#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lwx n ASN 7 N 0.00 0.00 -0.29 6.55 6.94 -1.26 -3.35 115.26 123.85 1lwx n ASN 7 Ca 0.00 -0.73 0.08 0.00 -0.02 0.00 0.00 54.58 53.91 1lwx n ASN 7 Cb 0.00 0.00 0.16 0.00 -2.36 0.00 0.00 39.78 37.58 1lwx n ASN 7 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1lwx n LYS 8 N -0.94 1.32 -2.05 -3.83 5.02 -1.26 -3.83 118.16 112.60 1lwx n LYS 8 Ca 0.14 -2.77 -0.33 0.00 -2.02 0.00 0.00 58.31 53.32 1lwx n LYS 8 Cb 0.06 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.61 1lwx n LYS 8 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1lwx s GLU 9 N -2.86 3.22 0.04 1.97 2.12 -1.21 -4.80 118.70 117.17 1lwx s GLU 9 Ca 0.33 1.34 -0.04 0.00 0.36 0.00 0.00 54.97 56.96 1lwx s GLU 9 Cb 0.30 -2.01 -0.02 0.00 0.26 0.00 0.00 34.13 32.67 1lwx s GLU 9 CO -0.01 -0.91 0.06 1.03 -0.54 0.00 0.00 175.26 174.89 1lwx s ARG 10 N -3.86 0.57 0.17 4.30 0.52 -1.26 -1.70 118.95 117.68 1lwx s ARG 10 Ca 0.66 -0.84 0.02 0.00 -0.52 0.00 0.00 55.73 55.06 1lwx s ARG 10 Cb -0.19 0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.45 1lwx s ARG 10 CO 0.35 -0.13 -0.02 -0.08 0.02 0.00 0.00 175.30 175.43 1lwx s THR 11 N -2.78 0.81 -0.07 0.02 -1.32 -0.90 -4.72 115.64 106.67 1lwx s THR 11 Ca -0.03 -1.99 0.03 0.00 -1.21 0.00 0.00 61.69 58.48 1lwx s THR 11 Cb -0.00 -2.06 -0.02 0.00 -1.51 0.00 0.00 72.50 68.91 1lwx s THR 11 CO -0.06 -0.55 -0.16 0.12 -2.21 0.00 0.00 174.62 171.77 1lwx s PHE 12 N -3.57 2.68 0.10 9.09 5.36 -1.26 -2.64 117.98 127.75 1lwx s PHE 12 Ca 0.22 -0.36 0.03 0.00 -0.96 0.00 0.00 56.93 55.86 1lwx s PHE 12 Cb 0.05 -1.67 -0.04 0.00 -0.34 0.00 0.00 43.02 41.02 1lwx s PHE 12 CO 0.03 0.03 -0.09 -0.51 -1.46 0.00 0.00 175.22 173.22 1lwx s LEU 13 N -0.38 2.44 -0.18 6.12 1.43 0.12 -2.24 118.68 125.99 1lwx s LEU 13 Ca 0.04 -0.87 -0.07 0.00 -1.03 0.00 0.00 54.13 52.20 1lwx s LEU 13 Cb -0.12 -0.25 0.08 0.00 0.03 0.00 0.00 46.19 45.92 1lwx s LEU 13 CO 0.02 -0.31 0.37 0.00 0.23 0.00 0.00 176.35 176.66 1lwx s ALA 14 N -2.77 -0.98 0.04 4.21 0.00 -1.05 -1.40 121.76 119.82 1lwx s ALA 14 Ca 0.08 1.35 -0.30 0.00 0.00 0.00 0.00 51.96 53.08 1lwx s ALA 14 Cb -0.01 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.88 1lwx s ALA 14 CO -0.01 -0.66 1.07 0.08 0.00 0.00 0.00 175.76 176.24 1lwx s VAL 15 N 2.39 4.49 0.82 0.00 1.01 -0.04 -1.31 120.40 127.76 1lwx s VAL 15 Ca -0.02 1.81 -0.12 0.00 0.00 0.00 0.00 61.98 63.65 1lwx s VAL 15 Cb -0.12 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.19 1lwx s VAL 15 CO -0.12 0.16 1.18 -0.54 0.00 0.00 0.00 175.10 175.78 1lwx s LYS 16 N 0.90 1.88 0.42 2.72 3.01 -0.39 -1.98 119.74 126.31 1lwx s LYS 16 Ca 0.54 0.10 0.15 0.00 -1.01 0.00 0.00 55.97 55.76 1lwx s LYS 16 Cb -0.25 -1.94 1.04 0.00 -1.01 0.00 0.00 37.83 35.67 1lwx s LYS 16 CO 0.29 -1.65 1.91 -1.35 0.51 0.00 0.00 175.35 175.06 1lwx h PRO 17 N -1.10 0.42 0.00 -1.68 0.11 -1.86 0.19 132.00 128.07 1lwx h PRO 17 Ca -0.46 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.49 1lwx h PRO 17 Cb 1.33 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1lwx h PRO 17 CO 0.65 0.28 -0.63 0.38 -0.21 0.00 0.00 178.00 178.46 1lwx h ASP 18 N 0.43 0.00 0.03 -2.05 2.03 -1.88 -2.51 116.42 112.47 1lwx h ASP 18 Ca 0.38 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.57 1lwx h ASP 18 Cb 0.85 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.36 1lwx h ASP 18 CO -0.13 0.63 -0.42 1.23 -1.03 0.00 0.00 179.24 179.53 1lwx h GLY 19 N 2.83 0.26 0.83 7.15 0.00 -0.84 -2.29 103.07 111.01 1lwx h GLY 19 Ca -0.01 -0.52 0.02 0.00 0.00 0.00 0.00 47.33 46.82 1lwx h GLY 19 CO 0.08 0.46 0.01 -2.08 0.00 0.00 0.00 176.54 175.01 1lwx h VAL 20 N -0.44 0.93 -0.28 4.60 2.07 -1.27 -1.31 116.25 120.55 1lwx h VAL 20 Ca -0.06 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1lwx h VAL 20 Cb 1.21 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1lwx h VAL 20 CO 0.08 0.01 0.01 0.00 0.02 0.00 0.00 177.57 177.69 1lwx h ALA 21 N 1.10 1.50 -0.00 1.67 0.00 -1.53 -1.26 119.26 120.74 1lwx h ALA 21 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1lwx h ALA 21 Cb 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1lwx h ALA 21 CO -0.09 0.36 -0.04 0.54 0.00 0.00 0.00 179.25 180.02 1lwx n ARG 22 N -4.32 0.79 -2.08 0.00 1.74 -0.86 -4.92 116.66 107.01 1lwx n ARG 22 Ca 0.01 -0.17 -0.02 0.00 -0.77 0.00 0.00 57.85 56.90 1lwx n ARG 22 Cb 0.21 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.17 1lwx n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1lwx n GLY 23 N 1.19 0.41 0.00 -0.13 0.00 -0.47 -5.02 105.19 101.17 1lwx n GLY 23 Ca 0.18 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1lwx n GLY 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lwx n LEU 24 N -1.55 1.73 -0.23 0.99 4.77 -0.52 -4.73 117.00 117.47 1lwx n LEU 24 Ca -0.03 -1.73 -0.08 0.00 -0.03 0.00 0.00 56.01 54.14 1lwx n LEU 24 Cb 0.52 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.65 1lwx n LEU 24 CO 0.09 0.43 0.93 0.58 -1.33 0.00 0.00 177.39 178.10 1lwx h VAL 25 N 0.13 1.25 -0.13 4.08 2.07 -1.87 -1.78 116.25 120.01 1lwx h VAL 25 Ca 0.00 -0.91 -0.15 0.00 