#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwk s PHE 2 N 0.00 3.49 -0.08 7.33 0.08 -1.26 -1.19 117.98 126.34 1bwk s PHE 2 Ca 0.00 1.03 -0.31 0.00 0.12 0.00 0.00 56.93 57.77 1bwk s PHE 2 Cb 0.00 -2.44 -0.09 0.00 -0.57 0.00 0.00 43.02 39.92 1bwk s PHE 2 CO 0.00 -0.14 2.01 0.28 -0.10 0.00 0.00 175.22 177.27 1bwk n VAL 3 N -1.45 0.60 0.00 -0.44 0.31 0.19 -4.72 118.33 112.82 1bwk n VAL 3 Ca 0.02 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 1bwk n VAL 3 Cb 0.54 -2.20 0.00 0.00 -0.91 0.00 0.00 33.84 31.27 1bwk n VAL 3 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1bwk n LYS 4 N 7.57 0.00 -1.62 5.55 4.76 -1.26 -3.72 118.16 129.44 1bwk n LYS 4 Ca 0.24 0.62 -0.36 0.00 -2.87 0.00 0.00 58.31 55.94 1bwk n LYS 4 Cb 0.37 -1.28 0.06 0.00 -1.84 0.00 0.00 35.03 32.34 1bwk n LYS 4 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1bwk n ASP 5 N -1.87 7.46 -4.62 4.39 8.00 -1.26 -4.96 116.55 123.69 1bwk n ASP 5 Ca 0.00 -3.81 -0.35 0.00 0.71 0.00 0.00 54.79 51.35 1bwk n ASP 5 Cb 0.00 -0.97 -0.10 0.00 -0.02 0.00 0.00 41.12 40.03 1bwk n ASP 5 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1bwk s PHE 6 N -3.91 3.24 -0.78 1.24 5.36 -1.24 -5.05 117.98 116.83 1bwk s PHE 6 Ca 0.59 0.04 -0.12 0.00 -0.96 0.00 0.00 56.93 56.48 1bwk s PHE 6 Cb 0.48 -2.08 0.20 0.00 -0.34 0.00 0.00 43.02 41.28 1bwk s PHE 6 CO -0.17 0.13 0.69 0.15 -1.46 0.00 0.00 175.22 174.56 1bwk s LYS 7 N 0.43 3.38 0.95 10.12 3.01 -1.26 -5.03 119.74 131.34 1bwk s LYS 7 Ca 0.03 -2.45 -0.11 0.00 -1.01 0.00 0.00 55.97 52.43 1bwk s LYS 7 Cb -0.13 -4.29 0.11 0.00 -1.01 0.00 0.00 37.83 32.52 1bwk s LYS 7 CO 0.00 -1.27 0.81 -0.35 0.51 0.00 0.00 175.35 175.06 1bwk n PRO 8 N 3.92 -0.53 -3.70 -1.68 -0.04 -1.26 -5.00 135.00 126.72 1bwk n PRO 8 Ca 0.12 -0.10 -0.15 0.00 -0.04 0.00 0.00 63.50 63.33 1bwk n PRO 8 Cb 0.45 -2.14 -0.15 0.00 -0.04 0.00 0.00 33.50 31.62 1bwk n PRO 8 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1bwk s GLN 9 N -4.19 0.09 0.26 0.54 0.74 -1.26 -5.01 119.66 110.83 1bwk s GLN 9 Ca 0.63 0.53 -0.30 0.00 0.05 0.00 0.00 55.36 56.26 1bwk s GLN 9 Cb -0.22 -0.19 -0.11 0.00 1.10 0.00 0.00 33.01 33.59 1bwk s GLN 9 CO 0.62 -0.24 1.58 0.00 -0.55 0.00 0.00 175.29 176.70 1bwk s ALA 10 N 1.81 3.75 -0.35 1.58 0.00 -1.26 -4.35 121.76 122.95 1bwk s ALA 10 Ca -0.03 1.51 0.09 0.00 0.00 0.00 0.00 51.96 53.53 1bwk s ALA 10 Cb -0.12 -3.63 0.23 0.00 0.00 0.00 0.00 23.12 19.60 1bwk s ALA 10 CO -0.07 -0.91 1.17 1.28 0.00 0.00 0.00 175.76 177.23 1bwk n LEU 11 N 2.60 2.64 0.24 0.00 4.32 -0.24 -4.71 117.00 121.85 1bwk n LEU 11 Ca 0.09 -2.33 0.08 0.00 -0.02 0.00 0.00 56.01 53.83 1bwk n LEU 11 Cb 0.38 -0.23 0.59 0.00 -1.62 0.00 0.00 43.42 42.54 1bwk n LEU 11 CO 0.63 0.64 0.93 1.23 -1.22 0.00 0.00 177.39 179.59 1bwk h GLY 12 N 0.93 0.00 -2.78 -0.72 0.00 -1.69 -2.71 103.07 96.10 1bwk h GLY 12 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1bwk h GLY 12 CO 0.03 0.00 0.24 2.09 0.00 0.00 0.00 176.54 178.91 1bwk n ASP 13 N -4.09 3.33 -4.53 0.19 5.75 -1.26 -4.75 116.55 111.19 1bwk n ASP 13 Ca -0.02 -2.69 -0.29 0.00 -0.01 0.00 0.00 54.79 51.78 1bwk n ASP 13 Cb 0.24 -0.64 -0.09 0.00 -1.03 0.00 0.00 41.12 39.60 1bwk n ASP 13 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1bwk s THR 14 N -1.61 1.16 -1.09 2.12 -4.23 -1.02 -5.01 115.64 105.95 1bwk s THR 14 Ca 0.27 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.93 1bwk s THR 14 Cb 0.22 -2.43 0.16 0.00 1.34 0.00 0.00 72.50 71.79 1bwk s THR 14 CO 0.06 0.00 1.48 0.59 -0.54 0.00 0.00 174.62 176.21 1bwk n ASN 15 N -1.16 0.00 0.32 3.99 3.02 -1.26 -2.49 115.26 117.68 1bwk n ASN 15 Ca -0.11 0.40 0.21 0.00 -0.03 0.00 0.00 54.58 55.05 1bwk n ASN 15 Cb 0.66 -0.45 1.03 0.00 -0.61 0.00 0.00 39.78 40.41 1bwk n ASN 15 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1bwk h LEU 16 N 0.00 0.00 -2.96 3.41 5.85 -1.87 -2.21 115.31 117.53 1bwk h LEU 16 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1bwk h LEU 16 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1bwk h LEU 16 CO 0.00 0.00 0.00 0.49 -0.34 0.00 0.00 178.44 178.59 1bwk n PHE 17 N -3.07 0.58 -3.51 1.25 3.72 -1.04 0.64 117.46 116.04 1bwk n PHE 17 Ca -0.02 -0.58 -0.38 0.00 -0.05 0.00 0.00 57.45 56.43 1bwk n PHE 17 Cb 0.15 -0.09 -0.06 0.00 -0.94 0.00 0.00 39.48 38.54 1bwk n PHE 17 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1bwk s LYS 18 N -1.38 4.02 1.17 -1.08 -0.14 -0.83 -4.68 119.74 116.82 1bwk s LYS 18 Ca 0.28 0.31 -0.13 0.00 -1.36 0.00 0.00 55.97 55.07 1bwk s LYS 18 Cb 0.17 -3.30 0.29 0.00 -1.68 0.00 0.00 37.83 33.31 1bwk s LYS 18 CO 0.15 0.51 1.03 -2.14 -0.76 0.00 0.00 175.35 174.14 1bwk s PRO 19 N -0.46 -0.97 -0.15 -1.68 0.02 -1.25 -4.35 135.00 126.16 1bwk s PRO 19 Ca 0.22 0.86 -0.30 0.00 0.02 0.00 0.00 61.00 61.80 1bwk s PRO 19 Cb -0.15 -1.55 0.11 0.00 0.02 0.00 0.00 34.50 32.93 1bwk s PRO 19 CO 0.10 -3.77 0.90 -1.50 -0.33 0.00 0.00 177.00 172.41 1bwk s ILE 20 N -2.45 0.00 -0.31 2.83 2.07 -0.90 -4.94 121.20 117.50 1bwk s ILE 20 Ca 0.69 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.83 1bwk s ILE 20 Cb -0.25 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.33 1bwk s ILE 20 CO 0.65 0.00 0.15 -0.75 -1.91 0.00 0.00 174.94 173.08 1bwk s LYS 21 N -0.93 3.37 -0.20 3.50 2.20 -1.26 -0.60 119.74 125.81 1bwk s LYS 21 Ca -0.04 -0.70 -0.02 0.00 -0.36 0.00 0.00 55.97 54.85 1bwk s LYS 21 Cb -0.01 -3.56 -0.00 0.00 -1.51 0.00 0.00 37.83 32.75 1bwk s LYS 21 CO 0.03 -0.40 -0.08 0.42 -0.36 0.00 0.00 175.35 174.96 1bwk s ILE 22 N 1.62 3.05 0.00 5.43 -1.09 0.93 -4.95 121.20 126.19 1bwk s ILE 22 Ca 0.05 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 57.86 1bwk s ILE 22 Cb -0.17 -2.36 0.00 0.00 -1.58 0.00 0.00 42.46 38.35 1bwk s ILE 22 CO 0.06 0.46 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 1bwk n GLY 23 N 4.66 4.08 0.63 6.18 0.00 -1.26 -0.58 105.19 118.90 1bwk n GLY 23 Ca -0.19 0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.00 1bwk n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bwk n ASN 24 N 9.02 2.29 -4.86 1.61 5.03 -1.25 -4.99 115.26 122.11 1bwk n ASN 24 Ca 0.00 -1.65 -0.36 0.00 0.87 0.00 0.00 54.58 53.44 1bwk n ASN 24 Cb 0.00 0.26 -0.06 0.00 -1.02 0.00 0.00 39.78 38.96 1bwk n ASN 24 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 1bwk s ASN 25 N -2.03 6.62 -0.50 6.41 0.02 0.25 -5.06 114.94 120.66 1bwk s ASN 25 Ca 0.20 0.74 -0.06 0.00 -1.02 0.00 0.00 52.86 52.73 1bwk s ASN 25 Cb 0.17 -2.16 0.13 0.00 0.02 0.00 0.00 41.25 39.40 1bwk s ASN 25 CO 0.39 0.30 0.34 -1.61 0.02 0.00 0.00 177.10 176.54 1bwk s GLU 26 N -1.38 2.39 0.38 -0.60 2.02 -1.26 -0.05 118.70 120.20 1bwk s GLU 26 Ca 0.25 -1.99 -0.25 0.00 0.02 0.00 0.00 54.97 53.00 1bwk s