#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bw1 h ALA 23 N 0.00 0.11 -4.08 -1.18 0.00 -2.00 -3.46 119.26 108.64 2bw1 h ALA 23 Ca 0.00 -0.40 -0.28 0.00 0.00 0.00 0.00 54.91 54.23 2bw1 h ALA 23 Cb 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2bw1 h ALA 23 CO 0.00 0.10 -0.27 -0.40 0.00 0.00 0.00 179.25 178.68 2bw1 n ASP 24 N -4.52 -0.42 -0.15 0.00 5.75 -1.26 -5.04 116.55 110.91 2bw1 n ASP 24 Ca -0.08 -2.28 -0.11 0.00 -0.01 0.00 0.00 54.79 52.31 2bw1 n ASP 24 Cb 0.45 0.99 -0.01 0.00 -1.03 0.00 0.00 41.12 41.51 2bw1 n ASP 24 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2bw1 h SER 25 N 1.19 0.83 -0.55 -1.12 0.02 -1.93 -2.06 113.55 109.93 2bw1 h SER 25 Ca -0.14 -0.36 0.05 0.00 -0.84 0.00 0.00 61.79 60.50 2bw1 h SER 25 Cb 0.70 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.97 2bw1 h SER 25 CO 0.20 0.99 0.29 0.11 -1.14 0.00 0.00 176.83 177.28 2bw1 h LYS 26 N 0.65 0.53 -0.86 3.45 1.57 -1.97 0.21 116.57 120.15 2bw1 h LYS 26 Ca 0.11 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 2bw1 h LYS 26 Cb 0.63 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.78 2bw1 h LYS 26 CO 0.04 0.35 0.46 0.00 -0.57 0.00 0.00 179.45 179.73 2bw1 h ALA 27 N 1.30 1.11 0.00 3.86 0.00 -1.89 -1.38 119.26 122.25 2bw1 h ALA 27 Ca 0.24 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 2bw1 h ALA 27 Cb 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bw1 h ALA 27 CO -0.17 0.63 -0.86 -0.24 0.00 0.00 0.00 179.25 178.61 2bw1 h VAL 28 N 1.21 1.50 -0.64 0.00 3.04 -1.05 -1.03 116.25 119.29 2bw1 h VAL 28 Ca 0.30 -2.62 0.00 0.00 -1.01 0.00 0.00 66.70 63.38 2bw1 h VAL 28 Cb 0.05 2.45 -0.03 0.00 -2.01 0.00 0.00 31.29 31.76 2bw1 h VAL 28 CO -0.05 0.76 0.40 -0.07 -1.01 0.00 0.00 177.57 177.61 2bw1 h LEU 29 N 0.10 0.75 -0.58 3.16 3.38 -0.70 -0.57 115.31 120.85 2bw1 h LEU 29 Ca -0.04 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 2bw1 h LEU 29 Cb 1.49 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 2bw1 h LEU 29 CO 0.13 0.57 -0.42 -1.13 0.09 0.00 0.00 178.44 177.68 2bw1 h ASN 30 N 0.87 0.70 -0.33 -0.43 -1.24 -1.12 -0.54 115.58 113.48 2bw1 h ASN 30 Ca 0.23 -0.32 0.06 0.00 0.71 0.00 0.00 56.30 56.97 2bw1 h ASN 30 Cb -0.05 -0.20 -0.05 0.00 0.73 0.00 0.00 38.32 38.75 2bw1 h ASN 30 CO -0.05 1.03 0.01 -0.61 -1.29 0.00 0.00 177.43 176.53 2bw1 h GLN 31 N 0.54 0.11 -0.72 6.67 5.75 -0.99 -1.72 115.11 124.75 2bw1 h GLN 31 Ca 0.04 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 2bw1 h GLN 31 Cb 0.95 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.44 2bw1 h GLN 31 CO 0.09 0.07 0.47 0.00 -2.65 0.00 0.00 178.83 176.81 2bw1 h ALA 32 N 1.28 1.54 -0.04 3.38 0.00 -0.67 0.00 119.26 124.75 2bw1 h ALA 32 Ca 0.16 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2bw1 h ALA 32 Cb 0.21 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2bw1 h ALA 32 CO -0.26 0.41 -0.00 0.28 0.00 0.00 0.00 179.25 179.68 2bw1 h VAL 33 N 0.92 0.98 -0.01 0.00 2.07 -0.26 0.19 116.25 120.13 2bw1 h VAL 33 Ca 0.27 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.79 2bw1 h VAL 33 Cb -0.03 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 2bw1 h VAL 33 CO -0.07 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.53 2bw1 h ALA 34 N 1.03 0.01 -0.50 1.67 0.00 -0.92 -2.43 119.26 118.12 2bw1 h ALA 34 Ca 0.02 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2bw1 h ALA 34 Cb 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2bw1 h ALA 34 CO -0.03 -0.45 -0.04 -0.44 0.00 0.00 0.00 179.25 178.29 2bw1 h ASP 35 N -0.06 0.85 -0.23 0.00 3.32 -0.88 -1.71 116.42 117.70 2bw1 h ASP 35 Ca 0.00 -0.23 -0.11 0.00 0.02 0.00 0.00 57.03 56.71 2bw1 h ASP 35 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2bw1 h ASP 35 CO -0.00 0.94 -0.25 -0.07 -1.72 0.00 0.00 179.24 178.14 2bw1 h LEU 36 N 0.80 0.72 -0.33 1.55 3.38 -0.64 -0.15 115.31 120.64 2bw1 h LEU 36 Ca 0.14 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2bw1 h LEU 36 Cb 0.53 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2bw1 h LEU 36 CO 0.03 0.94 0.16 0.28 0.09 0.00 0.00 178.44 179.94 2bw1 h SER 37 N 0.62 0.43 -0.49 -0.43 0.02 -1.05 0.20 113.55 112.84 2bw1 h SER 37 Ca 0.08 -0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 2bw1 h SER 37 Cb 0.74 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2bw1 h SER 37 CO 0.06 0.43 0.05 0.58 -1.14 0.00 0.00 176.83 176.80 2bw1 h VAL 38 N 0.40 1.26 -0.84 2.27 2.07 -1.25 -2.41 116.25 117.74 2bw1 h VAL 38 Ca 0.11 -0.99 0.05 0.00 0.82 0.00 0.00 66.70 66.70 2bw1 h VAL 38 Cb 0.11 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 2bw1 h VAL 38 CO -0.01 0.35 0.52 0.00 0.02 0.00 0.00 177.57 178.45 2bw1 h ALA 39 N 0.95 1.13 -0.58 1.67 0.00 -0.79 0.33 119.26 121.98 2bw1 h ALA 39 Ca 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2bw1 h ALA 39 Cb 0.44 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2bw1 h ALA 39 CO 0.02 0.30 0.33 1.25 0.00 0.00 0.00 179.25 181.14 2bw1 h HIS 40 N 0.98 0.79 -0.64 0.00 6.17 -0.84 -0.45 115.15 121.15 2bw1 h HIS 40 Ca 0.36 -0.02 0.01 0.00 0.71 0.00 0.00 60.37 61.43 2bw1 h HIS 40 Cb 0.11 -0.25 -0.03 0.00 2.52 0.00 0.00 27.41 29.76 2bw1 h HIS 40 CO -0.03 0.57 0.42 1.03 0.71 0.00 0.00 177.93 180.63 2bw1 h SER 41 N 0.79 0.74 -0.33 3.26 0.87 -0.72 -0.41 113.55 117.75 2bw1 h SER 41 Ca 0.21 -0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 2bw1 h SER 41 Cb 0.03 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 2bw1 h SER 41 CO -0.03 0.54 -0.12 0.40 -0.53 0.00 0.00 176.83 177.09 2bw1 h ILE 42 N 0.87 1.28 -0.99 2.23 2.04 -0.72 -0.27 117.51 121.95 2bw1 h ILE 42 Ca 0.24 -1.20 0.05 0.00 1.00 0.00 0.00 64.86 64.94 2bw1 h ILE 42 Cb -0.09 1.37 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 2bw1 h ILE 42 CO -0.05 0.39 0.64 -0.07 0.00 0.00 0.00 178.15 179.06 2bw1 h LEU 43 N 0.45 1.05 -0.61 1.44 3.38 -0.92 -0.58 115.31 119.53 2bw1 h LEU 43 Ca 0.08 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 2bw1 h LEU 43 Cb 0.64 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2bw1 h LEU 43 CO 0.04 0.70 -0.15 -0.74 0.09 0.00 0.00 178.44 178.38 2bw1 h HIS 44 N 1.21 1.06 -0.45 1.13 2.76 -0.66 -0.43 115.15 119.78 2bw1 h HIS 44 Ca 0.41 -0.23 0.02 0.00 -2.20 0.00 0.00 60.37 58.38 2bw1 h HIS 44 Cb 0.08 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.74 2bw1 h HIS 44 CO -0.00 1.02 0.25 0.37 -1.30 0.00 0.00 177.93 178.27 2bw1 h GLN 45 N 0.84 0.50 -0.11 5.26 4.15 -0.46 -1.53 115.11 123.76 2bw1 h GLN 45 Ca 0.13 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2bw1 h GLN 45 Cb 0.70 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.27 2bw1 h GLN 45 CO 0.05 0.33 0.06 0.28 -1.93 0.00 0.00 178.83 177.62 2bw1 h VAL 46 N 0.51 1.01 -0.60 2.39 2.07 -0.83 -0.96 116.25 119.85 2bw1 h VAL 46 Ca 0.18 -0.04 0.12 0.00 0.82 0.00 0.00 66.70 67.78 2bw1 h VAL 46 Cb 0.04 0.87 -0.11 0.00 -1.52 0.00 0.00 31.29 30.56 2bw1 h VAL 46 CO -0.10 0.02 -0.17 -0.74 0.02 0.00 0.00 177.57 176.61 2bw1 h HIS 47 N 0.13 -0.37 0.09 1.57 -0.00 -0.92 -1.63 115.15 114.02 2bw1 h HIS 47 Ca 0.04 0.06 -0.16 0.00 -0.00 0.00 0.00 60.37 60.30 2bw1 h HIS 47 Cb -0.00 0.25 0.02 0.00 -0.00 0.00 0.00 27.41 27.68 2bw1 h HIS 47 CO -0.08 -0.27 -0.70 -1.49 -0.00 0.00 0.00 177.93 175.39 2bw1 h TRP 48 N -0.02 0.53 -0.00 5.26 6.55 -0.95 -3.33 115.95 123.99 2bw1 h TRP 48 Ca 0.28 -0.35 0.00 0.00 0.95 0.00 0.00 58.89 59.77 2bw1 h TRP 48 Cb 0.45 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.72 2bw1 h TRP 48 CO -0.51 1.24 -0.15 0.66 -1.05 0.00 0.00 178.44 178.63 2bw1 n TYR 49 N -4.19 0.00 -1.67 0.49 4.02 -0.39 -4.94 117.16 110.48 2bw1 n TYR 49 Ca -0.13 0.00 -0.46 0.00 -0.01 0.00 0.00 57.90 57.31 2bw1 n TYR 49 Cb 0.76 -0.25 -0.04 0.00 -0.02 0.00 0.00 39.34 39.79 2bw1 n TYR 49 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 176.86 175.73 2bw1 n MET 50 N -1.13 2.20 -3.88 -0.72 1.56 -0.62 -4.45 117.12 110.09 2bw1 n MET 50 Ca 0.12 0.79 -0.11 0.00 -0.27 0.00 0.00 57.70 58.22 2bw1 n MET 50 Cb 0.30 -2.56 -0.13 0.00 2.15 0.00 0.00 33.22 32.98 2bw1 n MET 50 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2bw1 s ARG 51 N 0.84 0.15 0.00 2.12 0.52 -1.26 -5.05 118.95 116.27 2bw1 s ARG 51 Ca 0.78 -0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.88 2bw1 s ARG 51 Cb -0.66 0.06 0.00 0.00 0.52 0.00 0.00 34.95 34.87 2bw1 s ARG 51 CO 0.38 -0.03 0.00 0.41 0.02 0.00 0.00 175.30 176.09 2bw1 n GLY 52 N 2.62 2.68 3.71 -3.53 0.00 -1.26 -3.47 105.19 105.95 2bw1 n GLY 52 Ca -0.15 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 2bw1 n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bw1 s ARG 53 N -1.91 4.14 0.00 1.61 1.81 -1.26 -1.59 118.95 121.75 2bw1 s ARG 53 Ca 0.00 2.58 0.00 0.00 -1.72 0.00 0.00 55.73 56.59 2bw1 s ARG 53 Cb 0.00 -3.29 0.00 0.00 -0.45 0.00 0.00 34.95 31.21 2bw1 s ARG 53 CO 0.00 -0.78 0.00 0.41 -0.68 0.00 0.00 175.30 174.25 2bw1 n GLY 54 N 4.06 0.31 0.25 -3.53 0.00 -1.26 -4.96 105.19 100.06 2bw1 n GLY 54 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 2bw1 n GLY 54 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bw1 h PHE 55 N 0.00 0.24 0.00 1.61 3.57 -1.66 0.01 116.94 120.70 2bw1 h PHE 55 Ca 0.00 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2bw1 h PHE 55 Cb 0.00 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 2bw1 h PHE 55 CO 0.00 -0.05 -0.13 1.98 -2.23 0.00 0.00 178.31 177.88 2bw1 h MET 56 N 0.27 0.00 0.11 1.11 4.05 -1.94 0.24 114.93 118.77 2bw1 h MET 56 Ca 0.36 0.00 -0.24 0.00 -0.28 0.00 0.00 59.70 59.53 2bw1 h MET 56 Cb 0.56 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 2bw1 h MET 56 CO -0.44 0.13 -1.21 0.82 0.23 0.00 0.00 176.91 176.44 2bw1 h ILE 57 N 0.00 1.18 0.00 1.77 2.04 -1.89 -3.41 117.51 117.20 2bw1 h ILE 57 Ca -0.00 -2.42 -0.20 0.00 1.00 0.00 0.00 64.86 63.23 2bw1 h ILE 57 Cb 0.24 2.84 -0.03 0.00 -0.74 0.00 0.00 36.82 39.13 2bw1 h ILE 57 CO 0.02 0.69 -1.07 -0.50 0.00 0.00 0.00 178.15 177.28 2bw1 h TRP 58 N -0.38 0.00 0.53 1.37 4.06 -0.63 -2.84 115.95 118.06 2bw1 h TRP 58 Ca -0.25 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.67 2bw1 h TRP 58 Cb 1.69 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.85 2bw1 h TRP 58 CO 0.15 0.86 -0.26 1.25 -3.56 0.00 0.00 178.44 176.88 2bw1 h HIS 59 N 0.00 -0.66 0.00 0.49 -0.00 -0.75 -2.18 115.15 112.05 2bw1 h HIS 59 Ca -0.08 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.24 2bw1 h HIS 59 Cb 1.72 0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 29.35 2bw1 h HIS 59 CO 0.00 -0.38 -0.20 -1.00 -0.00 0.00 0.00 177.93 176.35 2bw1 h PRO 60 N -0.78 0.00 -0.33 5.26 0.13 -1.77 -2.55 132.00 131.96 2bw1 h PRO 60 Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 