0.82 0.00 0.00 66.70 66.46 1lwx h VAL 25 Cb 0.43 0.62 0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1lwx h VAL 25 CO 0.00 0.34 -0.49 1.23 0.02 0.00 0.00 177.57 178.67 1lwx h GLY 26 N 0.94 0.62 0.64 2.17 0.00 -1.97 -1.84 103.07 103.62 1lwx h GLY 26 Ca 0.20 -0.84 0.06 0.00 0.00 0.00 0.00 47.33 46.75 1lwx h GLY 26 CO -0.00 0.75 0.23 -2.09 0.00 0.00 0.00 176.54 175.42 1lwx h GLU 27 N 0.19 0.43 -0.20 4.80 4.57 -1.85 -1.11 114.58 121.41 1lwx h GLU 27 Ca -0.03 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 1lwx h GLU 27 Cb 1.13 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.62 1lwx h GLU 27 CO 0.10 0.28 -0.25 0.82 -1.18 0.00 0.00 179.01 178.79 1lwx h ILE 28 N 0.44 1.33 -0.68 2.32 2.04 -1.29 -3.15 117.51 118.53 1lwx h ILE 28 Ca 0.23 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.63 1lwx h ILE 28 Cb 0.19 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1lwx h ILE 28 CO -0.20 0.44 0.32 0.40 0.00 0.00 0.00 178.15 179.11 1lwx h ILE 29 N 0.18 1.23 -0.53 -0.67 2.04 -1.21 -2.97 117.51 115.59 1lwx h ILE 29 Ca 0.02 -0.65 0.15 0.00 1.00 0.00 0.00 64.86 65.38 1lwx h ILE 29 Cb 0.81 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1lwx h ILE 29 CO 0.06 0.27 0.38 0.00 0.00 0.00 0.00 178.15 178.86 1lwx h ALA 30 N 1.15 2.50 0.04 1.87 0.00 -1.16 -1.98 119.26 121.67 1lwx h ALA 30 Ca 0.23 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.90 1lwx h ALA 30 Cb 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1lwx h ALA 30 CO -0.03 -0.65 -1.00 0.00 0.00 0.00 0.00 179.25 177.57 1lwx h ARG 31 N 0.00 0.19 0.04 0.00 3.08 -1.50 -0.68 114.38 115.51 1lwx h ARG 31 Ca 0.25 -0.25 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 1lwx h ARG 31 Cb 1.00 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1lwx h ARG 31 CO -0.00 1.04 -1.01 1.88 -1.07 0.00 0.00 179.97 180.81 1lwx h TYR 32 N 0.08 0.26 0.01 3.04 0.05 -1.48 -1.58 116.97 117.35 1lwx h TYR 32 Ca -0.06 -0.17 -0.00 0.00 0.05 0.00 0.00 58.73 58.55 1lwx h TYR 32 Cb 1.69 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.41 1lwx h TYR 32 CO 0.03 1.06 -0.00 0.93 -1.05 0.00 0.00 178.16 179.13 1lwx h GLU 33 N 0.06 -0.01 -0.22 4.88 5.08 -1.39 0.12 114.58 123.10 1lwx h GLU 33 Ca -0.06 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1lwx h GLU 33 Cb 1.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.94 1lwx h GLU 33 CO 0.15 0.44 0.07 0.87 -1.00 0.00 0.00 179.01 179.54 1lwx h LYS 34 N -0.46 0.31 0.00 2.33 1.57 -1.17 0.13 116.57 119.28 1lwx h LYS 34 Ca -0.00 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1lwx h LYS 34 Cb 0.45 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1lwx h LYS 34 CO 0.00 0.28 -0.36 -0.22 -0.57 0.00 0.00 179.45 178.58 1lwx h LYS 35 N 0.31 0.00 0.00 3.15 1.63 -1.08 -3.46 116.57 117.12 1lwx h LYS 35 Ca 0.08 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1lwx h LYS 35 Cb 0.10 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1lwx h LYS 35 CO -0.01 0.36 0.00 0.41 -3.45 0.00 0.00 179.45 176.77 1lwx n GLY 36 N -0.49 0.86 3.78 5.01 0.00 0.46 -5.07 105.19 109.74 1lwx n GLY 36 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1lwx n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lwx s PHE 37 N -2.00 3.05 -0.14 1.61 0.08 0.33 -4.84 117.98 116.07 1lwx s PHE 37 Ca 0.00 1.59 -0.07 0.00 0.12 0.00 0.00 56.93 58.57 1lwx s PHE 37 Cb 0.00 -3.23 -0.04 0.00 -0.57 0.00 0.00 43.02 39.18 1lwx s PHE 37 CO 0.00 -1.05 0.10 0.08 -0.10 0.00 0.00 175.22 174.26 1lwx s VAL 38 N -1.66 5.18 -0.57 -0.44 1.01 -0.75 -4.33 120.40 118.83 1lwx s VAL 38 Ca 0.62 0.09 -0.23 0.00 0.00 0.00 0.00 61.98 62.46 1lwx s VAL 38 Cb -0.24 -3.27 0.05 0.00 0.00 0.00 0.00 36.38 32.92 1lwx s VAL 38 CO 0.29 0.56 0.90 -0.22 0.00 0.00 0.00 175.10 176.63 1lwx s LEU 39 N -0.55 4.29 0.00 3.92 2.96 -1.26 -0.54 118.68 127.49 1lwx s LEU 39 Ca 0.12 -0.57 0.21 0.00 -0.22 0.00 0.00 54.13 53.67 1lwx s LEU 39 Cb -0.12 -2.69 0.38 0.00 0.50 0.00 0.00 46.19 44.27 1lwx s LEU 39 CO 0.02 -1.22 1.34 1.33 -1.32 0.00 0.00 176.35 176.49 1lwx n VAL 40 N 6.05 0.52 -3.63 1.68 0.24 -0.58 -4.94 118.33 117.67 1lwx n VAL 40 Ca -0.01 -0.76 -0.11 0.00 -2.04 0.00 0.00 64.34 61.43 1lwx n VAL 40 Cb 0.47 0.96 -0.07 0.00 -1.47 0.00 0.00 33.84 33.72 1lwx n VAL 40 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1lwx s GLY 41 N -1.37 -0.27 -0.27 7.63 0.00 -1.21 -1.60 107.32 110.22 1lwx s GLY 41 Ca 0.35 2.43 -0.25 0.00 0.00 0.00 0.00 44.72 47.25 1lwx s GLY 41 CO 0.28 1.73 0.80 -2.27 0.00 0.00 0.00 173.10 173.65 1lwx s LEU 42 N 0.12 -0.67 -0.19 0.66 2.96 -1.26 -2.21 118.68 118.10 1lwx s LEU 42 Ca 0.02 1.29 -0.32 0.00 -0.22 0.00 0.00 54.13 54.90 1lwx s LEU 42 Cb -0.05 2.31 0.15 0.00 0.50 0.00 0.00 46.19 49.10 1lwx s LEU 42 CO -0.03 -0.22 1.17 -1.59 -1.32 0.00 0.00 176.35 174.35 1lwx s LYS 43 N 0.35 0.36 0.13 1.98 -2.85 0.05 -4.98 119.74 114.77 1lwx s LYS 43 Ca 0.01 -0.05 0.07 0.00 -1.00 0.00 0.00 55.97 55.00 1lwx s LYS 43 Cb -0.05 0.17 -0.04 0.00 -2.06 0.00 0.00 37.83 35.85 1lwx s LYS 43 CO -0.01 -0.14 -0.07 -1.14 0.10 0.00 0.00 175.35 174.09 1lwx s GLN 44 N -1.88 2.23 0.11 1.78 0.74 -1.26 0.22 119.66 121.59 1lwx s GLN 44 Ca 0.07 -1.05 -0.26 0.00 0.05 0.00 0.00 55.36 54.16 1lwx s GLN 44 Cb -0.01 -2.33 0.08 0.00 1.10 0.00 0.00 33.01 31.86 1lwx s GLN 44 CO -0.04 0.49 1.07 -0.48 -0.55 0.00 0.00 175.29 175.77 1lwx s LEU 45 N -2.46 -0.11 -0.31 3.68 2.34 -0.48 -4.97 118.68 116.37 1lwx s LEU 45 Ca 0.24 -0.38 -0.06 0.00 0.06 0.00 0.00 54.13 53.98 1lwx s LEU 45 Cb -0.10 1.93 0.02 0.00 -0.56 0.00 0.00 46.19 47.47 1lwx s LEU 45 CO 0.16 -0.75 0.08 -0.69 -1.06 0.00 0.00 176.35 174.09 1lwx s VAL 46 N -2.85 3.84 0.51 1.48 1.01 -1.26 -0.80 120.40 122.34 1lwx s VAL 46 Ca 0.15 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 61.04 1lwx s VAL 46 Cb 0.00 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 1lwx s VAL 46 CO 0.01 -0.01 1.25 -2.84 0.00 0.00 0.00 175.10 173.51 1lwx s PRO 47 N 1.46 3.40 0.17 2.72 0.02 -1.26 -5.04 135.00 136.47 1lwx s PRO 47 Ca 0.01 1.97 0.01 0.00 0.02 0.00 0.00 61.00 63.01 1lwx s PRO 47 Cb -0.18 -2.28 -0.04 0.00 0.02 0.00 0.00 34.50 32.02 1lwx s PRO 47 CO 0.02 -0.90 0.32 0.95 -0.33 0.00 0.00 177.00 177.07 1lwx s THR 48 N -1.45 5.28 0.32 0.99 -4.23 -1.26 -4.68 115.64 110.61 1lwx s THR 48 Ca 0.69 -0.57 0.09 0.00 -1.18 0.00 0.00 61.69 60.72 1lwx s THR 48 Cb -0.34 -3.74 0.31 0.00 1.34 0.00 0.00 72.50 70.08 1lwx s THR 48 CO 0.40 -0.12 1.69 0.50 -0.54 0.00 0.00 174.62 176.54 1lwx h LYS 49 N 2.08 0.39 0.00 3.99 3.11 -1.96 0.25 116.57 124.42 1lwx h LYS 49 Ca -0.48 -0.02 -0.05 0.00 -2.81 0.00 0.00 60.65 57.29 1lwx h LYS 49 Cb 1.19 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 32.33 1lwx h LYS 49 CO 0.68 0.26 -0.22 -0.44 -2.81 0.00 0.00 179.45 176.92 1lwx h ASP 50 N 0.40 0.00 0.14 4.20 5.19 -2.00 -2.44 116.42 121.91 1lwx h ASP 50 Ca 0.65 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.82 1lwx h ASP 50 Cb 1.34 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.86 1lwx h ASP 50 CO -0.56 0.22 -1.11 0.25 -3.12 0.00 0.00 179.24 174.92 1lwx h LEU 51 N 0.00 0.48 -0.85 1.55 5.85 -0.92 -3.25 115.31 118.16 1lwx h LEU 51 Ca -0.00 -0.91 -0.10 0.00 0.84 0.00 0.00 57.88 57.70 1lwx h LEU 51 Cb 0.72 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1lwx h LEU 51 CO 0.03 1.51 -0.25 0.00 -0.34 0.00 0.00 178.44 179.39 1lwx h ALA 52 N 0.04 1.02 -0.17 1.25 0.00 -1.39 -0.87 119.26 119.15 1lwx h ALA 52 Ca -0.22 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.27 1lwx h ALA 52 Cb 1.74 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.40 1lwx h ALA 52 CO 0.13 0.59 -0.17 0.93 0.00 0.00 0.00 179.25 180.72 1lwx h GLU 53 N 0.50 0.41 -0.46 0.00 5.08 -1.58 -1.24 114.58 117.29 1lwx h GLU 53 Ca 0.07 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1lwx h GLU 53 Cb 0.70 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 1lwx h GLU 53 CO 0.05 0.79 0.28 0.77 -1.00 0.00 0.00 179.01 179.90 1lwx h SER 54 N 0.05 0.46 0.13 1.42 0.02 -1.58 0.88 113.55 114.94 1lwx h SER 54 Ca 0.03 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1lwx h SER 54 Cb 0.71 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 1lwx h SER 54 CO 0.04 0.33 -0.32 -0.74 -1.14 0.00 0.00 176.83 175.01 1lwx h HIS 55 N 0.57 -0.90 -0.34 3.45 -0.00 -1.01 -1.57 115.15 115.35 1lwx h HIS 55 Ca 0.18 0.02 -0.18 0.00 -0.00 0.00 0.00 60.37 60.39 1lwx h HIS 55 Cb -0.01 0.38 -0.10 0.00 -0.00 0.00 0.00 27.41 27.67 1lwx h HIS 55 CO -0.06 -0.37 0.23 0.66 -0.00 0.00 0.00 177.93 178.38 1lwx n TYR 56 N -4.25 1.04 -0.19 5.26 4.01 -0.48 -4.59 117.16 117.95 1lwx n TYR 56 Ca -0.06 -1.01 -0.01 0.00 -0.16 0.00 0.00 57.90 56.66 1lwx n TYR 56 Cb 0.26 -0.51 0.06 0.00 -0.31 0.00 0.00 39.34 38.83 1lwx n TYR 56 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1lwx h ALA 57 N 1.64 0.41 0.00 -0.72 0.00 0.24 -0.90 119.26 119.92 1lwx h ALA 57 Ca 0.21 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1lwx h ALA 57 Cb 1.57 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1lwx h ALA 57 CO 0.39 -0.43 0.07 -0.85 0.00 0.00 0.00 179.25 178.43 1lwx n GLU 58 N -5.39 0.00 -0.43 0.00 0.28 -1.26 0.53 120.64 114.37 1lwx n GLU 58 Ca 0.07 0.22 0.07 0.00 -0.16 0.00 0.00 57.16 57.36 1lwx n GLU 58 Cb 0.31 -1.57 0.17 0.00 1.43 0.00 0.00 31.44 31.78 1lwx n GLU 58 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1lwx n HIS 59 N -1.17 0.00 -0.33 -1.84 8.25 -0.34 -4.85 115.22 114.94 1lwx n HIS 59 Ca 0.00 -1.23 0.27 0.00 -0.26 0.00 0.00 57.72 56.50 1lwx n HIS 59 Cb 0.07 -0.20 0.51 0.00 1.12 0.00 0.00 29.99 31.49 1lwx n HIS 59 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1lwx h LYS 60 N 0.60 0.15 -3.39 -0.41 -0.00 -0.00 -3.26 116.57 110.27 1lwx h LYS 60 Ca -0.01 -0.01 -0.62 0.00 -0.00 0.00 0.00 60.65 60.01 1lwx h LYS 60 Cb 1.05 -0.03 -0.40 0.00 -0.00 0.00 0.00 32.23 32.84 1lwx h LYS 60 CO 0.00 0.10 -0.72 -1.83 -0.00 0.00 0.00 179.45 177.01 1lwx s GLU 61 N -5.62 1.32 0.00 0.07 -1.05 -1.26 -4.95 118.70 107.21 1lwx s GLU 61 Ca -0.10 -1.92 -0.16 0.00 -0.15 0.00 0.00 54.97 52.65 1lwx s GLU 61 Cb 0.32 -2.56 0.03 0.00 -0.44 0.00 0.00 34.13 31.48 1lwx s GLU 61 CO 0.78 -1.09 0.34 1.03 0.95 0.00 0.00 175.26 177.28 1lwx s ARG 62 N 0.56 0.74 0.65 -4.83 1.81 -1.23 -5.05 118.95 111.59 1lwx s ARG 62 Ca 0.15 -0.24 0.25 0.00 -1.72 0.00 0.00 55.73 54.17 1lwx s ARG 62 Cb -0.23 0.33 1.32 0.00 -0.45 0.00 0.00 34.95 35.93 1lwx s ARG 62 CO -0.06 -0.22 1.75 -1.35 -0.68 0.00 0.00 175.30 174.75 1lwx h PRO 63 N 3.60 0.00 -0.02 3.54 0.11 -1.98 -2.32 132.00 134.93 1lwx h PRO 63 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1lwx h PRO 63 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1lwx h PRO 63 CO 0.41 0.00 0.00 1.97 -0.21 0.00 0.00 178.00 180.17 1lwx n PHE 64 N -3.03 0.03 -0.00 0.65 1.16 -1.26 -4.81 117.46 110.20 1lwx n PHE 64 Ca 0.02 -0.40 -0.10 0.00 -1.87 0.00 0.00 57.45 55.10 1lwx n PHE 64 Cb 0.59 -0.04 -0.03 0.00 -1.61 0.00 0.00 39.48 38.39 1lwx n PHE 64 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 1lwx h PHE 65 N 0.17 -0.67 0.45 2.97 3.04 -1.69 -1.43 116.94 119.77 1lwx h PHE 65 Ca 0.00 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 1lwx h PHE 65 Cb 0.42 0.32 -0.02 0.00 2.56 0.00 0.00 35.95 39.23 1lwx h PHE 65 CO 0.02 -0.33 -0.38 0.78 -2.02 0.00 0.00 178.31 176.38 1lwx h GLY 66 N -0.32 -0.92 1.19 2.40 0.00 -1.87 0.20 103.07 103.74 1lwx h GLY 66 Ca 0.10 0.43 0.06 0.00 0.00 0.00 0.00 47.33 47.92 1lwx h GLY 66 CO -0.32 -0.32 0.35 -1.33 0.00 0.00 0.00 176.54 174.92 1lwx h GLY 67 N -0.82 0.00 0.66 4.60 0.00 -1.84 0.36 103.07 106.02 1lwx h GLY 67 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.94 1lwx h GLY 67 CO -0.02 0.00 -1.86 -2.00 0.00 0.00 0.00 176.54 172.65 1lwx h LEU 68 N 0.00 0.45 -1.23 3.11 5.85 -0.83 -2.98 115.31 119.67 1lwx h LEU 68 Ca 0.10 -0.93 -0.07 0.00 0.84 0.00 0.00 57.88 57.83 1lwx h LEU 68 Cb 0.79 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1lwx h LEU 68 CO -0.00 1.81 -0.32 0.58 -0.34 0.00 0.00 178.44 180.17 1lwx h VAL 69 N 0.00 0.92 0.00 1.05 2.07 0.11 -0.22 116.25 120.19 1lwx h VAL 69 Ca -0.39 -1.25 -0.06 0.00 0.82 0.00 0.00 66.70 65.81 1lwx h VAL 69 Cb 2.00 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.50 1lwx h VAL 69 CO 0.10 0.32 -0.69 0.77 0.02 0.00 0.00 177.57 178.08 1lwx h SER 70 N 0.00 0.00 0.00 0.57 4.64 -0.51 -3.22 113.55 115.03 1lwx h SER 70 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 1lwx h SER 70 Cb 0.71 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 1lwx h SER 70 CO 0.04 0.25 -0.29 0.15 -0.87 0.00 0.00 176.83 176.11 1lwx h PHE 71 N 0.00 0.00 0.00 4.77 3.57 -1.27 -3.05 116.94 120.96 1lwx h PHE 71 Ca -0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1lwx h PHE 71 Cb 1.22 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.96 1lwx h PHE 71 CO 0.00 1.11 0.00 1.51 -2.23 0.00 0.00 178.31 178.70 1lwx n ILE 72 N -4.57 1.21 0.64 1.41 3.06 -0.14 -1.45 119.36 119.52 1lwx n ILE 72 Ca -0.15 0.30 0.07 0.00 -2.50 0.00 0.00 62.75 60.47 1lwx n ILE 72 Cb 0.53 -1.23 -0.09 0.00 0.54 0.00 0.00 39.64 39.39 1lwx n ILE 72 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1lwx n THR 73 N -1.36 0.00 0.64 9.51 -2.24 -1.22 -4.40 114.28 115.22 1lwx n THR 73 Ca 0.02 -0.17 0.08 0.00 -2.27 0.00 0.00 64.05 61.71 1lwx n THR 73 Cb 0.04 0.92 0.37 0.00 -2.10 0.00 0.00 70.33 69.56 1lwx n THR 73 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1lwx n SER 74 N -1.41 0.00 -1.13 3.42 3.41 -0.53 -4.76 113.62 112.61 1lwx n SER 74 Ca 0.02 0.29 -0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1lwx n SER 74 Cb 0.25 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1lwx n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lwx n GLY 75 N 0.10 1.24 3.78 5.00 0.00 -1.26 -5.13 105.19 108.92 1lwx n GLY 75 Ca 0.06 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1lwx n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lwx s PRO 76 N -2.00 4.25 0.10 1.61 0.04 -1.26 -4.38 135.00 133.36 1lwx s PRO 76 Ca 0.01 1.50 0.09 0.00 0.04 0.00 0.00 61.00 62.64 1lwx s PRO 76 Cb -0.00 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 1lwx s PRO 76 CO 0.00 -0.06 -0.23 0.08 0.04 0.00 0.00 177.00 176.83 1lwx s VAL 77 N -1.64 1.90 -0.24 -0.36 1.01 0.02 -3.66 120.40 117.43 1lwx s VAL 77 Ca 0.56 -1.58 0.02 0.00 0.00 0.00 0.00 61.98 60.99 1lwx s VAL 77 Cb -0.22 -1.70 0.05 0.00 0.00 0.00 0.00 36.38 34.52 1lwx s VAL 77 CO 0.28 0.03 -0.12 0.68 0.00 0.00 0.00 175.10 175.97 1lwx s VAL 78 N -1.09 2.05 0.33 2.92 -7.23 -0.84 -1.39 120.40 115.17 1lwx s VAL 78 Ca 0.09 -1.46 -0.09 0.00 -1.81 0.00 0.00 61.98 58.71 1lwx s VAL 78 Cb -0.10 -2.13 -0.07 0.00 0.56 0.00 0.00 36.38 34.64 1lwx s VAL 78 CO 0.04 0.05 0.67 0.00 -0.31 0.00 0.00 175.10 175.56 1lwx s ALA 79 N 1.18 3.46 0.05 1.32 0.00 0.13 -0.86 121.76 127.03 1lwx s ALA 79 Ca -0.06 -0.28 -0.27 0.00 0.00 0.00 0.00 51.96 51.35 1lwx s ALA 79 Cb -0.19 -2.55 0.09 0.00 0.00 0.00 0.00 23.12 20.47 1lwx s ALA 79 CO -0.06 0.20 0.76 0.00 0.00 0.00 0.00 175.76 176.66 1lwx s MET 80 N -3.46 1.01 -0.03 0.00 0.23 -0.49 -0.77 119.30 115.79 1lwx s MET 80 Ca 0.49 -0.29 0.01 0.00 -1.03 0.00 0.00 55.69 54.87 1lwx s MET 80 Cb -0.11 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.69 1lwx s MET 80 CO 0.27 -0.43 -0.02 0.54 -2.03 0.00 0.00 175.02 173.36 1lwx s VAL 81 N -3.05 0.32 0.10 5.16 0.11 -0.94 -0.70 120.40 121.40 1lwx s VAL 81 Ca 0.01 -0.01 0.07 0.00 -2.93 0.00 0.00 61.98 59.12 1lwx s VAL 81 Cb -0.01 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 1lwx s VAL 81 CO -0.08 0.17 -0.09 -0.36 -3.33 0.00 0.00 175.10 171.41 1lwx s PHE 82 N 0.90 2.77 0.07 1.54 0.40 -1.08 -1.53 117.98 121.06 1lwx s PHE 82 Ca -0.10 -0.14 0.08 0.00 -0.60 0.00 0.00 56.93 56.17 1lwx s PHE 82 Cb -0.13 -1.44 -0.03 0.00 0.51 0.00 0.00 43.02 41.92 1lwx s PHE 82 CO -0.01 0.44 -0.22 -2.00 0.70 0.00 0.00 175.22 174.13 1lwx s GLU 83 N -2.24 1.34 0.00 0.44 2.12 0.30 -2.12 118.70 118.54 1lwx s GLU 83 Ca 0.22 -1.07 0.00 0.00 0.36 0.00 0.00 54.97 54.48 1lwx s GLU 83 Cb -0.11 -1.54 0.00 0.00 0.26 0.00 0.00 34.13 32.74 1lwx s GLU 83 CO 0.14 0.38 0.00 0.41 -0.54 0.00 0.00 175.26 175.65 1lwx n GLY 84 N 1.50 1.69 3.74 -1.50 0.00 -0.69 -1.82 105.19 108.12 1lwx n GLY 84 Ca -0.18 -1.21 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 1lwx n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwx s LYS 85 N -1.98 4.31 -1.61 1.61 1.02 -1.26 -2.97 119.74 118.86 1lwx s LYS 85 Ca 0.00 2.20 0.00 0.00 0.02 0.00 0.00 55.97 58.19 1lwx s LYS 85 Cb 0.00 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 1lwx s LYS 85 CO 0.00 -0.37 0.00 0.41 -0.92 0.00 0.00 175.35 174.47 1lwx n GLY 86 N 2.37 1.07 0.31 -3.33 0.00 -1.26 -4.85 105.19 99.49 1lwx n GLY 86 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1lwx n GLY 86 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1lwx h VAL 87 N 0.00 0.89 0.13 1.61 3.04 -1.84 0.72 116.25 120.79 1lwx h VAL 87 Ca -0.34 -0.27 -0.01 0.00 -1.01 0.00 0.00 66.70 65.08 1lwx h VAL 87 Cb 1.09 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 1lwx h VAL 87 CO 0.47 0.14 -0.06 0.58 -1.01 0.00 0.00 177.57 177.69 1lwx h VAL 88 N 0.78 0.88 -0.09 1.51 2.07 -1.87 0.16 116.25 119.69 1lwx h VAL 88 Ca 0.41 -0.04 -0.16 0.00 0.82 0.00 0.00 66.70 67.72 1lwx h VAL 88 Cb 0.40 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1lwx h VAL 88 CO -0.26 0.01 -0.64 0.00 0.02 0.00 0.00 177.57 176.70 1lwx h ALA 89 N 0.68 0.72 -0.13 1.67 0.00 -1.79 -2.47 119.26 117.95 1lwx h ALA 89 Ca -0.02 -0.56 -0.11 0.00 0.00 0.00 0.00 54.91 54.22 1lwx h ALA 89 Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1lwx h ALA 89 CO 0.03 0.74 -0.36 0.77 0.00 0.00 0.00 179.25 180.43 1lwx h SER 90 N 0.26 0.53 -0.29 0.00 0.02 -0.81 -2.24 113.55 111.02 1lwx h SER 90 Ca -0.01 -0.59 0.05 0.00 -0.84 0.00 0.00 61.79 60.39 1lwx h SER 90 Cb 1.18 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 1lwx h SER 90 CO 0.11 1.03 0.20 0.00 -1.14 0.00 0.00 176.83 177.03 1lwx h ALA 91 N 0.51 2.04 -0.19 3.77 0.00 -0.72 0.62 119.26 125.29 1lwx h ALA 91 Ca -0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1lwx h ALA 91 Cb 0.98 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1lwx h ALA 91 CO 0.08 -0.10 -0.61 0.00 0.00 0.00 0.00 179.25 178.62 1lwx h ARG 92 N 0.18 0.74 -0.54 0.00 2.47 -1.20 -2.70 114.38 113.34 1lwx h ARG 92 Ca 0.13 -0.55 -0.04 0.00 -1.26 0.00 0.00 59.98 58.26 1lwx h ARG 92 Cb 0.27 0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 1lwx h ARG 92 CO -0.02 1.17 0.19 1.25 0.56 0.00 0.00 179.97 183.12 1lwx h LEU 93 N 0.46 0.76 -1.67 3.04 5.85 -0.55 -2.16 115.31 121.04 1lwx h LEU 93 Ca -0.02 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1lwx h LEU 93 Cb 1.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1lwx h LEU 93 CO 0.13 0.74 -0.18 0.24 -0.34 0.00 0.00 178.44 179.03 1lwx h MET 94 N 0.73 0.00 0.00 1.25 2.86 -0.96 -3.01 114.93 115.80 1lwx h MET 94 Ca 0.18 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.62 1lwx h MET 94 Cb 0.23 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.91 1lwx h MET 94 CO -0.01 0.18 -0.78 0.82 1.06 0.00 0.00 176.91 178.18 1lwx h ILE 95 N 0.00 1.37 0.00 -1.22 2.04 -1.11 0.23 117.51 118.82 1lwx h ILE 95 Ca -0.00 -2.15 0.00 0.00 1.00 0.00 0.00 64.86 63.71 1lwx h ILE 95 Cb 0.32 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 1lwx h ILE 95 CO 0.02 0.64 0.00 0.61 0.00 0.00 0.00 178.15 179.43 1lwx n GLY 96 N 1.09 0.09 3.90 5.37 0.00 -0.85 -0.93 105.19 113.85 1lwx n GLY 96 Ca -0.11 -2.12 -0.20 0.00 0.00 0.00 0.00 46.02 43.59 1lwx n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1lwx s VAL 97 N 0.00 2.65 0.24 1.61 -7.23 -1.26 -4.75 120.40 111.66 1lwx s VAL 97 Ca 0.00 -1.30 -0.05 0.00 -1.81 0.00 0.00 61.98 58.82 1lwx s VAL 97 Cb 0.00 -2.96 0.23 0.00 0.56 0.00 0.00 36.38 34.21 1lwx s VAL 97 CO 0.00 0.00 1.68 0.74 -0.31 0.00 0.00 175.10 177.21 1lwx h THR 98 N 0.96 0.52 -3.56 5.32 2.02 -1.98 -3.37 112.91 112.81 1lwx h THR 98 Ca -0.41 -0.09 -0.63 0.00 0.77 0.00 0.00 66.41 66.05 1lwx h THR 98 Cb 1.27 0.23 -0.13 0.00 -1.74 0.00 0.00 68.15 67.78 1lwx h THR 98 CO 0.56 0.05 0.10 0.21 0.37 0.00 0.00 175.52 176.80 1lwx s ASN 99 N -5.24 6.43 0.23 4.18 3.04 -1.26 -4.76 114.94 117.56 1lwx s ASN 99 Ca -0.13 0.22 -0.07 0.00 0.04 0.00 0.00 52.86 52.93 1lwx s ASN 99 Cb 0.21 -2.31 0.39 0.00 -1.54 0.00 0.00 41.25 38.00 1lwx s ASN 99 CO 0.75 -0.52 1.71 -0.65 -3.04 0.00 0.00 177.10 175.36 1lwx h PRO 100 N 8.35 0.33 -0.68 0.43 0.11 -1.82 -2.10 132.00 136.62 1lwx h PRO 100 Ca -0.27 -0.02 0.14 0.00 0.11 0.00 0.00 66.00 65.96 1lwx h PRO 100 Cb 1.12 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1lwx h PRO 100 CO 0.81 0.22 0.46 -0.07 -0.21 0.00 0.00 178.00 179.20 1lwx h LEU 101 N 0.34 0.31 -1.24 2.35 3.38 -1.72 0.39 115.31 119.12 1lwx h LEU 101 Ca 0.37 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1lwx h LEU 101 Cb 0.58 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1lwx h LEU 101 CO -0.42 0.17 0.00 0.00 0.09 0.00 0.00 178.44 178.27 1lwx n ALA 102 N -2.55 2.54 -1.89 1.53 0.00 -0.81 -4.90 120.51 114.43 1lwx n ALA 102 Ca 0.12 -0.53 -0.39 0.00 0.00 0.00 0.00 53.44 52.64 1lwx n ALA 102 Cb 0.51 -1.07 -0.06 0.00 0.00 0.00 0.00 19.45 18.83 1lwx n ALA 102 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1lwx s SER 103 N -1.89 7.43 0.67 0.00 0.01 0.13 -4.86 113.70 115.18 1lwx s SER 103 Ca 0.35 1.75 -0.13 0.00 1.31 0.00 0.00 55.95 59.23 1lwx s SER 103 Cb 0.20 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.90 1lwx s SER 103 CO 0.31 0.13 1.08 0.00 0.41 0.00 0.00 173.24 175.17 1lwx s ALA 104 N -1.28 2.57 0.47 1.44 0.00 -1.26 -4.32 121.76 119.38 1lwx s ALA 104 Ca 0.41 0.31 -0.24 0.00 0.00 0.00 0.00 51.96 52.44 1lwx s ALA 104 Cb -0.22 -3.24 -0.07 0.00 0.00 0.00 0.00 23.12 19.58 1lwx s ALA 104 CO 0.27 -1.21 1.32 -2.14 0.00 0.00 0.00 175.76 173.99 1lwx s PRO 105 N -4.52 3.61 0.00 0.00 0.02 -1.26 -2.36 135.00 130.48 1lwx s PRO 105 Ca 0.62 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1lwx s PRO 105 Cb -0.17 -2.51 0.00 0.00 0.02 0.00 0.00 34.50 31.84 1lwx s PRO 105 CO 0.47 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 1lwx n GLY 106 N 0.63 2.69 3.90 0.52 0.00 -1.26 -4.99 105.19 106.68 1lwx n GLY 106 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1lwx n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lwx s SER 107 N -0.01 6.43 0.12 1.61 1.04 -1.00 -4.94 113.70 116.95 1lwx s SER 107 Ca 0.00 0.76 -0.23 0.00 0.48 0.00 0.00 55.95 56.96 1lwx s SER 107 Cb 0.00 -2.16 -0.05 0.00 0.10 0.00 0.00 66.02 63.91 1lwx s SER 107 CO 0.00 -0.26 1.67 0.40 0.98 0.00 0.00 173.24 176.03 1lwx h ILE 108 N 1.17 0.61 0.00 -1.02 2.04 -0.62 -1.10 117.51 118.58 1lwx h ILE 108 Ca -0.48 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 1lwx h ILE 108 Cb 1.19 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1lwx h ILE 108 CO 0.65 0.00 -0.36 0.03 0.00 0.00 0.00 178.15 178.46 1lwx h ARG 109 N -0.22 0.00 0.00 2.37 3.08 -1.27 -2.55 114.38 115.78 1lwx h ARG 109 Ca 0.07 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.97 1lwx h ARG 109 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1lwx h ARG 109 CO -0.19 0.36 -0.73 0.78 -1.07 0.00 0.00 179.97 179.13 1lwx h GLY 110 N 1.40 0.00 1.22 0.04 0.00 -1.62 -0.21 103.07 103.90 1lwx h GLY 110 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 1lwx h GLY 110 CO 0.05 0.00 -1.54 -0.55 0.00 0.00 0.00 176.54 174.50 1lwx h ASP 111 N 0.00 0.44 0.00 0.19 3.32 -1.14 -3.43 116.42 115.79 1lwx h ASP 111 Ca -0.01 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.45 1lwx h ASP 111 Cb 1.41 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1lwx h ASP 111 CO 0.09 1.49 -0.91 0.49 -1.72 0.00 0.00 179.24 178.69 1lwx n PHE 112 N -3.48 0.00 -3.96 4.55 3.72 -0.97 -5.08 117.46 112.24 1lwx n PHE 112 Ca -0.17 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.01 1lwx n PHE 112 Cb 1.05 -0.05 -0.02 0.00 -0.94 0.00 0.00 39.48 39.51 1lwx n PHE 112 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1lwx s GLY 113 N -2.10 1.32 0.00 1.37 0.00 -0.09 -5.01 107.32 102.81 1lwx s GLY 113 Ca -0.01 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1lwx s GLY 113 CO 0.12 -1.20 0.00 -0.62 0.00 0.00 0.00 173.10 171.40 1lwx n VAL 114 N -1.21 0.00 -5.09 1.40 0.31 -1.26 -4.07 118.33 108.40 1lwx n VAL 114 Ca -0.09 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 63.93 1lwx n VAL 114 Cb 0.56 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.34 1lwx n VAL 114 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1lwx s ASP 115 N -1.29 3.30 0.50 4.52 2.15 -1.26 -4.12 116.67 120.46 1lwx s ASP 115 Ca 0.00 -0.45 0.25 0.00 0.43 0.00 0.00 52.55 52.78 1lwx s ASP 115 Cb 0.00 -0.43 1.33 0.00 -0.30 0.00 0.00 42.92 43.52 1lwx s ASP 115 CO 0.00 0.30 2.03 0.58 -0.17 0.00 0.00 175.17 177.92 1lwx h VAL 116 N 4.36 0.66 0.03 1.11 2.07 -1.96 -1.94 116.25 120.56 1lwx h VAL 116 Ca -0.45 -0.62 -0.22 0.00 0.82 0.00 0.00 66.70 66.24 1lwx h VAL 116 Cb 1.13 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1lwx h VAL 116 CO 0.47 0.14 -1.00 1.23 0.02 0.00 0.00 177.57 178.43 1lwx h GLY 117 N 0.92 0.10 -6.46 2.17 0.00 -1.94 -3.34 103.07 94.52 1lwx h GLY 117 Ca -0.00 -0.24 -0.68 0.00 0.00 0.00 0.00 47.33 46.41 1lwx h GLY 117 CO 0.02 0.21 -0.05 0.54 0.00 0.00 0.00 176.54 177.26 1lwx n ARG 118 N -3.48 3.32 -0.01 4.80 5.12 -0.74 -4.86 116.66 120.81 1lwx n ARG 118 Ca -0.02 -4.64 0.12 0.00 -1.93 0.00 0.00 57.85 51.38 1lwx n ARG 118 Cb 0.91 -2.36 0.62 0.00 -1.16 0.00 0.00 32.46 30.47 1lwx n ARG 118 