#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sw0 s PRO 3 N 0.00 2.98 0.10 0.00 0.02 -1.26 -4.94 135.00 131.90 1sw0 s PRO 3 Ca 0.00 1.26 -0.30 0.00 0.02 0.00 0.00 61.00 61.98 1sw0 s PRO 3 Cb 0.00 -1.98 -0.06 0.00 0.02 0.00 0.00 34.50 32.48 1sw0 s PRO 3 CO 0.00 -1.09 1.00 1.03 -0.33 0.00 0.00 177.00 177.61 1sw0 s ARG 4 N -4.23 4.65 0.09 5.54 0.52 -1.26 -4.98 118.95 119.28 1sw0 s ARG 4 Ca 0.64 1.51 -0.31 0.00 -0.52 0.00 0.00 55.73 57.05 1sw0 s ARG 4 Cb -0.18 -3.37 -0.07 0.00 0.52 0.00 0.00 34.95 31.85 1sw0 s ARG 4 CO 0.42 0.13 1.42 0.21 0.02 0.00 0.00 175.30 177.49 1sw0 s LYS 5 N 0.14 4.30 0.29 3.54 2.20 -1.26 -4.95 119.74 123.99 1sw0 s LYS 5 Ca 0.49 2.08 -0.30 0.00 -0.36 0.00 0.00 55.97 57.87 1sw0 s LYS 5 Cb -0.24 -3.34 -0.12 0.00 -1.51 0.00 0.00 37.83 32.62 1sw0 s LYS 5 CO 0.30 -0.49 1.56 0.34 -0.36 0.00 0.00 175.35 176.70 1sw0 n PHE 6 N 4.37 2.75 -4.24 4.03 -0.00 -1.25 -4.84 117.46 118.27 1sw0 n PHE 6 Ca 0.12 0.29 -0.26 0.00 -0.00 0.00 0.00 57.45 57.60 1sw0 n PHE 6 Cb 0.42 -2.57 -0.17 0.00 -0.00 0.00 0.00 39.48 37.16 1sw0 n PHE 6 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.76 176.88 1sw0 s PHE 7 N -0.05 1.51 -0.14 -5.13 2.19 -0.81 -0.58 117.98 114.97 1sw0 s PHE 7 Ca 0.64 -0.67 0.00 0.00 0.33 0.00 0.00 56.93 57.24 1sw0 s PHE 7 Cb -0.52 -1.17 0.02 0.00 -1.31 0.00 0.00 43.02 40.04 1sw0 s PHE 7 CO 0.49 -0.41 -0.13 0.08 1.83 0.00 0.00 175.22 177.09 1sw0 s VAL 8 N 1.18 1.43 -0.07 3.12 1.01 0.29 -2.10 120.40 125.27 1sw0 s VAL 8 Ca -0.05 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 61.38 1sw0 s VAL 8 Cb -0.14 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1sw0 s VAL 8 CO -0.03 0.44 -0.03 -0.83 0.00 0.00 0.00 175.10 174.65 1sw0 s GLY 9 N 1.48 1.78 -0.13 4.51 0.00 0.28 -1.71 107.32 113.53 1sw0 s GLY 9 Ca 0.04 -0.86 -0.02 0.00 0.00 0.00 0.00 44.72 43.87 1sw0 s GLY 9 CO -0.09 -0.65 -0.05 -0.32 0.00 0.00 0.00 173.10 171.99 1sw0 s GLY 10 N -0.93 1.70 -0.36 0.20 0.00 0.57 -0.40 107.32 108.11 1sw0 s GLY 10 Ca 0.14 -0.84 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 1sw0 s GLY 10 CO 0.03 -0.21 0.10 0.21 0.00 0.00 0.00 173.10 173.22 1sw0 s ASN 11 N 0.09 4.99 0.12 1.64 2.47 0.54 0.62 114.94 125.42 1sw0 s ASN 11 Ca -0.01 -1.85 0.22 0.00 0.42 0.00 0.00 52.86 51.63 1sw0 s ASN 11 Cb -0.14 -1.73 0.87 0.00 -1.45 0.00 0.00 41.25 38.80 1sw0 s ASN 11 CO 0.03 -0.41 1.67 0.79 -3.72 0.00 0.00 177.10 175.45 1sw0 n TRP 12 N 4.50 0.43 -4.01 0.43 8.01 -0.86 -4.39 117.44 121.54 1sw0 n TRP 12 Ca -0.04 0.16 0.00 0.00 -1.31 0.00 0.00 57.50 56.31 1sw0 n TRP 12 Cb 0.42 -0.75 0.00 0.00 -2.01 0.00 0.00 31.31 28.97 1sw0 n TRP 12 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1sw0 n LYS 13 N -1.88 0.00 -2.57 -0.99 5.02 -1.26 -2.97 118.16 113.51 1sw0 n LYS 13 Ca 0.04 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 1sw0 n LYS 13 Cb 0.25 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.27 1sw0 n LYS 13 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 1sw0 n MET 14 N 5.44 4.22 -4.06 1.97 0.00 -1.26 -4.28 117.12 119.14 1sw0 n MET 14 Ca 0.00 -4.00 -0.13 0.00 0.00 0.00 0.00 57.70 53.57 1sw0 n MET 14 Cb 0.00 -2.70 -0.12 0.00 0.00 0.00 0.00 33.22 30.40 1sw0 n MET 14 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1sw0 s ASN 15 N -0.39 0.69 0.00 6.12 0.01 -1.16 -5.14 114.94 115.07 1sw0 s ASN 15 Ca 0.38 -0.45 0.00 0.00 -0.71 0.00 0.00 52.86 52.07 1sw0 s ASN 15 Cb 0.10 0.03 0.00 0.00 0.41 0.00 0.00 41.25 41.79 1sw0 s ASN 15 CO 0.02 -0.17 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 1sw0 n GLY 16 N 1.76 2.92 3.30 0.66 0.00 -1.26 -4.79 105.19 107.78 1sw0 n GLY 16 Ca -0.21 -1.94 -0.22 0.00 0.00 0.00 0.00 46.02 43.65 1sw0 n GLY 16 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1sw0 n ASP 17 N 0.00 -0.14 -0.23 1.61 5.68 -1.26 -4.96 116.55 117.25 1sw0 n ASP 17 Ca 0.00 -3.22 0.00 0.00 -0.50 0.00 0.00 54.79 51.07 1sw0 n ASP 17 Cb 0.00 1.51 0.12 0.00 -1.14 0.00 0.00 41.12 41.61 1sw0 n ASP 17 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1sw0 h LYS 18 N 0.00 0.60 0.44 0.11 1.57 -1.99 0.12 116.57 117.41 1sw0 h LYS 18 Ca -0.26 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 1sw0 h LYS 18 Cb 1.22 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1sw0 h LYS 18 CO 0.40 0.40 -0.21 -0.22 -0.57 0.00 0.00 179.45 179.24 1sw0 h LYS 19 N 0.62 -0.57 -0.40 3.15 3.64 -1.98 -0.24 116.57 120.78 1sw0 h LYS 19 Ca 0.33 0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.59 1sw0 h LYS 19 Cb 0.30 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1sw0 h LYS 19 CO -0.24 -0.30 -0.34 0.66 -2.27 0.00 0.00 179.45 176.96 1sw0 h SER 20 N -0.77 0.99 -0.23 4.20 4.64 -1.91 -1.40 113.55 119.07 1sw0 h SER 20 Ca -0.06 -0.43 -0.11 0.00 -0.47 0.00 0.00 61.79 60.72 1sw0 h SER 20 Cb 0.54 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1sw0 h SER 20 CO 0.10 1.23 -0.22 -0.07 -0.87 0.00 0.00 176.83 177.00 1sw0 h LEU 21 N 0.78 0.69 -0.57 5.97 4.07 -0.82 -2.20 115.31 123.22 1sw0 h LEU 21 Ca 0.07 -0.24 0.04 0.00 0.08 0.00 0.00 57.88 57.84 1sw0 h LEU 21 Cb 0.93 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 42.44 1sw0 h LEU 21 CO 0.09 0.90 0.32 1.23 -1.08 0.00 0.00 178.44 179.89 1sw0 h GLY 22 N 0.98 0.81 0.97 0.83 0.00 -0.74 -1.12 103.07 104.81 1sw0 h GLY 22 Ca 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1sw0 h GLY 22 CO 0.05 0.16 0.23 0.83 0.00 0.00 0.00 176.54 177.81 1sw0 h GLU 23 N 0.61 0.63 -0.79 4.80 5.08 -1.03 -1.44 114.58 122.43 1sw0 h GLU 23 Ca 0.25 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1sw0 h GLU 23 Cb 0.11 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1sw0 h GLU 23 CO -0.15 0.52 0.49 1.25 -1.00 0.00 0.00 179.01 180.12 1sw0 h LEU 24 N 0.57 0.94 -0.31 1.33 5.85 -1.06 -1.59 115.31 121.05 1sw0 h LEU 24 Ca 0.15 -0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 1sw0 h LEU 24 Cb 0.09 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1sw0 h LEU 24 CO -0.02 0.72 -0.26 0.40 -0.34 0.00 0.00 178.44 178.94 1sw0 h ILE 25 N 1.08 1.30 -0.44 4.05 2.04 -1.12 -1.60 117.51 122.82 1sw0 h ILE 25 Ca 0.29 -1.42 0.08 0.00 1.00 0.00 0.00 64.86 64.81 1sw0 h ILE 25 Cb -0.06 1.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.46 1sw0 h ILE 25 CO -0.06 0.46 -0.02 -0.74 0.00 0.00 0.00 178.15 177.79 1sw0 h HIS 26 N 0.48 -0.07 -0.19 1.37 2.76 -1.02 -0.38 115.15 118.10 1sw0 h HIS 26 Ca 0.05 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1sw0 h HIS 26 Cb 0.82 0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.86 1sw0 h HIS 26 CO 0.07 -0.12 0.02 1.15 -1.30 0.00 0.00 177.93 177.75 1sw0 h THR 27 N 0.08 0.89 -0.78 6.26 2.02 -0.98 -2.31 112.91 118.09 1sw0 h THR 27 Ca 0.22 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.33 1sw0 h THR 27 Cb 0.32 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 1sw0 h THR 27 CO -0.38 0.02 0.35 -0.07 0.37 0.00 0.00 175.52 175.80 1sw0 h LEU 28 N 0.08 1.04 -1.30 2.58 3.38 -0.72 -1.93 115.31 118.45 1sw0 h LEU 28 Ca 0.09 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1sw0 h LEU 28 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1sw0 h LEU 28 CO -0.13 0.91 0.09 0.78 0.09 0.00 0.00 178.44 180.17 1sw0 h ASN 29 N 1.11 0.52 0.97 -0.43 2.35 -0.93 -2.95 115.58 116.23 1sw0 h ASN 29 Ca 0.26 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1sw0 h ASN 29 Cb 0.16 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1sw0 h ASN 29 CO -0.03 0.53 -0.47 0.61 -1.65 0.00 0.00 177.43 176.42 1sw0 n GLY 30 N -1.04 -1.47 3.83 2.83 0.00 -0.88 -4.94 105.19 103.52 1sw0 n GLY 30 Ca 0.02 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 1sw0 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sw0 s ALA 31 N -3.14 2.80 -0.74 4.61 0.00 -0.77 -4.99 121.76 119.54 1sw0 s ALA 31 Ca 0.08 0.04 -0.22 0.00 0.00 0.00 0.00 51.96 51.86 1sw0 s ALA 31 Cb 0.14 -3.15 0.08 0.00 0.00 0.00 0.00 23.12 20.19 1sw0 s ALA 31 CO 0.69 -1.08 1.02 0.21 0.00 0.00 0.00 175.76 176.60 1sw0 s LYS 32 N -5.08 3.24 -0.09 0.00 2.20 -1.26 -5.02 119.74 113.72 1sw0 s LYS 32 Ca 0.57 -1.06 -0.07 0.00 -0.36 0.00 0.00 55.97 55.06 1sw0 s LYS 32 Cb -0.13 -4.43 -0.04 0.00 -1.51 0.00 0.00 37.83 31.72 1sw0 s LYS 32 CO 0.55 -1.82 0.17 -0.51 -0.36 0.00 0.00 175.35 173.38 1sw0 s LEU 33 N 3.79 4.39 0.25 5.43 1.43 -1.26 -5.00 118.68 127.72 1sw0 s LEU 33 Ca 0.25 0.50 -0.31 0.00 -1.03 0.00 0.00 54.13 53.55 1sw0 s LEU 33 Cb -0.13 -2.21 -0.13 0.00 0.03 0.00 0.00 