GLU 26 Cb -0.14 -3.79 -0.09 0.00 0.10 0.00 0.00 34.13 30.20 1bwk s GLU 26 CO 0.13 -1.15 1.06 -0.51 0.02 0.00 0.00 175.26 174.80 1bwk s LEU 27 N 0.91 4.19 0.00 1.80 1.43 0.24 -4.84 118.68 122.41 1bwk s LEU 27 Ca 0.10 2.08 0.24 0.00 -1.03 0.00 0.00 54.13 55.51 1bwk s LEU 27 Cb -0.23 -4.11 0.31 0.00 0.03 0.00 0.00 46.19 42.19 1bwk s LEU 27 CO -0.03 -0.45 1.28 0.18 0.23 0.00 0.00 176.35 177.55 1bwk n LEU 28 N 0.09 0.66 -3.89 1.79 4.32 -1.04 -2.12 117.00 116.81 1bwk n LEU 28 Ca 0.04 -0.15 -0.08 0.00 -0.02 0.00 0.00 56.01 55.81 1bwk n LEU 28 Cb 0.49 -0.18 -0.03 0.00 -1.62 0.00 0.00 43.42 42.09 1bwk n LEU 28 CO 0.46 0.16 0.40 -1.38 -1.22 0.00 0.00 177.39 175.82 1bwk s HIS 29 N -2.98 -0.06 -0.48 -1.77 -3.43 -1.26 -3.95 115.29 101.36 1bwk s HIS 29 Ca 0.11 -0.38 0.15 0.00 -0.80 0.00 0.00 55.06 54.13 1bwk s HIS 29 Cb 0.17 0.59 0.55 0.00 -1.43 0.00 0.00 32.58 32.46 1bwk s HIS 29 CO 0.74 -1.19 1.46 0.54 -2.00 0.00 0.00 174.74 174.29 1bwk n ARG 30 N -0.44 3.29 -3.22 -0.38 1.74 0.21 -4.83 116.66 113.02 1bwk n ARG 30 Ca -0.03 -2.73 -0.41 0.00 -0.77 0.00 0.00 57.85 53.90 1bwk n ARG 30 Cb 0.60 -1.79 -0.08 0.00 -1.02 0.00 0.00 32.46 30.17 1bwk n ARG 30 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bwk s ALA 31 N -2.30 3.49 0.22 7.54 0.00 -1.26 -1.76 121.76 127.69 1bwk s ALA 31 Ca 0.41 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.51 1bwk s ALA 31 Cb 0.30 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 1bwk s ALA 31 CO 0.13 -1.17 0.12 0.14 0.00 0.00 0.00 175.76 174.98 1bwk s VAL 32 N 2.43 4.17 -0.39 0.00 -7.23 -0.20 -4.51 120.40 114.67 1bwk s VAL 32 Ca 0.20 -1.42 -0.16 0.00 -1.81 0.00 0.00 61.98 58.78 1bwk s VAL 32 Cb -0.15 -3.19 0.01 0.00 0.56 0.00 0.00 36.38 33.60 1bwk s VAL 32 CO 0.13 -0.26 0.40 -0.63 -0.31 0.00 0.00 175.10 174.43 1bwk s ILE 33 N -2.01 5.13 0.69 -0.62 1.01 -0.93 -2.28 121.20 122.18 1bwk s ILE 33 Ca 0.31 -0.17 -0.11 0.00 0.00 0.00 0.00 60.65 60.68 1bwk s ILE 33 Cb -0.08 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1bwk s ILE 33 CO 0.23 -0.27 1.06 -2.16 0.00 0.00 0.00 174.94 173.79 1bwk s PRO 34 N 2.08 2.99 -0.01 2.79 0.04 -1.26 -1.07 135.00 140.55 1bwk s PRO 34 Ca 0.12 0.87 -0.32 0.00 0.04 0.00 0.00 61.00 61.71 1bwk s PRO 34 Cb -0.17 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.26 1bwk s PRO 34 CO 0.13 -1.04 1.90 -0.35 0.04 0.00 0.00 177.00 177.67 1bwk n PRO 35 N -3.08 2.49 -3.81 0.56 -0.04 -1.22 -4.74 135.00 125.16 1bwk n PRO 35 Ca 0.07 0.91 -0.29 0.00 -0.04 0.00 0.00 63.50 64.15 1bwk n PRO 35 Cb 0.54 -2.80 -0.16 0.00 -0.04 0.00 0.00 33.50 31.05 1bwk n PRO 35 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bwk s LEU 36 N 3.90 2.12 0.31 1.53 1.43 -1.26 -4.86 118.68 121.86 1bwk s LEU 36 Ca 0.90 -1.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.45 1bwk s LEU 36 Cb -0.58 -0.91 -0.10 0.00 0.03 0.00 0.00 46.19 44.63 1bwk s LEU 36 CO 0.46 -0.32 1.41 -0.89 0.23 0.00 0.00 176.35 177.24 1bwk s THR 37 N 1.59 2.51 0.00 5.49 2.01 -1.26 -4.35 115.64 121.63 1bwk s THR 37 Ca 0.02 0.47 0.00 0.00 0.31 0.00 0.00 61.69 62.49 1bwk s THR 37 Cb -0.18 -3.30 0.00 0.00 0.01 0.00 0.00 72.50 69.03 1bwk s THR 37 CO -0.13 0.10 0.21 0.54 -0.69 0.00 0.00 174.62 174.64 1bwk n ARG 38 N 1.35 -0.40 -3.39 4.92 5.12 -1.26 -4.90 116.66 118.10 1bwk n ARG 38 Ca 0.03 -0.21 -0.24 0.00 -1.93 0.00 0.00 57.85 55.50 1bwk n ARG 38 Cb 0.40 -0.70 0.00 0.00 -1.16 0.00 0.00 32.46 31.00 1bwk n ARG 38 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1bwk n MET 39 N -0.00 -3.85 -0.03 5.56 2.81 -1.26 -4.02 117.12 116.33 1bwk n MET 39 Ca 0.00 0.56 0.12 0.00 -1.81 0.00 0.00 57.70 56.56 1bwk n MET 39 Cb 0.15 -5.31 0.12 0.00 -0.71 0.00 0.00 33.22 27.46 1bwk n MET 39 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1bwk n ARG 40 N -3.90 2.28 -1.78 0.03 3.00 -1.20 -4.55 116.66 110.55 1bwk n ARG 40 Ca -0.02 -1.95 -0.34 0.00 -0.01 0.00 0.00 57.85 55.53 1bwk n ARG 40 Cb 0.55 -1.46 0.05 0.00 0.00 0.00 0.00 32.46 31.60 1bwk n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1bwk s ALA 41 N -1.87 2.44 -0.08 7.54 0.00 -0.41 -3.87 121.76 125.52 1bwk s ALA 41 Ca 0.29 0.65 -0.19 0.00 0.00 0.00 0.00 51.96 52.71 1bwk s ALA 41 Cb 0.20 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1bwk s ALA 41 CO 0.30 -1.30 0.53 -0.51 0.00 0.00 0.00 175.76 174.77 1bwk s LEU 42 N -4.74 4.33 -0.12 0.00 1.43 0.22 -4.49 118.68 115.31 1bwk s LEU 42 Ca 0.69 0.95 -0.05 0.00 -1.03 0.00 0.00 54.13 54.70 1bwk s LEU 42 Cb -0.23 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 1bwk s LEU 42 CO 0.40 0.03 0.05 -2.28 0.23 0.00 0.00 176.35 174.78 1bwk s HIS 43 N 0.33 3.29 0.76 0.29 5.65 -1.26 -1.66 115.29 122.69 1bwk s HIS 43 Ca 0.28 0.23 -0.10 0.00 0.25 0.00 0.00 55.06 55.73 1bwk s HIS 43 Cb -0.16 -1.91 0.07 0.00 -1.18 0.00 0.00 32.58 29.40 1bwk s HIS 43 CO 0.13 0.44 1.10 -2.14 -0.65 0.00 0.00 174.74 173.62 1bwk s PRO 44 N -0.55 2.10 0.00 2.88 0.02 -1.26 -4.99 135.00 133.20 1bwk s PRO 44 Ca 0.10 -0.03 0.00 0.00 0.02 0.00 0.00 61.00 61.09 1bwk s PRO 44 Cb -0.12 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1bwk s PRO 44 CO 0.02 -1.42 0.00 0.41 -0.33 0.00 0.00 177.00 175.69 1bwk n GLY 45 N -3.13 0.91 3.85 0.52 0.00 -1.26 -4.45 105.19 101.64 1bwk n GLY 45 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1bwk n GLY 45 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bwk n ASN 46 N 0.00 -3.14 -4.72 1.61 4.13 -0.73 -4.73 115.26 107.68 1bwk n ASN 46 Ca 0.00 -1.06 -0.38 0.00 1.68 0.00 0.00 54.58 54.82 1bwk n ASN 46 Cb 0.00 -2.97 -0.06 0.00 -1.54 0.00 0.00 39.78 35.21 1bwk n ASN 46 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1bwk s ILE 47 N -3.68 5.18 0.30 2.41 -1.09 -0.67 -2.00 121.20 121.66 1bwk s ILE 47 Ca 0.29 0.95 -0.29 0.00 -2.23 0.00 0.00 60.65 59.37 1bwk s ILE 47 Cb -0.12 -3.82 -0.13 0.00 -1.58 0.00 0.00 42.46 36.82 1bwk s ILE 47 CO 0.89 0.32 1.26 -2.65 -1.23 0.00 0.00 174.94 173.52 1bwk n PRO 48 N 3.76 1.92 -1.69 2.79 -0.02 -1.26 0.73 135.00 141.23 1bwk n PRO 48 Ca -0.07 0.68 -0.55 0.00 -2.02 0.00 0.00 63.50 61.53 1bwk n PRO 48 Cb 0.52 -2.23 -0.07 0.00 -0.02 0.00 0.00 33.50 31.70 1bwk n PRO 48 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1bwk n ASN 49 N 1.23 2.58 0.23 2.55 2.85 -1.25 -4.67 115.26 118.78 1bwk n ASN 49 Ca 0.08 1.01 0.11 0.00 -0.11 0.00 0.00 54.58 55.67 1bwk n ASN 49 Cb 0.34 -1.19 0.43 0.00 1.24 0.00 0.00 39.78 40.60 1bwk n ASN 49 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 1bwk h ARG 50 N 7.99 0.00 0.00 1.20 3.08 -1.89 -2.74 114.38 122.01 1bwk h ARG 50 Ca -0.45 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.35 1bwk h ARG 50 Cb 1.31 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.32 1bwk h ARG 50 CO 0.97 