36.57 3lwo h ILE 183 CO 0.83 0.44 0.61 -0.09 -0.69 0.00 0.00 178.15 179.25 3lwo h ARG 184 N 0.18 0.66 -0.12 2.37 2.43 -1.98 0.05 114.38 117.97 3lwo h ARG 184 Ca 0.03 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 3lwo h ARG 184 Cb 0.80 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 30.21 3lwo h ARG 184 CO 0.06 0.44 -0.48 1.03 -1.51 0.00 0.00 179.97 179.51 3lwo h SER 185 N 0.68 0.63 -0.30 -3.80 0.87 -1.94 -2.33 113.55 107.37 3lwo h SER 185 Ca 0.56 -0.62 0.05 0.00 -1.23 0.00 0.00 61.79 60.55 3lwo h SER 185 Cb 0.98 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 62.71 3lwo h SER 185 CO -0.33 1.15 -0.01 0.25 -0.53 0.00 0.00 176.83 177.36 3lwo h LEU 186 N 0.15 -0.13 -1.43 2.23 5.85 -0.62 0.53 115.31 121.88 3lwo h LEU 186 Ca -0.03 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.79 3lwo h LEU 186 Cb 1.11 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 3lwo h LEU 186 CO 0.10 -0.03 0.40 0.40 -0.34 0.00 0.00 178.44 178.97 3lwo h ILE 187 N 0.08 1.11 0.04 4.05 2.04 -1.07 0.41 117.51 124.17 3lwo h ILE 187 Ca 0.14 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3lwo h ILE 187 Cb 0.19 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3lwo h ILE 187 CO -0.25 0.14 -0.05 -0.74 0.00 0.00 0.00 178.15 177.25 3lwo h HIS 188 N 0.76 -0.13 0.00 1.37 2.76 -0.40 -1.64 115.15 117.88 3lwo h HIS 188 Ca 0.24 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.35 3lwo h HIS 188 Cb 0.01 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 3lwo h HIS 188 CO -0.00 -0.08 -0.25 0.45 -1.30 0.00 0.00 177.93 176.74 3lwo h HIS 189 N -0.11 0.00 -0.06 5.26 3.86 -0.14 -1.59 115.15 122.37 3lwo h HIS 189 Ca 0.01 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 3lwo h HIS 189 Cb 0.11 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.58 3lwo h HIS 189 CO -0.10 0.25 0.01 0.82 0.86 0.00 0.00 177.93 179.77 3lwo h ILE 190 N 0.00 1.22 -0.78 2.45 2.04 -0.72 0.23 117.51 121.95 3lwo h ILE 190 Ca -0.00 -0.66 0.17 0.00 1.00 0.00 0.00 64.86 65.37 3lwo h ILE 190 Cb 0.46 1.55 -0.11 0.00 -0.74 0.00 0.00 36.82 37.98 3lwo h ILE 190 CO 0.03 0.18 0.28 1.23 0.00 0.00 0.00 178.15 179.88 3lwo h GLY 191 N -0.15 1.19 0.91 5.37 0.00 -0.71 0.59 103.07 110.27 3lwo h GLY 191 Ca 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 3lwo h GLY 191 CO 0.00 -0.17 0.09 1.41 0.00 0.00 0.00 176.54 177.87 3lwo h LEU 192 N 0.38 0.50 -1.60 3.11 3.38 -0.96 -0.82 115.31 119.30 3lwo h LEU 192 Ca 0.45 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 3lwo h LEU 192 Cb 0.75 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3lwo h LEU 192 CO -0.47 0.59 -0.16 0.00 0.09 0.00 0.00 178.44 178.50 3lwo h ALA 193 N 0.92 1.67 0.00 1.53 0.00 0.29 -2.00 119.26 121.67 3lwo h ALA 193 Ca 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3lwo h ALA 193 Cb 0.29 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3lwo h ALA 193 CO 0.00 0.25 -0.31 -0.07 0.00 0.00 0.00 179.25 179.12 3lwo h LEU 194 N 0.06 0.00 0.00 0.00 3.38 -0.68 -3.48 115.31 114.59 3lwo h LEU 194 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3lwo h LEU 194 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3lwo h LEU 194 CO 0.02 0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.30 3lwo n GLY 195 N 1.15 2.76 0.05 0.83 0.00 -0.40 -4.85 105.19 104.73 3lwo n GLY 195 Ca 0.02 -0.67 0.07 0.00 0.00 0.00 0.00 46.02 45.44 3lwo n GLY 195 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3lwo n VAL 196 N 0.00 1.27 -0.02 1.61 0.24 -1.23 -4.77 118.33 115.42 3lwo n VAL 196 Ca 0.00 0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.71 3lwo n VAL 196 Cb 0.00 -1.31 -0.00 0.00 -1.47 0.00 0.00 33.84 31.06 3lwo n VAL 196 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3lwo n GLY 197 N -0.66 -2.37 3.45 7.63 0.00 -0.66 -4.03 105.19 108.54 3lwo n GLY 197 Ca 0.01 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 3lwo n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lwo s ALA 198 N -2.63 -1.65 0.07 4.61 0.00 -1.26 -1.36 121.76 119.53 3lwo s ALA 198 Ca 0.00 0.72 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 3lwo s ALA 198 Cb 0.00 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 3lwo s ALA 198 CO 0.00 -0.67 -0.03 -3.38 0.00 0.00 0.00 175.76 171.68 3lwo s HIS 199 N -3.10 0.63 -0.37 0.00 -3.43 -0.79 -4.47 115.29 103.76 3lwo s HIS 199 Ca -0.02 -1.04 -0.17 0.00 -0.80 0.00 0.00 55.06 53.03 3lwo s HIS 199 Cb -0.01 -0.43 0.00 0.00 -1.43 0.00 0.00 32.58 30.72 3lwo s HIS 199 CO -0.07 -0.33 0.47 1.41 -2.00 0.00 0.00 174.74 174.21 3lwo s MET 200 N -3.91 3.49 0.00 -0.38 1.75 -1.26 0.16 119.30 119.15 3lwo s MET 200 Ca 0.09 -0.35 0.25 0.00 -1.25 0.00 0.00 55.69 54.43 3lwo s MET 200 Cb 0.07 -3.84 0.47 0.00 2.84 0.00 0.00 34.83 34.37 3lwo s MET 200 CO -0.08 -0.67 1.39 -1.13 -0.65 0.00 0.00 175.02 173.87 3lwo n SER 201 N 5.65 0.88 -3.64 1.11 3.41 -0.29 -4.93 113.62 115.82 3lwo n SER 201 Ca -0.06 -0.68 -0.06 0.00 -0.26 0.00 0.00 58.87 57.80 3lwo n SER 201 Cb 0.49 0.31 -0.07 0.00 -0.26 0.00 0.00 64.21 64.68 3lwo n SER 201 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3lwo s GLU 202 N -2.77 0.41 -0.07 4.33 2.12 -1.18 -5.00 118.70 116.55 3lwo s GLU 202 Ca 0.16 0.56 -0.06 0.00 0.36 0.00 0.00 54.97 55.99 3lwo s GLU 202 Cb 0.18 0.17 0.02 0.00 0.26 0.00 0.00 34.13 34.75 3lwo s GLU 202 CO 0.64 -0.06 0.18 -1.17 -0.54 0.00 0.00 175.26 174.31 3lwo s LEU 203 N 0.57 1.30 -0.09 2.70 