#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwp s ASN 6 N 0.00 6.50 0.36 1.62 3.04 -1.26 -4.93 114.94 120.27 1bwp s ASN 6 Ca 0.00 1.93 0.11 0.00 0.04 0.00 0.00 52.86 54.95 1bwp s ASN 6 Cb 0.00 -2.53 0.89 0.00 -1.54 0.00 0.00 41.25 38.07 1bwp s ASN 6 CO 0.00 -1.11 1.83 1.55 -3.04 0.00 0.00 177.10 176.33 1bwp h PRO 7 N 10.23 0.60 0.00 0.43 0.13 -1.95 -1.93 132.00 139.51 1bwp h PRO 7 Ca -0.36 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1bwp h PRO 7 Cb 1.17 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1bwp h PRO 7 CO 0.98 0.39 0.00 0.00 -0.23 0.00 0.00 178.00 179.14 1bwp h ALA 8 N 1.61 1.00 -0.08 -0.56 0.00 -1.92 -2.95 119.26 116.36 1bwp h ALA 8 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1bwp h ALA 8 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1bwp h ALA 8 CO -0.26 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 177.86 1bwp n SER 9 N -2.98 2.50 -4.50 0.00 3.41 -0.76 -2.69 113.62 108.60 1bwp n SER 9 Ca 0.00 -2.53 -0.42 0.00 -0.26 0.00 0.00 58.87 55.67 1bwp n SER 9 Cb 0.26 -0.26 -0.10 0.00 -0.26 0.00 0.00 64.21 63.86 1bwp n SER 9 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1bwp s LYS 10 N -1.92 3.27 0.17 4.33 2.20 -1.00 -4.99 119.74 121.80 1bwp s LYS 10 Ca 0.20 -0.73 -0.31 0.00 -0.36 0.00 0.00 55.97 54.77 1bwp s LYS 10 Cb 0.16 -3.89 -0.09 0.00 -1.51 0.00 0.00 37.83 32.49 1bwp s LYS 10 CO 0.04 -0.64 1.49 -1.25 -0.36 0.00 0.00 175.35 174.63 1bwp s PRO 11 N 1.86 4.26 -0.14 4.03 0.04 -1.26 -4.82 135.00 138.97 1bwp s PRO 11 Ca 0.08 2.26 -0.26 0.00 0.04 0.00 0.00 61.00 63.13 1bwp s PRO 11 Cb -0.18 -3.17 0.06 0.00 0.04 0.00 0.00 34.50 31.25 1bwp s PRO 11 CO 0.11 -0.51 0.64 -0.08 0.04 0.00 0.00 177.00 177.20 1bwp s THR 12 N 0.88 0.00 0.79 1.26 -1.32 -1.16 -4.90 115.64 111.19 1bwp s THR 12 Ca 0.66 -0.04 -0.11 0.00 -1.21 0.00 0.00 61.69 60.99 1bwp s THR 12 Cb -0.41 -0.92 0.06 0.00 -1.51 0.00 0.00 72.50 69.72 1bwp s THR 12 CO 0.33 -0.02 1.08 -2.16 -2.21 0.00 0.00 174.62 171.65 1bwp s PRO 13 N -0.45 2.17 -0.28 7.08 0.04 -1.26 -4.06 135.00 138.24 1bwp s PRO 13 Ca -0.06 0.91 -0.29 0.00 0.04 0.00 0.00 61.00 61.60 1bwp s PRO 13 Cb -0.03 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 1bwp s PRO 13 CO 0.05 -1.63 1.39 0.08 0.04 0.00 0.00 177.00 176.93 1bwp s VAL 14 N -3.01 4.02 0.29 -0.36 1.01 -1.26 -5.01 120.40 116.07 1bwp s VAL 14 Ca 0.61 1.15 -0.30 0.00 0.00 0.00 0.00 61.98 63.44 1bwp s VAL 14 Cb -0.16 -4.04 -0.11 0.00 0.00 0.00 0.00 36.38 32.08 1bwp s VAL 14 CO 0.56 -0.43 1.50 -1.58 0.00 0.00 0.00 175.10 175.15 1bwp s GLN 15 N 4.31 4.19 -0.54 2.72 0.74 -1.26 -4.90 119.66 124.93 1bwp s GLN 15 Ca 0.60 2.44 -0.26 0.00 0.05 0.00 0.00 55.36 58.19 1bwp s GLN 15 Cb -0.19 -3.05 0.03 0.00 1.10 0.00 0.00 33.01 30.90 1bwp s GLN 15 CO 0.25 -0.50 1.04 0.34 -0.55 0.00 0.00 175.29 175.86 1bwp s ASP 16 N 0.30 6.43 -0.10 6.67 2.15 -1.26 -4.84 116.67 126.01 1bwp s ASP 16 Ca 0.59 -0.05 0.17 0.00 0.43 0.00 0.00 52.55 53.69 1bwp s ASP 16 Cb -0.45 -2.49 0.61 0.00 -0.30 0.00 0.00 42.92 40.29 1bwp s ASP 16 CO 0.48 -1.29 1.52 1.33 -0.17 0.00 0.00 175.17 177.04 1bwp n VAL 17 N 6.45 1.72 -0.02 1.11 0.24 -1.26 -4.65 118.33 121.92 1bwp n VAL 17 Ca 0.06 -1.27 -0.05 0.00 -2.04 0.00 0.00 64.34 61.04 1bwp n VAL 17 Cb 0.48 0.15 -0.02 0.00 -1.47 0.00 0.00 33.84 32.99 1bwp n VAL 17 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bwp n GLN 18 N 0.75 0.10 0.00 7.34 6.02 -1.26 -5.09 117.38 125.24 1bwp n GLN 18 Ca 0.22 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 1bwp n GLN 18 Cb 0.79 -0.75 0.00 0.00 1.02 0.00 0.00 30.24 31.31 1bwp n GLN 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bwp n GLY 19 N 2.82 1.07 0.74 1.08 0.00 -1.26 -5.00 105.19 104.64 1bwp n GLY 19 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1bwp n GLY 19 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bwp n ASP 20 N 0.00 2.25 -1.56 1.61 5.68 -1.26 -5.00 116.55 118.27 1bwp n ASP 20 Ca 0.00 -1.78 -0.18 0.00 -0.50 0.00 0.00 54.79 52.34 1bwp n ASP 20 Cb 0.00 -0.10 -0.05 0.00 -1.14 0.00 0.00 41.12 39.82 1bwp n ASP 20 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bwp n GLY 21 N 1.26 1.07 0.13 6.12 0.00 -1.26 -4.89 105.19 107.62 1bwp n GLY 21 Ca 0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 1bwp n GLY 21 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1bwp h ARG 22 N 0.00 0.00 -0.23 1.61 3.08 -1.99 -2.15 114.38 114.70 1bwp h ARG 22 Ca -0.38 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.65 1bwp h ARG 22 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1bwp h ARG 22 CO 0.52 0.64 0.05 2.35 -1.07 0.00 0.00 179.97 182.46 1bwp h TRP 23 N 0.00 0.38 -0.22 3.04 7.01 -1.94 -1.51 115.95 122.72 1bwp h TRP 23 Ca -0.01 -0.05 -0.12 0.00 2.11 0.00 0.00 58.89 60.83 1bwp h TRP 23 Cb 1.13 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.07 1bwp h TRP 23 CO 0.00 0.47 -0.37 1.98 -2.79 0.00 0.00 178.44 177.73 1bwp h MET 24 N 0.19 0.47 -0.93 2.65 4.05 -1.89 -1.51 114.93 117.96 1bwp h MET 24 Ca 0.07 -0.22 0.01 0.00 -0.28 0.00 0.00 59.70 59.27 1bwp h MET 24 Cb 0.28 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.03 1bwp h MET 24 CO 0.00 0.78 0.60 0.77 0.23 0.00 0.00 176.91 179.29 1bwp h SER 25 N 0.40 1.08 -0.21 1.39 0.02 -1.21 -0.61 113.55 114.40 1bwp h SER 25 Ca 0.04 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1bwp h SER 25 Cb 0.83 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1bwp h SER 25 CO 0.07 0.79 0.05 -0.07 -1.14 0.00 0.00 176.83 176.53 1bwp h LEU 26 N 1.26 0.32 -0.40 5.07 3.38 -1.01 -1.81 115.31 122.13 1bwp h LEU 26 Ca 0.34 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1bwp h LEU 26 Cb -0.12 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1bwp h LEU 26 CO -0.07 0.48 0.14 -0.74 0.09 0.00 0.00 178.44 178.34 1bwp h HIS 27 N 0.15 0.26 -0.66 1.13 2.76 -1.13 -1.78 115.15 115.88 1bwp h HIS 27 Ca 0.07 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1bwp h HIS 27 Cb 0.28 -0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.15 1bwp h HIS 27 CO 0.01 0.10 0.33 0.45 -1.30 0.00 0.00 177.93 177.53 1bwp h HIS 28 N 0.31 0.92 -0.44 5.26 3.86 -1.07 -1.24 115.15 122.75 1bwp h HIS 28 Ca 0.18 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1bwp h HIS 28 Cb 0.16 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 1bwp h HIS 28 CO -0.14 0.66 0.24 -0.09 0.86 0.00 0.00 177.93 179.45 1bwp h ARG 29 N 0.93 0.62 -0.71 2.45 2.43 -0.83 -2.11 114.38 117.16 1bwp h ARG 29 Ca 0.23 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 1bwp h ARG 29 Cb 0.07 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1bwp h ARG 29 CO -0.03 0.50 0.22 0.74 -1.51 0.00 0.00 179.97 179.89 1bwp h PHE 30 N 0.57 1.14 -0.53 2.20 0.04 -0.99 -1.03 116.94 118.35 1bwp h PHE 30 Ca 0.15 -0.12 0.09 0.00 2.80 0.00 0.00 57.97 60.89 1bwp h PHE 30 Cb 0.07 -0.33 -0.07 0.00 2.20 0.00 0.00 35.95 37.82 1bwp h PHE 30 CO -0.02 0.91 0.15 0.28 -0.60 0.00 0.00 178.31 179.03 1bwp h VAL 31 N 1.05 0.75 -0.42 -0.55 2.07 -1.16 -1.10 116.25 116.89 1bwp h VAL 31 Ca 0.23 -0.10 -0.10 0.00 0.82 0.00 0.00 66.70 67.55 1bwp h VAL 31 Cb 0.30 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1bwp h VAL 31 CO -0.01 0.05 -0.13 0.00 0.02 0.00 0.00 177.57 177.51 1bwp h ALA 32 N 1.39 0.98 -0.37 1.67 0.00 -0.99 -1.20 119.26 120.74 