46.19 43.74 1sw0 s LEU 33 CO 0.05 0.38 1.33 -0.24 0.23 0.00 0.00 176.35 178.10 1sw0 n SER 34 N 1.78 2.49 0.27 2.29 2.88 -1.26 -4.89 113.62 117.18 1sw0 n SER 34 Ca -0.18 1.16 0.14 0.00 -1.33 0.00 0.00 58.87 58.65 1sw0 n SER 34 Cb 0.54 -1.40 0.78 0.00 -0.75 0.00 0.00 64.21 63.38 1sw0 n SER 34 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sw0 h ALA 35 N 3.68 1.32 -0.59 -1.46 0.00 -1.99 -3.01 119.26 117.21 1sw0 h ALA 35 Ca -0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1sw0 h ALA 35 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1sw0 h ALA 35 CO 0.72 0.11 0.00 -0.25 0.00 0.00 0.00 179.25 179.83 1sw0 n ASP 36 N -3.66 5.24 -4.42 0.00 10.43 -1.26 -4.88 116.55 118.00 1sw0 n ASP 36 Ca -0.02 -2.72 -0.33 0.00 2.57 0.00 0.00 54.79 54.29 1sw0 n ASP 36 Cb 0.20 -0.64 -0.14 0.00 1.84 0.00 0.00 41.12 42.38 1sw0 n ASP 36 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1sw0 s THR 37 N -2.37 3.17 -0.28 -3.53 2.01 -1.14 -3.89 115.64 109.62 1sw0 s THR 37 Ca 0.52 -0.63 -0.19 0.00 0.31 0.00 0.00 61.69 61.70 1sw0 s THR 37 Cb 0.37 -2.32 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 1sw0 s THR 37 CO 0.19 0.54 0.56 -0.70 -0.69 0.00 0.00 174.62 174.51 1sw0 s GLU 38 N 0.07 3.99 -0.10 4.92 2.12 0.26 -4.93 118.70 125.03 1sw0 s GLU 38 Ca -0.05 0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.60 1sw0 s GLU 38 Cb -0.14 -3.68 -0.02 0.00 0.26 0.00 0.00 34.13 30.54 1sw0 s GLU 38 CO 0.04 -0.44 -0.13 0.08 -0.54 0.00 0.00 175.26 174.27 1sw0 s VAL 39 N 2.41 3.11 -0.02 3.70 1.01 -1.26 -0.55 120.40 128.80 1sw0 s VAL 39 Ca 0.22 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1sw0 s VAL 39 Cb -0.15 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.96 1sw0 s VAL 39 CO 0.10 0.55 -0.07 -0.69 0.00 0.00 0.00 175.10 174.99 1sw0 s VAL 40 N -0.09 0.63 -0.15 2.92 1.01 -0.69 -0.77 120.40 123.26 1sw0 s VAL 40 Ca -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 1sw0 s VAL 40 Cb -0.14 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 1sw0 s VAL 40 CO 0.04 0.21 -0.12 0.00 0.00 0.00 0.00 175.10 175.22 1sw0 s GLY 42 N 0.61 2.02 0.20 0.00 0.00 0.20 -1.13 107.32 109.23 1sw0 s GLY 42 Ca -0.07 -1.94 -0.02 0.00 0.00 0.00 0.00 44.72 42.69 1sw0 s GLY 42 CO 0.03 0.99 0.41 0.00 0.00 0.00 0.00 173.10 174.52 1sw0 s ALA 43 N 1.64 3.80 0.50 3.20 0.00 -0.91 -2.03 121.76 127.96 1sw0 s ALA 43 Ca 0.04 -0.75 -0.21 0.00 0.00 0.00 0.00 51.96 51.04 1sw0 s ALA 43 Cb -0.22 -2.06 -0.08 0.00 0.00 0.00 0.00 23.12 20.76 1sw0 s ALA 43 CO 0.08 0.46 0.90 -2.30 0.00 0.00 0.00 175.76 174.89 1sw0 n PRO 44 N -0.55 1.04 -0.28 0.00 -0.02 -1.26 -4.25 135.00 129.67 1sw0 n PRO 44 Ca -0.04 0.38 0.05 0.00 -2.02 0.00 0.00 63.50 61.88 1sw0 n PRO 44 Cb 0.53 -2.00 0.27 0.00 -0.02 0.00 0.00 33.50 32.27 1sw0 n PRO 44 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1sw0 h SER 45 N 0.97 0.85 0.21 2.55 4.64 -1.96 -1.04 113.55 119.77 1sw0 h SER 45 Ca -0.46 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1sw0 h SER 45 Cb 1.36 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1sw0 h SER 45 CO 0.53 0.54 0.00 -0.29 -0.87 0.00 0.00 176.83 176.74 1sw0 h ILE 46 N 0.96 0.00 -0.14 0.95 2.10 -2.03 -2.84 117.51 116.51 1sw0 h ILE 46 Ca 0.39 -0.10 0.00 0.00 1.08 0.00 0.00 64.86 66.22 1sw0 h ILE 46 Cb 0.25 1.09 0.00 0.00 -1.09 0.00 0.00 36.82 37.08 1sw0 h ILE 46 CO -0.15 0.00 0.00 -1.22 -1.08 0.00 0.00 178.15 175.70 1sw0 n TYR 47 N -3.06 0.18 -0.23 2.19 0.53 -0.43 -4.69 117.16 111.65 1sw0 n TYR 47 Ca -0.02 -0.32 -0.03 0.00 -1.02 0.00 0.00 57.90 56.50 1sw0 n TYR 47 Cb 0.12 -0.02 0.07 0.00 -1.03 0.00 0.00 39.34 38.48 1sw0 n TYR 47 CO 0.00 0.00 0.00 -0.07 -1.02 0.00 0.00 176.86 175.77 1sw0 h LEU 48 N 1.28 0.66 0.14 7.72 4.07 -1.22 0.26 115.31 128.22 1sw0 h LEU 48 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.96 1sw0 h LEU 48 Cb 0.52 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1sw0 h LEU 48 CO 0.00 0.46 -0.07 -0.78 -1.08 0.00 0.00 178.44 176.97 1sw0 h ASP 49 N 0.80 -0.16 -0.42 -0.43 -0.00 -1.83 -0.68 116.42 113.69 1sw0 h ASP 49 Ca 0.27 -0.22 0.09 0.00 -0.00 0.00 0.00 57.03 57.17 1sw0 h ASP 49 Cb 0.04 0.04 -0.09 0.00 -0.00 0.00 0.00 39.33 39.32 1sw0 h ASP 49 CO -0.11 0.14 -0.18 0.15 -0.00 0.00 0.00 179.24 179.23 1sw0 h PHE 50 N -0.46 -0.44 -0.45 0.28 3.04 -1.86 -1.14 116.94 115.90 1sw0 h PHE 50 Ca -0.02 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.98 1sw0 h PHE 50 Cb 0.37 0.26 -0.02 0.00 2.56 0.00 0.00 35.95 39.11 1sw0 h PHE 50 CO 0.02 -0.26 0.29 0.00 -2.02 0.00 0.00 178.31 176.34 1sw0 h ALA 51 N 1.22 0.57 -0.33 2.41 0.00 -0.73 -1.98 119.26 120.44 1sw0 h ALA 51 Ca 0.20 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1sw0 h ALA 51 Cb 0.41 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1sw0 h ALA 51 CO -0.49 0.03 -0.10 -0.09 0.00 0.00 0.00 179.25 178.61 1sw0 h ARG 52 N 0.61 0.55 -0.65 0.00 9.65 -0.73 -1.05 114.38 122.76 1sw0 h ARG 52 Ca 0.16 -0.15 -0.08 0.00 -1.10 0.00 0.00 59.98 58.81 1sw0 h ARG 52 Cb -0.06 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1sw0 h ARG 52 CO -0.03 0.65 0.09 1.96 2.80 0.00 0.00 179.97 185.43 1sw0 h GLN 53 N 0.51 1.07 0.09 0.20 4.20 -0.76 -3.33 115.11 117.11 1sw0 h GLN 53 Ca 0.10 -0.29 -0.33 0.00 0.06 0.00 0.00 58.65 58.18 1sw0 h GLN 53 Cb 0.48 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1sw0 h GLN 53 CO 0.03 0.99 -1.80 0.87 -0.67 0.00 0.00 178.83 178.25 1sw0 h LYS 54 N 1.00 0.20 -6.85 1.46 1.79 -1.18 -3.47 116.57 109.52 1sw0 h LYS 54 Ca 0.20 -0.34 -0.51 0.00 -2.18 0.00 0.00 60.65 57.81 1sw0 h LYS 54 Cb 0.45 0.13 0.04 0.00 -1.58 0.00 0.00 32.23 31.27 1sw0 h LYS 54 CO 0.02 1.00 0.55 -0.51 -1.08 0.00 0.00 179.45 179.43 1sw0 s LEU 55 N -6.79 4.48 0.12 2.94 1.43 -0.42 -4.97 118.68 115.48 1sw0 s LEU 55 Ca -0.14 2.47 -0.35 0.00 -1.03 0.00 0.00 54.13 55.08 1sw0 s LEU 55 Cb 0.07 -3.66 -0.17 0.00 0.03 0.00 0.00 46.19 42.46 1sw0 s LEU 55 CO 0.81 -0.35 1.09 -0.67 0.23 0.00 0.00 176.35 177.46 1sw0 n ASP 56 N 0.95 0.73 0.10 2.29 -0.08 -1.26 -4.85 116.55 114.43 1sw0 n ASP 56 Ca -0.00 1.14 0.13 0.00 -1.51 0.00 0.00 54.79 54.55 1sw0 n ASP 56 Cb 0.43 -1.10 0.64 0.00 2.34 0.00 0.00 41.12 43.43 1sw0 n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sw0 h ALA 57 N 3.18 2.21 0.00 -1.67 0.00 -1.93 -1.55 119.26 119.50 1sw0 h ALA 57 Ca -0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 1sw0 h ALA 57 Cb 1.38 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1sw0 h ALA 57 CO 0.68 -0.29 -0.03 1.57 0.00 0.00 0.00 179.25 181.18 1sw0 h LYS 58 N 0.06 0.00 -5.59 0.00 2.10 -1.99 -3.40 116.57 107.75 1sw0 h LYS 58 Ca 0.14 0.00 -0.59 0.00 -2.00 0.00 0.00 60.65 58.20 1sw0 h LYS 58 Cb 0.49 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 31.72 1sw0 h LYS 58 CO -0.01 0.03 -0.10 0.42 -2.00 0.00 0.00 179.45 177.79 1sw0 s ILE 59 N -4.36 5.15 0.64 0.07 1.01 -0.58 -4.71 121.20 118.41 1sw0 s ILE 59 Ca -0.04 0.91 -0.10 0.00 0.00 0.00 0.00 60.65 61.42 1sw0 s ILE 59 Cb 0.14 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 1sw0 s ILE 59 CO 0.53 0.24 1.02 -0.83 0.00 0.00 0.00 174.94 175.90 1sw0 s GLY 60 N 0.93 1.62 -0.08 6.18 0.00 0.05 -4.82 107.32 111.22 1sw0 s GLY 60 Ca 0.24 -0.30 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1sw0 s GLY 60 CO 0.10 -0.00 -0.19 0.14 0.00 0.00 0.00 173.10 173.14 1sw0 s VAL 61 N -3.18 1.63 0.02 1.40 1.01 -1.26 -0.60 120.40 119.41 1sw0 s VAL 61 Ca 0.55 -0.78 0.09 0.00 0.00 0.00 0.00 61.98 61.84 1sw0 s VAL 61 Cb -0.11 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1sw0 s VAL 61 CO 0.51 0.46 -0.26 0.00 0.00 0.00 0.00 175.10 175.82 1sw0 s ALA 62 N 0.40 2.25 0.65 5.51 0.00 -0.28 -1.79 121.76 128.50 1sw0 s ALA 62 Ca -0.15 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.47 1sw0 s ALA 62 Cb -0.16 -0.52 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 1sw0 s ALA 62 CO 0.06 0.53 1.05 0.00 0.00 0.00 0.00 175.76 177.41 1sw0 s ALA 63 N -0.75 2.75 -2.57 0.00 0.00 -0.49 -2.14 121.76 118.55 1sw0 s ALA 63 Ca 0.11 0.16 0.25 0.00 0.00 0.00 0.00 51.96 52.49 1sw0 s ALA 63 Cb -0.10 -3.18 0.46 0.00 0.00 0.00 0.00 23.12 20.30 1sw0 s ALA 63 CO 0.01 -1.02 1.40 1.04 0.00 0.00 0.00 175.76 177.20 1sw0 n GLN 64 N -2.72 1.80 -3.64 0.00 6.02 -1.26 -0.95 117.38 116.63 1sw0 n GLN 64 Ca 0.08 -1.35 -0.02 0.00 -0.01 0.00 0.00 57.00 55.69 1sw0 n GLN 64 Cb 0.53 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.30 1sw0 n GLN 64 