0.17 -1.72 -0.25 -1.07 0.00 0.00 179.97 178.07 1bwk n ASP 51 N -3.26 0.69 0.00 7.04 8.00 -1.26 -4.77 116.55 122.98 1bwk n ASP 51 Ca 0.01 0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.82 1bwk n ASP 51 Cb 0.44 0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 1bwk n ASP 51 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1bwk n TRP 52 N -2.90 0.00 -0.16 1.24 8.01 -1.24 -4.84 117.44 117.55 1bwk n TRP 52 Ca -0.16 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.01 1bwk n TRP 52 Cb 0.96 0.00 0.07 0.00 -2.01 0.00 0.00 31.31 30.33 1bwk n TRP 52 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1bwk h ALA 53 N 0.00 0.53 -0.79 6.99 0.00 -1.79 -1.72 119.26 122.48 1bwk h ALA 53 Ca 0.00 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1bwk h ALA 53 Cb 0.01 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1bwk h ALA 53 CO 0.00 -0.35 0.31 0.28 0.00 0.00 0.00 179.25 179.49 1bwk h VAL 54 N 0.18 1.26 0.24 0.00 2.07 -1.90 -2.32 116.25 115.78 1bwk h VAL 54 Ca 0.25 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1bwk h VAL 54 Cb 0.37 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1bwk h VAL 54 CO -0.37 0.34 -0.12 -0.08 0.02 0.00 0.00 177.57 177.36 1bwk h GLU 55 N 1.16 -0.31 -0.36 1.57 4.57 -1.78 0.18 114.58 119.60 1bwk h GLU 55 Ca 0.26 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.54 1bwk h GLU 55 Cb 0.23 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.82 1bwk h GLU 55 CO -0.02 -0.10 -0.09 -0.92 -1.18 0.00 0.00 179.01 176.71 1bwk h TYR 56 N -0.48 -0.19 -0.33 0.92 3.20 -1.25 0.17 116.97 119.02 1bwk h TYR 56 Ca -0.03 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1bwk h TYR 56 Cb 0.36 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1bwk h TYR 56 CO -0.02 -0.15 -0.21 1.88 -1.64 0.00 0.00 178.16 178.02 1bwk h TYR 57 N 0.00 0.85 -0.54 -3.82 0.05 -1.43 -2.61 116.97 109.47 1bwk h TYR 57 Ca 0.17 -0.23 0.03 0.00 0.05 0.00 0.00 58.73 58.76 1bwk h TYR 57 Cb 0.27 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 37.77 1bwk h TYR 57 CO -0.33 0.96 0.30 1.15 -1.05 0.00 0.00 178.16 179.19 1bwk h THR 58 N 0.50 1.01 -0.52 -2.88 2.02 -0.52 -1.47 112.91 111.06 1bwk h THR 58 Ca 0.07 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.11 1bwk h THR 58 Cb 0.76 0.37 -0.05 0.00 -1.74 0.00 0.00 68.15 67.48 1bwk h THR 58 CO 0.06 0.11 0.22 1.56 0.37 0.00 0.00 175.52 177.84 1bwk h GLN 59 N 0.59 0.41 -0.00 6.66 4.20 -0.57 -2.29 115.11 124.13 1bwk h GLN 59 Ca 0.23 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1bwk h GLN 59 Cb 0.08 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1bwk h GLN 59 CO -0.13 0.27 -0.05 0.54 -0.67 0.00 0.00 178.83 178.80 1bwk n ARG 60 N -4.95 0.24 -0.68 1.46 1.74 -0.97 -3.38 116.66 110.12 1bwk n ARG 60 Ca 0.05 -0.03 0.08 0.00 -0.77 0.00 0.00 57.85 57.19 1bwk n ARG 60 Cb 0.18 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.48 1bwk n ARG 60 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bwk n ALA 61 N -1.35 3.35 -0.15 7.54 0.00 -0.59 -4.61 120.51 124.70 1bwk n ALA 61 Ca 0.10 -1.84 -0.07 0.00 0.00 0.00 0.00 53.44 51.63 1bwk n ALA 61 Cb 0.30 -0.97 0.09 0.00 0.00 0.00 0.00 19.45 18.86 1bwk n ALA 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1bwk h GLN 62 N 3.54 0.91 -6.49 0.00 3.07 -1.56 -3.40 115.11 111.18 1bwk h GLN 62 Ca 0.00 -0.29 -0.57 0.00 0.09 0.00 0.00 58.65 57.88 1bwk h GLN 62 Cb 1.64 -0.08 -0.07 0.00 0.08 0.00 0.00 27.48 29.04 1bwk h GLN 62 CO 0.33 0.94 0.85 0.50 0.09 0.00 0.00 178.83 181.53 1bwk s ARG 63 N -4.91 3.83 0.48 0.06 6.06 -1.26 -4.99 118.95 118.23 1bwk s ARG 63 Ca -0.10 0.70 -0.21 0.00 -2.50 0.00 0.00 55.73 53.62 1bwk s ARG 63 Cb 0.14 -3.85 -0.10 0.00 0.06 0.00 0.00 34.95 31.20 1bwk s ARG 63 CO 0.84 -1.18 0.66 -2.30 -2.50 0.00 0.00 175.30 170.81 1bwk n PRO 64 N 7.40 0.72 -1.36 5.12 -0.02 -1.26 -3.24 135.00 142.37 1bwk n PRO 64 Ca 0.11 0.27 -0.08 0.00 -2.02 0.00 0.00 63.50 61.78 1bwk n PRO 64 Cb 0.48 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.21 1bwk n PRO 64 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bwk n GLY 65 N 1.63 0.86 3.78 -1.23 0.00 -0.26 -4.57 105.19 105.40 1bwk n GLY 65 Ca 0.11 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1bwk n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bwk s THR 66 N -2.31 4.87 -0.24 2.61 2.01 -1.20 -2.49 115.64 118.89 1bwk s THR 66 Ca 0.00 1.21 -0.16 0.00 0.31 0.00 0.00 61.69 63.05 1bwk s THR 66 Cb 0.00 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 1bwk s THR 66 CO 0.00 0.46 0.41 -0.32 -0.69 0.00 0.00 174.62 174.49 1bwk s MET 67 N -0.49 4.09 -0.20 4.92 1.75 -1.26 -0.45 119.30 127.66 1bwk s MET 67 Ca 0.30 0.17 -0.02 0.00 -1.25 0.00 0.00 55.69 54.88 1bwk s MET 67 Cb -0.18 -3.61 -0.00 0.00 2.84 0.00 0.00 34.83 33.88 1bwk s MET 67 CO 0.17 -0.20 -0.09 0.42 -0.65 0.00 0.00 175.02 174.67 1bwk s ILE 68 N 1.83 3.00 -0.27 10.11 1.01 -0.42 -2.19 121.20 134.27 1bwk s ILE 68 Ca 0.18 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 1bwk s ILE 68 Cb -0.15 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 1bwk s ILE 68 CO 0.09 0.46 0.18 -0.63 0.00 0.00 0.00 174.94 175.04 1bwk s ILE 69 N 1.31 5.24 0.90 2.92 1.01 -0.23 -0.41 121.20 131.94 1bwk s ILE 69 Ca 0.04 0.15 -0.12 0.00 0.00 0.00 0.00 60.65 60.72 1bwk s ILE 69 Cb -0.14 -3.49 0.13 0.00 0.01 0.00 0.00 42.46 38.97 1bwk s ILE 69 CO -0.05 0.27 1.09 0.42 0.00 0.00 0.00 174.94 176.67 1bwk s THR 70 N 1.68 2.62 0.71 2.92 -4.23 -0.12 -3.39 115.64 115.82 1bwk s THR 70 Ca 0.07 0.20 -0.16 0.00 -1.18 0.00 0.00 61.69 60.62 1bwk s THR 70 Cb -0.16 -2.70 0.02 0.00 1.34 0.00 0.00 72.50 71.01 1bwk s THR 70 CO 0.10 -0.26 1.20 -1.84 -0.54 0.00 0.00 174.62 173.28 1bwk n GLU 71 N -3.89 0.72 -1.69 3.99 0.28 -1.26 -4.15 120.64 114.64 1bwk n GLU 71 Ca 0.07 0.31 -0.44 0.00 -0.16 0.00 0.00 57.16 56.94 1bwk n GLU 71 Cb 0.55 -2.44 -0.02 0.00 1.43 0.00 0.00 31.44 30.96 1bwk n GLU 71 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1bwk n GLY 72 N 0.85 0.95 3.19 -1.84 0.00 -1.26 -4.37 105.19 102.72 1bwk n GLY 72 Ca 0.15 0.48 -0.32 0.00 0.00 0.00 0.00 46.02 46.33 1bwk n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwk s ALA 73 N -0.04 2.24 0.25 4.61 0.00 0.24 -4.49 121.76 124.57 1bwk s ALA 73 Ca 0.67 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 1bwk s ALA 73 Cb -0.60 -0.95 -0.11 0.00 0.00 0.00 0.00 23.12 21.46 1bwk s ALA 73 CO 0.49 0.07 1.52 -0.06 0.00 0.00 0.00 175.76 177.78 1bwk s PHE 74 N 0.66 2.94 -0.52 0.00 0.08 -0.10 -0.46 117.98 120.58 1bwk s PHE 74 Ca -0.11 0.86 0.24 0.00 0.12 0.00 0.00 56.93 58.05 1bwk s PHE 74 Cb -0.16 -3.92 0.44 0.00 -0.57 0.00 0.00 43.02 38.81 1bwk s PHE 74 CO 0.02 -3.13 1.58 -0.84 -0.10 0.00 0.00 175.22 172.75 