1bwp h ALA 32 Ca 0.27 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1bwp h ALA 32 Cb 0.34 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1bwp h ALA 32 CO -0.31 0.60 -0.03 -0.44 0.00 0.00 0.00 179.25 179.07 1bwp h ASP 33 N 0.69 -0.21 -0.27 0.00 3.32 -0.83 -1.54 116.42 117.59 1bwp h ASP 33 Ca 0.11 0.09 -0.10 0.00 0.02 0.00 0.00 57.03 57.16 1bwp h ASP 33 Cb 0.61 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 1bwp h ASP 33 CO 0.04 -0.06 -0.18 0.28 -1.72 0.00 0.00 179.24 177.60 1bwp h SER 34 N 0.07 0.71 -0.81 6.45 0.02 -1.01 0.33 113.55 119.32 1bwp h SER 34 Ca 0.18 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1bwp h SER 34 Cb 0.26 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 1bwp h SER 34 CO -0.33 0.89 0.54 0.50 -1.14 0.00 0.00 176.83 177.29 1bwp h LYS 35 N 0.64 1.06 0.00 3.45 3.64 -0.82 -3.30 116.57 121.23 1bwp h LYS 35 Ca 0.10 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1bwp h LYS 35 Cb 0.65 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1bwp h LYS 35 CO 0.05 0.70 -1.37 -0.25 -2.27 0.00 0.00 179.45 176.30 1bwp n ASP 36 N -4.41 0.79 -4.73 4.20 8.00 -0.62 -5.02 116.55 114.76 1bwp n ASP 36 Ca 0.09 -0.45 -0.29 0.00 0.71 0.00 0.00 54.79 54.85 1bwp n ASP 36 Cb 0.03 1.44 -0.08 0.00 -0.02 0.00 0.00 41.12 42.50 1bwp n ASP 36 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1bwp s LYS 37 N -3.01 2.14 -0.47 -1.24 1.02 0.09 -5.07 119.74 113.19 1bwp s LYS 37 Ca -0.00 -2.17 0.07 0.00 0.02 0.00 0.00 55.97 53.88 1bwp s LYS 37 Cb 0.13 -1.71 0.23 0.00 -0.52 0.00 0.00 37.83 35.96 1bwp s LYS 37 CO 0.76 -0.25 0.54 0.39 -0.92 0.00 0.00 175.35 175.87 1bwp n GLU 38 N -1.23 1.11 -1.84 1.68 -0.58 -1.26 -4.82 120.64 113.71 1bwp n GLU 38 Ca -0.10 -3.63 -0.37 0.00 -0.42 0.00 0.00 57.16 52.65 1bwp n GLU 38 Cb 0.66 -1.59 0.06 0.00 -0.57 0.00 0.00 31.44 29.99 1bwp n GLU 38 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1bwp s PRO 39 N -1.29 2.71 -0.05 3.49 0.04 -1.26 -4.96 135.00 133.67 1bwp s PRO 39 Ca 0.35 1.98 0.12 0.00 0.04 0.00 0.00 61.00 63.50 1bwp s PRO 39 Cb 0.13 -1.88 -0.23 0.00 0.04 0.00 0.00 34.50 32.56 1bwp s PRO 39 CO -0.11 -1.45 0.62 0.39 0.04 0.00 0.00 177.00 176.49 1bwp n GLU 40 N -1.78 0.64 -4.56 4.56 1.02 0.39 -3.86 120.64 117.05 1bwp n GLU 40 Ca 0.15 0.28 -0.24 0.00 -0.02 0.00 0.00 57.16 57.33 1bwp n GLU 40 Cb 0.49 -1.78 -0.16 0.00 -0.02 0.00 0.00 31.44 29.96 1bwp n GLU 40 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1bwp s VAL 41 N -2.59 1.09 -0.14 2.62 1.01 -1.01 -0.68 120.40 120.70 1bwp s VAL 41 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1bwp s VAL 41 Cb 0.08 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 1bwp s VAL 41 CO 0.82 0.34 -0.15 -0.69 0.00 0.00 0.00 175.10 175.43 1bwp s VAL 42 N 0.64 2.83 -0.17 2.92 1.01 -0.57 -1.67 120.40 125.39 1bwp s VAL 42 Ca -0.14 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.03 1bwp s VAL 42 Cb -0.15 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1bwp s VAL 42 CO 0.03 0.52 0.12 -0.36 0.00 0.00 0.00 175.10 175.41 1bwp s PHE 43 N 0.55 3.44 -0.05 5.22 0.40 0.41 -0.91 117.98 127.04 1bwp s PHE 43 Ca -0.09 0.35 -0.06 0.00 -0.60 0.00 0.00 56.93 56.54 1bwp s PHE 43 Cb -0.16 -2.06 0.01 0.00 0.51 0.00 0.00 43.02 41.33 1bwp s PHE 43 CO 0.04 0.43 0.15 -1.50 0.70 0.00 0.00 175.22 175.04 1bwp s ILE 44 N -0.17 0.01 -3.73 0.64 2.07 -0.55 -0.37 121.20 119.11 1bwp s ILE 44 Ca 0.10 -0.07 0.00 0.00 -1.41 0.00 0.00 60.65 59.27 1bwp s ILE 44 Cb -0.12 -0.24 0.00 0.00 0.13 0.00 0.00 42.46 42.23 1bwp s ILE 44 CO 0.01 -0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.61 1bwp n GLY 45 N 2.84 -0.53 0.00 1.50 0.00 -1.25 -1.92 105.19 105.82 1bwp n GLY 45 Ca -0.13 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1bwp n GLY 45 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bwp n ASP 46 N 0.00 0.00 0.28 1.61 5.68 -1.01 -1.15 116.55 121.96 1bwp n ASP 46 Ca 0.00 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.42 1bwp n ASP 46 Cb 0.00 0.00 0.82 0.00 -1.14 0.00 0.00 41.12 40.80 1bwp n ASP 46 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1bwp h SER 47 N 0.00 0.00 -0.30 -1.12 4.64 -1.88 -1.77 113.55 113.12 1bwp h SER 47 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1bwp h SER 47 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1bwp h SER 47 CO 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 176.83 176.11 1bwp h ALA 48 N 1.99 1.62 -0.02 5.18 0.00 -1.92 -1.14 119.26 124.98 1bwp h ALA 48 Ca 0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1bwp h ALA 48 Cb 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1bwp h ALA 48 CO -0.00 0.31 -0.23 0.28 0.00 0.00 0.00 179.25 179.61 1bwp h VAL 49 N 0.48 1.51 -0.55 0.00 2.07 -1.62 -3.27 116.25 114.87 1bwp h VAL 49 Ca 0.12 -1.82 0.04 0.00 0.82 0.00 0.00 66.70 65.86 1bwp h VAL 49 Cb 0.08 2.62 -0.04 0.00 -1.52 0.00 0.00 31.29 32.42 1bwp h VAL 49 CO -0.02 0.50 0.31 -0.61 0.02 0.00 0.00 177.57 177.77 1bwp h GLN 50 N -0.43 0.58 0.00 1.57 4.15 -1.02 -2.75 115.11 117.21 1bwp h GLN 50 Ca -0.02 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1bwp h GLN 50 Cb 0.94 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.50 1bwp h GLN 50 CO 0.05 0.38 -0.12 -0.07 -1.93 0.00 0.00 178.83 177.14 1bwp h LEU 51 N 0.60 0.00 -1.31 -2.39 3.38 -1.39 -3.00 115.31 111.19 1bwp h LEU 51 Ca 0.23 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.21 1bwp h LEU 51 Cb 0.09 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1bwp h LEU 51 CO -0.13 0.00 0.47 -0.03 0.09 0.00 0.00 178.44 178.84 1bwp h MET 52 N 0.00 0.91 -0.57 1.13 4.05 -1.54 0.50 114.93 119.41 1bwp h MET 52 Ca 0.00 -0.05 -0.05 0.00 -0.28 0.00 0.00 59.70 59.32 1bwp h MET 52 Cb 0.96 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.53 1bwp h MET 52 CO 0.00 0.60 0.16 1.25 0.23 0.00 0.00 176.91 179.15 1bwp h HIS 53 N 0.94 0.90 0.09 1.39 -0.00 -1.58 -3.18 115.15 113.71 1bwp h HIS 53 Ca 0.26 -0.08 -0.21 0.00 -0.00 0.00 0.00 60.37 60.34 1bwp h HIS 53 Cb -0.07 -0.26 0.02 0.00 -0.00 0.00 0.00 27.41 27.09 1bwp h HIS 53 CO -0.00 0.74 -0.88 1.96 -0.00 0.00 0.00 177.93 179.75 1bwp h GLN 54 N 0.85 0.44 0.00 5.26 1.08 -1.48 -3.43 115.11 117.83 1bwp h GLN 54 Ca 0.19 -0.59 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 1bwp h GLN 54 Cb 0.28 0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1bwp h GLN 54 CO -0.00 1.24 -0.16 0.00 -0.95 0.00 0.00 178.83 178.95 1bwp s GLU 56 N -0.98 -1.94 -0.62 0.00 2.56 -1.21 -4.24 118.70 112.27 1bwp s GLU 56 Ca 0.00 0.05 -0.07 0.00 0.00 0.00 0.00 54.97 54.95 1bwp s GLU 56 Cb 0.00 -1.50 0.16 0.00 2.00 0.00 0.00 34.13 34.79 1bwp s GLU 56 CO 0.00 -4.21 0.48 0.42 -0.56 0.00 0.00 175.26 171.39 1bwp s ILE 57 N -2.68 4.23 0.27 -3.70 1.01 -1.26 -4.74 121.20 114.33 1bwp s ILE 57 Ca 0.70 -2.52 0.01 0.00 0.00 0.00 0.00 60.65 58.84 1bwp s ILE 57 Cb -0.12 -3.73 0.38 0.00 0.01 0.00 0.00 42.46 39.00 1bwp s ILE 57 CO 0.57 -0.88 1.39 1.87 0.00 0.00 0.00 174.94 177.90 1bwp n TRP 58 N 4.00 0.54 -0.15 3.97 -0.00 -1.24 -3.17 117.44 121.40 1bwp n TRP 58 Ca 0.05 1.07 -0.02 0.00 -0.00 0.00 0.00 57.50 58.60 1bwp n TRP 58 Cb 0.41 -1.15 0.22 0.00 -0.00 0.00 0.00 31.31 30.78 1bwp n TRP 58 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 177.69 177.60 1bwp h ARG 59 N 0.00 0.86 -0.14 5.87 2.43 -1.90 0.31 114.38 121.80 1bwp h ARG 59 Ca 0.53 -0.13 -0.22 0.00 -0.81 0.00 0.00 59.98 59.35 1bwp h ARG 59 Cb 1.07 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1bwp h ARG 59 CO -0.84 0.70 -0.77 0.93 -1.51 0.00 0.00 179.97 178.48 1bwp h GLU 60 N 0.85 0.78 0.00 0.20 4.39 -1.98 -3.37 114.58 115.45 1bwp h GLU 60 Ca 0.20 -0.64 -0.22 0.00 0.34 0.00 0.00 59.36 59.04 1bwp h GLU 60 Cb 0.16 0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.90 1bwp h GLU 60 CO -0.02 1.25 -1.82 1.28 -1.16 0.00 0.00 179.01 178.53 1bwp n LEU 61 N -3.96 1.69 -0.03 1.33 4.32 -1.14 -4.76 117.00 114.44 1bwp n LEU 61 Ca -0.08 -0.05 -0.03 0.00 -0.02 0.00 0.00 56.01 55.84 1bwp n LEU 61 Cb 0.74 -0.17 -0.05 0.00 -1.62 0.00 0.00 43.42 42.32 1bwp n LEU 61 CO 0.53 0.55 -0.72 0.49 -1.22 0.00 0.00 177.39 177.02 1bwp n PHE 62 N -2.71 0.00 -0.23 -1.77 3.72 0.98 -4.52 117.46 112.93 1bwp n PHE 62 Ca -0.23 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.15 1bwp n PHE 62 Cb 0.82 -0.33 0.09 0.00 -0.94 0.00 0.00 39.48 39.11 1bwp n PHE 62 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1bwp h SER 63 N 0.00 0.57 -0.63 4.37 0.02 -1.43 -1.52 113.55 114.93 1bwp h SER 63 Ca -0.18 0.02 0.17 0.00 -0.84 0.00 0.00 61.79 60.96 1bwp h SER 63 Cb 1.38 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 1bwp h SER 63 CO 0.01 0.38 0.45 -0.65 -1.14 0.00 0.00 176.83 175.88 1bwp h PRO 64 N 0.71 0.05 -0.03 3.45 0.11 -1.81 -2.09 132.00 132.40 1bwp h PRO 64 Ca 0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1bwp h PRO 64 Cb 0.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.23 1bwp h PRO 64 CO -0.16 0.04 0.00 1.28 -0.21 0.00 0.00 178.00 178.95 1bwp n LEU 65 N -4.37 0.42 -2.40 2.35 4.77 -0.57 -4.93 117.00 112.26 1bwp n LEU 65 Ca 0.12 -0.16 -0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1bwp n LEU 65 Cb 0.66 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1bwp n LEU 65 CO 0.37 0.08 0.19 1.41 -1.33 0.00 0.00 177.39 178.10 1bwp n HIS 66 N -0.59 -1.77 -4.86 -1.77 8.25 -0.79 -4.33 115.22 109.37 1bwp n HIS 66 Ca 0.18 0.68 -0.27 0.00 -0.26 0.00 0.00 57.72 58.06 1bwp n HIS 66 Cb 0.15 -3.02 -0.15 0.00 1.12 0.00 0.00 29.99 28.09 1bwp n HIS 66 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bwp s ALA 67 N -2.90 1.75 -0.02 -1.41 0.00 -1.26 -0.46 121.76 117.47 1bwp s ALA 67 Ca 0.01 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1bwp s ALA 67 Cb -0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 1bwp s ALA 67 CO 0.44 0.41 -0.12 -0.51 0.00 0.00 0.00 175.76 175.98 1bwp s LEU 68 N -0.78 2.90 -0.33 0.00 1.43 -0.67 -4.93 118.68 116.30 1bwp s LEU 68 Ca 0.08 -0.20 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 1bwp s LEU 68 Cb -0.08 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.53 1bwp s LEU 68 CO 0.00 0.31 0.09 0.21 0.23 0.00 0.00 176.35 177.20 1bwp s ASN 69 N -1.07 5.26 -0.40 2.29 3.84 -1.26 -0.44 114.94 123.15 1bwp s ASN 69 Ca 0.14 -1.12 0.05 0.00 0.21 0.00 0.00 52.86 52.14 1bwp s ASN 69 Cb -0.11 -1.86 0.48 0.00 -0.55 0.00 0.00 41.25 39.22 1bwp s ASN 69 CO 0.04 -0.31 1.54 0.49 -2.79 0.00 0.00 177.10 176.07 1bwp n PHE 70 N 4.80 2.39 -2.46 0.43 3.72 0.51 -4.99 117.46 121.86 1bwp n PHE 70 Ca -0.13 -2.25 -0.40 0.00 -0.05 0.00 0.00 57.45 54.62 1bwp n PHE 70 Cb 0.45 -0.73 -0.04 0.00 -0.94 0.00 0.00 39.48 38.22 1bwp n PHE 70 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1bwp s GLY 71 N -2.69 3.05 -0.08 1.37 0.00 -1.26 -3.92 107.32 103.79 1bwp s GLY 71 Ca 0.53 0.91 0.01 0.00 0.00 0.00 0.00 44.72 46.17 1bwp s GLY 71 CO 0.01 1.53 -0.07 -0.42 0.00 0.00 0.00 173.10 174.15 1bwp s ILE 72 N -1.10 0.86 0.27 0.90 1.01 -0.30 -4.52 121.20 118.32 1bwp s ILE 72 Ca 0.45 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 1bwp s ILE 72 Cb -0.32 -0.86 -0.12 0.00 0.01 0.00 0.00 42.46 41.16 1bwp s ILE 72 CO 0.41 0.31 1.50 0.61 0.00 0.00 0.00 174.94 177.78 1bwp n GLY 73 N 4.37 1.06 1.04 6.18 0.00 -1.26 -2.76 105.19 113.83 1bwp n GLY 73 Ca -0.18 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1bwp n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwp n GLY 74 N 2.12 0.98 3.76 -0.02 0.00 -1.26 -4.82 105.19 105.95 1bwp n GLY 74 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1bwp n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bwp s ASP 75 N -2.74 6.89 0.68 1.61 1.11 -1.11 -4.96 116.67 118.14 1bwp s ASP 75 Ca 0.00 2.55 -0.00 0.00 0.18 0.00 0.00 52.55 55.28 1bwp s ASP 75 Cb 0.00 -2.64 0.10 0.00 1.07 0.00 0.00 42.92 41.46 1bwp s ASP 75 CO 0.00 -0.47 0.94 -0.44 1.18 0.00 0.00 175.17 176.39 1bwp s SER 76 N -0.34 4.58 0.22 0.27 0.01 -1.26 -4.59 113.70 112.58 1bwp s SER 76 Ca 0.50 -0.28 -0.08 0.00 1.31 0.00 0.00 55.95 57.40 1bwp s SER 76 Cb -0.38 -0.22 0.34 0.00 0.21 0.00 0.00 66.02 65.98 1bwp s SER 76 CO 0.47 -1.69 1.72 0.71 0.41 0.00 0.00 173.24 174.86 1bwp h THR 77 N -0.38 0.65 0.00 1.44 1.35 -1.91 -2.27 112.91 111.78 1bwp h THR 77 Ca -0.38 -0.11 -0.04 0.00 -0.55 0.00 0.00 66.41 65.33 1bwp h THR 77 Cb 1.28 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.99 1bwp h THR 77 CO 0.43 0.06 -0.19 0.06 -0.25 0.00 0.00 175.52 175.63 1bwp h GLN 78 N 0.33 0.00 0.24 4.72 -0.00 -1.80 -1.22 115.11 117.37 1bwp h GLN 78 Ca 0.35 0.00 -0.33 0.00 -0.00 0.00 0.00 58.65 58.66 1bwp h GLN 78 Cb 0.51 0.00 0.04 0.00 -0.00 0.00 0.00 27.48 28.03 1bwp h GLN 78 CO -0.40 0.19 -1.45 0.45 -0.00 0.00 0.00 178.83 177.62 1bwp h HIS 79 N 0.00 0.99 -0.30 0.06 3.86 -1.56 -2.48 115.15 115.72 1bwp h HIS 79 Ca -0.00 -0.71 0.01 0.00 -1.16 0.00 0.00 60.37 58.51 1bwp h HIS 79 Cb 0.56 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 1bwp h HIS 79 CO 0.00 1.55 0.17 0.28 0.86 0.00 0.00 177.93 180.79 1bwp h VAL 80 N 0.17 1.03 -0.45 2.45 2.07 -1.27 -1.53 116.25 118.71 1bwp h VAL 80 Ca -0.25 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 67.22 1bwp h VAL 80 Cb 2.14 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.50 1bwp h VAL 80 CO 0.27 0.06 0.14 0.25 0.02 0.00 0.00 177.57 178.32 1bwp h LEU 81 N 0.35 0.13 -0.41 2.57 5.85 -1.25 -1.96 115.31 120.59 1bwp h LEU 81 Ca 0.12 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.91 1bwp h LEU 81 Cb 0.01 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1bwp h LEU 81 CO -0.06 0.10 0.24 -0.25 -0.34 0.00 0.00 178.44 178.13 1bwp h TRP 82 N 0.30 0.45 -0.90 1.25 7.01 -1.32 -2.12 115.95 120.63 1bwp h TRP 82 Ca 0.21 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.21 1bwp h TRP 82 Cb 0.23 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.10 1bwp h TRP 82 CO -0.17 0.26 0.49 0.00 -2.79 0.00 0.00 178.44 176.23 1bwp h ARG 83 N 0.48 1.25 0.00 2.65 3.08 -1.04 -1.47 114.38 119.34 1bwp h ARG 83 Ca 0.16 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 1bwp h ARG 83 Cb 0.01 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1bwp h ARG 83 CO -0.08 0.91 -0.26 -0.07 -1.07 0.00 0.00 179.97 179.40 1bwp h LEU 84 N 1.25 0.00 0.00 3.04 3.38 -1.07 -2.77 115.31 119.14 1bwp h LEU 84 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1bwp h LEU 84 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1bwp h LEU 84 CO -0.05 0.26 -0.31 -0.33 0.09 0.00 0.00 178.44 178.09 1bwp h GLU 85 N 0.00 0.00 -0.35 1.13 5.08 -0.88 -3.36 114.58 116.21 1bwp h GLU 85 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1bwp h GLU 85 Cb 0.64 