2.96 -1.26 -0.53 118.68 124.32 3lwo s LEU 203 Ca -0.00 0.36 -0.06 0.00 -0.22 0.00 0.00 54.13 54.21 3lwo s LEU 203 Cb -0.05 0.64 0.04 0.00 0.50 0.00 0.00 46.19 47.32 3lwo s LEU 203 CO -0.10 -0.07 0.23 -0.60 -1.32 0.00 0.00 176.35 174.49 3lwo s ARG 204 N 0.06 0.21 -0.24 1.98 3.52 -0.64 -3.05 118.95 120.80 3lwo s ARG 204 Ca -0.00 0.44 -0.13 0.00 -0.13 0.00 0.00 55.73 55.91 3lwo s ARG 204 Cb -0.01 -0.05 -0.04 0.00 -1.56 0.00 0.00 34.95 33.29 3lwo s ARG 204 CO 0.00 -0.12 0.28 0.50 -0.81 0.00 0.00 175.30 175.16 3lwo s ARG 205 N 0.88 4.07 0.00 5.12 3.52 0.59 -0.44 118.95 132.69 3lwo s ARG 205 Ca -0.06 -0.07 0.17 0.00 -0.13 0.00 0.00 55.73 55.64 3lwo s ARG 205 Cb -0.08 -3.58 -0.03 0.00 -1.56 0.00 0.00 34.95 29.70 3lwo s ARG 205 CO -0.05 -0.08 0.84 0.25 -0.81 0.00 0.00 175.30 175.45 3lwo n THR 206 N 4.59 0.00 -3.63 4.11 -2.24 -0.55 -0.14 114.28 116.42 3lwo n THR 206 Ca -0.11 -0.29 -0.13 0.00 -2.27 0.00 0.00 64.05 61.25 3lwo n THR 206 Cb 0.51 1.16 -0.07 0.00 -2.10 0.00 0.00 70.33 69.84 3lwo n THR 206 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3lwo s ARG 207 N -2.05 0.75 -0.28 -0.78 3.52 -1.12 -3.35 118.95 115.64 3lwo s ARG 207 Ca 0.12 0.84 -0.02 0.00 -0.13 0.00 0.00 55.73 56.55 3lwo s ARG 207 Cb 0.13 0.36 0.12 0.00 -1.56 0.00 0.00 34.95 34.01 3lwo s ARG 207 CO 0.46 -0.10 0.25 0.45 -0.81 0.00 0.00 175.30 175.55 3lwo s SER 208 N 0.25 2.06 1.89 -2.12 0.15 -0.38 -0.44 113.70 115.11 3lwo s SER 208 Ca 0.00 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 55.84 3lwo s SER 208 Cb -0.05 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 3lwo s SER 208 CO -0.01 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.65 3lwo n GLY 209 N 5.30 3.53 0.00 9.45 0.00 -0.18 -1.89 105.19 121.39 3lwo n GLY 209 Ca -0.03 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 45.93 3lwo n GLY 209 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3lwo n PRO 210 N 13.98 0.05 -3.20 1.61 -0.02 -1.26 -4.73 135.00 141.43 3lwo n PRO 210 Ca 0.00 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 3lwo n PRO 210 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 3lwo n PRO 210 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3lwo s PHE 211 N -2.89 3.14 0.42 6.00 0.08 -0.79 -5.04 117.98 118.88 3lwo s PHE 211 Ca 0.09 0.06 0.07 0.00 0.12 0.00 0.00 56.93 57.27 3lwo s PHE 211 Cb 0.10 -3.07 -0.07 0.00 -0.57 0.00 0.00 43.02 39.41 3lwo s PHE 211 CO 0.27 -0.67 0.08 0.15 -0.10 0.00 0.00 175.22 174.95 3lwo s LYS 212 N 2.52 2.07 -0.66 0.44 1.02 -1.26 -1.25 119.74 122.61 3lwo s LYS 212 Ca 0.20 -2.02 -0.27 0.00 0.02 0.00 0.00 55.97 53.89 3lwo s LYS 212 Cb -0.15 -1.76 0.01 0.00 -0.52 0.00 0.00 37.83 35.41 3lwo s LYS 212 CO 0.15 -0.09 1.44 -1.21 -0.92 0.00 0.00 175.35 174.72 3lwo s GLU 213 N -3.79 3.10 0.00 1.68 2.02 -1.21 -4.58 118.70 115.91 3lwo s GLU 213 Ca 0.36 0.13 0.00 0.00 0.02 0.00 0.00 54.97 55.48 3lwo s GLU 213 Cb 0.07 -4.21 0.00 0.00 0.10 0.00 0.00 34.13 30.10 3lwo s GLU 213 CO 0.19 -2.21 0.00 -0.40 0.02 0.00 0.00 175.26 172.86 3lwo n ASP 214 N 10.14 0.00 0.00 -0.19 5.68 -1.26 -5.00 116.55 125.91 3lwo n ASP 214 Ca 0.09 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.47 3lwo n ASP 214 Cb 0.50 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.92 3lwo n ASP 214 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3lwo n GLU 215 N 0.00 0.25 0.00 0.11 -0.58 -1.26 -2.55 120.64 116.61 3lwo n GLU 215 Ca 0.00 0.12 0.12 0.00 -0.42 0.00 0.00 57.16 56.98 3lwo n GLU 215 Cb 0.00 -1.50 0.16 0.00 -0.57 0.00 0.00 31.44 29.53 3lwo n GLU 215 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3lwo n THR 216 N -1.28 0.00 -2.76 2.62 -2.24 -1.26 -4.80 114.28 104.56 3lwo n THR 216 Ca 0.08 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 3lwo n THR 216 Cb 0.14 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 3lwo n THR 216 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3lwo s LEU 217 N -2.88 4.11 -0.12 3.22 2.96 -1.06 -4.34 118.68 120.57 3lwo s LEU 217 Ca 0.13 -1.15 -0.06 0.00 -0.22 0.00 0.00 54.13 52.83 3lwo s LEU 217 Cb 0.17 -2.47 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 3lwo s LEU 217 CO 0.71 -1.47 0.10 -0.51 -1.32 0.00 0.00 176.35 173.86 3lwo s ILE 218 N 4.31 5.15 0.68 6.68 2.07 -0.78 -4.81 121.20 134.50 3lwo s ILE 218 Ca 0.31 0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.51 3lwo s ILE 218 Cb -0.10 -3.24 -0.00 0.00 0.13 0.00 0.00 42.46 39.25 3lwo s ILE 218 CO 0.04 0.60 1.07 0.42 -1.91 0.00 0.00 174.94 175.16 3lwo s THR 219 N -0.86 3.96 0.17 4.00 -4.23 -1.26 -1.71 115.64 115.71 3lwo s THR 219 Ca 0.14 0.64 -0.14 0.00 -1.18 0.00 0.00 61.69 61.14 3lwo s THR 219 Cb -0.12 -3.61 0.07 0.00 1.34 0.00 0.00 72.50 70.19 3lwo s THR 219 CO 0.03 -0.83 1.73 -0.07 -0.54 0.00 0.00 174.62 174.94 3lwo h LEU 220 N -0.55 0.04 0.09 4.79 3.38 -2.00 -1.47 115.31 119.60 3lwo h LEU 220 Ca -0.45 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.60 3lwo h LEU 220 Cb 1.23 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 42.03 3lwo h LEU 220 CO 0.63 0.05 -0.39 0.45 0.09 0.00 0.00 178.44 179.28 3lwo h HIS 221 N 0.24 -1.12 -0.95 1.13 3.86 -1.97 0.15 115.15 116.49 3lwo h HIS 221 Ca 0.21 0.03 0.21 0.00 -1.16 0.00 0.00 60.37 59.66 3lwo h HIS 221 Cb 0.25 0.48 -0.08 0.00 1.06 0.00 0.00 27.41 29.12 3lwo h HIS 221 CO -0.20 -0.44 0.62 -0.44 0.86 0.00 0.00 177.93 178.33 3lwo h ASP 222 N -0.55 0.49 0.38 2.45 3.32 -1.91 -1.92 