2bw1 h PRO 60 Cb 0.58 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 2bw1 h PRO 60 CO 0.12 0.20 0.17 -0.22 -0.23 0.00 0.00 178.00 178.04 2bw1 h LYS 61 N 0.00 0.45 -0.67 0.86 1.63 -1.24 -1.23 116.57 116.36 2bw1 h LYS 61 Ca -0.00 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 59.78 2bw1 h LYS 61 Cb 0.37 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.87 2bw1 h LYS 61 CO 0.03 0.34 0.45 0.52 -3.45 0.00 0.00 179.45 177.33 2bw1 h MET 62 N 0.46 0.85 -0.71 1.90 2.86 -0.95 -1.57 114.93 117.76 2bw1 h MET 62 Ca 0.12 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2bw1 h MET 62 Cb 0.03 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 2bw1 h MET 62 CO -0.02 0.56 0.39 0.22 1.06 0.00 0.00 176.91 179.13 2bw1 h ASP 63 N 0.87 0.88 -0.34 1.22 3.58 -1.29 0.23 116.42 121.58 2bw1 h ASP 63 Ca 0.26 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 2bw1 h ASP 63 Cb -0.04 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 2bw1 h ASP 63 CO -0.06 0.72 0.18 -0.33 -2.88 0.00 0.00 179.24 176.87 2bw1 h GLU 64 N 0.98 0.47 -0.42 0.28 5.08 -1.11 -0.55 114.58 119.32 2bw1 h GLU 64 Ca 0.25 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 2bw1 h GLU 64 Cb 0.03 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2bw1 h GLU 64 CO -0.04 0.40 0.15 1.88 -1.00 0.00 0.00 179.01 180.40 2bw1 h TYR 65 N 0.42 0.65 -0.49 4.33 0.99 -0.98 -1.73 116.97 120.17 2bw1 h TYR 65 Ca 0.12 -0.06 0.07 0.00 2.00 0.00 0.00 58.73 60.86 2bw1 h TYR 65 Cb 0.07 -0.19 -0.06 0.00 1.00 0.00 0.00 36.73 37.55 2bw1 h TYR 65 CO -0.03 0.58 0.17 0.52 -0.00 0.00 0.00 178.16 179.40 2bw1 h MET 66 N 0.53 0.33 -0.67 4.88 2.86 -0.39 -0.41 114.93 122.05 2bw1 h MET 66 Ca 0.14 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.79 2bw1 h MET 66 Cb 0.22 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2bw1 h MET 66 CO -0.01 0.22 0.41 0.93 1.06 0.00 0.00 176.91 179.52 2bw1 h GLU 67 N 0.34 0.77 -0.23 1.72 3.07 -0.74 -1.13 114.58 118.38 2bw1 h GLU 67 Ca 0.23 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.02 2bw1 h GLU 67 Cb 0.25 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 2bw1 h GLU 67 CO -0.24 0.51 0.03 1.49 -1.40 0.00 0.00 179.01 179.40 2bw1 h GLU 68 N 0.79 0.38 -0.97 2.33 4.81 -0.90 -0.94 114.58 120.09 2bw1 h GLU 68 Ca 0.28 -0.10 0.05 0.00 -0.13 0.00 0.00 59.36 59.45 2bw1 h GLU 68 Cb 0.05 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 2bw1 h GLU 68 CO -0.12 0.52 0.63 0.82 -0.73 0.00 0.00 179.01 180.13 2bw1 h ILE 69 N 0.18 1.12 -0.18 2.32 5.03 -0.91 -1.08 117.51 123.98 2bw1 h ILE 69 Ca 0.07 -0.40 -0.10 0.00 -0.12 0.00 0.00 64.86 64.31 2bw1 h ILE 69 Cb 0.33 -0.15 -0.01 0.00 -3.03 0.00 0.00 36.82 33.96 2bw1 h ILE 69 CO 0.01 0.21 -0.32 0.44 -0.68 0.00 0.00 178.15 177.81 2bw1 h ASP 70 N 1.17 0.37 -0.16 1.72 3.45 -1.01 0.88 116.42 122.85 2bw1 h ASP 70 Ca 0.40 -0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.73 2bw1 h ASP 70 Cb 0.10 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.76 2bw1 h ASP 70 CO -0.14 0.68 0.10 1.23 -1.57 0.00 0.00 179.24 179.54 2bw1 h GLY 71 N 1.08 0.22 1.00 2.75 0.00 0.04 -0.59 103.07 107.57 2bw1 h GLY 71 Ca 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2bw1 h GLY 71 CO 0.06 0.08 0.36 -0.97 0.00 0.00 0.00 176.54 176.07 2bw1 h TYR 72 N 0.20 0.78 -0.87 5.60 0.05 -0.91 0.77 116.97 122.59 2bw1 h TYR 72 Ca 0.06 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.90 2bw1 h TYR 72 Cb -0.01 -0.26 -0.06 0.00 1.01 0.00 0.00 36.73 37.42 2bw1 h TYR 72 CO -0.06 0.52 0.57 1.25 -1.05 0.00 0.00 178.16 179.39 2bw1 h LEU 73 N 0.80 0.86 0.89 3.88 5.85 -0.62 0.44 115.31 127.41 2bw1 h LEU 73 Ca 0.21 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 2bw1 h LEU 73 Cb -0.03 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 40.83 2bw1 h LEU 73 CO -0.04 0.55 -0.46 0.44 -0.34 0.00 0.00 178.44 178.59 2bw1 h ASP 74 N 0.97 -1.12 0.28 1.25 3.32 -0.04 -0.11 116.42 120.97 2bw1 h ASP 74 Ca 0.37 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.42 2bw1 h ASP 74 Cb 0.21 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 2bw1 h ASP 74 CO -0.14 -0.76 -0.22 -0.33 -1.72 0.00 0.00 179.24 176.07 2bw1 h GLU 75 N -1.24 0.00 0.05 3.56 5.08 -0.64 -2.50 114.58 118.90 2bw1 h GLU 75 Ca -0.12 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 2bw1 h GLU 75 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2bw1 h GLU 75 CO 0.18 0.22 -0.54 0.52 -1.00 0.00 0.00 179.01 178.39 2bw1 h MET 76 N 0.00 0.10 -0.05 2.33 2.86 -0.83 -2.09 114.93 117.25 2bw1 h MET 76 Ca -0.00 -0.18 0.03 0.00 -2.06 0.00 0.00 59.70 57.50 2bw1 h MET 76 Cb 0.42 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.11 2bw1 h MET 76 CO 0.03 1.08 -0.18 0.66 1.06 0.00 0.00 176.91 179.56 2bw1 h SER 77 N -0.76 -0.54 -0.22 1.22 4.64 -1.08 -1.74 113.55 115.06 2bw1 h SER 77 Ca -0.12 0.08 0.05 0.00 -0.47 0.00 0.00 61.79 61.33 2bw1 h SER 77 Cb 1.29 0.24 -0.07 0.00 -0.31 0.00 0.00 62.40 63.54 2bw1 h SER 77 CO 0.01 -0.24 -0.46 -0.33 -0.87 0.00 0.00 176.83 174.95 2bw1 h GLU 78 N -0.27 -0.45 -1.00 4.77 5.08 -1.55 -1.12 114.58 120.04 2bw1 h GLU 78 Ca 0.07 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.61 2bw1 h GLU 78 Cb 0.37 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.63 2bw1 h GLU 78 CO -0.20 -0.30 0.62 -0.09 -1.00 0.00 0.00 179.01 