1bwk h ILE 75 N 3.58 0.00 -2.66 0.64 3.07 -1.87 0.23 117.51 120.49 1bwk h ILE 75 Ca -0.46 -0.82 0.12 0.00 1.55 0.00 0.00 64.86 65.26 1bwk h ILE 75 Cb 1.22 1.74 -0.06 0.00 -0.27 0.00 0.00 36.82 39.44 1bwk h ILE 75 CO 0.81 0.00 0.37 -0.94 -1.05 0.00 0.00 178.15 177.34 1bwk s SER 76 N -5.51 -0.19 0.26 2.16 1.04 -1.26 -4.36 113.70 105.83 1bwk s SER 76 Ca 0.07 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 55.92 1bwk s SER 76 Cb 0.08 0.61 0.33 0.00 0.10 0.00 0.00 66.02 67.14 1bwk s SER 76 CO 0.66 -1.14 1.88 -0.65 0.98 0.00 0.00 173.24 174.98 1bwk h PRO 77 N 2.00 1.11 0.00 4.02 0.11 -1.99 -2.06 132.00 135.18 1bwk h PRO 77 Ca -0.22 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1bwk h PRO 77 Cb 1.24 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1bwk h PRO 77 CO 0.26 0.82 0.00 0.94 -0.21 0.00 0.00 178.00 179.80 1bwk n GLN 78 N -4.34 0.22 0.06 1.05 -0.06 -1.26 -2.45 117.38 110.60 1bwk n GLN 78 Ca 0.08 0.34 0.12 0.00 -2.00 0.00 0.00 57.00 55.54 1bwk n GLN 78 Cb 0.11 -1.85 0.23 0.00 -4.06 0.00 0.00 30.24 24.67 1bwk n GLN 78 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1bwk n ALA 79 N -1.78 2.86 -1.53 1.69 0.00 -0.79 -4.91 120.51 116.05 1bwk n ALA 79 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1bwk n ALA 79 Cb 0.31 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1bwk n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwk n GLY 80 N 1.35 1.44 0.00 0.00 0.00 -1.03 -1.48 105.19 105.48 1bwk n GLY 80 Ca 0.04 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1bwk n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwk n GLY 81 N 5.00 -0.58 3.18 -0.02 0.00 -1.26 -4.72 105.19 106.78 1bwk n GLY 81 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1bwk n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bwk s TYR 82 N 0.00 2.94 0.55 1.61 2.02 -1.26 -3.58 117.35 119.63 1bwk s TYR 82 Ca 0.00 -1.53 0.22 0.00 -0.37 0.00 0.00 57.07 55.40 1bwk s TYR 82 Cb 0.00 -2.00 1.47 0.00 -0.40 0.00 0.00 41.96 41.02 1bwk s TYR 82 CO 0.00 -0.74 2.14 -0.44 -1.57 0.00 0.00 175.55 174.95 1bwk h ASP 83 N 7.98 0.00 -0.28 2.29 3.32 -1.99 -3.13 116.42 124.61 1bwk h ASP 83 Ca -0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1bwk h ASP 83 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1bwk h ASP 83 CO 0.60 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.71 1bwk n ASN 84 N -4.26 3.94 -4.80 6.45 3.02 -1.26 -4.23 115.26 114.11 1bwk n ASN 84 Ca -0.00 -2.98 -0.33 0.00 -0.03 0.00 0.00 54.58 51.24 1bwk n ASN 84 Cb 0.20 -0.54 -0.07 0.00 -0.61 0.00 0.00 39.78 38.77 1bwk n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bwk s ALA 85 N -2.76 3.65 0.53 5.41 0.00 -1.19 -1.29 121.76 126.11 1bwk s ALA 85 Ca 0.42 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 51.33 1bwk s ALA 85 Cb 0.34 -1.61 -0.07 0.00 0.00 0.00 0.00 23.12 21.78 1bwk s ALA 85 CO 0.09 0.71 1.03 -1.25 0.00 0.00 0.00 175.76 176.34 1bwk s PRO 86 N -1.86 3.67 0.33 0.00 0.04 -1.26 -4.69 135.00 131.24 1bwk s PRO 86 Ca 0.24 1.20 0.09 0.00 0.04 0.00 0.00 61.00 62.57 1bwk s PRO 86 Cb -0.12 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1bwk s PRO 86 CO 0.16 -0.52 0.09 0.20 0.04 0.00 0.00 177.00 176.96 1bwk s GLY 87 N -2.54 1.96 -0.17 0.56 0.00 -0.85 -0.92 107.32 105.36 1bwk s GLY 87 Ca 0.64 -1.86 0.20 0.00 0.00 0.00 0.00 44.72 43.70 1bwk s GLY 87 CO 0.29 -1.80 1.16 1.55 0.00 0.00 0.00 173.10 174.29 1bwk n VAL 88 N -1.07 1.17 -0.06 1.40 3.14 0.07 -4.78 118.33 118.20 1bwk n VAL 88 Ca -0.04 -2.50 -0.05 0.00 -2.96 0.00 0.00 64.34 58.80 1bwk n VAL 88 Cb 0.61 0.58 -0.11 0.00 -1.06 0.00 0.00 33.84 33.87 1bwk n VAL 88 CO 0.00 0.00 0.00 -2.67 -6.46 0.00 0.00 176.83 167.70 1bwk n TRP 89 N -0.31 0.00 -3.85 1.45 2.14 -1.26 -4.67 117.44 110.93 1bwk n TRP 89 Ca 0.14 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.50 1bwk n TRP 89 Cb 0.93 -0.63 -0.04 0.00 -0.81 0.00 0.00 31.31 30.76 1bwk n TRP 89 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 1bwk s SER 90 N -4.54 5.22 0.10 -0.67 1.04 -1.26 -5.03 113.70 108.56 1bwk s SER 90 Ca -0.07 -0.52 -0.20 0.00 0.48 0.00 0.00 55.95 55.64 1bwk s SER 90 Cb 0.05 -0.95 -0.08 0.00 0.10 0.00 0.00 66.02 65.14 1bwk s SER 90 CO 0.57 -0.34 1.69 -0.33 0.98 0.00 0.00 173.24 175.81 1bwk h GLU 91 N 1.28 0.29 -0.75 4.02 5.08 -1.98 -1.14 114.58 121.38 1bwk h GLU 91 Ca -0.45 -0.04 0.21 0.00 -1.00 0.00 0.00 59.36 58.08 1bwk h GLU 91 Cb 1.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 1bwk h GLU 91 CO 0.59 0.30 0.54 1.49 -1.00 0.00 0.00 179.01 180.92 1bwk h GLU 92 N 0.21 0.06 0.00 2.33 4.81 -1.98 0.20 114.58 120.21 1bwk h GLU 92 Ca 0.07 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1bwk h GLU 92 Cb 0.10 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1bwk h GLU 92 CO -0.01 0.04 -0.43 1.96 -0.73 0.00 0.00 179.01 179.83 1bwk h GLN 93 N 0.06 0.00 -0.31 1.92 4.20 -1.79 -3.35 115.11 115.83 1bwk h GLN 93 Ca 0.36 0.00 0.09 0.00 0.06 0.00 0.00 58.65 59.16 1bwk h GLN 93 Cb 1.36 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.12 1bwk h GLN 93 CO -0.03 0.79 0.22 0.52 -0.67 0.00 0.00 178.83 179.67 1bwk h MET 94 N -1.00 0.00 -0.18 1.46 2.86 -0.55 0.60 114.93 118.13 1bwk h MET 94 Ca -0.11 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1bwk h MET 94 Cb 0.93 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 1bwk h MET 94 CO -0.07 0.00 -0.11 0.28 1.06 0.00 0.00 176.91 178.08 1bwk h VAL 95 N 0.00 1.18 0.01 -2.22 2.07 -0.77 -1.66 116.25 114.87 1bwk h VAL 95 Ca 0.15 -0.79 -0.27 0.00 0.82 0.00 0.00 66.70 66.61 1bwk h VAL 95 Cb 0.59 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 1bwk h VAL 95 CO -0.00 0.25 -1.53 -0.33 0.02 0.00 0.00 177.57 175.98 1bwk h GLU 96 N 0.27 0.02 -0.45 1.57 4.39 -1.07 -3.31 114.58 116.00 1bwk h GLU 96 Ca 0.06 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.61 1bwk h GLU 96 Cb 0.37 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1bwk h GLU 96 CO 0.02 0.68 -0.15 -1.49 -1.16 0.00 0.00 179.01 176.91 1bwk h TRP 97 N 0.01 0.94 -0.45 4.33 4.06 -0.98 -2.88 115.95 120.99 1bwk h TRP 97 Ca -0.22 -0.19 0.02 0.00 2.06 0.00 0.00 58.89 60.56 1bwk h TRP 97 Cb 1.95 -0.23 -0.03 0.00 -1.00 0.00 0.00 29.16 29.85 1bwk h TRP 97 CO 0.01 0.93 0.25 1.15 -3.56 0.00 0.00 178.44 177.22 1bwk h THR 98 N 0.75 1.03 -0.80 1.49 2.02 -1.43 0.17 112.91 116.13 1bwk h THR 98 Ca 0.12 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 67.16 1bwk h THR 98 Cb 0.66 0.47 -0.05 0.00 -1.74 0.00 0.00 68.15 67.49 1bwk h THR 98 CO 0.05 0.09 0.51 0.11 0.37 0.00 0.00 175.52 176.65 1bwk h LYS 99 N 0.51 0.96 -0.33 6.66 1.57 -1.63 -0.60 116.57 123.70 1bwk h LYS 99 Ca 0.18 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1bwk h LYS 99 