116.42 118.68 3lwo h ASP 222 Ca -0.01 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 3lwo h ASP 222 Cb 0.55 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3lwo h ASP 222 CO -0.21 0.17 -0.18 0.25 -1.72 0.00 0.00 179.24 177.55 3lwo h LEU 223 N 0.48 -0.44 -1.97 1.55 5.85 -0.22 -0.31 115.31 120.25 3lwo h LEU 223 Ca 0.51 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 3lwo h LEU 223 Cb 1.18 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 3lwo h LEU 223 CO -0.23 -0.00 -0.11 -0.37 -0.34 0.00 0.00 178.44 177.38 3lwo h VAL 224 N -1.00 0.65 0.34 1.05 -1.51 -0.78 -1.49 116.25 113.51 3lwo h VAL 224 Ca -0.05 -0.45 -0.02 0.00 -1.23 0.00 0.00 66.70 64.95 3lwo h VAL 224 Cb 0.52 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 3lwo h VAL 224 CO 0.09 0.11 -0.16 0.44 -1.23 0.00 0.00 177.57 176.81 3lwo h ASP 225 N 0.00 -0.39 -1.28 4.19 3.32 -1.34 -2.93 116.42 117.99 3lwo h ASP 225 Ca -0.00 0.01 0.39 0.00 0.02 0.00 0.00 57.03 57.45 3lwo h ASP 225 Cb 0.27 0.10 -0.11 0.00 0.22 0.00 0.00 39.33 39.81 3lwo h ASP 225 CO 0.01 -0.04 0.84 1.88 -1.72 0.00 0.00 179.24 180.22 3lwo h TYR 226 N -0.93 0.46 0.45 4.55 0.05 -0.66 0.20 116.97 121.10 3lwo h TYR 226 Ca -0.05 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 3lwo h TYR 226 Cb 0.35 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 37.97 3lwo h TYR 226 CO 0.02 -0.10 -0.22 -0.92 -1.05 0.00 0.00 178.16 175.89 3lwo h TYR 227 N 0.15 -0.56 -0.70 4.88 3.20 -1.32 -2.08 116.97 120.54 3lwo h TYR 227 Ca 0.74 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.62 3lwo h TYR 227 Cb 2.34 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 40.76 3lwo h TYR 227 CO -0.00 -0.33 0.46 1.88 -1.64 0.00 0.00 178.16 178.53 3lwo h TYR 228 N -0.65 0.84 -0.96 -3.82 0.99 -0.50 0.22 116.97 113.07 3lwo h TYR 228 Ca -0.06 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.75 3lwo h TYR 228 Cb 0.49 -0.28 -0.06 0.00 1.00 0.00 0.00 36.73 37.88 3lwo h TYR 228 CO -0.03 0.50 0.62 0.74 -0.00 0.00 0.00 178.16 179.99 3lwo h PHE 229 N 0.88 1.13 0.00 4.88 0.05 -0.77 0.25 116.94 123.36 3lwo h PHE 229 Ca 0.27 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 62.09 3lwo h PHE 229 Cb 0.00 -0.37 -0.00 0.00 2.00 0.00 0.00 35.95 37.58 3lwo h PHE 229 CO -0.00 0.58 -0.00 2.35 -0.18 0.00 0.00 178.31 181.06 3lwo h TRP 230 N 1.10 0.00 -0.36 -0.55 7.01 -0.59 0.76 115.95 123.32 3lwo h TRP 230 Ca 0.41 0.00 -0.12 0.00 2.11 0.00 0.00 58.89 61.29 3lwo h TRP 230 Cb 0.19 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.24 3lwo h TRP 230 CO -0.00 0.94 -0.25 -0.22 -2.79 0.00 0.00 178.44 176.13 3lwo h LYS 231 N -1.00 0.81 0.00 2.65 1.63 -0.55 -1.26 116.57 118.85 3lwo h LYS 231 Ca -0.00 -0.39 -0.37 0.00 -0.85 0.00 0.00 60.65 59.04 3lwo h LYS 231 Cb 0.94 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.50 3lwo h LYS 231 CO -0.00 1.02 -2.40 0.39 -3.45 0.00 0.00 179.45 175.01 3lwo n GLU 232 N -4.22 0.68 0.00 1.90 1.02 0.85 -4.56 120.64 116.31 3lwo n GLU 232 Ca -0.02 0.03 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 3lwo n GLU 232 Cb 0.46 -1.52 -0.06 0.00 -0.02 0.00 0.00 31.44 30.29 3lwo n GLU 232 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3lwo n ASP 233 N -2.85 0.71 -0.76 1.62 10.43 -0.94 -5.01 116.55 119.75 3lwo n ASP 233 Ca -0.35 -0.86 -0.08 0.00 2.57 0.00 0.00 54.79 56.08 3lwo n ASP 233 Cb 1.13 0.92 -0.01 0.00 1.84 0.00 0.00 41.12 44.99 3lwo n ASP 233 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3lwo n GLY 234 N 1.25 0.40 3.55 0.44 0.00 0.05 -4.91 105.19 105.97 3lwo n GLY 234 Ca 0.03 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 3lwo n GLY 234 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lwo s ILE 235 N -2.34 4.70 -0.16 -0.61 -1.09 -0.01 -4.92 121.20 116.77 3lwo s ILE 235 Ca 0.00 -0.05 -0.12 0.00 -2.23 0.00 0.00 60.65 58.25 3lwo s ILE 235 Cb 0.00 -3.18 -0.06 0.00 -1.58 0.00 0.00 42.46 37.64 3lwo s ILE 235 CO 0.00 0.37 -0.15 1.21 -1.23 0.00 0.00 174.94 175.14 3lwo n GLU 236 N 4.43 0.48 0.00 2.79 2.13 -1.26 -2.40 120.64 126.81 3lwo n GLU 236 Ca -0.16 0.49 0.00 0.00 0.66 0.00 0.00 57.16 58.15 3lwo n GLU 236 Cb 0.52 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.57 3lwo n GLU 236 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3lwo n GLU 237 N -4.56 0.00 -0.29 5.31 1.02 -1.26 -0.52 120.64 120.35 3lwo n GLU 237 Ca -0.13 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.02 3lwo n GLU 237 Cb 0.38 0.00 0.14 0.00 -0.02 0.00 0.00 31.44 31.94 3lwo n GLU 237 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3lwo h TYR 238 N 0.00 0.87 0.00 -0.32 0.99 -1.92 -0.48 116.97 116.11 3lwo h TYR 238 Ca 0.00 0.03 -0.14 0.00 2.00 0.00 0.00 58.73 60.62 3lwo h TYR 238 Cb 0.00 -0.27 -0.02 0.00 1.00 0.00 0.00 36.73 37.44 3lwo h TYR 238 CO 0.00 0.41 -0.67 0.35 -0.00 0.00 0.00 178.16 178.25 3lwo h PHE 239 N 0.84 0.00 -0.22 4.88 3.57 -0.97 -2.98 116.94 122.06 3lwo h PHE 239 Ca 0.36 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.75 3lwo h PHE 239 Cb 0.24 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 3lwo h PHE 239 CO -0.05 0.67 -0.36 -0.09 -2.23 0.00 0.00 178.31 176.25 3lwo h ARG 240 N 0.00 0.47 0.00 1.11 2.43 -0.15 -2.17 114.38 116.07 3lwo h ARG 240 Ca -0.01 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 3lwo h ARG 240 Cb 1.19 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 3lwo h ARG 240 CO 0.09 0.77 0.00 0.87 -1.51 0.00 0.00 