178.04 2bw1 h ARG 79 N -0.46 0.86 -0.42 2.33 9.65 -1.26 -0.06 114.38 125.02 2bw1 h ARG 79 Ca 0.08 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 2bw1 h ARG 79 Cb 0.63 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.99 2bw1 h ARG 79 CO -0.47 0.57 0.24 1.25 2.80 0.00 0.00 179.97 184.36 2bw1 h LEU 80 N 0.88 0.51 -0.27 3.80 5.85 -0.56 -0.53 115.31 125.00 2bw1 h LEU 80 Ca 0.53 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.18 2bw1 h LEU 80 Cb 0.68 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2bw1 h LEU 80 CO -0.31 0.44 0.16 0.40 -0.34 0.00 0.00 178.44 178.79 2bw1 h ILE 81 N 0.55 1.10 -0.78 4.05 2.04 -0.00 0.20 117.51 124.67 2bw1 h ILE 81 Ca 0.15 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.83 2bw1 h ILE 81 Cb 0.02 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 2bw1 h ILE 81 CO -0.03 0.10 0.51 0.74 0.00 0.00 0.00 178.15 179.48 2bw1 h THR 82 N 0.34 1.04 0.00 -0.27 2.02 -0.88 -0.79 112.91 114.37 2bw1 h THR 82 Ca 0.10 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2bw1 h THR 82 Cb 0.02 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 2bw1 h THR 82 CO -0.02 0.15 0.00 0.18 0.37 0.00 0.00 175.52 176.21 2bw1 n LEU 83 N -4.48 0.00 0.00 2.58 4.77 -0.22 -4.87 117.00 114.77 2bw1 n LEU 83 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2bw1 n LEU 83 Cb 0.22 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2bw1 n LEU 83 CO 0.33 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2bw1 n GLY 84 N 0.54 0.47 4.02 -0.72 0.00 -0.30 -5.07 105.19 104.13 2bw1 n GLY 84 Ca 0.15 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 45.02 2bw1 n GLY 84 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bw1 s GLY 85 N -2.90 1.73 -0.29 -0.02 0.00 0.67 -5.00 107.32 101.52 2bw1 s GLY 85 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 42.69 2bw1 s GLY 85 CO 0.00 -1.50 0.05 0.00 0.00 0.00 0.00 173.10 171.65 2bw1 s ALA 86 N -2.88 1.82 0.41 3.20 0.00 -1.26 -4.33 121.76 118.72 2bw1 s ALA 86 Ca 0.64 -1.66 -0.26 0.00 0.00 0.00 0.00 51.96 50.69 2bw1 s ALA 86 Cb -0.05 -1.60 -0.09 0.00 0.00 0.00 0.00 23.12 21.39 2bw1 s ALA 86 CO 0.42 -1.51 1.30 -1.25 0.00 0.00 0.00 175.76 174.72 2bw1 s PRO 87 N 1.46 3.94 0.35 0.00 0.04 -1.26 -4.97 135.00 134.56 2bw1 s PRO 87 Ca 0.05 2.15 -0.27 0.00 0.04 0.00 0.00 61.00 62.98 2bw1 s PRO 87 Cb -0.18 -2.73 -0.12 0.00 0.04 0.00 0.00 34.50 31.50 2bw1 s PRO 87 CO -0.16 -0.52 1.09 1.19 0.04 0.00 0.00 177.00 178.64 2bw1 n PHE 88 N 0.08 1.52 -2.26 0.56 0.99 -1.26 -4.90 117.46 112.20 2bw1 n PHE 88 Ca 0.04 0.61 -0.03 0.00 -0.00 0.00 0.00 57.45 58.07 2bw1 n PHE 88 Cb 0.44 -2.29 -0.02 0.00 -1.00 0.00 0.00 39.48 36.61 2bw1 n PHE 88 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2bw1 n SER 89 N 0.84 -0.35 -3.95 4.37 3.41 -1.26 -4.94 113.62 111.74 2bw1 n SER 89 Ca 0.08 -2.02 -0.09 0.00 -0.26 0.00 0.00 58.87 56.57 2bw1 n SER 89 Cb 0.36 0.13 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 2bw1 n SER 89 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2bw1 s THR 90 N -0.19 0.12 0.31 6.66 -4.23 -1.26 -5.06 115.64 112.00 2bw1 s THR 90 Ca 0.12 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.62 2bw1 s THR 90 Cb 0.17 -0.61 0.20 0.00 1.34 0.00 0.00 72.50 73.60 2bw1 s THR 90 CO -0.06 -0.56 1.90 -0.07 -0.54 0.00 0.00 174.62 175.29 2bw1 h LEU 91 N 4.12 0.75 -0.17 4.79 3.38 -1.99 -1.87 115.31 124.32 2bw1 h LEU 91 Ca -0.32 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.59 2bw1 h LEU 91 Cb 1.19 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 2bw1 h LEU 91 CO 0.46 0.66 -0.01 0.50 0.09 0.00 0.00 178.44 180.15 2bw1 h LYS 92 N 0.83 0.04 -0.38 1.13 3.64 -1.99 0.29 116.57 120.13 2bw1 h LYS 92 Ca 0.20 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2bw1 h LYS 92 Cb 0.13 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2bw1 h LYS 92 CO -0.02 0.03 0.24 0.93 -2.27 0.00 0.00 179.45 178.36 2bw1 h GLU 93 N 0.05 0.51 0.00 1.90 5.08 -1.90 0.37 114.58 120.59 2bw1 h GLU 93 Ca 0.08 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2bw1 h GLU 93 Cb 0.10 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2bw1 h GLU 93 CO -0.14 0.37 -0.00 0.74 -1.00 0.00 0.00 179.01 178.97 2bw1 h PHE 94 N 0.51 -0.00 -0.18 4.33 0.05 -1.10 -1.34 116.94 119.21 2bw1 h PHE 94 Ca 0.14 -0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.91 2bw1 h PHE 94 Cb -0.02 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.92 2bw1 h PHE 94 CO -0.04 0.02 0.03 1.03 -0.18 0.00 0.00 178.31 179.16 2bw1 h SER 95 N -0.02 0.28 -0.52 2.17 0.87 -0.71 -0.88 113.55 114.75 2bw1 h SER 95 Ca -0.00 -0.26 -0.11 0.00 -1.23 0.00 0.00 61.79 60.18 2bw1 h SER 95 Cb 0.02 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 2bw1 h SER 95 CO 0.00 0.47 -0.10 -0.33 -0.53 0.00 0.00 176.83 176.34 2bw1 h GLU 96 N 0.08 1.00 0.00 2.24 5.08 -0.94 -3.22 114.58 118.82 2bw1 h GLU 96 Ca 0.05 -0.36 -0.13 0.00 -1.00 0.00 0.00 59.36 57.92 2bw1 h GLU 96 Cb 0.31 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2bw1 h GLU 96 CO 0.00 1.04 -0.62 -0.91 -1.00 0.00 0.00 179.01 177.53 2bw1 h ASN 97 N 0.89 0.00 -3.92 1.42 2.35 -1.21 -3.46 115.58 111.66 2bw1 h ASN 97 Ca 0.14 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.37 2bw1 h ASN 97 Cb 0.66 0.00 0.07 0.00 0.05 0.00 0.00 38.32 39.10 2bw1 h ASN 97 CO 0.05 0.62 