Cb 0.04 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1bwk h LYS 99 CO -0.10 0.63 0.03 0.82 -0.57 0.00 0.00 179.45 180.27 1bwk h ILE 100 N 0.99 1.24 -0.37 1.86 2.04 -1.17 -2.44 117.51 119.66 1bwk h ILE 100 Ca 0.33 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 1bwk h ILE 100 Cb 0.03 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 1bwk h ILE 100 CO -0.12 0.29 0.10 -0.26 0.00 0.00 0.00 178.15 178.16 1bwk h PHE 101 N 0.39 0.54 -0.14 1.37 0.04 -0.21 -2.69 116.94 116.22 1bwk h PHE 101 Ca 0.10 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 1bwk h PHE 101 Cb 0.39 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 1bwk h PHE 101 CO 0.03 0.46 -0.03 -0.91 -0.60 0.00 0.00 178.31 177.26 1bwk h ASN 102 N 0.53 0.28 -0.87 2.17 -0.26 -0.96 -1.69 115.58 114.78 1bwk h ASN 102 Ca 0.13 -0.36 0.02 0.00 -0.56 0.00 0.00 56.30 55.53 1bwk h ASN 102 Cb 0.18 -0.08 -0.05 0.00 -1.06 0.00 0.00 38.32 37.32 1bwk h ASN 102 CO -0.01 0.58 0.57 0.00 -1.06 0.00 0.00 177.43 177.51 1bwk h ALA 103 N 0.71 1.14 -0.24 -0.83 0.00 -1.25 0.21 119.26 119.00 1bwk h ALA 103 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1bwk h ALA 103 Cb 0.46 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1bwk h ALA 103 CO 0.01 0.45 -0.01 0.82 0.00 0.00 0.00 179.25 180.52 1bwk h ILE 104 N 1.13 1.26 -0.44 0.00 2.04 -1.47 -2.54 117.51 117.49 1bwk h ILE 104 Ca 0.34 -0.94 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1bwk h ILE 104 Cb -0.04 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1bwk h ILE 104 CO -0.10 0.29 0.12 0.45 0.00 0.00 0.00 178.15 178.91 1bwk h HIS 105 N 0.19 0.66 0.00 1.37 3.86 -0.80 -1.57 115.15 118.87 1bwk h HIS 105 Ca 0.07 -0.05 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 1bwk h HIS 105 Cb 0.44 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 1bwk h HIS 105 CO 0.04 0.56 -0.29 1.05 0.86 0.00 0.00 177.93 180.15 1bwk h GLU 106 N 0.64 0.00 -0.19 2.45 4.11 -0.44 -0.46 114.58 120.69 1bwk h GLU 106 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.58 1bwk h GLU 106 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1bwk h GLU 106 CO -0.00 0.29 0.00 1.63 0.07 0.00 0.00 179.01 181.00 1bwk n LYS 107 N -3.97 1.50 -2.67 1.06 4.76 -0.63 -4.91 118.16 113.31 1bwk n LYS 107 Ca -0.02 -0.77 -0.21 0.00 -2.87 0.00 0.00 58.31 54.44 1bwk n LYS 107 Cb 0.36 -1.23 0.01 0.00 -1.84 0.00 0.00 35.03 32.33 1bwk n LYS 107 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1bwk n LYS 108 N 0.08 -3.08 -4.02 1.97 5.02 -0.18 -4.36 118.16 113.59 1bwk n LYS 108 Ca 0.10 0.95 -0.27 0.00 -2.02 0.00 0.00 58.31 57.07 1bwk n LYS 108 Cb 0.20 -5.67 -0.03 0.00 -0.02 0.00 0.00 35.03 29.51 1bwk n LYS 108 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1bwk n SER 109 N -2.15 2.93 -4.49 4.39 7.64 -0.98 -1.10 113.62 119.86 1bwk n SER 109 Ca -0.18 -2.88 -0.24 0.00 1.01 0.00 0.00 58.87 56.58 1bwk n SER 109 Cb 0.66 0.13 -0.10 0.00 -1.01 0.00 0.00 64.21 63.88 1bwk n SER 109 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1bwk s PHE 110 N -2.58 2.24 -0.07 1.43 0.40 0.40 -4.16 117.98 115.64 1bwk s PHE 110 Ca 0.15 -0.51 -0.03 0.00 -0.60 0.00 0.00 56.93 55.95 1bwk s PHE 110 Cb -0.01 -1.20 0.04 0.00 0.51 0.00 0.00 43.02 42.36 1bwk s PHE 110 CO 0.10 0.54 0.14 0.54 0.70 0.00 0.00 175.22 177.23 1bwk s VAL 111 N -2.70 -0.18 -0.13 -0.44 0.11 -1.26 -1.30 120.40 114.51 1bwk s VAL 111 Ca 0.31 0.31 -0.01 0.00 -2.93 0.00 0.00 61.98 59.66 1bwk s VAL 111 Cb 0.01 -0.25 -0.02 0.00 -1.53 0.00 0.00 36.38 34.58 1bwk s VAL 111 CO 0.15 0.13 -0.09 0.26 -3.33 0.00 0.00 175.10 172.22 1bwk s TRP 112 N 1.92 2.90 -0.12 1.54 0.52 0.45 -0.94 118.94 125.20 1bwk s TRP 112 Ca -0.01 -0.41 -0.18 0.00 0.02 0.00 0.00 56.10 55.53 1bwk s TRP 112 Cb -0.12 -1.86 -0.04 0.00 -1.15 0.00 0.00 33.47 30.30 1bwk s TRP 112 CO -0.05 -0.06 0.46 0.08 0.02 0.00 0.00 176.95 177.40 1bwk s VAL 113 N 0.14 5.20 -0.36 4.03 1.01 0.54 -0.95 120.40 130.01 1bwk s VAL 113 Ca -0.04 0.91 -0.21 0.00 0.00 0.00 0.00 61.98 62.63 1bwk s VAL 113 Cb -0.14 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1bwk s VAL 113 CO 0.04 0.33 0.67 -1.58 0.00 0.00 0.00 175.10 174.56 1bwk s GLN 114 N 0.62 3.68 -0.18 2.72 0.74 -1.26 0.42 119.66 126.40 1bwk s GLN 114 Ca 0.25 0.10 -0.29 0.00 0.05 0.00 0.00 55.36 55.47 1bwk s GLN 114 Cb -0.15 -3.81 0.00 0.00 1.10 0.00 0.00 33.01 30.15 1bwk s GLN 114 CO 0.10 -0.77 1.03 -0.51 -0.55 0.00 0.00 175.29 174.58 1bwk s LEU 115 N 2.81 4.16 -0.05 3.68 1.43 0.07 -0.59 118.68 130.19 1bwk s LEU 115 Ca 0.26 1.44 0.03 0.00 -1.03 0.00 0.00 54.13 54.84 1bwk s LEU 115 Cb -0.14 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 1bwk s LEU 115 CO 0.15 -0.58 -0.14 0.86 0.23 0.00 0.00 176.35 176.87 1bwk s TRP 116 N 2.72 2.71 -0.17 0.29 -0.00 0.39 -2.88 118.94 122.01 1bwk s TRP 116 Ca 0.46 -0.16 -0.04 0.00 -0.00 0.00 0.00 56.10 56.35 1bwk s TRP 116 Cb -0.16 -1.63 0.08 0.00 -0.00 0.00 0.00 33.47 31.75 1bwk s TRP 116 CO 0.11 0.18 0.19 0.08 -0.00 0.00 0.00 176.95 177.51 1bwk s VAL 117 N -0.71 -0.27 0.14 5.86 1.01 -1.26 -2.93 120.40 122.23 1bwk s VAL 117 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.95 1bwk s VAL 117 Cb -0.11 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.72 1bwk s VAL 117 CO 0.01 -0.12 1.62 -0.07 0.00 0.00 0.00 175.10 176.53 1bwk h LEU 118 N 8.34 0.72 0.00 3.92 3.38 -1.55 -2.47 115.31 127.66 1bwk h LEU 118 Ca -0.16 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1bwk h LEU 118 Cb 1.14 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1bwk h LEU 118 CO 0.24 0.81 0.00 0.61 0.09 0.00 0.00 178.44 180.19 1bwk n GLY 119 N -0.50 1.57 0.00 0.83 0.00 -1.26 -2.55 105.19 103.28 1bwk n GLY 119 Ca 0.00 -0.65 0.05 0.00 0.00 0.00 0.00 46.02 45.42 1bwk n GLY 119 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1bwk n TRP 120 N 10.32 0.00 1.47 1.61 2.14 -0.83 -2.15 117.44 130.00 1bwk n TRP 120 Ca 0.00 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.71 1bwk n TRP 120 Cb 0.00 -0.31 0.68 0.00 -0.81 0.00 0.00 31.31 30.87 1bwk n TRP 120 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1bwk n ALA 121 N -1.31 2.68 -1.87 -1.67 0.00 -1.06 -4.82 120.51 112.46 1bwk n ALA 121 Ca 0.05 -0.23 -0.30 0.00 0.00 0.00 0.00 53.44 52.95 1bwk n ALA 121 Cb 0.08 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.18 1bwk n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bwk s ALA 122 N -2.44 2.95 -0.46 0.00 0.00 -0.91 -5.01 121.76 115.88 1bwk s ALA 122 Ca 0.31 -0.26 -0.25 0.00 0.00 0.00 0.00 51.96 51.76 1bwk s ALA 122 Cb 0.20 -3.04 0.03 0.00 0.00 0.00 0.00 23.12 20.31 1bwk s ALA 122 CO 0.46 -1.01 0.90 -0.06 0.00 0.00 0.00 175.76 176.05 1bwk s PHE 123 N -3.30 2.93 0.35 0.00 0.08 -1.23 -4.94 117.98 