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1sw0 s ASN 65 N -2.13 -0.01 0.35 1.08 2.47 -1.23 -4.64 114.94 110.83 1sw0 s ASN 65 Ca 0.29 0.00 -0.11 0.00 0.42 0.00 0.00 52.86 53.46 1sw0 s ASN 65 Cb 0.20 0.01 0.03 0.00 -1.45 0.00 0.00 41.25 40.04 1sw0 s ASN 65 CO 0.38 -0.02 0.64 0.00 -3.72 0.00 0.00 177.10 174.38 1sw0 n TYR 67 N -0.53 -1.58 0.04 0.00 9.36 0.21 -4.95 117.16 119.70 1sw0 n TYR 67 Ca -0.04 -0.84 0.07 0.00 3.32 0.00 0.00 57.90 60.41 1sw0 n TYR 67 Cb 0.61 -0.18 0.15 0.00 -0.63 0.00 0.00 39.34 39.29 1sw0 n TYR 67 CO 0.00 0.00 0.00 0.36 0.22 0.00 0.00 176.86 177.44 1sw0 n LYS 68 N -1.11 2.25 -4.12 2.98 2.85 -1.26 -4.57 118.16 115.19 1sw0 n LYS 68 Ca 0.01 -1.94 -0.08 0.00 -1.05 0.00 0.00 58.31 55.25 1sw0 n LYS 68 Cb 0.23 -1.32 -0.10 0.00 -0.65 0.00 0.00 35.03 33.18 1sw0 n LYS 68 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1sw0 s VAL 69 N -1.06 0.31 0.26 0.58 0.11 -1.26 -4.80 120.40 114.53 1sw0 s VAL 69 Ca 0.26 -1.85 0.11 0.00 -2.93 0.00 0.00 61.98 57.57 1sw0 s VAL 69 Cb 0.14 -1.63 -0.02 0.00 -1.53 0.00 0.00 36.38 33.34 1sw0 s VAL 69 CO 0.20 -0.89 1.61 -0.65 -3.33 0.00 0.00 175.10 172.03 1sw0 h PRO 70 N 3.07 0.00 -3.18 1.54 0.11 -1.98 -3.43 132.00 128.12 1sw0 h PRO 70 Ca -0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 1sw0 h PRO 70 Cb 1.15 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.15 1sw0 h PRO 70 CO 0.65 0.61 0.09 -1.59 -0.21 0.00 0.00 178.00 177.55 1sw0 s LYS 71 N -3.59 1.29 0.00 1.05 -2.85 -1.26 -4.72 119.74 109.66 1sw0 s LYS 71 Ca -0.01 -0.67 0.00 0.00 -1.00 0.00 0.00 55.97 54.29 1sw0 s LYS 71 Cb 0.12 0.54 0.00 0.00 -2.06 0.00 0.00 37.83 36.44 1sw0 s LYS 71 CO 0.76 -0.55 0.00 0.41 0.10 0.00 0.00 175.35 176.07 1sw0 n GLY 72 N -0.34 0.49 2.79 0.59 0.00 -1.26 -4.98 105.19 102.48 1sw0 n GLY 72 Ca -0.14 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 1sw0 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sw0 n ALA 73 N -0.73 5.64 -3.59 4.61 0.00 -1.26 -4.75 120.51 120.43 1sw0 n ALA 73 Ca 0.00 -4.26 -0.27 0.00 0.00 0.00 0.00 53.44 48.91 1sw0 n ALA 73 Cb 0.00 -2.96 -0.10 0.00 0.00 0.00 0.00 19.45 16.38 1sw0 n ALA 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1sw0 n PHE 74 N 3.55 1.78 -1.67 0.00 3.72 -1.26 -5.09 117.46 118.49 1sw0 n PHE 74 Ca 0.44 -3.93 -0.47 0.00 -0.05 0.00 0.00 57.45 53.44 1sw0 n PHE 74 Cb 0.34 -0.34 -0.05 0.00 -0.94 0.00 0.00 39.48 38.50 1sw0 n PHE 74 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1sw0 n THR 75 N 1.93 0.15 -0.19 4.37 -1.04 -1.26 -1.78 114.28 116.46 1sw0 n THR 75 Ca 0.25 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1sw0 n THR 75 Cb 0.42 -1.54 0.00 0.00 -1.82 0.00 0.00 70.33 67.38 1sw0 n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sw0 n GLY 76 N 3.59 0.91 3.85 3.41 0.00 -1.26 -5.07 105.19 110.63 1sw0 n GLY 76 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1sw0 n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sw0 s GLU 77 N -0.62 3.06 0.16 1.61 0.41 -0.73 -5.14 118.70 117.45 1sw0 s GLU 77 Ca 0.00 -0.90 0.09 0.00 -0.41 0.00 0.00 54.97 53.75 1sw0 s GLU 77 Cb 0.00 -2.69 -0.04 0.00 -1.78 0.00 0.00 34.13 29.62 1sw0 s GLU 77 CO 0.00 0.44 -0.19 0.96 -0.49 0.00 0.00 175.26 175.98 1sw0 s ILE 78 N -1.95 1.87 0.25 -1.63 -4.36 -1.26 -5.01 121.20 109.11 1sw0 s ILE 78 Ca 0.33 -1.90 0.09 0.00 -0.26 0.00 0.00 60.65 58.91 1sw0 s ILE 78 Cb -0.09 -1.85 -0.04 0.00 1.25 0.00 0.00 42.46 41.72 1sw0 s ILE 78 CO 0.26 -0.27 0.01 -0.94 0.24 0.00 0.00 174.94 174.24 1sw0 s SER 79 N -2.60 4.67 0.45 4.36 1.04 -1.26 -0.62 113.70 119.74 1sw0 s SER 79 Ca 0.16 -0.57 0.19 0.00 0.48 0.00 0.00 55.95 56.21 1sw0 s SER 79 Cb -0.06 -0.92 1.16 0.00 0.10 0.00 0.00 66.02 66.30 1sw0 s SER 79 CO 0.07 0.01 1.91 -0.65 0.98 0.00 0.00 173.24 175.56 1sw0 h PRO 80 N 1.98 0.29 -0.78 4.02 0.11 -1.83 -2.29 132.00 133.51 1sw0 h PRO 80 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1sw0 h PRO 80 Cb 1.24 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1sw0 h PRO 80 CO 0.60 0.20 0.43 0.00 -0.21 0.00 0.00 178.00 179.02 1sw0 h ALA 81 N 1.64 1.30 -0.39 -0.75 0.00 -1.92 -1.24 119.26 117.91 1sw0 h ALA 81 Ca 0.38 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 1sw0 h ALA 81 Cb 1.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1sw0 h ALA 81 CO -0.10 0.57 -0.25 0.52 0.00 0.00 0.00 179.25 179.99 1sw0 h MET 82 N 1.08 0.79 -0.37 0.00 2.86 -1.74 -2.02 114.93 115.53 1sw0 h MET 82 Ca 0.28 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1sw0 h MET 82 Cb 0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1sw0 h MET 82 CO -0.05 0.96 -0.11 0.82 1.06 0.00 0.00 176.91 179.59 1sw0 h ILE 83 N 0.68 1.28 -0.24 -1.22 2.04 -1.25 -2.37 117.51 116.44 1sw0 h ILE 83 Ca 0.09 -1.21 -0.09 0.00 1.00 0.00 0.00 64.86 64.66 1sw0 h ILE 83 Cb 0.78 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1sw0 h ILE 83 CO 0.06 0.40 -0.22 0.50 0.00 0.00 0.00 178.15 178.89 1sw0 h LYS 84 N 0.53 0.44 -0.44 2.37 3.64 -1.25 -2.55 116.57 119.32 1sw0 h LYS 84 Ca 0.09 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 1sw0 h LYS 84 Cb 0.64 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.40 1sw0 h LYS 84 CO 0.04 0.64 0.12 0.22 -2.27 0.00 0.00 179.45 178.20 1sw0 h ASP 85 N 0.40 0.59 -0.05 4.20 3.58 -0.84 -1.81 116.42 122.49 1sw0 h ASP 85 Ca 0.06 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1sw0 h ASP 85 Cb 0.61 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.50 1sw0 h ASP 85 CO 0.04 0.58 0.00 2.30 -2.88 0.00 0.00 179.24 179.29 1sw0 n ILE 86 N -4.32 0.05 -0.16 2.25 -6.64 -1.07 -4.95 119.36 104.51 1sw0 n ILE 86 Ca 0.03 -0.32 0.00 0.00 -1.77 0.00 0.00 62.75 60.69 1sw0 n ILE 86 Cb 0.19 0.66 0.00 0.00 -1.44 0.00 0.00 39.64 39.05 1sw0 n ILE 86 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1sw0 n GLY 87 N 1.21 0.72 3.78 3.28 0.00 -0.68 -4.88 105.19 108.62 1sw0 n GLY 87 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1sw0 n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sw0 s ALA 88 N -2.20 2.71 0.00 4.61 0.00 -0.98 -4.86 121.76 121.05 1sw0 s ALA 88 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.74 1sw0 s ALA 88 Cb 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1sw0 s ALA 88 CO 0.00 -0.72 0.30 0.00 0.00 0.00 0.00 175.76 175.33 1sw0 n ALA 89 N -1.30 2.10 -2.39 0.00 0.00 -0.74 -4.17 120.51 114.02 1sw0 n ALA 89 Ca 0.11 -0.30 -0.10 0.00 0.00 0.00 0.00 53.44 53.15 1sw0 n ALA 89 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 1sw0 n ALA 89 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1sw0 s TRP 90 N -0.30 0.71 0.01 0.00 0.52 -1.13 -0.70 118.94 118.04 1sw0 s TRP 90 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 56.10 55.31 1sw0 s TRP 90 Cb 0.00 -0.44 -0.01 0.00 -1.15 0.00 0.00 33.47 31.88 1sw0 s TRP 90 CO 0.00 -0.18 -0.02 0.54 0.02 0.00 0.00 176.95 177.30 1sw0 s VAL 91 N -2.97 0.14 -0.17 4.03 0.11 -0.41 -1.40 120.40 119.73 1sw0 s VAL 91 Ca 0.03 -0.38 -0.19 0.00 -2.93 0.00 0.00 61.98 58.51 1sw0 s VAL 91 Cb 0.01 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.65 1sw0 s VAL 91 CO -0.04 -0.16 0.54 -0.63 -3.33 0.00 0.00 175.10 171.48 1sw0 s ILE 92 N -0.54 5.11 -0.02 7.04 1.01 -0.12 -1.39 121.20 132.29 1sw0 s ILE 92 Ca -0.05 1.02 0.05 0.00 0.00 0.00 0.00 60.65 61.67 1sw0 s ILE 92 Cb -0.04 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.56 1sw0 s ILE 92 CO -0.00 0.21 -0.16 -0.76 0.00 0.00 0.00 174.94 174.22 1sw0 s LEU 93 N 1.40 2.01 0.00 2.97 1.43 -0.08 -3.48 118.68 122.92 1sw0 s LEU 93 Ca 0.26 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1sw0 s LEU 93 Cb -0.16 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.24 1sw0 s LEU 93 CO 0.10 0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.48 1sw0 n GLY 94 N 2.75 0.49 3.76 -3.19 0.00 -1.26 -1.34 105.19 106.40 1sw0 n GLY 94 Ca -0.15 -0.91 -0.37 0.00 0.00 0.00 0.00 46.02 44.60 1sw0 n GLY 94 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1sw0 s HIS 95 N -2.00 2.65 0.32 1.61 2.46 -1.26 -4.40 115.29 114.66 1sw0 s HIS 95 Ca 0.00 1.51 0.08 0.00 0.47 0.00 0.00 55.06 57.12 1sw0 s HIS 95 Cb 0.00 -3.44 0.91 0.00 -0.13 0.00 0.00 32.58 29.92 1sw0 s HIS 95 CO 0.00 -1.87 1.64 1.03 -2.47 0.00 0.00 174.74 173.07 1sw0 h SER 96 N 1.54 0.16 -0.30 9.88 0.87 -1.94 0.64 113.55 124.40 1sw0 h SER 96 Ca -0.50 0.21 -0.10 0.00 -1.23 0.00 0.00 61.79 60.17 1sw0 h SER 96 Cb 1.27 0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 63.46 1sw0 h SER 96 CO 