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1lwx n ALA 119 N 1.00 2.61 0.00 7.54 0.00 -1.15 -4.23 120.51 126.28 1lwx n ALA 119 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1lwx n ALA 119 Cb 0.38 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1lwx n ALA 119 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1lwx n ILE 120 N -0.56 0.00 -3.81 0.00 5.41 -1.26 -4.79 119.36 114.35 1lwx n ILE 120 Ca 0.17 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.81 1lwx n ILE 120 Cb 0.15 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 39.00 1lwx n ILE 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1lwx s ILE 121 N 0.00 0.09 0.08 1.39 2.07 -1.26 -1.26 121.20 122.31 1lwx s ILE 121 Ca 0.00 -0.77 0.05 0.00 -1.41 0.00 0.00 60.65 58.52 1lwx s ILE 121 Cb 0.00 -0.87 -0.04 0.00 0.13 0.00 0.00 42.46 41.68 1lwx s ILE 121 CO 0.00 -0.42 -0.04 -2.28 -1.91 0.00 0.00 174.94 170.29 1lwx s HIS 122 N -2.39 2.90 -0.05 3.50 5.65 -0.43 -4.93 115.29 119.54 1lwx s HIS 122 Ca -0.06 -0.06 -0.04 0.00 0.25 0.00 0.00 55.06 55.14 1lwx s HIS 122 Cb -0.02 -1.52 0.02 0.00 -1.18 0.00 0.00 32.58 29.88 1lwx s HIS 122 CO -0.03 0.45 0.13 0.20 -0.65 0.00 0.00 174.74 174.85 1lwx s GLY 123 N -2.14 -0.08 0.36 1.59 0.00 -1.26 -2.51 107.32 103.27 1lwx s GLY 123 Ca 0.23 0.45 -0.28 0.00 0.00 0.00 0.00 44.72 45.11 1lwx s GLY 123 CO 0.15 0.49 1.52 -0.56 0.00 0.00 0.00 173.10 174.71 1lwx s SER 124 N 0.36 6.33 0.16 1.64 0.01 -0.95 -4.93 113.70 116.31 1lwx s SER 124 Ca -0.02 3.05 0.23 0.00 1.31 0.00 0.00 55.95 60.52 1lwx s SER 124 Cb -0.04 -2.66 0.20 0.00 0.21 0.00 0.00 66.02 63.74 1lwx s SER 124 CO -0.01 -0.90 1.21 -2.24 0.41 0.00 0.00 173.24 171.71 1lwx h ASP 125 N 3.44 0.00 -5.30 2.44 3.04 -1.92 -3.45 116.42 114.67 1lwx h ASP 125 Ca -0.50 -0.14 -0.09 0.00 -3.24 0.00 0.00 57.03 53.05 1lwx h ASP 125 Cb 1.23 0.00 -0.10 0.00 -1.04 0.00 0.00 39.33 39.42 1lwx h ASP 125 CO 0.68 0.07 -0.22 -0.94 -2.04 0.00 0.00 179.24 176.79 1lwx s SER 126 N -4.67 -0.04 0.23 4.15 1.04 -1.26 -4.95 113.70 108.20 1lwx s SER 126 Ca 0.04 -0.99 0.25 0.00 0.48 0.00 0.00 55.95 55.73 1lwx s SER 126 Cb 0.12 0.54 0.89 0.00 0.10 0.00 0.00 66.02 67.66 1lwx s SER 126 CO 0.75 -1.06 1.75 0.52 0.98 0.00 0.00 173.24 176.18 1lwx n VAL 127 N -0.34 0.69 0.03 5.02 0.31 -1.26 -1.77 118.33 121.01 1lwx n VAL 127 Ca -0.02 -0.07 -0.19 0.00 -0.01 0.00 0.00 64.34 64.05 1lwx n VAL 127 Cb 0.63 -0.82 -0.12 0.00 -0.91 0.00 0.00 33.84 32.61 1lwx n VAL 127 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1lwx h GLU 128 N 0.00 0.48 0.00 5.55 4.39 -1.97 -2.68 114.58 120.35 1lwx h GLU 128 Ca 0.00 -0.58 -0.04 0.00 0.34 0.00 0.00 59.36 59.08 1lwx h GLU 128 Cb 0.59 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.41 1lwx h GLU 128 CO 0.00 1.22 -0.21 0.77 -1.16 0.00 0.00 179.01 179.63 1lwx h SER 129 N 0.01 0.00 0.05 1.42 0.02 -1.92 -2.29 113.55 110.83 1lwx h SER 129 Ca -0.12 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.66 1lwx h SER 129 Cb 1.55 0.00 0.02 0.00 0.14 0.00 0.00 62.40 64.10 1lwx h SER 129 CO 0.16 0.21 -0.70 0.00 -1.14 0.00 0.00 176.83 175.36 1lwx h ALA 130 N 1.79 0.02 -0.12 3.77 0.00 -1.36 0.48 119.26 123.85 1lwx h ALA 130 Ca -0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 54.91 54.23 1lwx h ALA 130 Cb 0.94 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1lwx h ALA 130 CO 0.03 0.38 -0.21 -0.91 0.00 0.00 0.00 179.25 178.53 1lwx h ASN 131 N -0.17 0.19 0.07 0.00 2.35 -1.53 0.54 115.58 117.04 1lwx h ASN 131 Ca -0.10 -0.05 -0.23 0.00 -0.55 0.00 0.00 56.30 55.37 1lwx h ASN 131 Cb 1.45 -0.05 0.02 0.00 0.05 0.00 0.00 38.32 39.79 1lwx h ASN 131 CO 0.14 0.42 -0.94 -0.09 -1.65 0.00 0.00 177.43 175.30 1lwx h ARG 132 N 0.18 0.51 0.00 0.81 1.12 -1.35 -2.74 114.38 112.91 1lwx h ARG 132 Ca 0.03 -0.64 -0.15 0.00 -1.11 0.00 0.00 59.98 58.10 1lwx h ARG 132 Cb 0.49 0.21 -0.02 0.00 -0.01 0.00 0.00 29.97 30.63 1lwx h ARG 132 CO 0.03 1.26 -0.73 0.93 -3.11 0.00 0.00 179.97 178.35 1lwx h GLU 133 N 0.04 0.00 -0.06 0.20 5.08 0.20 -2.50 114.58 117.55 1lwx h GLU 133 Ca -0.14 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1lwx h GLU 133 Cb 1.65 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.90 1lwx h GLU 133 CO 0.18 0.73 0.02 0.82 -1.00 0.00 0.00 179.01 179.76 1lwx h ILE 134 N 0.00 1.17 0.00 3.13 2.04 0.02 -2.31 117.51 121.56 1lwx h ILE 134 Ca -0.01 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1lwx h ILE 134 Cb 1.35 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1lwx h ILE 134 CO 0.10 0.14 -0.10 0.00 0.00 0.00 0.00 178.15 178.29 1lwx h ALA 135 N 0.82 1.30 -0.08 1.87 0.00 -1.45 -2.47 119.26 119.25 1lwx h ALA 135 Ca 0.02 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1lwx h ALA 135 Cb 0.21 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1lwx h ALA 135 CO -0.00 0.12 -0.61 1.25 0.00 0.00 0.00 179.25 180.01 1lwx h LEU 136 N 0.00 0.68 0.00 0.00 6.46 -0.96 -3.38 115.31 118.12 1lwx h LEU 136 Ca -0.00 -0.67 -0.17 0.00 -0.12 0.00 0.00 57.88 56.92 1lwx h LEU 136 Cb 0.28 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 1lwx h LEU 136 CO 0.01 1.25 -1.85 0.79 -0.62 0.00 0.00 