111.87 1bwk s PHE 123 Ca 0.57 0.33 0.13 0.00 0.12 0.00 0.00 56.93 58.08 1bwk s PHE 123 Cb -0.11 -3.91 0.95 0.00 -0.57 0.00 0.00 43.02 39.38 1bwk s PHE 123 CO 0.52 -1.09 1.76 -1.35 -0.10 0.00 0.00 175.22 174.97 1bwk h PRO 124 N 9.07 0.52 -0.43 0.24 0.11 -1.90 -1.62 132.00 137.98 1bwk h PRO 124 Ca -0.24 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.69 1bwk h PRO 124 Cb 1.08 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1bwk h PRO 124 CO 1.02 0.34 -0.29 0.38 -0.21 0.00 0.00 178.00 179.24 1bwk h ASP 125 N 0.54 1.00 -0.57 -2.05 2.03 -1.92 -1.14 116.42 114.30 1bwk h ASP 125 Ca 0.60 -0.41 -0.03 0.00 -0.73 0.00 0.00 57.03 56.46 1bwk h ASP 125 Cb 1.26 -0.28 -0.03 0.00 -0.83 0.00 0.00 39.33 39.46 1bwk h ASP 125 CO -0.37 1.21 0.25 0.78 -1.03 0.00 0.00 179.24 180.08 1bwk h ASN 126 N 0.81 0.77 -0.03 4.15 2.35 -1.61 -0.93 115.58 121.09 1bwk h ASN 126 Ca 0.09 -0.15 -0.10 0.00 -0.55 0.00 0.00 56.30 55.58 1bwk h ASN 126 Cb 0.87 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 1bwk h ASN 126 CO 0.08 0.71 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.20 1bwk h LEU 127 N 0.78 0.49 -0.47 1.61 3.38 -1.43 -2.84 115.31 116.84 1bwk h LEU 127 Ca 0.19 -0.18 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1bwk h LEU 127 Cb 0.16 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1bwk h LEU 127 CO -0.02 0.77 -0.54 0.00 0.09 0.00 0.00 178.44 178.74 1bwk h ALA 128 N 1.27 0.65 -0.50 1.53 0.00 -0.94 1.39 119.26 122.65 1bwk h ALA 128 Ca 0.05 -0.51 0.07 0.00 0.00 0.00 0.00 54.91 54.53 1bwk h ALA 128 Cb 0.73 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1bwk h ALA 128 CO 0.06 0.68 0.17 -0.09 0.00 0.00 0.00 179.25 180.07 1bwk h ARG 129 N 0.50 0.33 -0.01 0.00 2.43 -0.94 -1.72 114.38 114.96 1bwk h ARG 129 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1bwk h ARG 129 Cb 1.09 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1bwk h ARG 129 CO 0.11 0.22 -0.10 -0.25 -1.51 0.00 0.00 179.97 178.43 1bwk n ASP 130 N -5.02 0.99 0.00 -3.80 8.00 -1.11 -4.94 116.55 110.67 1bwk n ASP 130 Ca 0.05 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.49 1bwk n ASP 130 Cb 0.21 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 1bwk n ASP 130 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bwk n GLY 131 N 1.23 0.56 3.94 0.44 0.00 -0.61 -5.07 105.19 105.69 1bwk n GLY 131 Ca 0.16 -0.82 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 1bwk n GLY 131 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwk s LEU 132 N 0.00 4.23 0.76 0.99 1.43 0.47 -4.97 118.68 121.58 1bwk s LEU 132 Ca 0.00 0.28 -0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1bwk s LEU 132 Cb 0.00 -3.07 0.07 0.00 0.03 0.00 0.00 46.19 43.22 1bwk s LEU 132 CO 0.00 -0.08 1.09 -0.13 0.23 0.00 0.00 176.35 177.46 1bwk s ARG 133 N -3.67 2.07 -0.72 1.70 0.52 -1.26 -3.88 118.95 113.71 1bwk s ARG 133 Ca 0.37 -0.10 -0.07 0.00 -0.52 0.00 0.00 55.73 55.41 1bwk s ARG 133 Cb -0.10 -2.07 0.19 0.00 0.52 0.00 0.00 34.95 33.49 1bwk s ARG 133 CO 0.30 -1.42 0.59 -0.47 0.02 0.00 0.00 175.30 174.33 1bwk s TYR 134 N -3.40 3.56 0.49 -0.53 5.04 -1.26 -4.90 117.35 116.35 1bwk s TYR 134 Ca 0.61 -2.44 -0.18 0.00 -2.44 0.00 0.00 57.07 52.62 1bwk s TYR 134 Cb -0.11 -3.45 -0.09 0.00 0.35 0.00 0.00 41.96 38.66 1bwk s TYR 134 CO 0.47 -0.90 0.98 -0.51 -1.34 0.00 0.00 175.55 174.25 1bwk s ASP 135 N 1.24 6.65 0.02 4.32 1.01 -1.26 0.45 116.67 129.09 1bwk s ASP 135 Ca 0.18 1.64 -0.29 0.00 0.71 0.00 0.00 52.55 54.80 1bwk s ASP 135 Cb -0.16 -2.52 0.11 0.00 1.01 0.00 0.00 42.92 41.36 1bwk s ASP 135 CO -0.06 -0.57 1.24 -0.55 0.21 0.00 0.00 175.17 175.44 1bwk s SER 136 N -2.71 -0.04 0.06 0.27 0.15 -0.67 -1.97 113.70 108.78 1bwk s SER 136 Ca 0.61 -0.23 -0.22 0.00 0.70 0.00 0.00 55.95 56.80 1bwk s SER 136 Cb -0.10 0.22 -0.14 0.00 -1.71 0.00 0.00 66.02 64.28 1bwk s SER 136 CO 0.25 -0.41 1.55 0.00 1.20 0.00 0.00 173.24 175.83 1bwk h ALA 137 N 2.00 0.11 -0.40 5.45 0.00 -1.82 -3.07 119.26 121.52 1bwk h ALA 137 Ca -0.28 -0.12 -0.67 0.00 0.00 0.00 0.00 54.91 53.84 1bwk h ALA 137 Cb 1.20 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.83 1bwk h ALA 137 CO 0.30 -0.27 -0.51 -1.12 0.00 0.00 0.00 179.25 177.65 1bwk s SER 138 N -5.53 4.03 0.00 0.00 0.01 -1.24 -4.31 113.70 106.65 1bwk s SER 138 Ca -0.14 -1.67 0.00 0.00 1.31 0.00 0.00 55.95 55.45 1bwk s SER 138 Cb 0.05 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.86 1bwk s SER 138 CO 0.69 -0.88 0.60 -0.90 0.41 0.00 0.00 173.24 173.16 1bwk n ASP 139 N -1.29 0.84 -0.27 2.44 5.75 -1.26 -4.35 116.55 118.41 1bwk n ASP 139 Ca -0.19 -1.35 0.03 0.00 -0.01 0.00 0.00 54.79 53.27 1bwk n ASP 139 Cb 0.67 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.84 1bwk n ASP 139 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1bwk n ASN 140 N -0.18 2.46 -3.78 -1.12 6.94 -1.26 -4.94 115.26 113.38 1bwk n ASN 140 Ca 0.00 -2.19 -0.15 0.00 -0.02 0.00 0.00 54.58 52.22 1bwk n ASN 140 Cb 0.31 -0.16 -0.16 0.00 -2.36 0.00 0.00 39.78 37.41 1bwk n ASN 140 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1bwk s VAL 141 N -1.34 -0.05 0.39 3.53 1.01 -1.26 -5.17 120.40 117.51 1bwk s VAL 141 Ca 0.14 0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1bwk s VAL 141 Cb 0.09 -0.08 -0.07 0.00 0.00 0.00 0.00 36.38 36.32 1bwk s VAL 141 CO 0.06 0.08 0.01 -0.36 0.00 0.00 0.00 175.10 174.89 1bwk s PHE 142 N 0.95 2.51 0.00 5.22 0.08 -1.26 -4.89 117.98 120.60 1bwk s PHE 142 Ca -0.08 -0.61 -0.04 0.00 0.12 0.00 0.00 56.93 56.31 1bwk s PHE 142 Cb -0.11 -1.71 -0.02 0.00 -0.57 0.00 0.00 43.02 40.60 1bwk s PHE 142 CO -0.03 0.44 0.80 1.98 -0.10 0.00 0.00 175.22 178.31 1bwk h MET 143 N 1.78 -0.16 -3.90 0.44 4.05 -1.92 -3.49 114.93 111.73 1bwk h MET 143 Ca -0.43 0.01 -0.21 0.00 -0.28 0.00 0.00 59.70 58.79 1bwk h MET 143 Cb 1.24 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 32.01 1bwk h MET 143 CO 0.77 -0.10 -0.11 0.16 0.23 0.00 0.00 176.91 177.85 1bwk s ASP 144 N -2.62 0.65 0.11 1.39 1.47 -1.26 -4.77 116.67 111.65 1bwk s ASP 144 Ca -0.02 -1.37 -0.33 0.00 1.18 0.00 0.00 52.55 52.00 1bwk s ASP 144 Cb 0.00 0.68 -0.12 0.00 -0.34 0.00 0.00 42.92 43.14 1bwk s ASP 144 CO 0.07 -1.34 1.56 0.00 0.68 0.00 0.00 175.17 176.14 1bwk h ALA 145 N 2.11 -0.89 0.00 2.11 0.00 -2.00 -2.07 119.26 118.52 1bwk h ALA 145 Ca -0.29 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1bwk h ALA 145 Cb 1.24 0.91 0.00 0.00 0.00 0.00 0.00 17.79 19.95 1bwk h ALA 145 CO 0.39 -1.08 0.00 1.05 0.00 0.00 0.00 179.25 179.60 1bwk h GLU 146 N -0.66 0.00 0.07 0.00 4.11 -1.98 -1.18 114.58 114.94 1bwk h GLU 146 Ca 0.02 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.18 1bwk h GLU 146 Cb 0.71 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.98 1bwk h GLU 146 CO -0.35 0.00 -1.13 1.96 0.07 0.00 0.00 179.01 179.56 1bwk h GLN 147 N 0.00 0.53 0.00 1.06 1.08 -1.81 -1.62 115.11 114.35 1bwk h GLN 147 Ca 0.00 -0.66 -0.07 0.00 -1.45 0.00 0.00 58.65 56.47 1bwk h GLN 147 Cb 0.28 0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1bwk h GLN 147 CO 0.00 1.27 -0.32 1.05 -0.95 0.00 0.00 178.83 179.88 1bwk h GLU 148 N 0.26 0.00 0.12 1.46 4.11 -0.86 -0.89 114.58 118.77 1bwk h GLU 148 Ca -0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.28 1bwk h GLU 148 Cb 1.