0.58 -0.20 -0.16 -0.33 -0.53 0.00 0.00 176.83 176.19 1sw0 h GLU 97 N 0.21 0.74 -0.50 2.24 5.08 -1.98 -1.00 114.58 119.37 1sw0 h GLU 97 Ca 0.65 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.70 1sw0 h GLU 97 Cb 1.43 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 1sw0 h GLU 97 CO -0.68 0.86 0.14 0.00 -1.00 0.00 0.00 179.01 178.33 1sw0 h ARG 98 N 0.67 0.79 0.06 2.33 2.47 -1.26 -1.28 114.38 118.15 1sw0 h ARG 98 Ca 0.11 -0.18 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1sw0 h ARG 98 Cb 0.64 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1sw0 h ARG 98 CO 0.05 0.75 -0.03 0.00 0.56 0.00 0.00 179.97 181.30 1sw0 h ARG 99 N 0.68 -0.08 0.00 0.04 3.08 -0.99 -1.57 114.38 115.55 1sw0 h ARG 99 Ca 0.16 0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.10 1sw0 h ARG 99 Cb 0.31 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1sw0 h ARG 99 CO -0.00 0.22 -2.05 0.72 -1.07 0.00 0.00 179.97 177.78 1sw0 n HIS 100 N -4.99 0.00 -0.07 3.04 8.25 -0.41 -2.25 115.22 118.79 1sw0 n HIS 100 Ca -0.08 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.17 1sw0 n HIS 100 Cb 0.18 -0.62 -0.13 0.00 1.12 0.00 0.00 29.99 30.54 1sw0 n HIS 100 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1sw0 n VAL 101 N -2.37 1.63 0.80 1.59 0.31 -0.50 -4.59 118.33 115.19 1sw0 n VAL 101 Ca -0.12 -0.54 0.10 0.00 -0.01 0.00 0.00 64.34 63.76 1sw0 n VAL 101 Cb 0.72 -1.66 0.08 0.00 -0.91 0.00 0.00 33.84 32.07 1sw0 n VAL 101 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1sw0 n PHE 102 N -3.55 0.00 -1.47 3.52 3.72 -1.09 -5.01 117.46 113.58 1sw0 n PHE 102 Ca -0.39 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 56.98 1sw0 n PHE 102 Cb 0.98 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.51 1sw0 n PHE 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sw0 n GLY 103 N 1.08 0.47 3.67 1.37 0.00 -0.67 -4.94 105.19 106.17 1sw0 n GLY 103 Ca 0.11 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 1sw0 n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sw0 s GLU 104 N -3.00 4.28 0.67 1.61 2.02 -0.74 -4.97 118.70 118.57 1sw0 s GLU 104 Ca 0.00 1.70 -0.10 0.00 0.02 0.00 0.00 54.97 56.60 1sw0 s GLU 104 Cb 0.00 -3.67 0.01 0.00 0.10 0.00 0.00 34.13 30.57 1sw0 s GLU 104 CO 0.00 -0.59 1.04 -1.54 0.02 0.00 0.00 175.26 174.18 1sw0 s SER 105 N 1.81 5.55 0.40 -0.19 1.04 -1.26 -4.43 113.70 116.62 1sw0 s SER 105 Ca 0.56 1.04 0.07 0.00 0.48 0.00 0.00 55.95 58.10 1sw0 s SER 105 Cb -0.24 -1.91 0.82 0.00 0.10 0.00 0.00 66.02 64.79 1sw0 s SER 105 CO 0.19 -1.22 2.02 0.44 0.98 0.00 0.00 173.24 175.65 1sw0 h ASP 106 N -0.49 0.45 -0.36 7.02 3.32 -1.99 -1.36 116.42 123.01 1sw0 h ASP 106 Ca -0.45 -0.03 -0.13 0.00 0.02 0.00 0.00 57.03 56.44 1sw0 h ASP 106 Cb 1.25 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 1sw0 h ASP 106 CO 0.63 0.37 -0.30 1.05 -1.72 0.00 0.00 179.24 179.27 1sw0 h GLU 107 N 0.51 0.84 -0.22 3.56 4.11 -1.95 -0.86 114.58 120.57 1sw0 h GLU 107 Ca 0.13 -0.42 -0.00 0.00 0.07 0.00 0.00 59.36 59.14 1sw0 h GLU 107 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1sw0 h GLU 107 CO -0.02 1.06 0.13 1.25 0.07 0.00 0.00 179.01 181.50 1sw0 h LEU 108 N 0.64 0.27 -0.55 3.06 6.46 -1.86 -2.56 115.31 120.77 1sw0 h LEU 108 Ca 0.07 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1sw0 h LEU 108 Cb 0.87 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.71 1sw0 h LEU 108 CO 0.08 0.24 0.32 0.40 -0.62 0.00 0.00 178.44 178.86 1sw0 h ILE 109 N 0.27 1.17 -0.92 4.05 2.04 -1.11 -0.93 117.51 122.08 1sw0 h ILE 109 Ca 0.08 -0.41 0.04 0.00 1.00 0.00 0.00 64.86 65.57 1sw0 h ILE 109 Cb 0.03 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 1sw0 h ILE 109 CO -0.01 0.18 0.60 1.23 0.00 0.00 0.00 178.15 180.15 1sw0 h GLY 110 N 0.74 1.34 1.33 5.37 0.00 -1.08 0.42 103.07 111.19 1sw0 h GLY 110 Ca 0.20 -0.45 -0.17 0.00 0.00 0.00 0.00 47.33 46.91 1sw0 h GLY 110 CO -0.03 0.37 -0.52 1.46 0.00 0.00 0.00 176.54 177.82 1sw0 h GLN 111 N 1.13 0.71 -0.21 4.80 4.20 -0.99 -2.07 115.11 122.68 1sw0 h GLN 111 Ca 0.37 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1sw0 h GLN 111 Cb 0.06 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1sw0 h GLN 111 CO -0.12 1.05 0.12 0.87 -0.67 0.00 0.00 178.83 180.08 1sw0 h LYS 112 N 0.55 0.29 -0.41 1.46 1.57 -0.65 -1.44 116.57 117.94 1sw0 h LYS 112 Ca 0.02 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 1sw0 h LYS 112 Cb 1.09 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.29 1sw0 h LYS 112 CO 0.11 0.25 0.14 0.28 -0.57 0.00 0.00 179.45 179.66 1sw0 h VAL 113 N 0.25 0.88 -0.63 0.50 2.07 -0.83 -0.72 116.25 117.77 1sw0 h VAL 113 Ca 0.08 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 1sw0 h VAL 113 Cb 0.04 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1sw0 h VAL 113 CO -0.01 0.06 0.13 0.00 0.02 0.00 0.00 177.57 177.76 1sw0 h ALA 114 N 1.26 1.04 -0.24 1.67 0.00 -1.15 -1.88 119.26 119.96 1sw0 h ALA 114 Ca 0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1sw0 h ALA 114 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1sw0 h ALA 114 CO -0.19 0.62 -0.18 1.25 0.00 0.00 0.00 179.25 180.76 1sw0 h HIS 115 N 0.95 0.64 -0.47 0.00 6.17 -0.83 -2.10 115.15 119.51 1sw0 h HIS 115 Ca 0.20 -0.18 0.05 0.00 0.71 0.00 0.00 60.37 61.15 1sw0 h HIS 115 Cb 0.38 -0.14 -0.05 0.00 2.52 0.00 0.00 27.41 30.12 1sw0 h HIS 115 CO 0.03 0.84 0.20 0.00 0.71 0.00 0.00 177.93 179.71 1sw0 h ALA 116 N 0.69 0.58 -0.17 5.26 0.00 -0.97 -2.18 119.26 122.48 1sw0 h ALA 116 Ca 0.05 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1sw0 h ALA 116 Cb 0.71 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1sw0 h ALA 116 CO 0.05 -0.17 -0.34 -0.07 0.00 0.00 0.00 179.25 178.72 1sw0 h LEU 117 N 0.41 0.36 -1.10 0.00 3.38 -1.31 -1.87 115.31 115.17 1sw0 h LEU 117 Ca 0.21 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1sw0 h LEU 117 Cb 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1sw0 h LEU 117 CO -0.18 0.68 -0.30 0.00 0.09 0.00 0.00 178.44 178.72 1sw0 h ALA 118 N 1.35 1.25 -0.00 1.53 0.00 -0.88 -2.66 119.26 119.83 1sw0 h ALA 118 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1sw0 h ALA 118 Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1sw0 h ALA 118 CO 0.06 0.51 -0.06 0.39 0.00 0.00 0.00 179.25 180.15 1sw0 n GLU 119 N -4.12 0.95 -0.19 0.00 -0.58 -0.86 -4.94 120.64 110.90 1sw0 n GLU 119 Ca -0.01 -0.30 0.00 0.00 -0.42 0.00 0.00 57.16 56.42 1sw0 n GLU 119 Cb 0.40 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 1sw0 n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sw0 n GLY 120 N 1.19 0.84 3.87 0.62 0.00 -1.00 -4.99 105.19 105.71 1sw0 n GLY 120 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1sw0 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sw0 s LEU 121 N 0.00 3.75 0.44 0.99 1.43 -0.72 -5.01 118.68 119.56 1sw0 s LEU 121 Ca 0.00 1.20 -0.14 0.00 -1.03 0.00 0.00 54.13 54.16 1sw0 s LEU 121 Cb 0.00 -4.10 -0.08 0.00 0.03 0.00 0.00 46.19 42.04 1sw0 s LEU 121 CO 0.00 -0.47 0.87 -0.83 0.23 0.00 0.00 176.35 176.15 1sw0 s GLY 122 N -3.29 2.06 -0.09 -3.19 0.00 0.12 -4.25 107.32 98.67 1sw0 s GLY 122 Ca 0.52 0.02 0.03 0.00 0.00 0.00 0.00 44.72 45.28 1sw0 s GLY 122 CO 0.34 0.25 -0.17 0.14 0.00 0.00 0.00 173.10 173.66 1sw0 s VAL 123 N -2.43 1.57 -0.41 1.40 1.01 -0.01 -1.28 120.40 120.24 1sw0 s VAL 123 Ca 0.55 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.66 1sw0 s VAL 123 Cb -0.10 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.89 1sw0 s VAL 123 CO 0.29 0.45 0.34 -0.63 0.00 0.00 0.00 175.10 175.55 1sw0 s ILE 124 N 0.70 5.21 -0.22 2.22 1.01 -0.49 -1.01 121.20 128.63 1sw0 s ILE 124 Ca -0.12 -0.57 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 1sw0 s ILE 124 Cb -0.16 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 1sw0 s ILE 124 CO 0.03 -0.34 0.03 0.00 0.00 0.00 0.00 174.94 174.66 1sw0 s ALA 125 N 1.81 3.11 -0.09 9.38 0.00 -0.15 -0.90 121.76 134.91 1sw0 s ALA 125 Ca 0.07 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 1sw0 s ALA 125 Cb -0.18 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.00 1sw0 s ALA 125 CO 0.11 -0.24 0.08 0.00 0.00 0.00 0.00 175.76 175.71 1sw0 s ILE 127 N -0.99 0.49 0.00 0.00 -0.00 -0.32 -4.67 121.20 115.72 1sw0 s ILE 127 Ca 0.15 -1.90 0.00 0.00 -0.00 0.00 0.00 60.65 58.90 1sw0 s ILE 127 Cb -0.12 -1.71 0.00 0.00 -0.00 0.00 0.00 42.46 40.63 1sw0 s ILE 127 CO 0.04 -0.83 0.00 0.61 -0.00 0.00 0.00 174.94 