0.61 -0.55 -1.65 0.00 0.00 177.43 176.50 2bw1 s SER 98 N -6.52 6.53 0.00 5.81 0.15 -0.34 -4.89 113.70 114.44 2bw1 s SER 98 Ca 0.03 2.63 0.28 0.00 0.70 0.00 0.00 55.95 59.59 2bw1 s SER 98 Cb 0.08 -2.64 1.08 0.00 -1.71 0.00 0.00 66.02 62.83 2bw1 s SER 98 CO 0.76 -0.69 1.76 0.00 1.20 0.00 0.00 173.24 176.27 2bw1 n GLN 99 N 0.40 1.15 -2.83 5.44 1.13 -1.26 -4.86 117.38 116.55 2bw1 n GLN 99 Ca 0.02 -0.58 -0.38 0.00 -1.94 0.00 0.00 57.00 54.13 2bw1 n GLN 99 Cb 0.43 -1.49 -0.06 0.00 0.11 0.00 0.00 30.24 29.23 2bw1 n GLN 99 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2bw1 s LEU 100 N -2.25 4.43 -0.12 1.08 1.43 -1.26 -5.07 118.68 116.92 2bw1 s LEU 100 Ca 0.33 1.79 -0.01 0.00 -1.03 0.00 0.00 54.13 55.22 2bw1 s LEU 100 Cb 0.20 -3.81 -0.02 0.00 0.03 0.00 0.00 46.19 42.59 2bw1 s LEU 100 CO 0.42 0.02 -0.10 -0.54 0.23 0.00 0.00 176.35 176.38 2bw1 s LYS 101 N -1.77 3.33 -0.00 1.70 1.02 -1.26 -5.08 119.74 117.68 2bw1 s LYS 101 Ca 0.46 -0.63 -0.04 0.00 0.02 0.00 0.00 55.97 55.78 2bw1 s LYS 101 Cb -0.20 -2.68 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 2bw1 s LYS 101 CO 0.25 0.30 0.20 -1.21 -0.92 0.00 0.00 175.35 173.97 2bw1 s GLU 102 N 0.16 3.47 0.35 1.68 2.02 -1.26 -5.11 118.70 120.01 2bw1 s GLU 102 Ca -0.05 -0.26 0.06 0.00 0.02 0.00 0.00 54.97 54.74 2bw1 s GLU 102 Cb -0.15 -3.09 -0.07 0.00 0.10 0.00 0.00 34.13 30.93 2bw1 s GLU 102 CO 0.04 0.67 0.00 0.14 0.02 0.00 0.00 175.26 176.13 2bw1 s VAL 103 N -1.32 1.72 0.45 2.63 -7.23 -1.26 -5.12 120.40 110.26 2bw1 s VAL 103 Ca 0.27 -2.05 -0.24 0.00 -1.81 0.00 0.00 61.98 58.16 2bw1 s VAL 103 Cb -0.13 -2.80 -0.08 0.00 0.56 0.00 0.00 36.38 33.94 2bw1 s VAL 103 CO 0.18 -0.08 1.18 -0.76 -0.31 0.00 0.00 175.10 175.32 2bw1 s LEU 104 N -3.58 4.06 0.36 1.32 1.43 -1.26 -4.96 118.68 116.05 2bw1 s LEU 104 Ca 0.34 2.36 -0.28 0.00 -1.03 0.00 0.00 54.13 55.52 2bw1 s LEU 104 Cb 0.08 -4.17 -0.11 0.00 0.03 0.00 0.00 46.19 42.01 2bw1 s LEU 104 CO 0.16 -0.89 1.47 0.61 0.23 0.00 0.00 176.35 177.93 2bw1 n GLY 105 N 0.52 1.12 2.70 -3.19 0.00 -1.26 -5.02 105.19 100.06 2bw1 n GLY 105 Ca 0.06 0.33 -0.21 0.00 0.00 0.00 0.00 46.02 46.20 2bw1 n GLY 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bw1 s ASP 106 N -0.09 1.63 0.43 1.61 -1.08 -1.26 -5.03 116.67 112.89 2bw1 s ASP 106 Ca 0.55 -0.25 0.30 0.00 -0.52 0.00 0.00 52.55 52.63 2bw1 s ASP 106 Cb -0.49 0.04 1.29 0.00 -1.46 0.00 0.00 42.92 42.30 2bw1 s ASP 106 CO 0.62 -0.31 1.89 1.88 0.52 0.00 0.00 175.17 179.76 2bw1 h TYR 107 N 8.38 0.00 0.00 -5.34 -1.99 -1.96 -2.87 116.97 113.19 2bw1 h TYR 107 Ca -0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.58 2bw1 h TYR 107 Cb 1.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.87 2bw1 h TYR 107 CO 0.23 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.48 2bw1 n ASN 108 N -2.70 0.14 -4.76 3.88 3.02 -1.26 -4.58 115.26 109.01 2bw1 n ASN 108 Ca 0.01 0.52 -0.41 0.00 -0.03 0.00 0.00 54.58 54.66 2bw1 n ASN 108 Cb 0.24 -0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 38.84 2bw1 n ASN 108 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bw1 s VAL 109 N -3.02 2.44 0.65 2.41 1.01 -1.09 -4.97 120.40 117.83 2bw1 s VAL 109 Ca 0.13 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.38 2bw1 s VAL 109 Cb 0.17 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.28 2bw1 s VAL 109 CO 0.52 0.08 1.05 0.42 0.00 0.00 0.00 175.10 177.17 2bw1 s THR 110 N -0.52 4.04 0.31 3.92 -4.23 -1.26 -4.64 115.64 113.25 2bw1 s THR 110 Ca 0.56 0.77 -0.01 0.00 -1.18 0.00 0.00 61.69 61.83 2bw1 s THR 110 Cb -0.43 -3.44 0.25 0.00 1.34 0.00 0.00 72.50 70.21 2bw1 s THR 110 CO 0.51 -0.76 1.96 -0.29 -0.54 0.00 0.00 174.62 175.51 2bw1 h ILE 111 N -0.22 1.20 -0.09 2.99 2.10 -1.93 0.03 117.51 121.60 2bw1 h ILE 111 Ca -0.45 -0.41 -0.10 0.00 1.08 0.00 0.00 64.86 64.98 2bw1 h ILE 111 Cb 1.21 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 37.02 2bw1 h ILE 111 CO 0.58 0.20 -0.41 -0.33 -1.08 0.00 0.00 178.15 177.11 2bw1 h GLU 112 N 1.05 0.20 -0.30 2.19 5.08 -1.92 -1.26 114.58 119.61 2bw1 h GLU 112 Ca 0.28 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 58.43 2bw1 h GLU 112 Cb -0.09 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2bw1 h GLU 112 CO -0.06 0.58 -0.27 0.93 -1.00 0.00 0.00 179.01 179.19 2bw1 h GLU 113 N 0.17 0.71 -0.53 2.33 5.08 -1.76 -1.23 114.58 119.35 2bw1 h GLU 113 Ca 0.01 -0.36 0.09 0.00 -1.00 0.00 0.00 59.36 58.10 2bw1 h GLU 113 Cb 0.80 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 2bw1 h GLU 113 CO 0.06 0.98 0.13 1.96 -1.00 0.00 0.00 179.01 181.15 2bw1 h GLN 114 N 0.46 0.27 -0.72 2.33 1.08 -0.78 0.28 115.11 118.03 2bw1 h GLN 114 Ca 0.05 -0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 2bw1 h GLN 114 Cb 0.83 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.17 2bw1 h GLN 114 CO 0.07 0.18 0.23 -0.07 -0.95 0.00 0.00 178.83 178.29 2bw1 h LEU 115 N 0.28 1.03 -1.12 1.46 3.38 -1.08 -1.47 115.31 117.80 2bw1 h LEU 115 Ca 0.26 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2bw1 h LEU 115 Cb 0.35 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2bw1 h LEU 115 CO -0.32 0.96 0.42 0.00 0.09 0.00 0.00 178.44 179.59 2bw1 h ALA 116 N 1.18 1.33 -0.58 1.53 0.00 -0.80 -0.87 119.26 121.04 2bw1 h ALA 116 Ca 0.23 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2bw1 h ALA 116 Cb 