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.05 1bwk h GLU 148 CO 0.21 0.32 -0.06 0.00 0.07 0.00 0.00 179.01 179.55 1bwk h ALA 149 N 1.68 -0.16 -0.63 1.06 0.00 -1.20 -2.20 119.26 117.80 1bwk h ALA 149 Ca -0.00 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.75 1bwk h ALA 149 Cb 1.14 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 1bwk h ALA 149 CO 0.04 -0.32 0.31 0.87 0.00 0.00 0.00 179.25 180.15 1bwk h LYS 150 N -0.69 0.54 -0.24 0.00 1.57 -1.27 0.12 116.57 116.60 1bwk h LYS 150 Ca -0.02 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1bwk h LYS 150 Cb 0.52 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1bwk h LYS 150 CO 0.03 0.36 0.13 0.00 -0.57 0.00 0.00 179.45 179.40 1bwk h ALA 151 N 1.38 0.29 0.00 3.86 0.00 -1.16 -1.58 119.26 122.05 1bwk h ALA 151 Ca 0.30 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 1bwk h ALA 151 Cb 0.28 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1bwk h ALA 151 CO -0.23 -0.26 -0.85 -0.22 0.00 0.00 0.00 179.25 177.68 1bwk h LYS 152 N 0.28 0.04 -0.49 0.00 1.63 -0.98 0.14 116.57 117.19 1bwk h LYS 152 Ca 0.09 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1bwk h LYS 152 Cb 0.00 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 1bwk h LYS 152 CO -0.05 0.87 0.30 -0.22 -3.45 0.00 0.00 179.45 176.90 1bwk h LYS 153 N 0.02 0.65 -0.00 1.90 1.63 -0.85 -1.21 116.57 118.72 1bwk h LYS 153 Ca -0.02 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1bwk h LYS 153 Cb 1.50 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 1bwk h LYS 153 CO 0.12 0.46 -0.07 0.00 -3.45 0.00 0.00 179.45 176.51 1bwk n ALA 154 N -2.25 2.59 -3.72 5.00 0.00 -0.61 -4.93 120.51 116.59 1bwk n ALA 154 Ca 0.02 -0.17 -0.27 0.00 0.00 0.00 0.00 53.44 53.02 1bwk n ALA 154 Cb 0.04 -1.42 0.03 0.00 0.00 0.00 0.00 19.45 18.11 1bwk n ALA 154 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1bwk n ASN 155 N -1.32 -3.32 -3.27 0.00 5.15 0.14 -4.93 115.26 107.70 1bwk n ASN 155 Ca 0.11 -0.95 -0.25 0.00 -0.60 0.00 0.00 54.58 52.89 1bwk n ASN 155 Cb 0.29 -3.58 -0.08 0.00 -0.53 0.00 0.00 39.78 35.89 1bwk n ASN 155 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bwk n ASN 156 N -2.87 0.79 -4.73 1.20 4.05 0.26 -5.01 115.26 108.96 1bwk n ASN 156 Ca -0.19 -2.80 -0.42 0.00 0.45 0.00 0.00 54.58 51.62 1bwk n ASN 156 Cb 0.63 -0.64 -0.01 0.00 1.23 0.00 0.00 39.78 41.00 1bwk n ASN 156 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1bwk n PRO 157 N 1.50 2.36 -1.66 1.20 -0.04 -1.26 -4.64 135.00 132.45 1bwk n PRO 157 Ca 0.24 0.83 -0.45 0.00 -0.04 0.00 0.00 63.50 64.07 1bwk n PRO 157 Cb 0.50 -2.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 1bwk n PRO 157 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1bwk n GLN 158 N 0.79 1.99 -4.96 0.54 7.27 -1.26 -4.43 117.38 117.32 1bwk n GLN 158 Ca 0.04 0.71 -0.32 0.00 0.07 0.00 0.00 57.00 57.50 1bwk n GLN 158 Cb 0.37 -2.38 -0.15 0.00 2.41 0.00 0.00 30.24 30.49 1bwk n GLN 158 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1bwk s HIS 159 N 0.11 2.67 -0.35 3.69 5.65 0.17 -4.76 115.29 122.48 1bwk s HIS 159 Ca 0.71 -0.57 -0.23 0.00 0.25 0.00 0.00 55.06 55.21 1bwk s HIS 159 Cb -0.67 -1.72 0.01 0.00 -1.18 0.00 0.00 32.58 29.02 1bwk s HIS 159 CO 0.48 -0.13 0.79 -1.12 -0.65 0.00 0.00 174.74 174.11 1bwk s SER 160 N -0.05 6.58 0.29 9.88 0.01 -1.26 -1.67 113.70 127.47 1bwk s SER 160 Ca -0.04 0.43 -0.29 0.00 1.31 0.00 0.00 55.95 57.36 1bwk s SER 160 Cb -0.14 -2.40 -0.13 0.00 0.21 0.00 0.00 66.02 63.55 1bwk s SER 160 CO 0.04 -0.71 1.23 0.18 0.41 0.00 0.00 173.24 174.39 1bwk n LEU 161 N 6.38 2.77 -4.93 2.44 4.77 -1.16 -5.00 117.00 122.27 1bwk n LEU 161 Ca 0.03 1.18 -0.25 0.00 -0.03 0.00 0.00 56.01 56.94 1bwk n LEU 161 Cb 0.48 -1.39 0.02 0.00 -2.33 0.00 0.00 43.42 40.20 1bwk n LEU 161 CO 0.53 -0.82 0.40 0.42 -1.33 0.00 0.00 177.39 176.60 1bwk s THR 162 N -0.75 4.04 0.56 -5.08 -4.23 -1.26 -4.92 115.64 103.99 1bwk s THR 162 Ca 0.61 -0.19 0.25 0.00 -1.18 0.00 0.00 61.69 61.18 1bwk s THR 162 Cb -0.65 -3.54 0.35 0.00 1.34 0.00 0.00 72.50 70.00 1bwk s THR 162 CO 0.58 -0.47 2.09 0.11 -0.54 0.00 0.00 174.62 176.38 1bwk h LYS 163 N 0.15 0.00 0.02 3.99 1.57 -2.00 -1.68 116.57 118.62 1bwk h LYS 163 Ca -0.46 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.11 1bwk h LYS 163 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1bwk h LYS 163 CO 0.59 0.00 -0.94 -0.44 -0.57 0.00 0.00 179.45 178.09 1bwk h ASP 164 N 0.00 0.19 1.17 0.86 3.32 -2.00 -2.83 116.42 117.13 1bwk h ASP 164 Ca 0.11 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 1bwk h ASP 164 Cb 0.51 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1bwk h ASP 164 CO -0.00 1.02 -0.38 -0.33 -1.72 0.00 0.00 179.24 177.83 1bwk h GLU 165 N 0.06 0.00 -0.27 3.56 5.08 -1.70 -2.50 114.58 118.82 1bwk h GLU 165 Ca -0.04 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.12 1bwk h GLU 165 Cb 1.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.86 1bwk h GLU 165 CO 0.14 0.38 -0.58 0.82 -1.00 0.00 0.00 179.01 178.77 1bwk h ILE 166 N 0.00 1.27 -0.62 3.13 2.04 -1.36 -2.41 117.51 119.56 1bwk h ILE 166 Ca -0.00 -1.76 -0.06 0.00 1.00 0.00 0.00 64.86 64.04 1bwk h ILE 166 Cb 1.07 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 1bwk h ILE 166 CO 0.05 0.57 0.15 0.11 0.00 0.00 0.00 178.15 179.04 1bwk h LYS 167 N 0.65 0.98 -0.55 2.37 1.57 -1.37 -1.75 116.57 118.47 1bwk h LYS 167 Ca 0.01 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.53 1bwk h LYS 167 Cb 1.19 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.33 1bwk h LYS 167 CO 0.13 0.87 0.19 0.37 -0.57 0.00 0.00 179.45 180.43 1bwk h GLN 168 N 0.93 0.81 -0.24 3.15 5.75 -1.36 0.53 115.11 124.68 1bwk h GLN 168 Ca 0.20 -0.14 -0.13 0.00 -0.15 0.00 0.00 58.65 58.43 1bwk h GLN 168 Cb 0.33 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 1bwk h GLN 168 CO -0.00 0.69 -0.41 1.88 -2.65 0.00 0.00 178.83 178.34 1bwk h TYR 169 N 0.79 0.68 -0.54 3.99 0.05 -0.88 -1.68 116.97 119.38 1bwk h TYR 169 Ca 0.18 -0.20 -0.10 0.00 0.05 0.00 0.00 58.73 58.67 1bwk h TYR 169 Cb 0.21 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 1bwk h TYR 169 CO 0.01 0.89 -0.04 