174.76 1sw0 n GLY 128 N -0.02 2.70 3.87 6.27 0.00 -1.26 -0.84 105.19 115.90 1sw0 n GLY 128 Ca -0.11 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.96 1sw0 n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1sw0 s GLU 129 N -2.00 3.19 0.65 1.61 1.03 -1.26 -4.76 118.70 117.16 1sw0 s GLU 129 Ca 0.00 -0.67 -0.09 0.00 0.03 0.00 0.00 54.97 54.24 1sw0 s GLU 129 Cb 0.00 -2.84 0.01 0.00 -0.80 0.00 0.00 34.13 30.50 1sw0 s GLU 129 CO 0.00 0.53 1.00 0.15 -1.33 0.00 0.00 175.26 175.61 1sw0 s LYS 130 N -2.96 2.86 0.18 -4.83 1.02 -1.26 -1.15 119.74 113.60 1sw0 s LYS 130 Ca 0.33 0.21 -0.14 0.00 0.02 0.00 0.00 55.97 56.39 1sw0 s LYS 130 Cb -0.11 -2.15 0.07 0.00 -0.52 0.00 0.00 37.83 35.12 1sw0 s LYS 130 CO 0.26 -0.88 1.84 1.25 -0.92 0.00 0.00 175.35 176.89 1sw0 h LEU 131 N -0.43 0.63 -1.52 3.17 7.12 -1.98 -1.81 115.31 120.49 1sw0 h LEU 131 Ca -0.45 -0.02 -0.02 0.00 0.13 0.00 0.00 57.88 57.51 1sw0 h LEU 131 Cb 1.26 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 41.22 1sw0 h LEU 131 CO 0.62 0.46 0.05 -2.24 -0.13 0.00 0.00 178.44 177.21 1sw0 h ASP 132 N 0.73 0.33 -0.13 1.25 2.03 -1.98 -0.39 116.42 118.26 1sw0 h ASP 132 Ca 0.20 -0.04 -0.04 0.00 -0.73 0.00 0.00 57.03 56.42 1sw0 h ASP 132 Cb -0.07 -0.08 -0.00 0.00 -0.83 0.00 0.00 39.33 38.34 1sw0 h ASP 132 CO -0.04 0.35 -0.08 -0.33 -1.03 0.00 0.00 179.24 178.10 1sw0 h GLU 133 N 0.36 0.28 -0.48 4.15 5.08 -1.78 -2.28 114.58 119.91 1sw0 h GLU 133 Ca 0.09 -0.13 0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1sw0 h GLU 133 Cb 0.16 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 1sw0 h GLU 133 CO -0.00 0.64 0.13 -0.09 -1.00 0.00 0.00 179.01 178.69 1sw0 h ARG 134 N -0.08 0.28 0.00 2.33 2.43 -0.87 -1.57 114.38 116.90 1sw0 h ARG 134 Ca 0.03 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1sw0 h ARG 134 Cb 0.56 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1sw0 h ARG 134 CO 0.02 0.18 0.00 0.39 -1.51 0.00 0.00 179.97 179.05 1sw0 n GLU 135 N -5.06 0.21 -0.05 0.20 1.02 -0.20 -1.87 120.64 114.89 1sw0 n GLU 135 Ca 0.05 0.32 0.12 0.00 -0.02 0.00 0.00 57.16 57.64 1sw0 n GLU 135 Cb 0.22 -1.82 0.32 0.00 -0.02 0.00 0.00 31.44 30.13 1sw0 n GLU 135 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sw0 n ALA 136 N -1.76 2.50 -0.58 0.62 0.00 -0.64 -4.94 120.51 115.71 1sw0 n ALA 136 Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1sw0 n ALA 136 Cb 0.31 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1sw0 n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sw0 n GLY 137 N 1.27 0.68 0.47 0.00 0.00 -0.78 -4.96 105.19 101.87 1sw0 n GLY 137 Ca 0.17 -0.23 0.07 0.00 0.00 0.00 0.00 46.02 46.03 1sw0 n GLY 137 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1sw0 n ILE 138 N -2.58 1.69 -0.20 -0.61 -0.00 -0.92 -4.64 119.36 112.10 1sw0 n ILE 138 Ca 0.00 -1.64 0.01 0.00 -0.00 0.00 0.00 62.75 61.12 1sw0 n ILE 138 Cb 0.00 0.04 0.10 0.00 -0.00 0.00 0.00 39.64 39.78 1sw0 n ILE 138 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.55 177.29 1sw0 h THR 139 N 1.08 0.51 -0.39 1.39 2.02 -1.84 -1.45 112.91 114.21 1sw0 h THR 139 Ca 0.00 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1sw0 h THR 139 Cb 1.01 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 1sw0 h THR 139 CO 0.08 0.02 0.17 -0.33 0.37 0.00 0.00 175.52 175.84 1sw0 h GLU 140 N 0.13 0.58 -0.08 6.66 5.08 -1.96 -0.56 114.58 124.42 1sw0 h GLU 140 Ca 0.32 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1sw0 h GLU 140 Cb 0.51 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1sw0 h GLU 140 CO -0.51 0.53 -0.01 -0.22 -1.00 0.00 0.00 179.01 177.79 1sw0 h LYS 141 N 0.49 0.02 0.19 2.33 3.11 -1.81 -0.63 116.57 120.26 1sw0 h LYS 141 Ca 0.13 -0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.96 1sw0 h LYS 141 Cb 0.15 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.38 1sw0 h LYS 141 CO -0.01 0.01 -0.09 0.28 -2.81 0.00 0.00 179.45 176.83 1sw0 h VAL 142 N 0.02 0.87 -0.87 2.00 2.07 -1.08 -0.89 116.25 118.36 1sw0 h VAL 142 Ca 0.04 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.30 1sw0 h VAL 142 Cb 0.05 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1sw0 h VAL 142 CO -0.07 0.06 0.57 0.58 0.02 0.00 0.00 177.57 178.73 1sw0 h VAL 143 N -0.38 1.23 -0.49 2.57 2.07 -1.08 -0.99 116.25 119.18 1sw0 h VAL 143 Ca -0.03 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 1sw0 h VAL 143 Cb 0.29 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1sw0 h VAL 143 CO 0.04 0.22 -0.13 -0.26 0.02 0.00 0.00 177.57 177.47 1sw0 h PHE 144 N 1.19 1.07 0.05 1.57 0.05 -1.00 -1.25 116.94 118.61 1sw0 h PHE 144 Ca 0.32 -0.23 0.01 0.00 3.82 0.00 0.00 57.97 61.88 1sw0 h PHE 144 Cb -0.12 -0.26 -0.01 0.00 2.00 0.00 0.00 35.95 37.56 1sw0 h PHE 144 CO -0.01 1.03 -0.08 0.93 -0.18 0.00 0.00 178.31 180.00 1sw0 h GLU 145 N 0.80 -0.16 -0.89 1.51 5.08 -0.69 0.60 114.58 120.83 1sw0 h GLU 145 Ca 0.12 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1sw0 h GLU 145 Cb 0.69 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 1sw0 h GLU 145 CO 0.05 -0.11 0.59 1.96 -1.00 0.00 0.00 179.01 180.51 1sw0 h GLN 146 N -0.16 1.17 -0.38 2.33 4.20 -1.19 -2.46 115.11 118.61 1sw0 h GLN 146 Ca 0.01 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 1sw0 h GLN 146 Cb 0.18 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1sw0 h GLN 146 CO -0.04 0.78 -0.25 1.15 -0.67 0.00 0.00 178.83 179.79 1sw0 h THR 147 N 1.21 1.28 -0.99 -0.54 2.02 -0.98 -3.00 112.91 111.91 1sw0 h THR 147 Ca 0.33 -1.41 0.01 0.00 0.77 0.00 0.00 66.41 66.11 1sw0 h THR 147 Cb -0.13 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 67.57 1sw0 h THR 147 CO -0.07 0.47 0.65 0.50 0.37 0.00 0.00 175.52 177.44 1sw0 h LYS 148 N 0.65 1.30 -0.70 6.66 3.64 -0.65 0.16 116.57 127.64 1sw0 h LYS 148 Ca 0.08 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1sw0 h LYS 148 Cb 0.83 -0.29 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1sw0 h LYS 148 CO 0.07 0.87 0.43 0.00 -2.27 0.00 0.00 179.45 178.55 1sw0 h ALA 149 N 1.38 1.44 0.11 5.00 0.00 -1.31 -0.30 119.26 125.58 1sw0 h ALA 149 Ca 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1sw0 h ALA 149 Cb -0.15 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.36 1sw0 h ALA 149 CO -0.08 0.49 -0.05 0.82 0.00 0.00 0.00 179.25 180.43 1sw0 h ILE 150 N 0.96 1.07 -0.56 0.00 2.04 -1.31 -3.35 117.51 116.36 1sw0 h ILE 150 Ca 0.25 -1.22 0.05 0.00 1.00 0.00 0.00 64.86 64.94 1sw0 h ILE 150 Cb -0.06 1.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 1sw0 h ILE 150 CO -0.05 0.27 0.37 0.00 0.00 0.00 0.00 178.15 178.74 1sw0 h ALA 151 N -0.06 1.79 0.00 1.87 0.00 -0.25 -0.53 119.26 122.07 1sw0 h ALA 151 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sw0 h ALA 151 Cb 0.56 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1sw0 h ALA 151 CO 0.03 0.13 0.00 -0.25 0.00 0.00 0.00 179.25 179.16 1sw0 n ASP 152 N -4.47 0.16 -0.32 0.00 8.00 -0.16 -2.15 116.55 117.61 1sw0 n ASP 152 Ca 0.07 0.55 0.06 0.00 0.71 0.00 0.00 54.79 56.18 1sw0 n ASP 152 Cb 0.19 -0.58 0.13 0.00 -0.02 0.00 0.00 41.12 40.84 1sw0 n ASP 152 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1sw0 n ASN 153 N -1.69 2.67 -4.23 -2.24 3.02 -0.22 -4.97 115.26 107.60 1sw0 n ASN 153 Ca 0.02 -2.58 -0.34 0.00 -0.03 0.00 0.00 54.58 51.65 1sw0 n ASN 153 Cb 0.12 -0.30 -0.15 0.00 -0.61 0.00 0.00 39.78 38.85 1sw0 n ASN 153 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1sw0 s VAL 154 N -2.01 2.90 -0.12 2.41 1.01 -0.91 -3.98 120.40 119.69 1sw0 s VAL 154 Ca 0.23 -0.72 0.19 0.00 0.00 0.00 0.00 61.98 61.69 1sw0 s VAL 154 Cb 0.19 -2.32 -0.25 0.00 0.00 0.00 0.00 36.38 33.99 1sw0 s VAL 154 CO 0.06 0.42 0.42 0.29 0.00 0.00 0.00 175.10 176.28 1sw0 n LYS 155 N 4.72 0.66 -3.86 2.72 5.02 -1.26 -4.90 118.16 121.26 1sw0 n LYS 155 Ca -0.19 -0.02 -0.27 0.00 -2.02 0.00 0.00 58.31 55.82 1sw0 n LYS 155 Cb 0.50 -1.59 -0.17 0.00 -0.02 0.00 0.00 35.03 33.75 1sw0 n LYS 155 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1sw0 s ASP 156 N -5.20 2.32 0.00 4.39 3.68 -1.26 -5.02 116.67 115.58 1sw0 s ASP 156 Ca -0.07 -0.41 0.28 0.00 2.13 0.00 0.00 52.55 54.47 1sw0 s ASP 156 Cb 0.10 -0.77 1.01 0.00 -1.45 0.00 0.00 42.92 41.80 1sw0 s ASP 156 CO 0.85 -0.17 1.72 0.79 0.13 0.00 0.00 175.17 178.50 1sw0 n TRP 157 N 4.97 0.00 0.37 -5.34 7.02 -1.26 -4.20 117.44 118.99 1sw0 n TRP 157 Ca -0.11 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.51 1sw0 