179.97 180.19 3lwo h LYS 241 N 0.40 0.00 0.10 0.20 1.57 -1.22 -3.07 116.57 114.56 3lwo h LYS 241 Ca 0.04 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.56 3lwo h LYS 241 Cb 0.82 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 3lwo h LYS 241 CO 0.07 0.00 -1.19 0.00 -0.57 0.00 0.00 179.45 177.76 3lwo h ALA 242 N 2.08 0.15 -2.80 3.86 0.00 -1.24 -3.44 119.26 117.87 3lwo h ALA 242 Ca 0.00 -0.88 -0.60 0.00 0.00 0.00 0.00 54.91 53.44 3lwo h ALA 242 Cb 0.51 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3lwo h ALA 242 CO 0.00 1.00 -0.21 0.42 0.00 0.00 0.00 179.25 180.46 3lwo s ILE 243 N -2.71 5.11 0.07 0.00 -1.09 -1.11 -4.48 121.20 116.99 3lwo s ILE 243 Ca -0.03 0.82 0.02 0.00 -2.23 0.00 0.00 60.65 59.23 3lwo s ILE 243 Cb 0.08 -3.73 -0.04 0.00 -1.58 0.00 0.00 42.46 37.19 3lwo s ILE 243 CO 0.87 0.49 0.11 -1.10 -1.23 0.00 0.00 174.94 174.08 3lwo s GLN 244 N -0.42 3.04 0.54 2.79 -1.52 0.85 -4.89 119.66 120.05 3lwo s GLN 244 Ca 0.23 -0.61 -0.22 0.00 -1.95 0.00 0.00 55.36 52.81 3lwo s GLN 244 Cb -0.16 -2.82 -0.05 0.00 -0.22 0.00 0.00 33.01 29.76 3lwo s GLN 244 CO 0.11 0.58 1.36 -2.14 -0.25 0.00 0.00 175.29 174.96 3lwo s PRO 245 N -2.37 3.18 0.54 2.91 0.02 -1.26 0.67 135.00 138.69 3lwo s PRO 245 Ca 0.30 2.25 0.25 0.00 0.02 0.00 0.00 61.00 63.82 3lwo s PRO 245 Cb -0.12 -2.29 1.44 0.00 0.02 0.00 0.00 34.50 33.55 3lwo s PRO 245 CO 0.23 -1.16 2.02 0.00 -0.33 0.00 0.00 177.00 177.76 3lwo h MET 246 N 1.52 0.00 -0.39 5.54 -0.00 -1.49 -1.45 114.93 118.67 3lwo h MET 246 Ca -0.51 0.00 0.11 0.00 -0.00 0.00 0.00 59.70 59.30 3lwo h MET 246 Cb 1.30 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.88 3lwo h MET 246 CO 0.57 0.00 0.45 0.93 -0.00 0.00 0.00 176.91 178.87 3lwo h GLU 247 N 0.00 0.00 -0.07 -0.10 3.07 -1.90 0.24 114.58 115.83 3lwo h GLU 247 Ca 0.20 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.98 3lwo h GLU 247 Cb 0.84 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 3lwo h GLU 247 CO -0.00 0.00 -0.32 -0.22 -1.40 0.00 0.00 179.01 177.07 3lwo h LYS 248 N 0.00 0.13 0.00 2.33 1.63 -1.62 -2.61 116.57 116.43 3lwo h LYS 248 Ca 0.19 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 3lwo h LYS 248 Cb 1.08 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.70 3lwo h LYS 248 CO -0.00 0.44 0.00 0.00 -3.45 0.00 0.00 179.45 176.44 3lwo n ALA 249 N -2.48 2.37 -0.49 5.00 0.00 0.86 -2.98 120.51 122.79 3lwo n ALA 249 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3lwo n ALA 249 Cb 0.39 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3lwo n ALA 249 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3lwo n VAL 250 N -0.54 0.00 -0.29 0.00 0.31 -0.99 -4.73 118.33 112.09 3lwo n VAL 250 Ca 0.02 -0.23 0.25 0.00 -0.01 0.00 0.00 64.34 64.37 3lwo n VAL 250 Cb 0.01 1.49 0.57 0.00 -0.91 0.00 0.00 33.84 35.00 3lwo n VAL 250 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3lwo h GLU 251 N 0.00 0.28 0.00 5.55 5.08 -1.54 -0.26 114.58 123.69 3lwo h GLU 251 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3lwo h GLU 251 Cb 0.25 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3lwo h GLU 251 CO 0.00 0.19 -0.02 -2.39 -1.00 0.00 0.00 179.01 175.79 3lwo n HIS 252 N -4.49 0.83 -3.14 4.33 1.44 -1.26 -4.87 115.22 108.06 3lwo n HIS 252 Ca 0.24 0.24 -0.33 0.00 -2.01 0.00 0.00 57.72 55.86 3lwo n HIS 252 Cb 0.92 -0.89 -0.06 0.00 0.12 0.00 0.00 29.99 30.08 3lwo n HIS 252 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3lwo s LEU 253 N -4.37 4.11 0.45 2.39 1.43 -0.11 -4.89 118.68 117.69 3lwo s LEU 253 Ca 0.11 1.29 -0.25 0.00 -1.03 0.00 0.00 54.13 54.25 3lwo s LEU 253 Cb 0.13 -3.99 -0.08 0.00 0.03 0.00 0.00 46.19 42.28 3lwo s LEU 253 CO 0.59 -0.16 1.36 -2.84 0.23 0.00 0.00 176.35 175.53 3lwo s PRO 254 N -2.82 3.71 0.12 1.29 0.02 -1.26 -4.81 135.00 131.25 3lwo s PRO 254 Ca 0.52 2.28 0.08 0.00 0.02 0.00 0.00 61.00 63.90 3lwo s PRO 254 Cb -0.11 -2.62 -0.04 0.00 0.02 0.00 0.00 34.50 31.75 3lwo s PRO 254 CO 0.18 -0.75 -0.20 0.15 -0.33 0.00 0.00 177.00 176.05 3lwo s LYS 255 N -2.46 1.17 -0.05 5.54 1.02 -1.26 -1.19 119.74 122.53 3lwo s LYS 255 Ca 0.61 -1.23 0.04 0.00 0.02 0.00 0.00 55.97 55.41 3lwo s LYS 255 Cb -0.41 -1.40 -0.00 0.00 -0.52 0.00 0.00 37.83 35.50 3lwo s LYS 255 CO 0.52 0.32 -0.17 0.14 -0.92 0.00 0.00 175.35 175.23 3lwo s VAL 256 N -1.38 1.44 -0.14 3.17 -7.23 -0.67 -1.77 120.40 113.83 3lwo s VAL 256 Ca 0.09 -0.72 -0.09 0.00 -1.81 0.00 0.00 61.98 59.46 3lwo s VAL 256 Cb -0.09 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.56 3lwo s VAL 256 CO 0.05 0.42 0.16 0.26 -0.31 0.00 0.00 175.10 175.68 3lwo s TRP 257 N 0.08 3.54 0.24 2.82 0.51 0.15 -1.27 118.94 125.02 3lwo s TRP 257 Ca -0.05 0.50 0.11 0.00 -2.12 0.00 0.00 56.10 54.54 3lwo s TRP 257 Cb -0.12 -2.05 -0.05 0.00 -0.81 0.00 0.00 33.47 30.44 3lwo s TRP 257 CO 0.02 0.57 -0.14 0.96 -0.51 0.00 0.00 176.95 177.86 3lwo s ILE 258 N -0.53 2.82 0.88 2.03 -4.36 -0.32 -0.23 121.20 121.48 3lwo s ILE 258 Ca 0.14 -2.09 -0.11 0.00 -0.26 0.00 0.00 60.65 58.33 3lwo s ILE 258 Cb -0.12 -2.45 0.12 0.00 1.25 0.00 0.00 42.46 41.25 3lwo s ILE 258 CO 0.03 -0.29 1.10 -0.54 0.24 0.00 0.00 174.94 175.47 3lwo s LYS 259 N -3.29 1.40 0.23 0.37 1.02 -0.31 -3.83 119.74 115.33 3lwo s LYS 259 Ca 0.28 1.08 -0.07 0.00 0.02 0.00 0.00 55.97 57.27 3lwo s LYS 259 Cb -0.07 -1.81 0.20 0.00 -0.52 0.00 0.00 37.83 35.64 3lwo s LYS 259 CO 0.15 -2.21 1.85 -0.44 -0.92 0.00 0.00 