0.29 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2bw1 h ALA 116 CO -0.01 0.56 0.02 0.00 0.00 0.00 0.00 179.25 179.82 2bw1 h ARG 117 N 1.04 1.00 -0.50 0.00 3.08 -0.16 -1.82 114.38 117.02 2bw1 h ARG 117 Ca 0.27 -0.29 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 2bw1 h ARG 117 Cb 0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 2bw1 h ARG 117 CO -0.05 0.97 0.07 0.28 -1.07 0.00 0.00 179.97 180.17 2bw1 h VAL 118 N 0.92 1.25 -0.54 2.04 2.07 -0.80 -2.02 116.25 119.17 2bw1 h VAL 118 Ca 0.17 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.78 2bw1 h VAL 118 Cb 0.51 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 2bw1 h VAL 118 CO 0.02 0.34 0.27 0.58 0.02 0.00 0.00 177.57 178.81 2bw1 h VAL 119 N 0.72 0.94 -0.40 2.57 2.07 -0.98 0.07 116.25 121.24 2bw1 h VAL 119 Ca 0.15 -0.18 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2bw1 h VAL 119 Cb 0.42 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2bw1 h VAL 119 CO 0.01 0.10 0.24 -0.33 0.02 0.00 0.00 177.57 177.60 2bw1 h GLU 120 N 0.53 0.46 -0.54 1.57 5.08 -1.05 0.19 114.58 120.83 2bw1 h GLU 120 Ca 0.24 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 2bw1 h GLU 120 Cb 0.16 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 2bw1 h GLU 120 CO -0.17 0.31 0.31 0.28 -1.00 0.00 0.00 179.01 178.74 2bw1 h VAL 121 N 0.48 1.04 -0.45 3.13 2.07 -0.95 -1.76 116.25 119.80 2bw1 h VAL 121 Ca 0.16 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.37 2bw1 h VAL 121 Cb 0.01 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 2bw1 h VAL 121 CO -0.08 0.11 -0.13 -0.26 0.02 0.00 0.00 177.57 177.24 2bw1 h PHE 122 N 0.62 0.93 -0.79 1.57 -1.00 -0.25 -0.34 116.94 117.68 2bw1 h PHE 122 Ca 0.22 -0.18 -0.05 0.00 2.81 0.00 0.00 57.97 60.77 2bw1 h PHE 122 Cb 0.04 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 39.33 2bw1 h PHE 122 CO -0.07 0.91 0.31 0.00 -1.61 0.00 0.00 178.31 177.86 2bw1 h ARG 123 N 0.75 1.17 0.16 1.51 3.08 -0.42 0.25 114.38 120.88 2bw1 h ARG 123 Ca 0.12 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2bw1 h ARG 123 Cb 0.63 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2bw1 h ARG 123 CO 0.04 0.95 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.90 2bw1 h TYR 124 N 1.14 -0.20 -0.73 3.04 3.20 -0.93 -2.21 116.97 120.29 2bw1 h TYR 124 Ca 0.26 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.21 2bw1 h TYR 124 Cb 0.21 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.48 2bw1 h TYR 124 CO 0.02 -0.01 0.39 -0.07 -1.64 0.00 0.00 178.16 176.85 2bw1 h LEU 125 N -0.35 0.55 -0.81 2.82 3.38 -0.78 0.09 115.31 120.21 2bw1 h LEU 125 Ca -0.02 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2bw1 h LEU 125 Cb 0.28 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2bw1 h LEU 125 CO 0.04 0.33 0.43 0.00 0.09 0.00 0.00 178.44 179.33 2bw1 h ALA 126 N 1.41 1.04 -0.27 1.53 0.00 -0.86 0.26 119.26 122.36 2bw1 h ALA 126 Ca 0.34 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 2bw1 h ALA 126 Cb 0.30 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2bw1 h ALA 126 CO -0.23 0.56 -0.35 0.00 0.00 0.00 0.00 179.25 179.23 2bw1 h ALA 127 N 1.23 0.88 -0.73 0.00 0.00 -0.98 0.20 119.26 119.86 2bw1 h ALA 127 Ca 0.28 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2bw1 h ALA 127 Cb 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2bw1 h ALA 127 CO -0.04 0.63 0.40 1.25 0.00 0.00 0.00 179.25 181.49 2bw1 h LEU 128 N 0.51 0.90 -0.87 0.00 5.85 -0.46 -0.63 115.31 120.61 2bw1 h LEU 128 Ca 0.05 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.58 2bw1 h LEU 128 Cb 0.84 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2bw1 h LEU 128 CO 0.07 0.73 -0.24 -0.26 -0.34 0.00 0.00 178.44 178.40 2bw1 h PHE 129 N 1.00 0.63 -0.44 1.25 0.05 -0.16 0.09 116.94 119.36 2bw1 h PHE 129 Ca 0.26 -0.14 -0.04 0.00 3.82 0.00 0.00 57.97 61.87 2bw1 h PHE 129 Cb 0.03 -0.15 -0.02 0.00 2.00 0.00 0.00 35.95 37.81 2bw1 h PHE 129 CO -0.00 0.76 0.11 0.37 -0.18 0.00 0.00 178.31 179.37 2bw1 h GLN 130 N 0.49 0.70 -0.73 1.51 5.75 -0.71 0.07 115.11 122.19 2bw1 h GLN 130 Ca 0.07 -0.17 0.09 0.00 -0.15 0.00 0.00 58.65 58.49 2bw1 h GLN 130 Cb 0.69 -0.09 -0.07 0.00 1.07 0.00 0.00 27.48 29.08 2bw1 h GLN 130 CO 0.05 0.70 0.38 0.87 -2.65 0.00 0.00 178.83 178.18 2bw1 h LYS 131 N 0.57 0.63 -0.51 1.69 1.57 -0.59 -0.49 116.57 119.45 2bw1 h LYS 131 Ca 0.14 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.76 2bw1 h LYS 131 Cb 0.31 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2bw1 h LYS 131 CO 0.00 0.42 -0.15 0.78 -0.57 0.00 0.00 179.45 179.93 2bw1 h GLY 132 N 0.65 1.06 0.54 3.86 0.00 -0.53 -1.18 103.07 107.47 2bw1 h GLY 132 Ca 0.35 -0.88 0.02 0.00 0.00 0.00 0.00 47.33 46.83 2bw1 h GLY 132 CO -0.25 0.80 -0.23 -2.75 0.00 0.00 0.00 176.54 174.10 2bw1 h PHE 133 N 0.86 -0.62 0.07 5.60 3.57 -0.57 -1.00 116.94 124.85 2bw1 h PHE 133 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2bw1 h PHE 133 Cb 0.71 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 2bw1 h PHE 133 CO 0.05 -0.33 -0.06 -0.44 -2.23 0.00 0.00 178.31 175.29 2bw1 h ASP 134 N -0.41 -0.16 -0.53 0.41 3.32 -0.91 0.13 116.42 118.27 2bw1 h ASP 134 Ca 0.04 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2bw1 h ASP 134 Cb 0.45 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 2bw1 h ASP 