n TRP 157 Cb 0.49 -0.06 0.51 0.00 -2.42 0.00 0.00 31.31 29.83 1sw0 n TRP 157 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1sw0 h SER 158 N 1.70 0.00 -0.06 -0.99 4.64 -1.99 -2.90 113.55 113.94 1sw0 h SER 158 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1sw0 h SER 158 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 1sw0 h SER 158 CO 0.00 0.00 -0.22 0.29 -0.87 0.00 0.00 176.83 176.03 1sw0 n LYS 159 N -2.65 1.60 -4.48 4.77 5.02 -1.26 -4.99 118.16 116.17 1sw0 n LYS 159 Ca 0.02 -2.97 -0.34 0.00 -2.02 0.00 0.00 58.31 53.00 1sw0 n LYS 159 Cb 0.32 -1.61 -0.11 0.00 -0.02 0.00 0.00 35.03 33.61 1sw0 n LYS 159 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1sw0 s VAL 160 N -3.07 3.87 -0.08 -0.18 1.01 -1.10 -0.83 120.40 120.03 1sw0 s VAL 160 Ca 0.37 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.99 1sw0 s VAL 160 Cb 0.34 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 34.07 1sw0 s VAL 160 CO -0.01 0.55 -0.19 -0.69 0.00 0.00 0.00 175.10 174.75 1sw0 s VAL 161 N -0.21 1.66 -0.14 2.92 1.01 -0.18 -4.47 120.40 120.99 1sw0 s VAL 161 Ca 0.04 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 1sw0 s VAL 161 Cb -0.13 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 1sw0 s VAL 161 CO 0.02 0.47 0.29 -0.76 0.00 0.00 0.00 175.10 175.12 1sw0 s LEU 162 N 0.38 4.28 -0.23 3.92 1.43 -0.86 -0.98 118.68 126.62 1sw0 s LEU 162 Ca -0.14 0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 1sw0 s LEU 162 Cb -0.16 -2.37 0.03 0.00 0.03 0.00 0.00 46.19 43.72 1sw0 s LEU 162 CO 0.06 0.14 -0.11 0.00 0.23 0.00 0.00 176.35 176.67 1sw0 s ALA 163 N 0.21 2.56 -0.29 4.21 0.00 -0.04 -0.31 121.76 128.10 1sw0 s ALA 163 Ca 0.17 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.51 1sw0 s ALA 163 Cb -0.13 -1.51 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 1sw0 s ALA 163 CO 0.05 -0.75 0.44 -0.47 0.00 0.00 0.00 175.76 175.02 1sw0 s TYR 164 N 1.27 3.23 -0.34 0.00 5.04 0.08 -1.17 117.35 125.46 1sw0 s TYR 164 Ca -0.00 0.36 -0.00 0.00 -2.44 0.00 0.00 57.07 54.98 1sw0 s TYR 164 Cb -0.16 -2.70 0.11 0.00 0.35 0.00 0.00 41.96 39.56 1sw0 s TYR 164 CO -0.07 -0.34 0.13 -2.00 -1.34 0.00 0.00 175.55 171.93 1sw0 s GLU 165 N 2.19 0.81 0.17 4.97 2.12 -0.02 -1.42 118.70 127.52 1sw0 s GLU 165 Ca 0.17 -1.27 -0.33 0.00 0.36 0.00 0.00 54.97 53.91 1sw0 s GLU 165 Cb -0.16 -2.00 -0.12 0.00 0.26 0.00 0.00 34.13 32.11 1sw0 s GLU 165 CO 0.11 -1.04 1.71 -2.30 -0.54 0.00 0.00 175.26 173.20 1sw0 n PRO 166 N 4.54 2.58 0.04 4.30 -0.02 -1.25 -4.23 135.00 140.97 1sw0 n PRO 166 Ca 0.01 0.93 0.01 0.00 -2.02 0.00 0.00 63.50 62.43 1sw0 n PRO 166 Cb 0.40 -2.76 0.34 0.00 -0.02 0.00 0.00 33.50 31.46 1sw0 n PRO 166 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1sw0 h VAL 167 N 3.95 1.18 0.00 -1.45 2.07 -1.43 -1.53 116.25 119.04 1sw0 h VAL 167 Ca -0.44 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.34 1sw0 h VAL 167 Cb 1.22 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1sw0 h VAL 167 CO 0.94 0.25 0.00 -2.67 0.02 0.00 0.00 177.57 176.10 1sw0 n TRP 168 N -4.29 0.65 1.08 1.57 4.27 -1.26 -2.26 117.44 117.20 1sw0 n TRP 168 Ca 0.01 0.26 0.12 0.00 -3.89 0.00 0.00 57.50 53.99 1sw0 n TRP 168 Cb 0.24 -0.91 0.13 0.00 -1.36 0.00 0.00 31.31 29.40 1sw0 n TRP 168 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1sw0 n ALA 169 N -1.72 3.57 -2.57 -1.67 0.00 -0.58 -4.69 120.51 112.84 1sw0 n ALA 169 Ca 0.02 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 1sw0 n ALA 169 Cb 0.22 -0.93 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 1sw0 n ALA 169 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1sw0 s ILE 170 N -2.60 4.73 0.00 0.00 1.01 -0.96 -2.36 121.20 121.02 1sw0 s ILE 170 Ca 0.18 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.56 1sw0 s ILE 170 Cb 0.18 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1sw0 s ILE 170 CO 0.61 -0.50 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1sw0 n GLY 171 N 4.67 0.42 0.01 6.18 0.00 -1.26 -4.85 105.19 110.36 1sw0 n GLY 171 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1sw0 n GLY 171 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1sw0 n THR 172 N -2.52 0.00 -0.04 2.61 -2.24 -1.25 -4.98 114.28 105.86 1sw0 n THR 172 Ca 0.00 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1sw0 n THR 172 Cb 0.12 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1sw0 n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sw0 n GLY 173 N 1.32 1.80 3.70 3.38 0.00 -1.26 -5.03 105.19 109.08 1sw0 n GLY 173 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1sw0 n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sw0 s LEU 174 N 0.00 4.25 0.21 0.99 1.43 -1.26 -5.00 118.68 119.30 1sw0 s LEU 174 Ca 0.00 1.05 0.11 0.00 -1.03 0.00 0.00 54.13 54.25 1sw0 s LEU 174 Cb 0.00 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 1sw0 s LEU 174 CO 0.00 -0.17 -0.17 -1.66 0.23 0.00 0.00 176.35 174.58 1sw0 s TRP 175 N 1.21 2.44 0.33 0.29 1.48 -1.26 -4.31 118.94 119.11 1sw0 s TRP 175 Ca 0.34 -0.30 -0.28 0.00 -1.06 0.00 0.00 56.10 54.79 1sw0 s TRP 175 Cb -0.17 -1.17 -0.10 0.00 -1.16 0.00 0.00 33.47 30.87 1sw0 s TRP 175 CO 0.14 0.54 1.23 0.00 -4.06 0.00 0.00 176.95 174.81 1sw0 s ALA 176 N -1.85 3.42 0.83 2.67 0.00 -1.26 -5.01 121.76 120.55 1sw0 s ALA 176 Ca 0.24 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 53.21 1sw0 s ALA 176 Cb -0.08 -3.42 0.09 0.00 0.00 0.00 0.00 23.12 19.71 1sw0 s ALA 176 CO 0.13 -0.50 1.16 0.95 0.00 0.00 0.00 175.76 177.50 1sw0 s THR 177 N -1.19 2.37 0.41 0.00 -4.23 -1.26 -4.78 115.64 106.96 1sw0 s THR 177 Ca 0.49 0.14 0.15 0.00 -1.18 0.00 0.00 61.69 61.29 1sw0 s THR 177 Cb -0.36 -2.43 0.36 0.00 1.34 0.00 0.00 72.50 71.41 1sw0 s THR 177 CO 0.48 -0.14 1.87 -0.65 -0.54 0.00 0.00 174.62 175.64 1sw0 h PRO 178 N -1.20 0.45 -0.13 3.99 0.11 -1.95 -1.61 132.00 131.67 1sw0 h PRO 178 Ca -0.45 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.43 1sw0 h PRO 178 Cb 1.27 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1sw0 h PRO 178 CO 0.46 0.30 -0.76 1.96 -0.21 0.00 0.00 178.00 179.75 1sw0 h GLN 179 N 0.47 0.64 -0.45 1.05 7.50 -1.97 -0.87 115.11 121.48 1sw0 h GLN 179 Ca 0.45 -0.52 -0.01 0.00 0.50 0.00 0.00 58.65 59.07 1sw0 h GLN 179 Cb 1.02 0.11 -0.02 0.00 0.05 0.00 0.00 27.48 28.64 1sw0 h GLN 179 CO -0.18 1.14 0.25 1.96 -1.50 0.00 0.00 178.83 180.50 1sw0 h GLN 180 N 0.44 0.64 -0.04 1.46 4.20 -1.72 -2.01 115.11 118.08 1sw0 h GLN 180 Ca -0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1sw0 h GLN 180 Cb 1.37 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 29.02 1sw0 h GLN 180 CO 0.15 0.51 -0.01 0.00 -0.67 0.00 0.00 178.83 178.80 1sw0 h ALA 181 N 1.09 0.06 -0.98 3.87 0.00 -1.27 -2.98 119.26 119.05 1sw0 h ALA 181 Ca 0.16 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1sw0 h ALA 181 Cb 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1sw0 h ALA 181 CO -0.03 -0.23 0.63 0.37 0.00 0.00 0.00 179.25 180.00 1sw0 h GLN 182 N -0.28 1.14 0.28 0.00 5.75 -1.17 -0.77 115.11 120.05 1sw0 h GLN 182 Ca 0.01 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1sw0 h GLN 182 Cb 0.41 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1sw0 h GLN 182 CO 0.00 0.75 -0.29 1.49 -2.65 0.00 0.00 178.83 178.14 1sw0 h GLU 183 N 1.17 -0.58 -0.65 1.69 4.81 -1.26 -0.76 114.58 118.99 1sw0 h GLU 183 Ca 0.41 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.64 1sw0 h GLU 183 Cb 0.11 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.60 1sw0 h GLU 183 CO -0.15 -0.39 0.25 0.28 -0.73 0.00 0.00 179.01 178.27 1sw0 h VAL 184 N -0.61 1.24 -0.49 0.32 2.07 -1.36 -2.10 116.25 115.32 1sw0 h VAL 184 Ca -0.01 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.64 1sw0 h VAL 184 Cb 0.56 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1sw0 h VAL 184 CO -0.06 0.30 -0.12 0.45 0.02 0.00 0.00 177.57 178.16 1sw0 h HIS 185 N 0.92 1.03 -0.06 1.57 3.86 -0.96 0.22 115.15 121.73 1sw0 h HIS 185 Ca 0.22 -0.21 -0.14 0.00 -1.16 0.00 0.00 60.37 59.08 1sw0 h HIS 185 Cb 0.22 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 1sw0 h HIS 185 CO 0.01 0.98 -0.58 1.05 0.86 0.00 0.00 177.93 180.25 1sw0 h GLU 186 N 0.82 0.20 -0.26 2.45 4.11 -1.02 -0.43 114.58 120.45 1sw0 h GLU 186 Ca 0.13 -0.13 -0.15 0.00 0.07 0.00 0.00 59.36 59.28 1sw0 h GLU 186 Cb 0.65 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1sw0 h GLU 186 CO 0.05 0.73 -0.42 0.87 0.07 0.00 0.00 