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.66 1bwp h GLU 85 CO 0.03 0.00 -0.71 0.09 -1.00 0.00 0.00 179.01 177.43 1bwp n ASN 86 N -2.56 3.04 0.00 1.42 3.02 -0.60 -4.93 115.26 114.65 1bwp n ASN 86 Ca 0.04 -3.62 0.00 0.00 -0.03 0.00 0.00 54.58 50.97 1bwp n ASN 86 Cb 0.48 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1bwp n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bwp n GLY 87 N -0.82 1.25 0.03 7.41 0.00 -1.22 -4.98 105.19 106.86 1bwp n GLY 87 Ca 0.28 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.44 1bwp n GLY 87 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bwp n GLU 88 N 0.00 0.07 -0.25 1.61 1.02 -1.16 -2.03 120.64 119.90 1bwp n GLU 88 Ca 0.00 0.06 0.10 0.00 -0.02 0.00 0.00 57.16 57.30 1bwp n GLU 88 Cb 0.00 -1.58 0.23 0.00 -0.02 0.00 0.00 31.44 30.07 1bwp n GLU 88 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1bwp n LEU 89 N -1.70 3.44 -4.81 -4.62 4.77 -1.26 -4.84 117.00 107.99 1bwp n LEU 89 Ca 0.07 -1.80 -0.34 0.00 -0.03 0.00 0.00 56.01 53.90 1bwp n LEU 89 Cb 0.36 -0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1bwp n LEU 89 CO 0.28 0.82 0.67 -1.61 -1.33 0.00 0.00 177.39 176.21 1bwp s GLU 90 N -1.13 4.23 -0.41 3.23 0.41 -0.86 -4.23 118.70 119.94 1bwp s GLU 90 Ca 0.37 1.23 0.00 0.00 -0.41 0.00 0.00 54.97 56.17 1bwp s GLU 90 Cb 0.20 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 30.24 1bwp s GLU 90 CO 0.27 -0.04 0.00 0.72 -0.49 0.00 0.00 175.26 175.72 1bwp n HIS 91 N -0.41 0.00 -4.34 1.61 8.25 -1.26 -4.37 115.22 114.69 1bwp n HIS 91 Ca 0.06 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.35 1bwp n HIS 91 Cb 0.53 -1.30 -0.10 0.00 1.12 0.00 0.00 29.99 30.23 1bwp n HIS 91 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1bwp s ILE 92 N -1.87 1.01 -0.40 1.59 -4.36 -1.26 -4.85 121.20 111.06 1bwp s ILE 92 Ca 0.00 -2.03 0.10 0.00 -0.26 0.00 0.00 60.65 58.46 1bwp s ILE 92 Cb 0.00 -2.40 0.33 0.00 1.25 0.00 0.00 42.46 41.63 1bwp s ILE 92 CO 0.00 -0.27 0.82 -1.14 0.24 0.00 0.00 174.94 174.58 1bwp n ARG 93 N -0.44 0.94 -1.76 0.37 0.63 -1.26 -5.08 116.66 110.06 1bwp n ARG 93 Ca -0.04 -2.90 -0.37 0.00 -0.92 0.00 0.00 57.85 53.62 1bwp n ARG 93 Cb 0.64 -1.46 0.06 0.00 0.45 0.00 0.00 32.46 32.15 1bwp n ARG 93 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1bwp s PRO 94 N -1.42 2.71 0.11 -0.14 0.04 -1.25 -4.91 135.00 130.13 1bwp s PRO 94 Ca 0.34 2.11 -0.03 0.00 0.04 0.00 0.00 61.00 63.46 1bwp s PRO 94 Cb 0.31 -1.95 -0.19 0.00 0.04 0.00 0.00 34.50 32.71 1bwp s PRO 94 CO -0.08 -1.49 1.23 0.87 0.04 0.00 0.00 177.00 177.57 1bwp h LYS 95 N 0.79 0.28 -4.14 4.56 1.57 -1.15 -3.38 116.57 115.09 1bwp h LYS 95 Ca -0.51 -0.39 -0.39 0.00 -1.87 0.00 0.00 60.65 57.49 1bwp h LYS 95 Cb 1.33 0.13 -0.32 0.00 0.08 0.00 0.00 32.23 33.45 1bwp h LYS 95 CO 0.54 1.14 -0.77 0.42 -0.57 0.00 0.00 179.45 180.21 1bwp s ILE 96 N -2.90 0.51 -0.17 1.86 1.01 -0.86 -0.76 121.20 119.88 1bwp s ILE 96 Ca -0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 60.65 60.43 1bwp s ILE 96 Cb 0.08 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 42.03 1bwp s ILE 96 CO 0.87 0.20 -0.10 -0.69 0.00 0.00 0.00 174.94 175.22 1bwp s VAL 97 N 0.58 3.11 -0.24 2.92 1.01 -0.34 -1.52 120.40 125.92 1bwp s VAL 97 Ca -0.08 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1bwp s VAL 97 Cb -0.11 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 1bwp s VAL 97 CO 0.00 0.48 0.17 -0.69 0.00 0.00 0.00 175.10 175.07 1bwp s VAL 98 N 0.91 5.35 -0.12 2.92 1.01 -0.08 -0.95 120.40 129.43 1bwp s VAL 98 Ca -0.02 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.16 1bwp s VAL 98 Cb -0.15 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1bwp s VAL 98 CO -0.00 0.33 -0.12 -0.69 0.00 0.00 0.00 175.10 174.62 1bwp s VAL 99 N 1.14 3.16 -0.33 2.92 1.01 0.16 -1.48 120.40 126.98 1bwp s VAL 99 Ca 0.08 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1bwp s VAL 99 Cb -0.14 -2.32 0.14 0.00 0.00 0.00 0.00 36.38 34.06 1bwp s VAL 99 CO 0.05 0.53 0.29 0.86 0.00 0.00 0.00 175.10 176.83 1bwp s TRP 100 N 0.22 -0.14 0.06 5.22 -0.00 -0.81 -1.85 118.94 121.63 1bwp s TRP 100 Ca -0.08 -0.68 -0.23 0.00 -0.00 0.00 0.00 56.10 55.11 1bwp s TRP 100 Cb -0.15 -0.56 0.06 0.00 -0.00 0.00 0.00 33.47 32.81 1bwp s TRP 100 CO 0.05 -0.91 0.55 0.54 -0.00 0.00 0.00 176.95 177.17 1bwp s VAL 101 N 1.84 0.02 0.00 5.86 0.11 -1.26 -2.42 120.40 124.55 1bwp s VAL 101 Ca 0.13 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 58.99 1bwp s VAL 101 Cb -0.16 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.70 1bwp s VAL 101 CO -0.19 -0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.09 1bwp n GLY 102 N 0.29 1.27 0.26 6.54 0.00 -1.26 -4.92 105.19 107.37 1bwp n GLY 102 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 1bwp n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwp h THR 103 N 0.00 0.51 -0.16 2.61 1.03 -1.95 -2.79 112.91 112.17 1bwp h THR 103 Ca 0.00 -0.64 0.00 0.00 -0.01 0.00 0.00 66.41 65.76 1bwp h THR 103 Cb 0.00 1.43 0.00 0.00 -1.07 0.00 0.00 68.15 68.51 1bwp h THR 103 CO 0.00 0.13 0.00 0.59 -0.01 0.00 0.00 175.52 176.23 1bwp n ASN 104 N -3.54 1.93 -2.95 0.00 3.02 -1.26 -4.69 115.26 107.77 1bwp n ASN 104 Ca -0.01 -1.72 -0.23 0.00 -0.03 0.00 0.00 54.58 52.59 1bwp n ASN 104 Cb 0.28 -0.10 -0.05 0.00 -0.61 0.00 0.00 39.78 39.30 1bwp n ASN 104 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bwp n ASN 105 N 0.49 5.68 -4.74 6.41 3.02 -1.05 -4.78 115.26 120.29 1bwp n ASN 105 Ca 0.17 -2.36 -0.41 0.00 -0.03 0.00 0.00 54.58 51.95 1bwp n ASN 105 Cb 0.38 -1.20 -0.03 0.00 -0.61 0.00 0.00 39.78 38.33 1bwp n ASN 105 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1bwp s HIS 106 N 2.62 3.09 0.00 3.10 3.76 -1.26 -2.15 115.29 124.44 1bwp s HIS 106 Ca 0.50 1.05 0.00 0.00 -0.15 0.00 0.00 55.06 56.46 1bwp s HIS 106 Cb 0.15 -3.77 0.00 0.00 1.11 0.00 0.00 32.58 30.08 1bwp s HIS 106 CO -0.03 -2.51 0.00 0.41 -0.85 0.00 0.00 174.74 171.76 1bwp n GLY 107 N 2.36 1.09 3.78 -2.22 0.00 -1.26 -5.05 105.19 103.88 1bwp n GLY 107 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1bwp n GLY 107 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1bwp s HIS 108 N -2.62 3.42 0.92 1.61 4.02 -0.91 -5.12 115.29 116.61 1bwp s HIS 108 Ca 0.00 0.36 -0.11 0.00 1.02 0.00 0.00 55.06 56.33 1bwp s HIS 108 Cb 0.00 -1.94 0.15 0.00 -1.02 0.00 0.00 32.58 29.77 1bwp s HIS 108 CO 0.00 0.55 1.11 0.95 1.02 0.00 0.00 174.74 178.37 1bwp s THR 109 N -0.69 2.42 0.28 1.30 -4.23 -1.26 -4.80 115.64 108.67 1bwp s THR 109 Ca 0.12 0.14 -0.03 0.00 -1.18 0.00 0.00 61.69 60.74 1bwp s THR 109 Cb -0.12 -2.34 0.26 0.00 1.34 0.00 0.00 72.50 71.65 1bwp s THR 109 CO 0.03 -0.18 1.94 0.00 -0.54 0.00 0.00 174.62 175.87 1bwp h ALA 110 N -1.78 1.37 -0.63 3.99 0.00 -1.97 -1.81 119.26 118.43 1bwp h ALA 110 Ca -0.47 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.42 1bwp h ALA 110 Cb 1.27 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1bwp h ALA 110 CO 0.47 0.57 0.38 0.93 0.00 0.00 0.00 179.25 181.60 1bwp h GLU 111 N 1.21 0.71 -0.34 0.00 3.07 -1.93 -1.19 114.58 116.11 1bwp h GLU 111 Ca 0.35 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 59.13 1bwp h GLU 111 Cb -0.08 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.65 1bwp h GLU 111 CO -0.09 0.47 0.09 1.96 -1.40 0.00 0.00 179.01 180.04 1bwp h GLN 112 N 0.73 0.55 -0.65 2.33 4.20 -1.76 -1.86 115.11 118.65 1bwp h GLN 112 Ca 0.26 -0.13 0.05 0.00 0.06 0.00 0.00 58.65 58.89 1bwp h GLN 112 Cb 0.06 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 1bwp h GLN 112 CO -0.12 0.59 0.37 0.28 -0.67 0.00 0.00 178.83 179.29 1bwp h VAL 113 N 0.40 1.01 -0.70 -0.54 2.07 -1.27 -0.48 116.25 116.73 1bwp h VAL 113 Ca 0.11 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.45 1bwp h VAL 113 Cb 0.29 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 30.24 1bwp h VAL 113 CO 0.00 0.13 0.39 0.74 0.02 0.00 0.00 177.57 178.85 1bwp h THR 114 N 0.71 0.95 -0.66 2.57 2.02 -1.08 -1.00 112.91 116.42 1bwp h THR 114 Ca 0.28 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.20 1bwp h THR 114 Cb 0.12 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 1bwp h THR 114 CO -0.15 0.13 0.32 1.23 0.37 0.00 0.00 175.52 177.42 1bwp h GLY 115 N 0.70 1.02 0.22 2.16 0.00 -0.43 -0.72 103.07 106.00 1bwp h GLY 115 Ca 0.32 -0.50 0.09 0.00 0.00 0.00 0.00 47.33 47.24 1bwp h GLY 115 CO -0.20 0.47 -0.03 -1.33 0.00 0.00 0.00 176.54 175.46 1bwp h GLY 116 N 0.91 0.43 1.04 4.60 0.00 -0.59 -0.55 103.07 108.90 1bwp h GLY 116 Ca 0.23 0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.57 1bwp h GLY 116 CO -0.03 -0.13 0.10 -2.22 0.00 0.00 0.00 176.54 174.26 1bwp h ILE 117 N 0.08 1.26 -0.51 2.60 2.04 -0.74 -2.30 117.51 119.94 1bwp h ILE 117 Ca 0.23 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1bwp h ILE 117 Cb 0.34 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1bwp h ILE 117 CO -0.40 0.37 0.14 0.11 0.00 0.00 0.00 178.15 178.37 1bwp h LYS 118 N 0.91 0.77 -0.10 2.37 1.57 -0.87 -1.87 116.57 119.35 1bwp h LYS 118 Ca 0.19 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.71 1bwp h LYS 118 Cb 0.42 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1bwp h LYS 118 CO 0.01 0.69 -0.43 0.00 -0.57 0.00 0.00 179.45 179.14 1bwp h ALA 119 N 1.41 1.09 -0.16 3.86 0.00 -0.81 -1.82 119.26 122.82 1bwp h ALA 119 Ca 0.17 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1bwp h ALA 119 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1bwp h ALA 119 CO -0.01 0.60 0.05 0.82 0.00 0.00 0.00 179.25 180.71 1bwp h ILE 120 N 0.19 1.19 -0.76 0.00 2.04 -1.04 -2.08 117.51 117.05 1bwp h ILE 120 Ca 0.01 -0.59 0.03 0.00 1.00 0.00 0.00 64.86 65.31 1bwp h ILE 120 Cb 0.84 1.28 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 1bwp h ILE 120 CO 0.07 0.18 0.48 0.58 0.00 0.00 0.00 178.15 179.46 1bwp h VAL 121 N 0.08 1.12 -0.49 1.67 2.07 -1.09 -2.10 116.25 117.51 1bwp h VAL 121 Ca 0.05 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1bwp h VAL 121 Cb 0.24 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1bwp h VAL 121 CO -0.00 0.17 0.21 -0.61 0.02 0.00 0.00 177.57 177.37 1bwp h GLN 122 N 0.94 0.72 -0.24 1.57 5.75 -1.30 -0.36 115.11 122.19 1bwp h GLN 122 Ca 0.30 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1bwp h GLN 122 Cb 0.00 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.41 1bwp h GLN 122 CO -0.11 0.63 0.15 1.25 -2.65 0.00 0.00 178.83 178.11 1bwp h LEU 123 N 0.65 0.25 -0.94 -2.39 7.12 -1.21 -0.02 115.31 118.78 1bwp h LEU 123 Ca 0.17 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.18 1bwp h LEU 123 Cb 0.16 -0.06 -0.05 0.00 -0.53 0.00 0.00 40.66 40.19 1bwp h LEU 123 CO -0.02 0.19 0.60 0.58 -0.13 0.00 0.00 178.44 179.65 1bwp h VAL 124 N 0.31 1.25 0.00 1.05 2.07 -1.23 0.13 116.25 119.83 1bwp h VAL 124 Ca 0.09 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1bwp h VAL 124 Cb -0.02 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 29.64 1bwp h VAL 124 CO -0.03 0.25 -0.14 0.78 0.02 0.00 0.00 177.57 178.45 1bwp h ASN 125 N 1.28 0.00 0.06 0.57 2.35 -0.68 -0.04 115.58 119.11 1bwp h ASN 125 Ca 0.34 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.96 1bwp h ASN 125 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1bwp h ASN 125 CO -0.07 0.14 -0.63 -0.33 -1.65 0.00 0.00 177.43 174.89 1bwp h GLU 126 N 0.00 0.13 0.00 0.81 5.08 -0.04 -3.25 114.58 117.31 1bwp h GLU 126 Ca -0.00 -0.22 -0.21 0.00 -1.00 0.00 0.00 59.36 57.93 1bwp h GLU 126 Cb 0.26 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1bwp h GLU 126 CO 0.02 1.10 -1.08 -0.09 -1.00 0.00 0.00 179.01 177.96 1bwp h ARG 127 N -0.71 0.00 -2.03 2.33 9.65 -0.74 -3.38 114.38 119.50 1bwp h ARG 127 Ca -0.14 0.00 -0.49 0.00 -1.10 0.00 0.00 59.98 58.25 1bwp h ARG 127 Cb 1.35 0.00 -0.40 0.00 -1.39 0.00 0.00 29.97 29.53 1bwp h ARG 127 CO 0.02 0.87 -1.14 1.04 2.80 0.00 0.00 179.97 183.56 1bwp n GLN 128 N -3.28 1.21 0.32 0.20 1.13 -0.04 -4.98 117.38 111.94 1bwp n GLN 128 Ca -0.03 -3.54 0.21 0.00 -1.94 0.00 0.00 57.00 51.70 1bwp n GLN 128 Cb 0.94 -1.77 1.10 0.00 0.11 0.00 0.00 30.24 30.62 1bwp n GLN 128 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1bwp h PRO 129 N 3.00 0.00 0.00 -1.09 0.13 -1.65 -0.86 132.00 131.53 1bwp h PRO 129 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1bwp h PRO 129 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1bwp h PRO 129 CO 0.53 0.01 0.00 -0.56 -0.23 0.00 0.00 178.00 177.75 1bwp h GLN 130 N 0.00 0.00 -6.38 0.86 -0.00 -1.91 -3.47 115.11 104.21 1bwp h GLN 130 Ca -0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 58.65 58.10 1bwp h GLN 130 Cb 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 27.54 1bwp h GLN 130 CO 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 178.83 178.92 1bwp s ALA 131 N -3.56 3.50 0.48 0.06 0.00 -0.33 -4.92 121.76 116.99 1bwp s ALA 131 Ca 0.02 0.22 -0.22 0.00 0.00 0.00 0.00 51.96 51.99 1bwp s ALA 131 Cb 0.09 -2.83 -0.07 0.00 0.00 0.00 0.00 23.12 20.31 1bwp s ALA 131 CO 0.49 0.31 1.12 1.03 0.00 0.00 0.00 175.76 178.71 1bwp s ARG 132 N -1.01 3.68 -0.18 0.00 1.81 0.06 -4.89 118.95 118.41 1bwp s ARG 132 Ca 0.33 1.63 -0.01 0.00 -1.72 0.00 0.00 55.73 55.96 1bwp s ARG 132 Cb -0.21 -2.25 -0.00 0.00 -0.45 0.00 0.00 34.95 32.04 1bwp s ARG 132 CO 0.23 -0.59 -0.11 0.08 -0.68 0.00 0.00 175.30 174.23 1bwp s VAL 133 N -1.69 2.89 -0.21 3.52 1.01 -0.61 -1.20 120.40 124.10 1bwp s VAL 133 Ca 0.66 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.89 1bwp s VAL 133 Cb -0.25 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1bwp s VAL 133 CO 0.29 0.48 0.09 -0.69 0.00 0.00 0.00 175.10 175.27 1bwp s VAL 134 N 1.13 4.82 -0.19 2.92 1.01 -0.13 -0.34 120.40 129.61 1bwp s VAL 134 Ca 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.95 1bwp s VAL 134 Cb -0.14 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 1bwp s VAL 134 CO -0.04 0.40 -0.08 -0.69 0.00 0.00 0.00 175.10 174.70 1bwp s VAL 135 N 0.86 3.19 0.19 2.92 1.01 -0.41 0.38 120.40 128.53 1bwp s VAL 135 Ca 0.05 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.30 1bwp s VAL 135 Cb -0.13 -2.42 -0.08 0.00 0.00 0.00 0.00 36.38 33.75 1bwp s VAL 135 CO 0.03 0.46 0.62 -0.76 0.00 0.00 0.00 175.10 175.45 1bwp s LEU 136 N 1.13 4.31 0.58 3.92 1.02 -0.77 -1.20 118.68 127.67 1bwp s LEU 136 Ca 0.01 1.20 -0.20 0.00 0.02 0.00 0.00 54.13 55.16 1bwp s LEU 136 Cb -0.14 -3.45 -0.04 0.00 0.02 0.00 0.00 46.19 42.58 1bwp s LEU 136 CO -0.02 0.05 1.32 -0.83 0.02 0.00 0.00 176.35 176.89 1bwp s GLY 137 N -1.77 2.87 0.09 -3.19 0.00 -0.02 -4.75 107.32 100.54 1bwp s GLY 137 Ca 0.41 1.27 -0.31 0.00 