134 CO -0.16 -0.10 0.32 0.58 -1.72 0.00 0.00 179.24 178.15 2bw1 h VAL 135 N -0.14 1.17 -0.27 -1.35 2.07 -1.15 -1.71 116.25 114.87 2bw1 h VAL 135 Ca 0.00 -0.39 -0.15 0.00 0.82 0.00 0.00 66.70 66.98 2bw1 h VAL 135 Cb 0.13 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2bw1 h VAL 135 CO -0.01 0.17 -0.45 0.77 0.02 0.00 0.00 177.57 178.07 2bw1 h SER 136 N 0.72 0.74 -0.21 0.57 4.64 -1.02 -1.89 113.55 117.10 2bw1 h SER 136 Ca 0.19 -0.35 0.01 0.00 -0.47 0.00 0.00 61.79 61.17 2bw1 h SER 136 Cb 0.00 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 2bw1 h SER 136 CO -0.03 1.08 0.11 -0.78 -0.87 0.00 0.00 176.83 176.34 2bw1 h ASP 137 N 0.55 0.18 -0.59 4.97 3.58 -0.82 0.18 116.42 124.47 2bw1 h ASP 137 Ca 0.03 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.55 2bw1 h ASP 137 Cb 1.00 -0.04 -0.05 0.00 1.72 0.00 0.00 39.33 41.96 2bw1 h ASP 137 CO 0.09 0.14 0.29 -0.33 -2.88 0.00 0.00 179.24 176.56 2bw1 h GLU 138 N 0.24 0.54 0.00 0.28 3.07 -1.11 -1.09 114.58 116.51 2bw1 h GLU 138 Ca 0.08 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 2bw1 h GLU 138 Cb 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 27.79 2bw1 h GLU 138 CO -0.04 0.35 0.00 0.39 -1.40 0.00 0.00 179.01 178.31 2bw1 n GLU 139 N -4.87 0.18 -1.43 2.33 1.02 -0.73 -4.90 120.64 112.24 2bw1 n GLU 139 Ca 0.07 0.32 -0.03 0.00 -0.02 0.00 0.00 57.16 57.49 2bw1 n GLU 139 Cb 0.18 -1.79 -0.01 0.00 -0.02 0.00 0.00 31.44 29.80 2bw1 n GLU 139 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bw1 n GLY 140 N 0.48 0.48 3.42 0.62 0.00 -0.25 -4.98 105.19 104.97 2bw1 n GLY 140 Ca 0.04 -0.87 -0.44 0.00 0.00 0.00 0.00 46.02 44.74 2bw1 n GLY 140 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bw1 s ASP 141 N -2.93 6.99 0.32 1.61 -1.08 0.47 -4.86 116.67 117.20 2bw1 s ASP 141 Ca 0.00 -2.86 0.14 0.00 -0.52 0.00 0.00 52.55 49.31 2bw1 s ASP 141 Cb 0.00 -2.35 0.50 0.00 -1.46 0.00 0.00 42.92 39.62 2bw1 s ASP 141 CO 0.00 -0.72 1.67 0.77 0.52 0.00 0.00 175.17 177.42 2bw1 h SER 142 N 7.51 0.00 -0.16 -0.34 4.64 -1.94 -1.22 113.55 122.04 2bw1 h SER 142 Ca 0.23 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2bw1 h SER 142 Cb 0.92 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 2bw1 h SER 142 CO 1.12 0.51 0.05 0.58 -0.87 0.00 0.00 176.83 178.22 2bw1 h VAL 143 N 0.00 1.18 -0.49 0.95 2.07 -1.96 -1.90 116.25 116.10 2bw1 h VAL 143 Ca -0.01 -0.56 -0.07 0.00 0.82 0.00 0.00 66.70 66.89 2bw1 h VAL 143 Cb 0.99 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2bw1 h VAL 143 CO 0.07 0.17 0.03 0.74 0.02 0.00 0.00 177.57 178.60 2bw1 h THR 144 N 0.08 1.24 -0.70 2.57 2.02 -1.94 -2.51 112.91 113.66 2bw1 h THR 144 Ca 0.05 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.32 2bw1 h THR 144 Cb 0.22 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 2bw1 h THR 144 CO -0.00 0.34 0.44 -1.13 0.37 0.00 0.00 175.52 175.53 2bw1 h ASN 145 N 0.75 0.71 -0.21 4.18 -0.73 -0.98 -2.56 115.58 116.74 2bw1 h ASN 145 Ca 0.15 0.00 -0.16 0.00 1.87 0.00 0.00 56.30 58.16 2bw1 h ASN 145 Cb 0.41 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.84 2bw1 h ASN 145 CO 0.01 0.49 -0.46 -0.78 -0.37 0.00 0.00 177.43 176.33 2bw1 h ASP 146 N 0.85 0.84 -0.47 1.15 3.58 -1.10 -2.06 116.42 119.22 2bw1 h ASP 146 Ca 0.29 -0.41 0.09 0.00 0.42 0.00 0.00 57.03 57.41 2bw1 h ASP 146 Cb 0.04 -0.24 -0.07 0.00 1.72 0.00 0.00 39.33 40.77 2bw1 h ASP 146 CO -0.12 1.17 0.03 0.40 -2.88 0.00 0.00 179.24 177.84 2bw1 h ILE 147 N 0.62 0.67 -0.52 2.25 2.04 -1.10 0.40 117.51 121.87 2bw1 h ILE 147 Ca 0.04 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 2bw1 h ILE 147 Cb 1.03 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2bw1 h ILE 147 CO 0.10 0.03 -0.05 -0.26 0.00 0.00 0.00 178.15 177.97 2bw1 h PHE 148 N 0.15 1.05 -0.55 1.37 0.05 -1.42 -2.45 116.94 115.13 2bw1 h PHE 148 Ca 0.23 -0.20 -0.01 0.00 3.82 0.00 0.00 57.97 61.81 2bw1 h PHE 148 Cb 0.34 -0.27 -0.03 0.00 2.00 0.00 0.00 35.95 37.99 2bw1 h PHE 148 CO -0.27 0.98 0.30 -0.97 -0.18 0.00 0.00 178.31 178.17 2bw1 h ASN 149 N 0.82 0.70 -0.59 2.17 -1.24 -0.96 -0.40 115.58 116.07 2bw1 h ASN 149 Ca 0.14 -0.10 -0.09 0.00 0.71 0.00 0.00 56.30 56.96 2bw1 h ASN 149 Cb 0.60 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.45 2bw1 h ASN 149 CO 0.04 0.59 0.00 0.58 -1.29 0.00 0.00 177.43 177.36 2bw1 h VAL 150 N 0.75 1.27 -0.17 2.57 2.07 -0.86 -1.87 116.25 120.00 2bw1 h VAL 150 Ca 0.19 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 2bw1 h VAL 150 Cb 0.05 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2bw1 h VAL 150 CO -0.03 0.41 0.02 0.00 0.02 0.00 0.00 177.57 177.99 2bw1 h ALA 151 N 0.98 0.23 -0.48 1.67 0.00 -1.29 -2.79 119.26 117.59 2bw1 h ALA 151 Ca 0.17 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2bw1 h ALA 151 Cb 0.55 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2bw1 h ALA 151 CO 0.03 -0.10 0.19 -0.22 0.00 0.00 0.00 179.25 179.16 2bw1 h LYS 152 N 0.07 0.37 -0.35 0.00 3.64 -0.98 -1.30 116.57 118.01 2bw1 h LYS 152 Ca 0.05 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 2bw1 h LYS 152 Cb 0.32 -0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 2bw1 h LYS 152 CO 0.00 0.25 -0.09 0.00 -2.27 0.00 0.00 179.45 177.34 2bw1 h ALA 153 N 1.30 0.23 -0.17 5.00 0.00 -1.20 -0.32 119.26 124.11 2bw1 h ALA 153 Ca 0.22 0.14 -0.19 0.00 0.00 