175.35 173.78 3lwo h ASP 260 N -1.54 1.09 0.22 2.83 5.19 -1.92 -2.42 116.42 119.88 3lwo h ASP 260 Ca -0.47 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 3lwo h ASP 260 Cb 1.27 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.50 3lwo h ASP 260 CO 0.51 0.88 0.00 -1.54 -3.12 0.00 0.00 179.24 175.97 3lwo n SER 261 N -4.35 0.00 -0.00 6.45 3.41 -1.26 -2.45 113.62 115.41 3lwo n SER 261 Ca 0.09 0.06 0.06 0.00 -0.26 0.00 0.00 58.87 58.82 3lwo n SER 261 Cb 0.10 -0.26 -0.08 0.00 -0.26 0.00 0.00 64.21 63.71 3lwo n SER 261 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3lwo n ALA 262 N -1.26 3.01 0.17 7.33 0.00 -0.92 -4.53 120.51 124.31 3lwo n ALA 262 Ca 0.06 -0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.06 3lwo n ALA 262 Cb 0.10 -0.42 -0.08 0.00 0.00 0.00 0.00 19.45 19.05 3lwo n ALA 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3lwo h VAL 263 N 0.00 0.64 -0.58 0.00 2.07 -1.41 -2.49 116.25 114.48 3lwo h VAL 263 Ca 0.00 -0.60 0.09 0.00 0.82 0.00 0.00 66.70 67.01 3lwo h VAL 263 Cb 0.40 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 3lwo h VAL 263 CO 0.00 0.11 0.18 0.00 0.02 0.00 0.00 177.57 177.88 3lwo h ALA 264 N -0.30 0.72 -0.66 1.67 0.00 -1.81 -1.64 119.26 117.24 3lwo h ALA 264 Ca -0.05 0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.07 3lwo h ALA 264 Cb 0.52 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 3lwo h ALA 264 CO 0.07 -0.24 0.23 0.00 0.00 0.00 0.00 179.25 179.32 3lwo h ALA 265 N 1.42 0.87 -0.28 0.00 0.00 -1.82 -2.47 119.26 116.97 3lwo h ALA 265 Ca 0.29 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.19 3lwo h ALA 265 Cb 0.38 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3lwo h ALA 265 CO -0.32 -0.22 -0.31 0.28 0.00 0.00 0.00 179.25 178.67 3lwo h VAL 266 N 0.39 1.28 0.00 0.00 2.07 -0.85 -1.86 116.25 117.28 3lwo h VAL 266 Ca 0.35 -1.42 0.00 0.00 0.82 0.00 0.00 66.70 66.44 3lwo h VAL 266 Cb 0.49 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3lwo h VAL 266 CO -0.37 0.46 0.00 0.35 0.02 0.00 0.00 177.57 178.03 3lwo n THR 267 N -4.08 0.49 -0.55 2.57 -2.24 -0.79 -1.68 114.28 108.00 3lwo n THR 267 Ca -0.01 0.12 0.09 0.00 -2.27 0.00 0.00 64.05 61.98 3lwo n THR 267 Cb 0.46 -0.78 0.30 0.00 -2.10 0.00 0.00 70.33 68.21 3lwo n THR 267 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3lwo n HIS 268 N -1.39 1.15 -0.42 4.78 8.25 -0.81 -4.79 115.22 122.00 3lwo n HIS 268 Ca 0.07 -0.61 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 3lwo n HIS 268 Cb 0.20 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.13 3lwo n HIS 268 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3lwo n GLY 269 N 0.85 0.77 3.71 -1.41 0.00 -0.68 -5.04 105.19 103.40 3lwo n GLY 269 Ca 0.22 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3lwo n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lwo s ALA 270 N -2.00 3.23 0.83 4.61 0.00 -0.77 -4.95 121.76 122.71 3lwo s ALA 270 Ca 0.00 0.60 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 3lwo s ALA 270 Cb 0.00 -3.37 0.10 0.00 0.00 0.00 0.00 23.12 19.85 3lwo s ALA 270 CO 0.00 -0.30 1.16 -0.51 0.00 0.00 0.00 175.76 176.11 3lwo s ASP 271 N 1.03 3.58 -0.44 0.00 1.01 -1.26 -4.33 116.67 116.27 3lwo s ASP 271 Ca 0.53 2.20 -0.22 0.00 0.71 0.00 0.00 52.55 55.77 3lwo s ASP 271 Cb -0.23 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.16 3lwo s ASP 271 CO 0.28 -2.66 0.72 -0.22 0.21 0.00 0.00 175.17 173.50 3lwo s LEU 272 N -6.00 4.35 0.33 1.23 2.96 -0.58 -4.91 118.68 116.06 3lwo s LEU 272 Ca 0.69 -0.18 -0.21 0.00 -0.22 0.00 0.00 54.13 54.21 3lwo s LEU 272 Cb -0.24 -2.87 -0.10 0.00 0.50 0.00 0.00 46.19 43.49 3lwo s LEU 272 CO 0.53 -0.85 0.85 0.00 -1.32 0.00 0.00 176.35 175.57 3lwo s ALA 273 N 3.08 3.24 0.23 5.97 0.00 -1.26 0.02 121.76 133.03 3lwo s ALA 273 Ca 0.27 0.31 -0.17 0.00 0.00 0.00 0.00 51.96 52.37 3lwo s ALA 273 Cb -0.13 -3.00 0.25 0.00 0.00 0.00 0.00 23.12 20.23 3lwo s ALA 273 CO 0.21 0.23 1.55 0.28 0.00 0.00 0.00 175.76 178.03 3lwo h VAL 274 N 2.33 0.01 0.00 0.00 2.07 -0.75 -0.71 116.25 119.21 3lwo h VAL 274 Ca -0.48 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3lwo h VAL 274 Cb 1.19 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3lwo h VAL 274 CO 0.64 0.00 0.14 -2.65 0.02 0.00 0.00 177.57 175.72 3lwo n PRO 275 N -5.48 0.00 -0.46 1.57 -0.02 -1.26 -0.60 135.00 128.75 3lwo n PRO 275 Ca 0.10 0.29 0.10 0.00 -2.02 0.00 0.00 63.50 61.97 3lwo n PRO 275 Cb 0.40 -1.64 0.31 0.00 -0.02 0.00 0.00 33.50 32.56 3lwo n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3lwo n GLY 276 N -1.26 2.74 3.83 -1.23 0.00 -0.27 -4.96 105.19 104.03 3lwo n GLY 276 Ca 0.00 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 3lwo n GLY 276 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lwo s ILE 277 N -1.48 5.42 -0.17 -0.61 1.01 0.23 -1.16 121.20 124.44 3lwo s ILE 277 Ca 0.46 0.18 -0.11 0.00 0.00 0.00 0.00 60.65 61.18 3lwo s ILE 277 Cb 0.27 -3.39 -0.07 0.00 0.01 0.00 0.00 42.46 39.28 3lwo s ILE 277 CO 0.26 0.57 -0.26 0.00 0.00 0.00 0.00 174.94 175.50 3lwo n ALA 278 N 2.45 1.58 -2.64 9.38 0.00 0.68 -4.41 120.51 127.54 3lwo n ALA 278 Ca -0.19 -0.74 -0.08 0.00 0.00 0.00 0.00 53.44 52.42 3lwo n ALA 278 Cb 0.54 0.18 -0.10 0.00 0.00 0.00 0.00 19.45 20.07 3lwo n ALA 278 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3lwo s LYS 279 N -2.49 0.47 -0.00 0.00 1.02 -1.10 -0.11 119.74 117.53 3lwo s LYS 279 Ca -0.26 -0.83 -0.18 0.00 0.02 0.00 0.00 55.97 54.72 3lwo s LYS 279 Cb 0.08 0.17 0.03 0.00 -0.52 0.00 0.00 37.83 37.59 3lwo s LYS 279 CO 0.35 -0.09 0.39 -0.48 -0.92 0.00 0.00 175.35 174.59 3lwo s LEU 280 N -2.07 0.54 0.61 3.17 2.34 -0.16 0.32 118.68 123.43 3lwo s LEU 280 Ca -0.06 0.13 -0.19 0.00 0.06 0.00 0.00 54.13 54.07 3lwo s LEU 280 Cb -0.02 1.56 -0.03 0.00 -0.56 0.00 0.00 46.19 47.14 3lwo s LEU 280 CO -0.05 -0.53 1.29 -1.00 -1.06 0.00 0.00 176.35 175.00 3lwo s HIS 281 N -1.67 2.20 0.70 3.48 3.76 -0.73 -0.17 115.29 122.87 3lwo s HIS 281 Ca -0.11 1.47 -0.11 0.00 -0.15 0.00 0.00 55.06 56.16 3lwo s HIS 281 Cb -0.03 -3.67 0.01 0.00 1.11 0.00 0.00 32.58 30.00 3lwo s HIS 281 CO 0.03 -2.74 1.07 0.00 -0.85 0.00 0.00 174.74 172.25 3lwo s ALA 282 N -1.42 2.72 -1.36 -1.40 0.00 0.27 -4.32 121.76 116.25 3lwo s ALA 282 Ca 0.79 -0.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.64 3lwo s ALA 282 Cb -0.36 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.65 3lwo s ALA 282 CO 0.40 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 175.38 3lwo n GLY 283 N -2.39 -0.29 3.74 0.00 0.00 -1.26 -4.80 105.19 100.20 3lwo n GLY 283 Ca 0.07 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 3lwo n GLY 283 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lwo s ILE 284 N -2.80 4.35 0.15 -0.61 1.01 -1.26 -4.93 121.20 117.11 3lwo s ILE 284 Ca 0.00 2.03 0.10 0.00 0.00 0.00 0.00 60.65 62.78 3lwo s ILE 284 Cb -0.00 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 3lwo s ILE 284 CO 0.00 0.40 -0.18 -0.54 0.00 0.00 0.00 174.94 174.62 3lwo s LYS 285 N -0.52 1.76 -0.14 2.79 1.02 -1.26 -1.56 119.74 121.83 3lwo s LYS 285 Ca 0.43 -1.29 -0.36 0.00 0.02 0.00 0.00 55.97 54.77 3lwo s LYS 285 Cb -0.24 -2.05 -0.13 0.00 -0.52 0.00 0.00 37.83 34.89 3lwo s LYS 285 CO 0.30 0.45 1.83 0.54 -0.92 0.00 0.00 175.35 177.55 3lwo n ARG 286 N 0.51 1.86 0.00 1.68 1.74 -1.26 -1.54 116.66 119.66 3lwo n ARG 286 Ca -0.14 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 3lwo n ARG 286 Cb 0.54 -2.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 3lwo n ARG 286 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3lwo n GLY 287 N 4.30 2.35 3.77 -0.13 0.00 -0.02 -4.99 105.19 110.47 3lwo n GLY 287 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 3lwo n GLY 287 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3lwo s ASP 288 N -1.46 6.46 0.03 1.61 1.01 -0.59 -4.57 116.67 119.17 3lwo s ASP 288 Ca 0.00 2.93 -0.30 0.00 0.71 0.00 0.00 52.55 55.89 3lwo s ASP 288 Cb 0.00 -2.66 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 3lwo s ASP 288 CO 0.00 -0.79 1.27 -0.22 0.21 0.00 0.00 175.17 175.63 3lwo s LEU 289 N -1.69 4.34 0.10 1.23 2.96 -1.26 -1.39 118.68 122.96 3lwo s LEU 289 Ca 0.54 2.04 0.06 0.00 -0.22 0.00 0.00 54.13 56.54 3lwo s LEU 289 Cb -0.45 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.64 3lwo s LEU 289 CO 0.57 -0.57 -0.14 0.68 -1.32 0.00 0.00 176.35 175.57 3lwo s VAL 290 N 1.56 1.26 -0.05 1.68 -7.23 0.27 -4.35 120.40 113.54 3lwo s VAL 290 Ca 0.60 -1.56 -0.04 0.00 -1.81 0.00 0.00 61.98 59.17 3lwo s VAL 290 Cb -0.30 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.24 3lwo s VAL 290 CO 0.27 -0.33 0.16 0.00 -0.31 0.00 0.00 175.10 174.89 3lwo s ALA 291 N -1.79 3.89 -0.34 1.32 0.00 -0.33 -0.86 121.76 123.65 3lwo s ALA 291 Ca 0.05 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 3lwo s ALA 291 Cb -0.07 -1.88 0.05 0.00 0.00 0.00 0.00 23.12 21.22 3lwo s ALA 291 CO 0.03 0.70 0.10 0.42 0.00 0.00 0.00 175.76 177.01 3lwo s ILE 292 N -1.21 3.67 -0.01 0.00 1.01 0.83 -1.67 121.20 123.81 3lwo s ILE 292 Ca 0.23 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.66 3lwo s ILE 292 Cb -0.12 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 3lwo s ILE 292 CO 0.13 -0.21 0.00 -0.04 0.00 0.00 0.00 174.94 174.83 3lwo s MET 293 N 1.37 2.83 0.84 2.79 -1.94 -0.40 -0.22 119.30 124.56 3lwo s MET 293 Ca -0.01 -0.58 -0.12 0.00 -1.71 0.00 0.00 55.69 53.27 3lwo s MET 293 Cb -0.20 -2.69 0.09 0.00 2.01 0.00 0.00 34.83 34.04 3lwo s MET 293 CO 0.02 0.64 1.10 0.95 -0.01 0.00 0.00 175.02 177.72 3lwo s THR 294 N -1.06 2.79 -0.45 2.05 -4.23 -0.06 -1.18 115.64 113.50 3lwo s THR 294 Ca 0.19 0.26 0.22 0.00 -1.18 0.00 0.00 61.69 61.18 3lwo s THR 294 Cb -0.11 -2.96 0.23 0.00 1.34 0.00 0.00 72.50 71.00 3lwo s THR 294 CO 0.09 -0.33 1.68 0.18 -0.54 0.00 0.00 174.62 175.70 3lwo n LEU 295 N -3.57 0.61 -0.31 4.79 4.77 -1.25 -0.10 117.00 121.94 3lwo n LEU 295 Ca 0.07 0.68 0.05 0.00 -0.03 0.00 0.00 56.01 56.77 3lwo n LEU 295 Cb 0.57 -0.63 0.19 0.00 -2.33 0.00 0.00 43.42 41.22 3lwo n LEU 295 CO 0.57 -0.63 0.64 0.29 -1.33 0.00 0.00 177.39 176.92 3lwo n LYS 296 N -2.20 1.40 -3.11 3.23 5.02 -1.26 -4.91 118.16 116.33 3lwo n LYS 296 Ca 0.01 -0.61 -0.19 0.00 -2.02 0.00 0.00 58.31 55.51 3lwo n LYS 296 Cb 0.18 -1.20 0.05 0.00 -0.02 0.00 0.00 35.03 34.04 3lwo n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3lwo n ASP 297 N -0.06 -5.44 -4.86 4.39 8.00 0.86 -4.78 116.55 114.66 3lwo n ASP 297 Ca 0.09 -0.33 -0.36 0.00 0.71 0.00 0.00 54.79 54.90 3lwo n ASP 297 Cb 0.16 -4.18 -0.06 0.00 -0.02 0.00 0.00 41.12 37.03 3lwo n ASP 297 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3lwo s GLU 298 N -5.75 3.78 -0.23 -1.24 2.02 -1.24 -4.86 118.70 111.17 3lwo s GLU 298 Ca 0.35 0.21 -0.29 0.00 0.02 0.00 0.00 54.97 55.26 3lwo s GLU 298 Cb -0.15 -3.07 -0.00 0.00 0.10 0.00 