179.01 180.30 1sw0 h LYS 187 N 0.15 0.75 -0.97 1.06 1.57 -1.09 -1.80 116.57 116.24 1sw0 h LYS 187 Ca -0.00 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1sw0 h LYS 187 Cb 1.07 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.38 1sw0 h LYS 187 CO 0.09 1.08 0.61 -0.07 -0.57 0.00 0.00 179.45 180.59 1sw0 h LEU 188 N 0.49 1.13 -1.01 2.94 3.38 -0.77 -0.67 115.31 120.81 1sw0 h LEU 188 Ca 0.02 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1sw0 h LEU 188 Cb 1.02 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1sw0 h LEU 188 CO 0.10 0.85 -0.05 -0.09 0.09 0.00 0.00 178.44 179.33 1sw0 h ARG 189 N 1.32 0.66 -0.05 1.13 2.43 -0.90 -1.58 114.38 117.39 1sw0 h ARG 189 Ca 0.35 -0.18 -0.13 0.00 -0.81 0.00 0.00 59.98 59.21 1sw0 h ARG 189 Cb -0.11 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1sw0 h ARG 189 CO -0.07 0.71 -0.57 0.78 -1.51 0.00 0.00 179.97 179.31 1sw0 h GLY 190 N 0.94 0.17 0.91 2.80 0.00 -0.94 -1.66 103.07 105.29 1sw0 h GLY 190 Ca 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1sw0 h GLY 190 CO 0.02 0.18 0.11 -0.25 0.00 0.00 0.00 176.54 176.60 1sw0 h TRP 191 N 0.12 0.41 -0.77 5.60 7.01 -0.67 -2.29 115.95 125.36 1sw0 h TRP 191 Ca -0.00 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.97 1sw0 h TRP 191 Cb 1.04 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.94 1sw0 h TRP 191 CO 0.01 0.42 0.49 -0.07 -2.79 0.00 0.00 178.44 176.50 1sw0 h LEU 192 N 0.28 0.89 -0.27 0.65 4.07 -1.03 -0.83 115.31 119.08 1sw0 h LEU 192 Ca 0.09 -0.03 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1sw0 h LEU 192 Cb 0.18 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1sw0 h LEU 192 CO -0.01 0.66 0.04 0.50 -1.08 0.00 0.00 178.44 178.55 1sw0 h LYS 193 N 1.05 0.44 0.08 1.13 3.64 -1.08 -0.55 116.57 121.28 1sw0 h LYS 193 Ca 0.28 -0.12 -0.25 0.00 -1.27 0.00 0.00 60.65 59.29 1sw0 h LYS 193 Cb -0.10 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1sw0 h LYS 193 CO -0.06 0.57 -1.16 0.66 -2.27 0.00 0.00 179.45 177.19 1sw0 h SER 194 N 0.25 0.26 0.12 4.20 4.64 -1.17 -3.22 113.55 118.63 1sw0 h SER 194 Ca 0.08 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1sw0 h SER 194 Cb 0.34 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1sw0 h SER 194 CO 0.01 1.22 -1.56 1.41 -0.87 0.00 0.00 176.83 177.03 1sw0 n HIS 195 N -3.46 0.09 0.00 4.77 8.25 -0.34 -4.82 115.22 119.72 1sw0 n HIS 195 Ca -0.05 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1sw0 n HIS 195 Cb 0.99 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.71 1sw0 n HIS 195 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1sw0 n VAL 196 N -2.06 0.00 -3.60 1.59 0.31 -0.34 -5.05 118.33 109.18 1sw0 n VAL 196 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.29 1sw0 n VAL 196 Cb 0.49 -0.45 -0.02 0.00 -0.91 0.00 0.00 33.84 32.96 1sw0 n VAL 196 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1sw0 s SER 197 N 1.00 -0.14 0.14 4.52 1.04 -0.45 -4.99 113.70 114.81 1sw0 s SER 197 Ca 0.00 -0.06 -0.13 0.00 0.48 0.00 0.00 55.95 56.24 1sw0 s SER 197 Cb 0.00 0.19 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 1sw0 s SER 197 CO 0.00 -0.32 1.57 0.44 0.98 0.00 0.00 173.24 175.91 1sw0 h ASP 198 N 2.00 0.81 -0.99 7.02 3.45 -1.83 -2.15 116.42 124.74 1sw0 h ASP 198 Ca -0.17 -0.34 0.08 0.00 0.43 0.00 0.00 57.03 57.03 1sw0 h ASP 198 Cb 1.19 -0.22 -0.07 0.00 -0.56 0.00 0.00 39.33 39.67 1sw0 h ASP 198 CO 0.25 0.96 0.64 0.00 -1.57 0.00 0.00 179.24 179.51 1sw0 h ALA 199 N 0.88 1.45 -0.16 3.45 0.00 -1.95 -1.48 119.26 121.45 1sw0 h ALA 199 Ca 0.12 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 1sw0 h ALA 199 Cb 0.57 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1sw0 h ALA 199 CO 0.03 0.38 -0.74 0.28 0.00 0.00 0.00 179.25 179.21 1sw0 h VAL 200 N 1.11 1.30 -0.65 0.00 2.07 -1.86 -2.40 116.25 115.82 1sw0 h VAL 200 Ca 0.44 -1.97 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 1sw0 h VAL 200 Cb 0.24 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1sw0 h VAL 200 CO -0.19 0.62 0.33 0.00 0.02 0.00 0.00 177.57 178.35 1sw0 h ALA 201 N 0.66 0.84 0.00 1.67 0.00 -1.10 -2.04 119.26 119.28 1sw0 h ALA 201 Ca -0.04 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1sw0 h ALA 201 Cb 1.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1sw0 h ALA 201 CO 0.15 0.39 -0.33 1.96 0.00 0.00 0.00 179.25 181.42 1sw0 h GLN 202 N 0.90 0.00 0.00 0.00 7.50 -1.19 -3.30 115.11 119.02 1sw0 h GLN 202 Ca 0.23 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.38 1sw0 h GLN 202 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.63 1sw0 h GLN 202 CO -0.03 0.33 -1.69 -1.13 -1.50 0.00 0.00 178.83 174.81 1sw0 n SER 203 N -3.47 0.37 -4.67 1.46 3.41 -0.91 -4.70 113.62 105.10 1sw0 n SER 203 Ca -0.00 -0.28 -0.39 0.00 -0.26 0.00 0.00 58.87 57.94 1sw0 n SER 203 Cb 0.49 1.70 -0.07 0.00 -0.26 0.00 0.00 64.21 66.08 1sw0 n SER 203 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1sw0 s THR 204 N -3.33 5.12 0.18 6.66 2.01 -0.78 -4.92 115.64 120.58 1sw0 s THR 204 Ca -0.03 0.94 -0.30 0.00 0.31 0.00 0.00 61.69 62.60 1sw0 s THR 204 Cb 0.14 -3.83 -0.09 0.00 0.01 0.00 0.00 72.50 68.73 1sw0 s THR 204 CO 0.88 0.20 1.34 -0.13 -0.69 0.00 0.00 174.62 176.22 1sw0 s ARG 205 N 1.49 4.36 -0.20 4.92 3.00 -1.26 -4.97 118.95 126.29 1sw0 s ARG 205 Ca 0.24 2.08 0.01 0.00 0.00 0.00 0.00 55.73 58.06 1sw0 s ARG 205 Cb -0.15 -3.20 0.03 0.00 0.00 0.00 0.00 34.95 31.62 1sw0 s ARG 205 CO 0.10 -0.32 -0.16 0.42 0.00 0.00 0.00 175.30 175.33 1sw0 s ILE 206 N 0.39 2.00 0.15 1.52 1.01 -1.26 -2.02 121.20 122.99 1sw0 s ILE 206 Ca 0.59 -1.09 0.07 0.00 0.00 0.00 0.00 60.65 60.23 1sw0 s ILE 206 Cb -0.37 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 1sw0 s ILE 206 CO 0.36 0.36 -0.05 0.27 0.00 0.00 0.00 174.94 175.89 1sw0 s ILE 207 N 1.27 3.55 -0.12 2.92 -4.36 0.57 -1.37 121.20 123.66 1sw0 s ILE 207 Ca 0.01 -1.40 -0.06 0.00 -0.26 0.00 0.00 60.65 58.94 1sw0 s ILE 207 Cb -0.15 -2.74 -0.04 0.00 1.25 0.00 0.00 42.46 40.78 1sw0 s ILE 207 CO -0.10 -0.04 0.11 -0.47 0.24 0.00 0.00 174.94 174.68 1sw0 s TYR 208 N -1.56 3.48 0.08 1.37 6.14 -0.28 -0.74 117.35 125.84 1sw0 s TYR 208 Ca 0.25 0.43 0.03 0.00 0.64 0.00 0.00 57.07 58.42 1sw0 s TYR 208 Cb -0.10 -1.93 -0.03 0.00 0.42 0.00 0.00 41.96 40.32 1sw0 s TYR 208 CO 0.17 0.63 -0.09 0.20 0.64 0.00 0.00 175.55 177.09 1sw0 s GLY 209 N -0.85 0.75 0.00 8.97 0.00 -0.51 -1.44 107.32 114.25 1sw0 s GLY 209 Ca 0.14 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 43.75 1sw0 s GLY 209 CO 0.03 -1.18 0.00 0.61 0.00 0.00 0.00 173.10 172.56 1sw0 n GLY 210 N 0.71 1.20 3.60 0.20 0.00 -1.26 -3.89 105.19 105.75 1sw0 n GLY 210 Ca -0.17 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 1sw0 n GLY 210 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1sw0 n SER 211 N 0.00 -4.78 -4.72 1.61 7.64 -0.99 -4.45 113.62 107.92 1sw0 n SER 211 Ca 0.00 -0.61 -0.42 0.00 1.01 0.00 0.00 58.87 58.86 1sw0 n SER 211 Cb 0.00 -4.85 -0.03 0.00 -1.01 0.00 0.00 64.21 58.31 1sw0 n SER 211 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1sw0 s VAL 212 N -3.35 4.20 0.31 0.44 1.01 -1.26 -4.75 120.40 117.00 1sw0 s VAL 212 Ca 0.41 1.70 0.04 0.00 0.00 0.00 0.00 61.98 64.13 1sw0 s VAL 212 Cb -0.19 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1sw0 s VAL 212 CO 0.75 0.20 0.19 0.42 0.00 0.00 0.00 175.10 176.65 1sw0 s THR 213 N 0.51 0.22 0.49 3.92 -4.23 -1.26 -4.53 115.64 110.76 1sw0 s THR 213 Ca 0.53 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.23 1sw0 s THR 213 Cb -0.27 -2.49 0.25 0.00 1.34 0.00 0.00 72.50 71.33 1sw0 s THR 213 CO 0.31 0.00 2.10 1.23 -0.54 0.00 0.00 174.62 177.72 1sw0 h GLY 214 N 2.20 0.00 1.87 3.99 0.00 -1.96 -2.46 103.07 106.71 1sw0 h GLY 214 Ca -0.32 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.85 1sw0 h GLY 214 CO 0.48 0.00 -0.76 -1.33 0.00 0.00 0.00 176.54 174.93 1sw0 h GLY 215 N 0.29 0.14 -0.47 4.60 0.00 -1.97 -3.35 103.07 102.30 1sw0 h GLY 215 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1sw0 h GLY 215 CO 0.01 0.19 -0.32 1.16 0.00 0.00 0.00 176.54 177.59 1sw0 n ASN 216 N -3.71 1.24 0.03 0.19 0.23 -1.17 -4.76 115.26 107.32 1sw0 n ASN 216 Ca -0.02 -1.12 -0.03 0.00 -0.53 0.00 0.00 54.58 52.87 1sw0 n ASN 216 Cb 0.73 0.56 0.21 0.00 -2.08 0.00 0.00 39.78 39.20 1sw0 n ASN 216 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1sw0 h LYS 218 N 0.38 0.95 -0.32 0.00 1.57 -1.83 -0.25 116.57 