0.00 0.00 0.00 44.72 46.09 1bwp s GLY 137 CO 0.20 1.74 1.26 1.08 0.00 0.00 0.00 173.10 177.38 1bwp s LEU 138 N -3.82 4.37 0.59 0.66 1.43 -1.26 -4.81 118.68 115.84 1bwp s LEU 138 Ca 0.75 2.13 -0.14 0.00 -1.03 0.00 0.00 54.13 55.84 1bwp s LEU 138 Cb -0.39 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.21 1bwp s LEU 138 CO 0.44 -0.52 1.03 -0.76 0.23 0.00 0.00 176.35 176.76 1bwp s LEU 139 N 0.99 3.42 0.80 1.79 1.43 -1.26 -4.78 118.68 121.07 1bwp s LEU 139 Ca 0.60 1.63 -0.13 0.00 -1.03 0.00 0.00 54.13 55.21 1bwp s LEU 139 Cb -0.32 -4.51 0.08 0.00 0.03 0.00 0.00 46.19 41.47 1bwp s LEU 139 CO 0.30 -0.99 1.17 -2.16 0.23 0.00 0.00 176.35 174.90 1bwp s PRO 140 N -4.45 1.77 0.14 1.29 0.05 -1.26 -4.97 135.00 127.57 1bwp s PRO 140 Ca 0.60 1.62 -0.15 0.00 0.05 0.00 0.00 61.00 63.12 1bwp s PRO 140 Cb -0.13 -1.80 0.02 0.00 0.05 0.00 0.00 34.50 32.64 1bwp s PRO 140 CO 0.42 -2.09 0.39 -0.98 0.05 0.00 0.00 177.00 174.79 1bwp s ARG 141 N -4.28 1.13 0.00 4.56 1.70 -1.26 -4.88 118.95 115.92 1bwp s ARG 141 Ca 0.70 -0.84 0.00 0.00 -0.47 0.00 0.00 55.73 55.13 1bwp s ARG 141 Cb -0.26 0.46 0.00 0.00 -0.57 0.00 0.00 34.95 34.58 1bwp s ARG 141 CO 0.51 -0.44 0.00 0.41 -1.08 0.00 0.00 175.30 174.70 1bwp n GLY 142 N -0.23 -0.70 0.26 3.88 0.00 -0.25 -4.57 105.19 103.57 1bwp n GLY 142 Ca -0.13 -1.42 -0.06 0.00 0.00 0.00 0.00 46.02 44.41 1bwp n GLY 142 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1bwp h GLN 143 N 0.00 0.71 -5.56 1.61 4.15 -1.87 -3.39 115.11 110.77 1bwp h GLN 143 Ca 0.00 -0.27 -0.57 0.00 0.77 0.00 0.00 58.65 58.58 1bwp h GLN 143 Cb 0.00 -0.04 -0.13 0.00 0.21 0.00 0.00 27.48 27.52 1bwp h GLN 143 CO 0.00 0.86 -0.62 -1.01 -1.93 0.00 0.00 178.83 176.13 1bwp s HIS 144 N -4.62 2.28 0.33 3.99 3.76 -1.26 -1.60 115.29 118.16 1bwp s HIS 144 Ca -0.09 -0.73 -0.28 0.00 -0.15 0.00 0.00 55.06 53.81 1bwp s HIS 144 Cb 0.13 -1.50 -0.13 0.00 1.11 0.00 0.00 32.58 32.20 1bwp s HIS 144 CO 0.82 0.33 1.19 -2.30 -0.85 0.00 0.00 174.74 173.93 1bwp n PRO 145 N -0.82 1.86 -3.67 8.40 -0.02 -1.25 -4.97 135.00 134.52 1bwp n PRO 145 Ca -0.04 0.65 -0.08 0.00 -2.02 0.00 0.00 63.50 62.01 1bwp n PRO 145 Cb 0.66 -2.16 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 1bwp n PRO 145 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1bwp s ASN 146 N -0.40 -0.33 0.55 2.55 4.22 -1.26 -5.06 114.94 115.21 1bwp s ASN 146 Ca 0.57 -0.32 0.32 0.00 -2.14 0.00 0.00 52.86 51.29 1bwp s ASN 146 Cb -0.61 0.59 1.58 0.00 1.28 0.00 0.00 41.25 44.09 1bwp s ASN 146 CO 0.61 -1.04 2.09 -0.65 -2.04 0.00 0.00 177.10 176.08 1bwp h PRO 147 N 2.00 0.00 0.00 3.55 0.11 -1.97 -2.53 132.00 133.15 1bwp h PRO 147 Ca -0.24 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.72 1bwp h PRO 147 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1bwp h PRO 147 CO 0.28 0.08 -0.67 -0.07 -0.21 0.00 0.00 178.00 177.41 1bwp h LEU 148 N 0.00 0.00 -0.38 2.35 3.38 -1.97 -1.09 115.31 117.60 1bwp h LEU 148 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1bwp h LEU 148 Cb 0.34 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1bwp h LEU 148 CO 0.01 0.67 0.21 0.03 0.09 0.00 0.00 178.44 179.46 1bwp h ARG 149 N 0.00 0.42 -0.29 1.13 3.08 -1.70 -0.80 114.38 116.23 1bwp h ARG 149 Ca -0.01 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1bwp h ARG 149 Cb 1.30 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 1bwp h ARG 149 CO 0.09 0.28 -0.09 0.93 -1.07 0.00 0.00 179.97 180.10 1bwp h GLU 150 N 0.44 0.58 -0.31 0.04 4.39 -1.52 -1.70 114.58 116.48 1bwp h GLU 150 Ca 0.15 -0.23 0.07 0.00 0.34 0.00 0.00 59.36 59.69 1bwp h GLU 150 Cb 0.02 -0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 28.56 1bwp h GLU 150 CO -0.08 0.79 -0.35 -0.22 -1.16 0.00 0.00 179.01 177.99 1bwp h LYS 151 N 0.33 -0.30 -0.63 2.33 3.64 -1.17 -1.04 116.57 119.73 1bwp h LYS 151 Ca 0.07 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1bwp h LYS 151 Cb 0.59 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 1bwp h LYS 151 CO 0.03 -0.20 0.05 -0.91 -2.27 0.00 0.00 179.45 176.15 1bwp h ASN 152 N -0.32 1.03 -0.46 4.20 4.21 -1.07 -0.64 115.58 122.53 1bwp h ASN 152 Ca 0.14 -0.27 0.09 0.00 1.21 0.00 0.00 56.30 57.47 1bwp h ASN 152 Cb 0.55 -0.27 -0.07 0.00 -1.12 0.00 0.00 38.32 37.40 1bwp h ASN 152 CO -0.49 1.05 0.02 -0.09 -1.29 0.00 0.00 177.43 176.63 1bwp h ARG 153 N 0.98 0.13 -0.55 0.81 2.43 -1.19 -1.84 114.38 115.15 1bwp h ARG 153 Ca 0.18 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1bwp h ARG 153 Cb 0.50 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1bwp h ARG 153 CO 0.02 0.09 0.22 -0.09 -1.51 0.00 0.00 179.97 178.70 1bwp h ARG 154 N 0.13 0.83 -0.22 0.20 9.65 -0.53 -1.89 114.38 122.54 1bwp h ARG 154 Ca 0.23 -0.15 0.06 0.00 -1.10 0.00 0.00 59.98 59.02 1bwp h ARG 154 Cb 0.33 -0.13 -0.06 0.00 -1.39 0.00 0.00 29.97 28.72 1bwp h ARG 154 CO -0.37 0.72 -0.19 0.28 2.80 0.00 0.00 179.97 183.21 1bwp h VAL 155 N 0.75 0.49 -0.99 0.20 2.07 -1.03 -0.85 116.25 116.89 1bwp h VAL 155 Ca 0.18 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.74 1bwp h VAL 155 Cb 0.20 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 1bwp h VAL 155 CO -0.01 0.00 0.65 0.78 0.02 0.00 0.00 177.57 179.00 1bwp h ASN 156 N -0.19 1.07 -0.07 0.57 2.35 -1.12 0.14 115.58 118.32 1bwp h ASN 156 Ca 0.13 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1bwp h ASN 156 Cb 0.39 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1bwp h ASN 156 CO -0.34 0.73 0.04 -0.33 -1.65 0.00 0.00 177.43 175.89 1bwp h GLU 157 N 1.24 0.08 -0.42 0.81 5.08 -0.96 -0.50 114.58 119.91 1bwp h GLU 157 Ca 0.39 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.61 1bwp h GLU 157 Cb 0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1bwp h GLU 157 CO -0.12 0.06 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.59 1bwp h LEU 158 N 0.09 0.94 -0.36 1.33 3.38 -0.46 -2.34 115.31 117.89 1bwp h LEU 158 Ca 0.03 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.53 1bwp h LEU 158 Cb -0.00 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1bwp h LEU 158 CO -0.02 1.16 -0.12 0.58 0.09 0.00 0.00 178.44 180.14 1bwp h VAL 159 N 0.77 1.28 -0.64 1.22 2.07 -0.72 -0.77 116.25 119.46 1bwp h VAL 159 Ca 0.09 -1.21 0.06 0.00 0.82 0.00 0.00 66.70 66.46 1bwp h VAL 159 Cb 0.85 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 1bwp h VAL 159 CO 0.08 0.40 0.33 -0.09 0.02 0.00 0.00 177.57 178.31 1bwp h ARG 160 N 0.51 0.59 -0.09 1.57 2.43 -1.02 -1.25 114.38 117.13 1bwp h ARG 160 Ca 0.09 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.07 1bwp h ARG 160 Cb 0.64 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1bwp h ARG 160 CO 0.04 0.39 -0.61 0.00 -1.51 0.00 0.00 179.97 178.28 1bwp h ALA 161 N 1.35 0.79 -0.70 2.80 0.00 -1.33 -2.20 119.26 119.97 1bwp h ALA 161 Ca 0.29 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1bwp h ALA 161 Cb 0.22 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1bwp h ALA 161 CO -0.20 0.73 0.26 0.00 0.00 0.00 0.00 179.25 180.03 1bwp h ALA 162 N 1.12 0.91 0.00 0.00 0.00 -0.77 -3.23 119.26 117.30 1bwp h ALA 162 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1bwp h ALA 162 Cb 1.13 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1bwp h ALA 162 CO 0.10 0.56 -0.38 1.28 0.00 0.00 0.00 179.25 180.81 1bwp n LEU 163 N -4.34 