0.00 0.00 54.91 55.08 2bw1 h ALA 153 Cb 0.20 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2bw1 h ALA 153 CO -0.20 -0.46 -0.65 1.03 0.00 0.00 0.00 179.25 178.97 2bw1 h SER 154 N -0.00 0.72 -0.68 0.00 0.87 -1.21 -2.18 113.55 111.06 2bw1 h SER 154 Ca 0.17 -0.43 -0.04 0.00 -1.23 0.00 0.00 61.79 60.27 2bw1 h SER 154 Cb 0.26 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2bw1 h SER 154 CO -0.37 1.18 0.28 0.40 -0.53 0.00 0.00 176.83 177.79 2bw1 h ILE 155 N 0.46 1.24 -0.57 2.23 1.08 -0.95 -1.83 117.51 119.16 2bw1 h ILE 155 Ca -0.01 -0.75 -0.06 0.00 -0.39 0.00 0.00 64.86 63.64 2bw1 h ILE 155 Cb 1.23 0.46 -0.03 0.00 -3.07 0.00 0.00 36.82 35.41 2bw1 h ILE 155 CO 0.13 0.30 0.10 -0.33 -0.69 0.00 0.00 178.15 177.66 2bw1 h GLU 156 N 0.97 0.91 -0.78 2.37 5.08 -0.93 -0.71 114.58 121.49 2bw1 h GLU 156 Ca 0.23 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2bw1 h GLU 156 Cb 0.20 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2bw1 h GLU 156 CO -0.02 0.84 0.50 -0.22 -1.00 0.00 0.00 179.01 179.11 2bw1 h LYS 157 N 0.87 1.04 -0.80 2.33 3.64 -1.09 -2.12 116.57 120.45 2bw1 h LYS 157 Ca 0.18 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 2bw1 h LYS 157 Cb 0.37 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 2bw1 h LYS 157 CO 0.01 0.71 0.33 0.45 -2.27 0.00 0.00 179.45 178.68 2bw1 h HIS 158 N 1.07 1.20 -0.58 1.91 3.86 -0.67 -2.56 115.15 119.39 2bw1 h HIS 158 Ca 0.29 -0.08 0.03 0.00 -1.16 0.00 0.00 60.37 59.44 2bw1 h HIS 158 Cb -0.09 -0.36 -0.04 0.00 1.06 0.00 0.00 27.41 27.98 2bw1 h HIS 158 CO -0.01 0.90 0.35 0.82 0.86 0.00 0.00 177.93 180.84 2bw1 h ILE 159 N 1.16 1.05 -0.08 2.45 2.04 -0.90 0.11 117.51 123.34 2bw1 h ILE 159 Ca 0.27 -0.23 0.04 0.00 1.00 0.00 0.00 64.86 65.94 2bw1 h ILE 159 Cb 0.19 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 2bw1 h ILE 159 CO -0.02 0.12 -0.26 -0.25 0.00 0.00 0.00 178.15 177.74 2bw1 h TRP 160 N 0.68 -0.69 -0.46 1.37 7.01 -1.15 -0.72 115.95 121.99 2bw1 h TRP 160 Ca 0.24 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 61.15 2bw1 h TRP 160 Cb 0.04 0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.40 2bw1 h TRP 160 CO -0.06 -0.34 -0.16 0.52 -2.79 0.00 0.00 178.44 175.60 2bw1 h MET 161 N -0.35 0.90 -0.53 2.65 2.86 -1.01 0.60 114.93 120.05 2bw1 h MET 161 Ca 0.09 -0.34 -0.11 0.00 -2.06 0.00 0.00 59.70 57.27 2bw1 h MET 161 Cb 0.47 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 2bw1 h MET 161 CO -0.28 0.99 -0.12 -0.07 1.06 0.00 0.00 176.91 178.49 2bw1 h LEU 162 N 0.79 1.02 -0.36 1.22 3.38 -0.69 -0.84 115.31 119.84 2bw1 h LEU 162 Ca 0.12 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 57.63 2bw1 h LEU 162 Cb 0.70 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2bw1 h LEU 162 CO 0.05 1.14 -0.17 1.56 0.09 0.00 0.00 178.44 181.11 2bw1 h GLN 163 N 0.89 0.75 -0.60 1.13 1.08 -0.87 -1.80 115.11 115.69 2bw1 h GLN 163 Ca 0.14 -0.33 0.08 0.00 -1.45 0.00 0.00 58.65 57.09 2bw1 h GLN 163 Cb 0.69 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 28.03 2bw1 h GLN 163 CO 0.05 0.94 0.26 0.00 -0.95 0.00 0.00 178.83 179.13 2bw1 h ALA 164 N 0.79 0.78 -0.93 3.87 0.00 -0.73 0.13 119.26 123.17 2bw1 h ALA 164 Ca 0.08 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.12 2bw1 h ALA 164 Cb 0.71 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 2bw1 h ALA 164 CO 0.05 -0.14 0.59 1.49 0.00 0.00 0.00 179.25 181.24 2bw1 h GLU 165 N 0.47 1.03 0.00 0.00 4.57 -0.82 -0.65 114.58 119.17 2bw1 h GLU 165 Ca 0.29 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 2bw1 h GLU 165 Cb 0.31 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2bw1 h GLU 165 CO -0.26 0.68 0.00 1.28 -1.18 0.00 0.00 179.01 179.53 2bw1 n LEU 166 N -4.57 0.00 -0.52 1.64 4.77 -0.65 -4.89 117.00 112.79 2bw1 n LEU 166 Ca 0.14 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.07 2bw1 n LEU 166 Cb 0.19 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 2bw1 n LEU 166 CO 0.31 0.00 -0.06 0.61 -1.33 0.00 0.00 177.39 176.92 2bw1 n GLY 167 N 0.70 0.41 3.33 -0.72 0.00 -0.25 -5.03 105.19 103.62 2bw1 n GLY 167 Ca 0.10 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.21 2bw1 n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bw1 s GLN 168 N -3.51 1.28 0.76 1.61 -0.21 0.32 -4.98 119.66 114.93 2bw1 s GLN 168 Ca 0.00 -1.56 -0.12 0.00 0.02 0.00 0.00 55.36 53.70 2bw1 s GLN 168 Cb 0.00 -1.05 0.06 0.00 1.00 0.00 0.00 33.01 33.02 2bw1 s GLN 168 CO 0.00 0.17 1.12 0.00 -2.12 0.00 0.00 175.29 174.46 2bw1 s ALA 169 N -2.99 2.17 0.43 6.09 0.00 -1.26 -3.08 121.76 123.13 2bw1 s ALA 169 Ca 0.21 0.45 0.11 0.00 0.00 0.00 0.00 51.96 52.73 2bw1 s ALA 169 Cb -0.00 -3.33 0.95 0.00 0.00 0.00 0.00 23.12 20.73 2bw1 s ALA 169 CO 0.06 -1.82 2.01 -1.35 0.00 0.00 0.00 175.76 174.66 2bw1 h PRO 170 N -0.88 0.21 -6.08 0.00 0.11 -1.87 -3.45 132.00 120.03 2bw1 h PRO 170 Ca -0.45 -0.03 -0.42 0.00 0.11 0.00 0.00 66.00 65.21 2bw1 h PRO 170 Cb 1.25 -0.04 0.05 0.00 0.11 0.00 0.00 31.00 32.37 2bw1 h PRO 170 CO 0.50 0.25 -0.78 1.63 -0.21 0.00 0.00 178.00 179.39 2bw1 n LYS 171 N -4.39 -5.67 0.00 1.05 5.02 -1.26 -4.84 118.16 108.07 2bw1 n LYS 171 Ca -0.01 0.66 0.14 0.00 -2.02 0.00 0.00 58.31 57.09 2bw1 n LYS 171 Cb 0.18 -5.44 0.54 0.00 -0.02 0.00 0.00 35.03 30.29 2bw1 n LYS 171 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16