0.00 34.13 31.01 3lwo s GLU 298 CO 0.43 0.61 1.19 -1.17 0.02 0.00 0.00 175.26 176.34 3lwo s LEU 299 N -1.65 4.06 -0.19 1.80 2.96 -1.26 -0.88 118.68 123.52 3lwo s LEU 299 Ca 0.29 1.42 -0.18 0.00 -0.22 0.00 0.00 54.13 55.44 3lwo s LEU 299 Cb -0.14 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.86 3lwo s LEU 299 CO 0.16 -0.83 0.11 0.58 -1.32 0.00 0.00 176.35 175.06 3lwo h VAL 300 N 5.62 0.66 -2.00 1.68 2.07 -0.96 -3.36 116.25 119.97 3lwo h VAL 300 Ca -0.24 -1.84 0.18 0.00 0.82 0.00 0.00 66.70 65.63 3lwo h VAL 300 Cb 1.09 1.59 -0.15 0.00 -1.52 0.00 0.00 31.29 32.30 3lwo h VAL 300 CO 1.00 0.22 0.61 0.00 0.02 0.00 0.00 177.57 179.42 3lwo s ALA 301 N -2.47 -1.90 0.11 1.67 0.00 -1.17 -1.18 121.76 116.83 3lwo s ALA 301 Ca -0.24 0.98 -0.01 0.00 0.00 0.00 0.00 51.96 52.69 3lwo s ALA 301 Cb 0.05 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 3lwo s ALA 301 CO 0.48 -0.76 0.28 -0.51 0.00 0.00 0.00 175.76 175.25 3lwo s LEU 302 N -2.53 4.32 0.31 0.00 1.02 0.61 -0.12 118.68 122.28 3lwo s LEU 302 Ca 0.08 0.34 -0.19 0.00 0.02 0.00 0.00 54.13 54.38 3lwo s LEU 302 Cb -0.00 -3.05 0.04 0.00 0.02 0.00 0.00 46.19 43.19 3lwo s LEU 302 CO -0.05 0.10 0.80 -0.83 0.02 0.00 0.00 176.35 176.38 3lwo s GLY 303 N -2.70 0.12 -0.16 -3.19 0.00 -0.04 -1.87 107.32 99.48 3lwo s GLY 303 Ca 0.37 -0.47 -0.01 0.00 0.00 0.00 0.00 44.72 44.61 3lwo s GLY 303 CO 0.28 0.01 -0.13 1.25 0.00 0.00 0.00 173.10 174.50 3lwo s LYS 304 N -3.02 3.26 0.14 2.90 2.20 -0.19 -0.56 119.74 124.47 3lwo s LYS 304 Ca 0.14 -0.72 -0.31 0.00 -0.36 0.00 0.00 55.97 54.72 3lwo s LYS 304 Cb -0.05 -2.69 -0.08 0.00 -1.51 0.00 0.00 37.83 33.50 3lwo s LYS 304 CO 0.08 -0.00 1.36 0.00 -0.36 0.00 0.00 175.35 176.43 3lwo s ALA 305 N 0.89 3.56 -1.91 3.13 0.00 -0.49 -0.90 121.76 126.04 3lwo s ALA 305 Ca -0.03 1.11 0.17 0.00 0.00 0.00 0.00 51.96 53.21 3lwo s ALA 305 Cb -0.15 -3.52 0.28 0.00 0.00 0.00 0.00 23.12 19.73 3lwo s ALA 305 CO -0.01 -0.59 1.20 -1.33 0.00 0.00 0.00 175.76 175.03 3lwo n MET 306 N 3.50 1.98 -3.80 0.00 0.00 -0.03 -0.84 117.12 117.93 3lwo n MET 306 Ca 0.10 -1.88 -0.10 0.00 0.00 0.00 0.00 57.70 55.82 3lwo n MET 306 Cb 0.43 -1.37 -0.07 0.00 0.00 0.00 0.00 33.22 32.20 3lwo n MET 306 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3lwo s MET 307 N -1.28 0.81 0.72 0.03 -1.94 -1.24 -4.92 119.30 111.49 3lwo s MET 307 Ca 0.27 -0.71 -0.11 0.00 -1.71 0.00 0.00 55.69 53.43 3lwo s MET 307 Cb 0.16 0.34 0.02 0.00 2.01 0.00 0.00 34.83 37.37 3lwo s MET 307 CO 0.23 -0.26 1.08 0.95 -0.01 0.00 0.00 175.02 177.01 3lwo s THR 308 N -3.10 3.66 0.51 2.05 -4.23 -1.26 -4.05 115.64 109.23 3lwo s THR 308 Ca -0.01 0.54 0.20 0.00 -1.18 0.00 0.00 61.69 61.23 3lwo s THR 308 Cb 0.01 -3.38 0.33 0.00 1.34 0.00 0.00 72.50 70.81 3lwo s THR 308 CO -0.07 -0.70 2.06 0.28 -0.54 0.00 0.00 174.62 175.65 3lwo h SER 309 N -0.78 0.06 -0.11 3.99 0.02 -1.59 -2.26 113.55 112.88 3lwo h SER 309 Ca -0.45 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.28 3lwo h SER 309 Cb 1.24 -0.01 0.01 0.00 0.14 0.00 0.00 62.40 63.77 3lwo h SER 309 CO 0.60 0.04 -0.76 1.56 -1.14 0.00 0.00 176.83 177.12 3lwo h GLN 310 N 0.06 0.76 -0.34 3.45 1.08 -1.92 -2.47 115.11 115.73 3lwo h GLN 310 Ca 0.15 -0.61 -0.02 0.00 -1.45 0.00 0.00 58.65 56.72 3lwo h GLN 310 Cb 0.50 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 3lwo h GLN 310 CO -0.01 1.22 0.13 0.93 -0.95 0.00 0.00 178.83 180.15 3lwo h GLU 311 N 0.52 0.50 -0.91 1.46 5.08 -1.80 -2.41 114.58 117.02 3lwo h GLU 311 Ca -0.05 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3lwo h GLU 311 Cb 1.39 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.51 3lwo h GLU 311 CO 0.16 0.51 0.60 0.52 -1.00 0.00 0.00 179.01 179.79 3lwo h MET 312 N 0.39 1.14 -0.11 2.33 2.86 -1.46 -0.10 114.93 119.98 3lwo h MET 312 Ca 0.11 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 3lwo h MET 312 Cb 0.19 -0.26 -0.00 0.00 0.06 0.00 0.00 31.60 31.59 3lwo h MET 312 CO -0.01 0.75 -0.04 1.25 1.06 0.00 0.00 176.91 179.92 3lwo h LEU 313 N 1.17 0.23 0.18 1.22 5.85 -1.17 -3.33 115.31 119.46 3lwo h LEU 313 Ca 0.35 -0.39 -0.28 0.00 0.84 0.00 0.00 57.88 58.41 3lwo h LEU 313 Cb -0.03 -0.06 0.02 0.00 0.37 0.00 0.00 40.66 40.95 3lwo h LEU 313 CO -0.10 0.57 -1.28 1.05 -0.34 0.00 0.00 178.44 178.35 3lwo h GLU 314 N -0.11 0.38 -7.18 1.25 4.11 -1.31 -3.47 114.58 108.26 3lwo h GLU 314 Ca 0.03 -0.66 -0.54 0.00 0.07 0.00 0.00 59.36 58.26 3lwo h GLU 314 Cb 0.48 0.24 0.17 0.00 0.50 0.00 0.00 28.75 30.15 3lwo h GLU 314 CO 0.01 1.31 0.39 0.15 0.07 0.00 0.00 179.01 180.95 3lwo s LYS 315 N -2.51 1.91 -0.01 1.06 1.02 -0.06 -4.97 119.74 116.19 3lwo s LYS 315 Ca -0.14 1.85 0.10 0.00 0.02 0.00 0.00 55.97 57.80 3lwo s LYS 315 Cb 0.03 -1.80 -0.12 0.00 -0.52 0.00 0.00 37.83 35.42 3lwo s LYS 315 CO 0.86 -2.03 0.33 0.25 -0.92 0.00 0.00 175.35 173.84 3lwo n THR 316 N -2.88 0.00 -3.96 2.17 -2.24 -1.26 -4.91 114.28 101.20 3lwo n THR 316 Ca 0.14 -0.25 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 3lwo n THR 316 Cb 0.50 0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 3lwo n THR 316 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3lwo s LYS 317 N -2.22 0.89 0.00 -0.78 1.02 -1.26 -4.18 119.74 113.21 3lwo s LYS 317 Ca 0.01 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 54.88 3lwo s LYS 317 Cb 0.07 0.31 0.00 0.00 -0.52 0.00 0.00 37.83 37.69 3lwo s LYS 317 CO 0.40 -0.28 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 