117.06 1sw0 h LYS 218 Ca 0.05 -0.19 -0.10 0.00 -1.87 0.00 0.00 60.65 58.55 1sw0 h LYS 218 Cb 0.69 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1sw0 h LYS 218 CO 0.05 0.82 -0.18 0.93 -0.57 0.00 0.00 179.45 180.51 1sw0 h GLU 219 N 0.88 0.69 -0.43 3.15 3.07 -1.89 -2.14 114.58 117.91 1sw0 h GLU 219 Ca 0.20 -0.31 -0.05 0.00 -0.50 0.00 0.00 59.36 58.71 1sw0 h GLU 219 Cb 0.25 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1sw0 h GLU 219 CO -0.01 0.91 0.08 -0.07 -1.40 0.00 0.00 179.01 178.52 1sw0 h LEU 220 N 0.46 0.67 -1.67 1.33 3.38 -1.47 -3.10 115.31 114.90 1sw0 h LEU 220 Ca 0.07 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1sw0 h LEU 220 Cb 0.71 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1sw0 h LEU 220 CO 0.05 0.75 -0.19 0.00 0.09 0.00 0.00 178.44 179.14 1sw0 h ALA 221 N 0.94 1.58 0.00 1.53 0.00 -0.87 -2.54 119.26 119.90 1sw0 h ALA 221 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sw0 h ALA 221 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1sw0 h ALA 221 CO 0.01 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.36 1sw0 n SER 222 N -4.15 0.31 -4.77 0.00 3.41 -0.82 -4.81 113.62 102.79 1sw0 n SER 222 Ca -0.02 0.55 -0.39 0.00 -0.26 0.00 0.00 58.87 58.74 1sw0 n SER 222 Cb 0.26 -0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 1sw0 n SER 222 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1sw0 s GLN 223 N -3.08 4.27 0.46 4.33 -1.52 -0.96 -4.92 119.66 118.24 1sw0 s GLN 223 Ca 0.10 1.94 0.23 0.00 -1.95 0.00 0.00 55.36 55.68 1sw0 s GLN 223 Cb 0.13 -2.90 1.11 0.00 -0.22 0.00 0.00 33.01 31.13 1sw0 s GLN 223 CO 0.46 -0.16 1.94 0.45 -0.25 0.00 0.00 175.29 177.72 1sw0 h HIS 224 N 3.11 0.00 -0.15 0.91 3.86 -1.90 -2.86 115.15 118.13 1sw0 h HIS 224 Ca -0.48 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 1sw0 h HIS 224 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 1sw0 h HIS 224 CO 0.56 0.22 0.00 -0.25 0.86 0.00 0.00 177.93 179.32 1sw0 n ASP 225 N -3.67 2.76 -4.45 2.45 9.92 -1.26 -4.87 116.55 117.43 1sw0 n ASP 225 Ca -0.01 -2.51 -0.38 0.00 -0.53 0.00 0.00 54.79 51.36 1sw0 n ASP 225 Cb 0.34 -0.29 -0.12 0.00 -0.64 0.00 0.00 41.12 40.41 1sw0 n ASP 225 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1sw0 s VAL 226 N -1.89 4.59 -1.90 2.53 -7.23 -1.08 -4.70 120.40 110.72 1sw0 s VAL 226 Ca 0.24 -0.37 0.22 0.00 -1.81 0.00 0.00 61.98 60.26 1sw0 s VAL 226 Cb 0.18 -3.31 0.65 0.00 0.56 0.00 0.00 36.38 34.45 1sw0 s VAL 226 CO 0.07 0.11 1.54 0.47 -0.31 0.00 0.00 175.10 176.98 1sw0 n ASP 227 N 4.98 3.97 0.00 4.85 10.43 -0.47 -4.75 116.55 135.55 1sw0 n ASP 227 Ca -0.14 -2.05 0.00 0.00 2.57 0.00 0.00 54.79 55.17 1sw0 n ASP 227 Cb 0.49 -0.49 0.00 0.00 1.84 0.00 0.00 41.12 42.96 1sw0 n ASP 227 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1sw0 n GLY 228 N 1.59 0.52 3.05 0.44 0.00 -1.26 -1.93 105.19 107.61 1sw0 n GLY 228 Ca 0.24 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 1sw0 n GLY 228 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sw0 s PHE 229 N -2.68 0.21 -0.23 1.61 0.08 -0.89 -1.13 117.98 114.96 1sw0 s PHE 229 Ca 0.00 -0.47 -0.05 0.00 0.12 0.00 0.00 56.93 56.53 1sw0 s PHE 229 Cb 0.00 -0.16 -0.02 0.00 -0.57 0.00 0.00 43.02 42.27 1sw0 s PHE 229 CO 0.00 -0.27 -0.01 -1.17 -0.10 0.00 0.00 175.22 173.67 1sw0 s LEU 230 N -1.73 3.08 -0.14 -0.37 2.96 -0.52 -0.55 118.68 121.40 1sw0 s LEU 230 Ca -0.11 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 1sw0 s LEU 230 Cb -0.06 -1.80 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 1sw0 s LEU 230 CO -0.02 -0.01 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.15 1sw0 s VAL 231 N 1.45 2.66 0.00 1.68 1.01 0.47 -4.15 120.40 123.53 1sw0 s VAL 231 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1sw0 s VAL 231 Cb -0.15 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1sw0 s VAL 231 CO -0.01 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1sw0 n GLY 232 N 3.88 -0.04 0.31 4.51 0.00 -1.26 -0.34 105.19 112.25 1sw0 n GLY 232 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1sw0 n GLY 232 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1sw0 h GLY 233 N 0.00 1.38 2.00 -0.02 0.00 -1.91 -1.04 103.07 103.49 1sw0 h GLY 233 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1sw0 h GLY 233 CO 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 176.54 176.47 1sw0 n ALA 234 N -2.44 1.95 0.64 3.60 0.00 -1.26 -2.86 120.51 120.14 1sw0 n ALA 234 Ca 0.17 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.68 1sw0 n ALA 234 Cb 0.46 -1.36 0.44 0.00 0.00 0.00 0.00 19.45 18.99 1sw0 n ALA 234 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1sw0 n SER 235 N -1.70 0.21 -1.29 0.00 3.41 -0.39 -2.71 113.62 111.15 1sw0 n SER 235 Ca 0.05 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.29 1sw0 n SER 235 Cb 0.26 -0.59 0.30 0.00 -0.26 0.00 0.00 64.21 63.92 1sw0 n SER 235 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1sw0 n LEU 236 N -1.71 3.77 -4.23 1.04 4.77 -1.13 -4.90 117.00 114.59 1sw0 n LEU 236 Ca 0.04 -1.89 -0.13 0.00 -0.03 0.00 0.00 56.01 54.00 1sw0 n LEU 236 Cb 0.26 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.77 1sw0 n LEU 236 CO 0.20 0.81 -0.41 -0.54 -1.33 0.00 0.00 177.39 176.13 1sw0 s LYS 237 N -1.39 1.01 0.54 3.23 1.02 -1.10 -5.05 119.74 118.00 1sw0 s LYS 237 Ca 0.44 -1.42 0.29 0.00 0.02 0.00 0.00 55.97 55.30 1sw0 s LYS 237 Cb 0.25 -0.53 1.56 0.00 -0.52 0.00 0.00 37.83 38.59 1sw0 s LYS 237 CO 0.27 0.05 2.11 -1.35 -0.92 0.00 0.00 175.35 175.51 1sw0 h PRO 238 N 2.84 0.00 0.00 -1.68 0.11 -1.93 -2.28 132.00 129.05 1sw0 h PRO 238 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1sw0 h PRO 238 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1sw0 h PRO 238 CO 0.64 0.09 0.00 -0.85 -0.21 0.00 0.00 178.00 177.67 1sw0 n GLU 239 N -3.58 0.16 -0.33 1.05 0.28 -1.26 -2.08 120.64 114.88 1sw0 n GLU 239 Ca -0.02 0.55 0.21 0.00 -0.16 0.00 0.00 57.16 57.74 1sw0 n GLU 239 Cb 0.21 -1.92 0.47 0.00 1.43 0.00 0.00 31.44 31.63 1sw0 n GLU 239 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1sw0 h PHE 240 N 0.00 0.77 -0.69 -1.84 3.57 -1.41 0.45 116.94 117.79 1sw0 h PHE 240 Ca 0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 1sw0 h PHE 240 Cb 0.15 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 1sw0 h PHE 240 CO 0.00 0.07 0.45 0.28 -2.23 0.00 0.00 178.31 176.88 1sw0 h VAL 241 N 0.46 1.15 -0.79 1.41 2.07 -1.66 -1.24 116.25 117.65 1sw0 h VAL 241 Ca 0.61 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.79 1sw0 h VAL 241 Cb 1.40 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 1sw0 h VAL 241 CO -0.34 0.17 0.42 0.44 0.02 0.00 0.00 177.57 178.28 1sw0 h ASP 242 N 0.91 0.99 -0.49 0.57 3.32 -1.11 -2.27 116.42 118.34 1sw0 h ASP 242 Ca 0.26 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 1sw0 h ASP 242 Cb -0.07 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 1sw0 h ASP 242 CO -0.07 0.80 -0.20 0.40 -1.72 0.00 0.00 179.24 178.45 1sw0 h ILE 243 N 1.11 1.27 -0.74 0.35 2.04 -0.90 -2.25 117.51 118.39 1sw0 h ILE 243 Ca 0.28 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.78 1sw0 h ILE 243 Cb 0.04 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 1sw0 h ILE 243 CO -0.04 0.47 0.49 0.40 0.00 0.00 0.00 178.15 179.47 1sw0 h ILE 244 N 0.86 1.17 -0.77 -0.67 2.04 -0.92 -2.16 117.51 117.05 1sw0 h ILE 244 Ca 0.11 -0.34 -0.33 0.00 1.00 0.00 0.00 64.86 65.31 1sw0 h ILE 244 Cb 0.79 0.10 -0.20 0.00 -0.74 0.00 0.00 36.82 36.77 1sw0 h ILE 244 CO 0.07 0.18 0.42 0.59 0.00 0.00 0.00 178.15 179.40 1sw0 n ASN 245 N -4.43 4.06 0.28 1.72 3.02 -0.88 -4.65 115.26 114.38 1sw0 n ASN 245 Ca 0.08 -3.25 0.12 0.00 -0.03 0.00 0.00 54.58 51.51 1sw0 n ASN 245 Cb 0.06 -0.76 0.79 0.00 -0.61 0.00 0.00 39.78 39.26 1sw0 n ASN 245 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sw0 h ALA 246 N 1.84 1.73 -0.00 5.41 0.00 -0.81 -0.54 119.26 126.89 1sw0 h ALA 246 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1sw0 h ALA 246 Cb 2.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.20 1sw0 h ALA 246 CO 0.82 0.00 -0.17 1.17 0.00 0.00 0.00 179.25 181.08 1sw0 n LYS 247 N -4.15 0.03 0.00 0.00 4.81 -1.26 -4.50 118.16 113.09 1sw0 n LYS 247 Ca -0.03 -0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 1sw0 n LYS 247 Cb 0.09 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.64 1sw0 n LYS 247 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29