0.40 -0.03 0.00 4.32 -0.50 -4.38 117.00 112.46 1bwp n LEU 163 Ca 0.05 0.16 -0.09 0.00 -0.02 0.00 0.00 56.01 56.11 1bwp n LEU 163 Cb 0.19 -0.31 -0.03 0.00 -1.62 0.00 0.00 43.42 41.66 1bwp n LEU 163 CO 0.40 0.07 0.88 0.00 -1.22 0.00 0.00 177.39 177.52 1bwp h ALA 164 N 2.94 0.18 -1.43 -1.18 0.00 -1.41 -1.69 119.26 116.67 1bwp h ALA 164 Ca 0.00 0.04 -0.68 0.00 0.00 0.00 0.00 54.91 54.27 1bwp h ALA 164 Cb 0.53 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.23 1bwp h ALA 164 CO 0.00 -0.41 1.45 0.20 0.00 0.00 0.00 179.25 180.49 1bwp s GLY 165 N -2.49 1.84 -0.33 0.00 0.00 -1.26 -4.81 107.32 100.27 1bwp s GLY 165 Ca -0.13 -2.85 0.07 0.00 0.00 0.00 0.00 44.72 41.80 1bwp s GLY 165 CO 0.68 2.34 0.60 0.30 0.00 0.00 0.00 173.10 177.02 1bwp s HIS 166 N 3.26 -1.79 0.24 1.90 4.02 -0.64 -5.07 115.29 117.22 1bwp s HIS 166 Ca 0.43 0.77 -0.05 0.00 1.02 0.00 0.00 55.06 57.24 1bwp s HIS 166 Cb -0.01 0.30 0.45 0.00 -1.02 0.00 0.00 32.58 32.30 1bwp s HIS 166 CO -0.03 -1.12 1.71 -1.35 1.02 0.00 0.00 174.74 174.98 1bwp h PRO 167 N 7.66 0.36 -0.31 8.40 0.11 -1.87 -2.45 132.00 143.89 1bwp h PRO 167 Ca 0.01 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.92 1bwp h PRO 167 Cb 1.18 -0.08 -0.11 0.00 0.11 0.00 0.00 31.00 32.10 1bwp h PRO 167 CO 0.14 0.24 -0.21 0.54 -0.21 0.00 0.00 178.00 178.50 1bwp n ARG 168 N -5.06 1.90 -5.14 1.05 1.74 -1.26 -4.94 116.66 104.95 1bwp n ARG 168 Ca 0.14 -3.29 -0.32 0.00 -0.77 0.00 0.00 57.85 53.61 1bwp n ARG 168 Cb 0.42 -1.81 -0.17 0.00 -1.02 0.00 0.00 32.46 29.88 1bwp n ARG 168 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bwp s ALA 169 N -3.29 2.14 -0.18 7.54 0.00 -0.93 -1.57 121.76 125.47 1bwp s ALA 169 Ca 0.44 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1bwp s ALA 169 Cb 0.40 -0.82 0.03 0.00 0.00 0.00 0.00 23.12 22.74 1bwp s ALA 169 CO -0.02 0.25 -0.15 -1.01 0.00 0.00 0.00 175.76 174.84 1bwp s HIS 170 N 0.40 2.56 0.03 0.00 3.76 0.53 -4.73 115.29 117.84 1bwp s HIS 170 Ca -0.18 -1.58 -0.29 0.00 -0.15 0.00 0.00 55.06 52.86 1bwp s HIS 170 Cb -0.18 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.72 1bwp s HIS 170 CO 0.08 -0.76 0.95 0.12 -0.85 0.00 0.00 174.74 174.28 1bwp s PHE 171 N 1.36 3.70 -0.16 1.40 5.36 -1.26 -1.29 117.98 127.08 1bwp s PHE 171 Ca 0.02 1.69 0.01 0.00 -0.96 0.00 0.00 56.93 57.68 1bwp s PHE 171 Cb -0.14 -3.07 0.02 0.00 -0.34 0.00 0.00 43.02 39.49 1bwp s PHE 171 CO -0.10 0.07 -0.15 -1.17 -1.46 0.00 0.00 175.22 172.41 1bwp s LEU 172 N 0.68 1.83 -0.68 6.12 2.96 -0.35 -4.96 118.68 124.28 1bwp s LEU 172 Ca 0.49 -0.56 -0.27 0.00 -0.22 0.00 0.00 54.13 53.56 1bwp s LEU 172 Cb -0.21 -1.24 0.02 0.00 0.50 0.00 0.00 46.19 45.26 1bwp s LEU 172 CO 0.28 -0.06 1.34 -0.62 -1.32 0.00 0.00 176.35 175.97 1bwp s ASP 173 N 1.44 6.12 -0.03 3.68 -1.08 -1.26 -0.84 116.67 124.70 1bwp s ASP 173 Ca 0.04 -0.19 0.12 0.00 -0.52 0.00 0.00 52.55 52.01 1bwp s ASP 173 Cb -0.13 -2.55 0.40 0.00 -1.46 0.00 0.00 42.92 39.17 1bwp s ASP 173 CO -0.11 -1.82 1.30 0.00 0.52 0.00 0.00 175.17 175.06 1bwp n ALA 174 N 9.58 2.60 -2.62 3.66 0.00 -1.26 -4.90 120.51 127.56 1bwp n ALA 174 Ca 0.07 -0.82 -0.42 0.00 0.00 0.00 0.00 53.44 52.26 1bwp n ALA 174 Cb 0.49 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.92 1bwp n ALA 174 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bwp s ASP 175 N -0.89 6.76 0.00 0.00 2.15 -1.26 -4.40 116.67 119.03 1bwp s ASP 175 Ca 0.29 0.83 0.22 0.00 0.43 0.00 0.00 52.55 54.32 1bwp s ASP 175 Cb 0.17 -2.45 1.29 0.00 -0.30 0.00 0.00 42.92 41.63 1bwp s ASP 175 CO 0.18 -0.67 1.69 -0.81 -0.17 0.00 0.00 175.17 175.39 1bwp n PRO 176 N 6.34 0.75 0.00 4.34 -0.04 -1.26 -4.84 135.00 140.29 1bwp n PRO 176 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1bwp n PRO 176 Cb 0.48 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 1bwp n PRO 176 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bwp n GLY 177 N 0.47 0.60 0.32 0.55 0.00 -1.26 -5.04 105.19 100.82 1bwp n GLY 177 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1bwp n GLY 177 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1bwp h PHE 178 N 0.00 0.75 -3.10 1.61 0.04 -1.96 -3.40 116.94 110.88 1bwp h PHE 178 Ca 0.00 -0.02 -0.57 0.00 2.80 0.00 0.00 57.97 60.18 1bwp h PHE 178 Cb 0.00 -0.24 -0.06 0.00 2.20 0.00 0.00 35.95 37.85 1bwp h PHE 178 CO 0.00 0.55 0.85 0.08 -0.60 0.00 0.00 178.31 179.19 1bwp s VAL 179 N -5.47 4.50 0.76 -0.55 1.01 -1.26 -4.47 120.40 114.92 1bwp s VAL 179 Ca -0.09 1.79 -0.08 0.00 0.00 0.00 0.00 61.98 63.59 1bwp s VAL 179 Cb 0.17 -4.25 0.09 0.00 0.00 0.00 0.00 36.38 32.38 1bwp s VAL 179 CO 0.77 -0.27 1.08 -1.00 0.00 0.00 0.00 175.10 175.69 1bwp s HIS 180 N 3.48 2.68 0.31 5.22 3.76 -0.39 -4.92 115.29 125.43 1bwp s HIS 180 Ca 0.48 0.44 0.35 0.00 -0.15 0.00 0.00 55.06 56.19 1bwp s HIS 180 Cb -0.16 -3.35 1.65 0.00 1.11 0.00 0.00 32.58 31.83 1bwp s HIS 180 CO 0.12 -1.65 2.10 0.66 -0.85 0.00 0.00 174.74 175.11 1bwp h SER 181 N -0.81 0.00 -0.13 1.40 4.64 -1.96 0.31 113.55 116.99 1bwp h SER 181 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1bwp h SER 181 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1bwp h SER 181 CO 0.58 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1bwp n ASP 182 N -3.19 0.78 0.00 4.97 5.75 -1.26 -4.92 116.55 118.69 1bwp n ASP 182 Ca -0.01 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.90 1bwp n ASP 182 Cb 0.24 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1bwp n ASP 182 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bwp n GLY 183 N 0.80 0.92 3.92 6.12 0.00 0.11 -5.00 105.19 112.05 1bwp n GLY 183 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1bwp n GLY 183 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bwp s THR 184 N -2.90 5.22 -0.09 2.61 -4.23 -1.25 -3.93 115.64 111.08 1bwp s THR 184 Ca 0.00 -0.23 -0.02 0.00 -1.18 0.00 0.00 61.69 60.26 1bwp s THR 184 Cb 0.00 -3.68 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 1bwp s THR 184 CO 0.00 -0.06 -0.00 -0.63 -0.54 0.00 0.00 174.62 173.39 1bwp s ILE 185 N -1.75 4.28 0.06 2.99 1.01 -0.63 -1.27 121.20 125.90 1bwp s ILE 185 Ca 0.39 -0.26 -0.14 0.00 0.00 0.00 0.00 60.65 60.64 1bwp s ILE 185 Cb -0.12 -2.80 -0.06 0.00 0.01 0.00 0.00 42.46 39.50 1bwp s ILE 185 CO 0.27 0.60 0.46 -0.94 0.00 0.00 0.00 174.94 175.34 1bwp s SER 186 N -0.86 6.81 0.23 3.58 1.04 -1.26 -4.79 113.70 118.44 1bwp s SER 186 Ca 0.13 0.99 0.22 0.00 0.48 0.00 0.00 55.95 57.77 1bwp s SER 186 Cb -0.11 -2.26 0.94 0.00 0.10 0.00 0.00 66.02 64.69 1bwp s SER 186 CO 0.02 0.23 1.67 0.00 0.98 0.00 0.00 173.24 176.15 1bwp n HIS 187 N 1.36 0.70 0.03 5.02 1.44 -1.26 -1.43 115.22 121.08 1bwp n HIS 187 Ca -0.10 0.28 0.02 0.00 -2.01 0.00 0.00 57.72 55.91 1bwp n HIS 187 Cb 0.52 -0.95 0.37 0.00 0.12 0.00 0.00 29.99 30.05 1bwp n HIS 187 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1bwp h HIS 188 N 0.00 0.47 0.17 -1.40 3.86 -1.94 -3.16 115.15 113.15 1bwp h HIS 188 Ca 0.00 -0.02 -0.32 0.00 -1.16 0.00 0.00 60.37 58.87 1bwp h HIS 188 Cb 0.33 -0.15 0.01 0.00 1.06 0.00 0.00 27.41 28.67 1bwp h HIS 188 CO 0.00 0.41 -1.58 -0.44 0.86 0.00 0.00 177.93 177.18 1bwp h ASP 189 N 0.47 0.57 -3.28 2.45 3.32 -1.64 -3.39 116.42 114.92 1bwp h ASP 189 Ca 0.11 -0.92 -0.54 0.00 0.02 0.00 0.00 57.03 55.71 1bwp h ASP 189 Cb 0.16 -0.18 -0.40 0.00 0.22 