178.44 178.02 1lwx n TRP 137 N -4.15 0.41 -4.41 1.25 7.02 -0.98 -5.00 117.44 111.57 1lwx n TRP 137 Ca -0.09 0.13 -0.24 0.00 -1.02 0.00 0.00 57.50 56.29 1lwx n TRP 137 Cb 0.66 -0.89 -0.09 0.00 -2.42 0.00 0.00 31.31 28.57 1lwx n TRP 137 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1lwx s PHE 138 N -2.99 2.42 0.12 -5.99 0.08 -0.95 -5.13 117.98 105.54 1lwx s PHE 138 Ca -0.06 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.72 1lwx s PHE 138 Cb 0.09 -1.05 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 1lwx s PHE 138 CO 0.84 0.69 0.17 0.15 -0.10 0.00 0.00 175.22 176.98 1lwx s LYS 139 N -3.56 3.14 0.55 0.44 1.02 -1.26 -4.69 119.74 115.38 1lwx s LYS 139 Ca 0.30 -0.67 0.26 0.00 0.02 0.00 0.00 55.97 55.89 1lwx s LYS 139 Cb -0.05 -2.83 1.44 0.00 -0.52 0.00 0.00 37.83 35.87 1lwx s LYS 139 CO 0.17 0.54 2.01 -1.35 -0.92 0.00 0.00 175.35 175.79 1lwx h PRO 140 N 2.70 0.00 -0.01 -1.68 0.11 -1.97 -0.93 132.00 130.21 1lwx h PRO 140 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1lwx h PRO 140 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1lwx h PRO 140 CO 0.68 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.62 1lwx n GLU 141 N -4.22 1.41 -0.27 1.05 0.28 -1.26 -3.69 120.64 113.94 1lwx n GLU 141 Ca 0.08 -0.60 0.11 0.00 -0.16 0.00 0.00 57.16 56.59 1lwx n GLU 141 Cb 0.55 -1.48 0.27 0.00 1.43 0.00 0.00 31.44 32.21 1lwx n GLU 141 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1lwx n GLU 142 N -0.27 2.50 -4.32 3.44 1.02 -0.35 -4.94 120.64 117.72 1lwx n GLU 142 Ca 0.21 -2.30 -0.25 0.00 -0.02 0.00 0.00 57.16 54.79 1lwx n GLU 142 Cb 0.26 -1.51 -0.12 0.00 -0.02 0.00 0.00 31.44 30.04 1lwx n GLU 142 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1lwx s LEU 143 N -1.21 2.32 0.92 -4.62 1.43 -1.24 -4.56 118.68 111.71 1lwx s LEU 143 Ca 0.42 -0.73 -0.13 0.00 -1.03 0.00 0.00 54.13 52.66 1lwx s LEU 143 Cb 0.23 -0.97 0.15 0.00 0.03 0.00 0.00 46.19 45.62 1lwx s LEU 143 CO 0.31 0.08 1.18 -0.76 0.23 0.00 0.00 176.35 177.39 1lwx s LEU 144 N -2.04 2.15 0.23 1.79 1.43 -0.63 -5.04 118.68 116.58 1lwx s LEU 144 Ca 0.10 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 1lwx s LEU 144 Cb -0.10 -3.03 0.00 0.00 0.03 0.00 0.00 46.19 43.09 1lwx s LEU 144 CO 0.05 -2.55 0.00 0.41 0.23 0.00 0.00 176.35 174.49 1lwx n THR 145 N -3.74 0.10 -2.38 5.49 -1.04 -1.26 -4.96 114.28 106.50 1lwx n THR 145 Ca 0.09 0.03 -0.38 0.00 -2.04 0.00 0.00 64.05 61.75 1lwx n THR 145 Cb 0.60 -0.61 -0.03 0.00 -1.82 0.00 0.00 70.33 68.47 1lwx n THR 145 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1lwx s GLU 146 N -2.00 3.10 -0.27 -2.82 2.12 -1.26 -4.93 118.70 112.64 1lwx s GLU 146 Ca 0.00 -0.35 -0.02 0.00 0.36 0.00 0.00 54.97 54.95 1lwx s GLU 146 Cb 0.00 -4.72 0.03 0.00 0.26 0.00 0.00 34.13 29.70 1lwx s GLU 146 CO 0.00 -2.48 -0.03 0.08 -0.54 0.00 0.00 175.26 172.29 1lwx s VAL 147 N 6.85 3.06 -0.49 3.70 1.01 -1.26 -5.07 120.40 128.20 1lwx s VAL 147 Ca 0.50 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 61.47 1lwx s VAL 147 Cb -0.06 -2.60 0.13 0.00 0.00 0.00 0.00 36.38 33.84 1lwx s VAL 147 CO 0.06 0.12 0.24 -0.54 0.00 0.00 0.00 175.10 174.97 1lwx s LYS 148 N 1.34 1.84 0.80 2.72 1.02 -1.26 -5.11 119.74 121.08 1lwx s LYS 148 Ca -0.01 -2.47 -0.13 0.00 0.02 0.00 0.00 55.97 53.38 1lwx s LYS 148 Cb -0.17 -3.18 0.08 0.00 -0.52 0.00 0.00 37.83 34.04 1lwx s LYS 148 CO -0.03 -1.10 1.18 -1.25 -0.92 0.00 0.00 175.35 173.23 1lwx s PRO 149 N -0.10 1.77 0.00 -1.68 0.04 -1.26 -4.82 135.00 128.95 1lwx s PRO 149 Ca 0.16 1.64 -0.39 0.00 0.04 0.00 0.00 61.00 62.45 1lwx s PRO 149 Cb -0.25 -1.80 -0.20 0.00 0.04 0.00 0.00 34.50 32.29 1lwx s PRO 149 CO -0.01 -2.09 1.05 -1.71 0.04 0.00 0.00 177.00 174.28 1lwx n ASN 150 N -3.30 -0.01 0.00 6.66 2.85 -1.26 -4.75 115.26 115.44 1lwx n ASN 150 Ca 0.13 1.14 0.02 0.00 -0.11 0.00 0.00 54.58 55.75 1lwx n ASN 150 Cb 0.51 -0.90 0.09 0.00 1.24 0.00 0.00 39.78 40.72 1lwx n ASN 150 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1lwx n PRO 151 N 1.47 0.06 0.00 1.20 -0.02 -1.26 -2.49 135.00 133.96 1lwx n PRO 151 Ca 0.20 0.19 0.08 0.00 -2.02 0.00 0.00 63.50 61.95 1lwx n PRO 151 Cb 0.08 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.08 1lwx n PRO 151 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1lwx n ASN 152 N -1.21 1.92 0.14 2.55 3.02 -1.26 -4.53 115.26 115.88 1lwx n ASN 152 Ca 0.02 -1.46 -0.25 0.00 -0.03 0.00 0.00 54.58 52.87 1lwx n ASN 152 Cb 0.02 0.31 -0.16 0.00 -0.61 0.00 0.00 39.78 39.35 1lwx n ASN 152 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1lwx h LEU 153 N 2.36 0.82 -9.28 3.41 3.38 -1.84 -3.46 115.31 110.70 1lwx h LEU 153 Ca 0.00 -0.90 -0.67 0.00 0.09 0.00 0.00 57.88 56.40 1lwx h LEU 153 Cb 0.61 -0.27 -0.16 0.00 0.09 0.00 0.00 40.66 40.94 1lwx h LEU 153 CO 0.00 1.71 -0.68 -0.31 0.09 0.00 0.00 178.44 179.25 1lwx s TYR 154 N -2.60 2.95 -2.23 1.13 2.02 -1.26 -5.16 117.35 112.20 1lwx s TYR 154 Ca -0.09 -0.00 0.30 0.00 -0.37 0.00 0.00 57.07 56.90 1lwx s TYR 154 Cb 0.04 -1.62 1.51 0.00 -0.40 0.00 0.00 41.96 41.50 1lwx s TYR 154 CO 0.94 0.41 2.00 -1.91 -1.57 0.00 0.00 175.55 175.43