3lwo n GLY 318 N -0.07 3.32 3.67 -3.33 0.00 -1.26 -4.79 105.19 102.72 3lwo n GLY 318 Ca -0.12 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 3lwo n GLY 318 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lwo s ILE 319 N -2.77 4.74 -0.17 -0.61 -1.09 -1.26 -0.01 121.20 120.02 3lwo s ILE 319 Ca 0.00 1.98 0.18 0.00 -2.23 0.00 0.00 60.65 60.58 3lwo s ILE 319 Cb 0.00 -4.29 -0.26 0.00 -1.58 0.00 0.00 42.46 36.34 3lwo s ILE 319 CO 0.00 -0.10 0.16 0.00 -1.23 0.00 0.00 174.94 173.77 3lwo n ALA 320 N 5.79 1.65 -3.67 9.38 0.00 0.10 -4.59 120.51 129.19 3lwo n ALA 320 Ca 0.10 -1.20 -0.15 0.00 0.00 0.00 0.00 53.44 52.19 3lwo n ALA 320 Cb 0.47 -0.29 -0.14 0.00 0.00 0.00 0.00 19.45 19.48 3lwo n ALA 320 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3lwo s VAL 321 N -2.62 -0.34 -0.30 0.00 1.01 -1.07 -0.86 120.40 116.23 3lwo s VAL 321 Ca -0.09 0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.92 3lwo s VAL 321 Cb 0.07 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 3lwo s VAL 321 CO 0.84 0.13 1.57 -0.62 0.00 0.00 0.00 175.10 177.02 3lwo s ASP 322 N 2.35 6.29 -0.02 3.32 -1.08 -0.08 -1.52 116.67 125.93 3lwo s ASP 322 Ca 0.02 1.30 -0.30 0.00 -0.52 0.00 0.00 52.55 53.05 3lwo s ASP 322 Cb -0.12 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.76 3lwo s ASP 322 CO -0.07 -1.39 1.28 -0.69 0.52 0.00 0.00 175.17 174.82 3lwo s VAL 323 N 5.55 4.00 0.00 1.11 1.01 -1.26 -1.02 120.40 129.79 3lwo s VAL 323 Ca 0.69 1.36 0.00 0.00 0.00 0.00 0.00 61.98 64.03 3lwo s VAL 323 Cb -0.20 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.30 3lwo s VAL 323 CO 0.30 0.01 0.00 -0.62 0.00 0.00 0.00 175.10 174.80 3lwo n GLU 324 N 5.09 2.55 -3.66 2.72 1.02 -0.78 -4.93 120.64 122.65 3lwo n GLU 324 Ca 0.12 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 57.03 3lwo n GLU 324 Cb 0.45 -0.96 -0.17 0.00 -0.02 0.00 0.00 31.44 30.73 3lwo n GLU 324 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3lwo s LYS 325 N -1.93 0.09 -0.18 3.49 -0.14 -1.07 -5.02 119.74 114.98 3lwo s LYS 325 Ca 0.00 0.14 -0.08 0.00 -1.36 0.00 0.00 55.97 54.67 3lwo s LYS 325 Cb 0.00 -1.13 -0.04 0.00 -1.68 0.00 0.00 37.83 34.98 3lwo s LYS 325 CO 0.00 -0.47 0.09 0.08 -0.76 0.00 0.00 175.35 174.29 3lwo s VAL 326 N 2.12 5.03 -0.11 3.17 1.01 -1.26 -0.29 120.40 130.08 3lwo s VAL 326 Ca 0.04 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.10 3lwo s VAL 326 Cb -0.14 -3.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.89 3lwo s VAL 326 CO -0.06 0.47 -0.06 0.49 0.00 0.00 0.00 175.10 175.94 3lwo n PHE 327 N 3.38 0.00 -2.42 5.22 3.01 -0.32 -4.98 117.46 121.35 3lwo n PHE 327 Ca -0.17 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.88 3lwo n PHE 327 Cb 0.52 -0.44 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 3lwo n PHE 327 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 3lwo s MET 328 N -2.22 4.48 0.68 -1.08 1.75 -0.88 -5.01 119.30 117.01 3lwo s MET 328 Ca -0.12 1.80 -0.17 0.00 -1.25 0.00 0.00 55.69 55.95 3lwo s MET 328 Cb 0.04 -3.30 -0.00 0.00 2.84 0.00 0.00 34.83 34.40 3lwo s MET 328 CO 0.29 -0.14 1.10 -2.30 -0.65 0.00 0.00 175.02 173.31 3lwo n PRO 329 N 3.17 0.77 0.00 4.11 -0.02 -1.26 -4.86 135.00 136.90 3lwo n PRO 329 Ca 0.06 0.32 0.14 0.00 -2.02 0.00 0.00 63.50 62.00 3lwo n PRO 329 Cb 0.46 -2.33 0.76 0.00 -0.02 0.00 0.00 33.50 32.37 3lwo n PRO 329 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3lwo n ARG 330 N -1.82 0.56 0.00 -0.52 1.74 -1.26 -3.45 116.66 111.91 3lwo n ARG 330 Ca 0.14 0.01 0.09 0.00 -0.77 0.00 0.00 57.85 57.33 3lwo n ARG 330 Cb 0.49 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.48 3lwo n ARG 330 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3lwo n ASP 331 N -1.20 2.28 -0.06 0.55 5.75 -1.26 -4.43 116.55 118.18 3lwo n ASP 331 Ca 0.16 -1.64 -0.13 0.00 -0.01 0.00 0.00 54.79 53.18 3lwo n ASP 331 Cb 0.19 0.16 -0.00 0.00 -1.03 0.00 0.00 41.12 40.44 3lwo n ASP 331 CO 0.00 0.00 0.00 -0.50 -0.11 0.00 0.00 177.20 176.59 3lwo h TRP 332 N 3.09 0.97 -4.00 2.11 4.06 -1.96 -3.44 115.95 116.78 3lwo h TRP 332 Ca 0.00 -0.33 -0.69 0.00 2.06 0.00 0.00 58.89 59.93 3lwo h TRP 332 Cb 0.72 -0.19 -0.22 0.00 -1.00 0.00 0.00 29.16 28.47 3lwo h TRP 332 CO 0.00 1.13 -0.81 0.71 -3.56 0.00 0.00 178.44 175.91 3lwo s TYR 333 N -4.14 2.53 0.37 0.49 1.51 -1.26 -2.61 117.35 114.23 3lwo s TYR 333 Ca -0.10 -0.27 -0.26 0.00 -1.01 0.00 0.00 57.07 55.43 3lwo s TYR 333 Cb 0.11 -1.45 -0.09 0.00 -0.11 0.00 0.00 41.96 40.42 3lwo s TYR 333 CO 0.87 0.24 1.14 -2.14 -1.11 0.00 0.00 175.55 174.56 3lwo s PRO 334 N -1.43 4.20 -1.15 -1.71 0.02 -1.26 -4.72 135.00 128.96 3lwo s PRO 334 Ca 0.14 1.80 -0.23 0.00 0.02 0.00 0.00 61.00 62.73 3lwo s PRO 334 Cb -0.10 -2.77 -0.10 0.00 0.02 0.00 0.00 34.50 31.54 3lwo s PRO 334 CO 0.05 -0.18 1.96 0.15 -0.33 0.00 0.00 177.00 178.65 3lwo s LYS 335 N -2.14 2.32 0.07 5.54 1.02 -1.26 -4.58 119.74 120.70 3lwo s LYS 335 Ca 0.54 -0.99 -0.22 0.00 0.02 0.00 0.00 55.97 55.32 3lwo s LYS 335 Cb -0.30 -5.19 -0.13 0.00 -0.52 0.00 0.00 37.83 31.69 3lwo s LYS 335 CO 0.38 -4.14 1.61 -0.07 -0.92 0.00 0.00 175.35 172.21 3lwo h LEU 336 N 18.41 0.11 0.00 3.17 4.07 -1.90 -3.51 115.31 135.65 3lwo h LEU 336 Ca 0.18 -0.15 0.00 0.00 0.08 0.00 0.00 57.88 57.99 3lwo h LEU 336 Cb 0.95 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.66 3lwo h LEU 336 CO 1.19 0.23 0.00 -2.67 -1.08 0.00 0.00 178.44 176.11