0.00 0.00 39.33 39.13 1bwp h ASP 189 CO -0.01 1.71 -0.77 -0.04 -1.72 0.00 0.00 179.24 178.42 1bwp s MET 190 N -2.54 0.77 0.39 3.56 -1.94 -1.01 -0.96 119.30 117.56 1bwp s MET 190 Ca -0.16 -0.62 0.17 0.00 -1.71 0.00 0.00 55.69 53.36 1bwp s MET 190 Cb 0.05 -2.12 0.80 0.00 2.01 0.00 0.00 34.83 35.57 1bwp s MET 190 CO 0.84 -0.72 1.82 0.10 -0.01 0.00 0.00 175.02 177.05 1bwp h TYR 191 N 8.18 0.00 -0.09 -0.03 -0.00 -1.43 -1.65 116.97 121.95 1bwp h TYR 191 Ca -0.16 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.54 1bwp h TYR 191 Cb 1.09 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.80 1bwp h TYR 191 CO 0.32 0.35 -0.22 -0.40 -0.00 0.00 0.00 178.16 178.22 1bwp n ASP 192 N -3.82 2.26 -1.85 0.10 5.68 -1.26 -4.91 116.55 112.74 1bwp n ASP 192 Ca -0.01 -3.55 -0.20 0.00 -0.50 0.00 0.00 54.79 50.53 1bwp n ASP 192 Cb 0.43 -0.52 -0.05 0.00 -1.14 0.00 0.00 41.12 39.83 1bwp n ASP 192 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1bwp n TYR 193 N -1.16 -0.42 0.07 2.11 4.01 -0.62 -4.69 117.16 116.47 1bwp n TYR 193 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 1bwp n TYR 193 Cb 0.76 -3.56 0.00 0.00 -0.31 0.00 0.00 39.34 36.23 1bwp n TYR 193 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1bwp n LEU 194 N -2.52 -0.52 -4.76 7.72 7.94 -1.26 -1.09 117.00 122.50 1bwp n LEU 194 Ca -0.22 0.25 -0.39 0.00 -1.11 0.00 0.00 56.01 54.54 1bwp n LEU 194 Cb 0.66 0.63 -0.06 0.00 0.53 0.00 0.00 43.42 45.19 1bwp n LEU 194 CO 0.29 -0.50 0.44 -1.00 -1.11 0.00 0.00 177.39 175.52 1bwp s HIS 195 N -2.00 3.81 0.11 1.96 3.76 -1.26 -5.01 115.29 116.65 1bwp s HIS 195 Ca 0.00 1.50 -0.30 0.00 -0.15 0.00 0.00 55.06 56.11 1bwp s HIS 195 Cb 0.00 -2.76 -0.06 0.00 1.11 0.00 0.00 32.58 30.87 1bwp s HIS 195 CO 0.00 0.40 1.02 -0.51 -0.85 0.00 0.00 174.74 174.80 1bwp s LEU 196 N -0.59 4.46 1.05 0.89 1.43 -1.26 -2.38 118.68 122.29 1bwp s LEU 196 Ca 0.36 1.87 -0.13 0.00 -1.03 0.00 0.00 54.13 55.20 1bwp s LEU 196 Cb -0.21 -3.59 0.22 0.00 0.03 0.00 0.00 46.19 42.63 1bwp s LEU 196 CO 0.24 -0.17 1.08 -0.94 0.23 0.00 0.00 176.35 176.79 1bwp s SER 197 N 0.23 2.16 0.20 2.29 1.04 -0.14 -4.81 113.70 114.67 1bwp s SER 197 Ca 0.49 1.15 -0.18 0.00 0.48 0.00 0.00 55.95 57.90 1bwp s SER 197 Cb -0.25 -1.80 0.18 0.00 0.10 0.00 0.00 66.02 64.25 1bwp s SER 197 CO 0.31 -3.42 1.60 -0.09 0.98 0.00 0.00 173.24 172.62 1bwp h ARG 198 N -2.09 -0.10 -0.67 4.02 1.12 -1.89 -0.98 114.38 113.79 1bwp h ARG 198 Ca -0.55 0.01 0.06 0.00 -1.11 0.00 0.00 59.98 58.38 1bwp h ARG 198 Cb 1.33 0.02 -0.05 0.00 -0.01 0.00 0.00 29.97 31.26 1bwp h ARG 198 CO 0.55 -0.06 0.38 1.25 -3.11 0.00 0.00 179.97 178.98 1bwp h LEU 199 N -0.10 0.57 -1.24 3.80 5.85 -1.90 -2.74 115.31 119.55 1bwp h LEU 199 Ca 0.27 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 1bwp h LEU 199 Cb 0.53 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1bwp h LEU 199 CO -0.68 0.37 0.06 1.23 -0.34 0.00 0.00 178.44 179.07 1bwp h GLY 200 N 0.70 0.62 2.00 3.75 0.00 -1.51 -3.01 103.07 105.62 1bwp h GLY 200 Ca 0.30 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 1bwp h GLY 200 CO -0.18 0.33 -0.04 -0.97 0.00 0.00 0.00 176.54 175.69 1bwp h TYR 201 N 0.56 0.00 -0.07 5.60 0.05 -0.89 -3.35 116.97 118.88 1bwp h TYR 201 Ca 0.13 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.89 1bwp h TYR 201 Cb 0.27 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.01 1bwp h TYR 201 CO 0.01 0.04 -0.01 1.15 -1.05 0.00 0.00 178.16 178.29 1bwp h THR 202 N 0.00 1.29 0.00 -2.88 2.02 -1.48 -1.19 112.91 110.67 1bwp h THR 202 Ca -0.00 -0.91 -0.16 0.00 0.77 0.00 0.00 66.41 66.12 1bwp h THR 202 Cb 0.50 1.76 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 1bwp h THR 202 CO 0.00 0.25 -0.74 1.55 0.37 0.00 0.00 175.52 176.95 1bwp h PRO 203 N -0.20 0.00 0.34 6.66 0.13 -1.77 -1.27 132.00 135.88 1bwp h PRO 203 Ca 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1bwp h PRO 203 Cb 0.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.54 1bwp h PRO 203 CO 0.01 0.74 -0.16 0.28 -0.23 0.00 0.00 178.00 178.64 1bwp h VAL 204 N 0.00 0.68 -0.53 1.56 2.07 -1.66 -2.16 116.25 116.20 1bwp h VAL 204 Ca -0.01 -0.09 -0.11 0.00 0.82 0.00 0.00 66.70 67.32 1bwp h VAL 204 Cb 1.32 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1bwp h VAL 204 CO 0.10 0.02 -0.08 0.00 0.02 0.00 0.00 177.57 177.63 1bwp h ARG 206 N 0.87 -0.28 -0.83 0.00 9.65 -1.28 0.29 114.38 122.80 1bwp h ARG 206 Ca 0.14 0.02 0.01 0.00 -1.10 0.00 0.00 59.98 59.05 1bwp h ARG 206 Cb 0.64 0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.24 1bwp h ARG 206 CO 0.04 -0.19 0.55 0.00 2.80 0.00 0.00 179.97 183.18 1bwp h ALA 207 N 0.62 1.06 -0.21 2.80 0.00 -1.05 -2.26 119.26 120.22 1bwp h ALA 207 Ca 0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1bwp h ALA 207 Cb 0.56 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1bwp h ALA 207 CO -0.55 0.45 0.02 1.25 0.00 0.00 0.00 179.25 180.43 1bwp h LEU 208 N 1.12 0.34 -0.72 0.00 5.85 -0.99 -2.71 115.31 118.20 1bwp h LEU 208 Ca 0.31 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1bwp h LEU 208 Cb -0.12 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 40.79 1bwp h LEU 208 CO -0.07 0.54 0.48 -0.74 -0.34 0.00 0.00 178.44 178.30 1bwp h HIS 209 N 0.14 0.90 0.19 1.25 2.76 -0.29 -0.47 115.15 119.63 1bwp h HIS 209 Ca 0.06 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1bwp h HIS 209 Cb 0.35 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 1bwp h HIS 209 CO 0.03 0.57 -0.17 1.03 -1.30 0.00 0.00 177.93 178.08 1bwp h SER 210 N 0.97 -0.45 -0.50 3.26 0.87 -1.40 -0.98 113.55 115.32 1bwp h SER 210 Ca 0.26 0.04 0.08 0.00 -1.23 0.00 0.00 61.79 60.94 1bwp h SER 210 Cb -0.11 0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 61.94 1bwp h SER 210 CO -0.06 -0.26 0.13 0.25 -0.53 0.00 0.00 176.83 176.36 1bwp h LEU 211 N -0.38 0.07 -0.33 2.23 5.85 -1.14 -2.05 115.31 119.56 1bwp h LEU 211 Ca -0.00 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1bwp h LEU 211 Cb 0.35 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1bwp h LEU 211 CO -0.03 0.07 0.13 -0.07 -0.34 0.00 0.00 178.44 178.20 1bwp h LEU 212 N 0.28 0.17 -0.52 2.25 4.07 -0.75 -0.97 115.31 119.85 1bwp h LEU 212 Ca 0.25 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.23 1bwp h LEU 212 Cb 0.31 -0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.02 1bwp h LEU 212 CO -0.30 0.14 0.30 -0.07 -1.08 0.00 0.00 178.44 177.44 1bwp h LEU 213 N 0.29 0.64 -0.38 1.67 -0.00 -0.91 0.47 115.31 117.10 1bwp h LEU 213 Ca 0.14 -0.07 0.07 0.00 -0.00 0.00 0.00 57.88 58.02 1bwp h LEU 213 Cb 0.09 -0.16 -0.07 0.00 -0.00 0.00 0.00 40.66 40.52 1bwp h LEU 213 CO -0.13 0.53 -0.07 -0.09 -0.00 0.00 0.00 178.44 178.67 1bwp h ARG 214 N 0.70 0.02 -0.45 1.13 2.43 -0.97 -2.73 114.38 114.51 1bwp h ARG 214 Ca 0.19 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.24 1bwp h ARG 214 Cb 0.01 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1bwp h ARG 214 CO -0.03 0.01 -0.17 -0.07 -1.51 0.00 0.00 179.97 178.20 1bwp h LEU 215 N 0.02 0.87 0.00 3.80 3.38 -0.75 -3.52 115.31 119.12 1bwp h LEU 215 Ca 0.18 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1bwp h LEU 215 Cb 0.28 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1bwp h LEU 215 CO -0.37 1.03 0.00 -0.11 0.09 0.00 0.00 178.44 179.08