0.82 -1.05 0.00 0.00 178.16 178.79 1bwk h ILE 170 N 0.47 1.26 0.22 -2.88 2.04 -0.65 -1.30 117.51 116.67 1bwk h ILE 170 Ca 0.04 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.74 1bwk h ILE 170 Cb 0.91 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1bwk h ILE 170 CO 0.08 0.41 -0.19 0.11 0.00 0.00 0.00 178.15 178.56 1bwk h LYS 171 N 0.87 -0.41 -0.33 2.37 6.56 -0.59 -2.62 116.57 122.43 1bwk h LYS 171 Ca 0.15 0.03 0.01 0.00 -1.06 0.00 0.00 60.65 59.78 1bwk h LYS 171 Cb 0.57 0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 32.31 1bwk h LYS 171 CO 0.03 -0.27 0.22 0.93 -2.06 0.00 0.00 179.45 178.30 1bwk h GLU 172 N -0.43 0.42 -0.33 3.15 5.08 -1.09 -2.10 114.58 119.28 1bwk h GLU 172 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1bwk h GLU 172 Cb 0.39 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1bwk h GLU 172 CO -0.03 0.28 0.14 1.88 -1.00 0.00 0.00 179.01 180.28 1bwk h TYR 173 N 0.43 0.49 -0.32 4.33 0.05 -0.89 -1.65 116.97 119.41 1bwk h TYR 173 Ca 0.12 -0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 1bwk h TYR 173 Cb -0.04 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 1bwk h TYR 173 CO -0.00 0.45 0.15 0.28 -1.05 0.00 0.00 178.16 177.99 1bwk h VAL 174 N 0.39 1.16 -0.66 -2.88 2.07 -1.05 -1.39 116.25 113.89 1bwk h VAL 174 Ca 0.11 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1bwk h VAL 174 Cb 0.15 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 1bwk h VAL 174 CO -0.01 0.16 0.25 -0.61 0.02 0.00 0.00 177.57 177.38 1bwk h GLN 175 N 0.38 0.98 -0.03 1.57 5.75 -1.33 0.43 115.11 122.86 1bwk h GLN 175 Ca 0.11 -0.17 -0.17 0.00 -0.15 0.00 0.00 58.65 58.27 1bwk h GLN 175 Cb 0.12 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 1bwk h GLN 175 CO -0.01 0.81 -0.76 0.00 -2.65 0.00 0.00 178.83 176.22 1bwk h ALA 176 N 1.32 0.67 -0.35 3.38 0.00 -1.16 -0.52 119.26 122.59 1bwk h ALA 176 Ca 0.22 -0.64 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1bwk h ALA 176 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1bwk h ALA 176 CO -0.02 0.83 -0.21 0.00 0.00 0.00 0.00 179.25 179.86 1bwk h ALA 177 N 1.07 0.50 -0.38 0.00 0.00 -0.80 -1.93 119.26 117.71 1bwk h ALA 177 Ca -0.03 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1bwk h ALA 177 Cb 1.33 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1bwk h ALA 177 CO 0.12 0.45 0.15 0.87 0.00 0.00 0.00 179.25 180.83 1bwk h LYS 178 N 0.54 0.58 -0.61 0.00 1.57 -0.82 -1.45 116.57 116.37 1bwk h LYS 178 Ca 0.07 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1bwk h LYS 178 Cb 0.76 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 1bwk h LYS 178 CO 0.06 0.55 0.32 -0.91 -0.57 0.00 0.00 179.45 178.90 1bwk h ASN 179 N 0.47 0.75 -0.31 0.86 -0.26 -1.05 0.11 115.58 116.16 1bwk h ASN 179 Ca 0.13 -0.06 -0.12 0.00 -0.56 0.00 0.00 56.30 55.68 1bwk h ASN 179 Cb 0.20 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1bwk h ASN 179 CO -0.01 0.62 -0.28 0.28 -1.06 0.00 0.00 177.43 176.99 1bwk h SER 180 N 0.85 0.78 -0.10 5.81 0.02 -1.04 -1.03 113.55 118.85 1bwk h SER 180 Ca 0.21 -0.46 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 1bwk h SER 180 Cb 0.05 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.37 1bwk h SER 180 CO -0.03 1.08 -0.13 0.40 -1.14 0.00 0.00 176.83 177.00 1bwk h ILE 181 N 0.50 1.38 -0.86 3.27 1.08 -1.07 0.29 117.51 122.10 1bwk h ILE 181 Ca 0.05 -1.35 0.11 0.00 -0.39 0.00 0.00 64.86 63.28 1bwk h ILE 181 Cb 0.85 2.05 -0.08 0.00 -3.07 0.00 0.00 36.82 36.56 1bwk h ILE 181 CO 0.07 0.39 0.49 0.00 -0.69 0.00 0.00 178.15 178.41 1bwk h ALA 182 N 0.54 1.27 0.00 1.87 0.00 -0.80 0.39 119.26 122.53 1bwk h ALA 182 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bwk h ALA 182 Cb 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1bwk h ALA 182 CO 0.03 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1bwk n ALA 183 N -2.38 2.36 -0.03 0.00 0.00 -0.39 -4.87 120.51 115.19 1bwk n ALA 183 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1bwk n ALA 183 Cb 0.33 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1bwk n ALA 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwk n GLY 184 N 0.44 0.98 3.83 0.00 0.00 0.14 -4.54 105.19 106.04 1bwk n GLY 184 Ca 0.17 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1bwk n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwk s ALA 185 N -2.00 3.02 -0.36 4.61 0.00 0.08 -4.95 121.76 122.16 1bwk s ALA 185 Ca 0.00 0.25 0.23 0.00 0.00 0.00 0.00 51.96 52.44 1bwk s ALA 185 Cb 0.00 -3.14 0.38 0.00 0.00 0.00 0.00 23.12 20.36 1bwk s ALA 185 CO 0.00 -0.25 1.62 -0.44 0.00 0.00 0.00 175.76 176.68 1bwk h ASP 186 N 1.03 0.00 0.00 0.00 3.32 -1.36 -3.42 116.42 115.98 1bwk h ASP 186 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1bwk h ASP 186 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1bwk h ASP 186 CO 0.61 0.07 0.00 0.61 -1.72 0.00 0.00 179.24 178.81 1bwk n GLY 187 N 1.03 -0.50 3.22 2.75 0.00 -1.22 -4.80 105.19 105.66 1bwk n GLY 187 Ca 0.03 -1.02 -0.19 0.00 0.00 0.00 0.00 46.02 44.84 1bwk n GLY 187 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bwk s VAL 188 N -2.00 1.31 -0.12 1.61 -7.23 -0.59 -0.34 120.40 113.04 1bwk s VAL 188 Ca 0.00 -1.51 0.02 0.00 -1.81 0.00 0.00 61.98 58.68 1bwk s VAL 188 Cb 0.00 -1.34 -0.00 0.00 0.56 0.00 0.00 36.38 35.60 1bwk s VAL 188 CO 0.00 -0.27 -0.20 -0.70 -0.31 0.00 0.00 175.10 173.62 1bwk s GLU 189 N -2.13 3.14 -0.30 4.82 2.12 0.17 -1.85 118.70 124.67 1bwk s GLU 189 Ca 0.04 -0.82 -0.23 0.00 0.36 0.00 0.00 54.97 54.32 1bwk s GLU 189 Cb -0.08 -2.43 -0.00 0.00 0.26 0.00 0.00 34.13 31.88 1bwk s GLU 189 CO 0.03 0.15 0.76 0.42 -0.54 0.00 0.00 175.26 176.07 1bwk s ILE 190 N 0.45 4.83 -0.58 -3.70 1.01 0.02 -0.75 121.20 122.48 1bwk s ILE 190 Ca -0.14 1.16 -0.24 0.00 0.00 0.00 0.00 60.65 61.43 1bwk s ILE 190 Cb -0.17 -4.11 0.05 0.00 0.01 0.00 0.00 42.46 38.24 1bwk s ILE 190 CO 0.06 -0.20 0.94 0.21 0.00 0.00 0.00 174.94 175.95 1bwk s ASN 191 N 1.59 6.28 -0.22 3.58 2.47 -1.14 -1.38 114.94 126.12 1bwk s ASN 191 Ca 0.31 -0.55 0.13 0.00 0.42 0.00 0.00 52.86 53.17 1bwk s ASN 191 Cb -0.14 -2.43 0.44 0.00 -1.45 0.00 0.00 41.25 37.67 1bwk s ASN 191 CO 0.12 -1.29 1.32 -0.24 -3.72 0.00 0.00 177.10 173.29 1bwk n SER 192 N 7.53 2.38 -2.84 -4.21 2.88 -0.87 -4.72 113.62 113.77 1bwk n SER 192 Ca -0.00 -3.59 -0.13 0.00 -1.33 0.00 0.00 58.87 53.82 1bwk n SER 192 Cb 0.47 -0.55 -0.03 0.00 -0.75 0.00 0.00 64.21 63.35 1bwk n SER 192 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bwk n ALA 193 N -1.11 0.23 -2.22 -1.46 0.00 -1.16 -4.02 120.51 110.76 1bwk n ALA 193 Ca 0.24 -0.96 -0.16 0.00 0.00 0.00 0.00 53.44 52.55 1bwk n ALA 193 Cb 0.83 0.59 -0.02 0.00 0.00 0.00 0.00 19.45 20.84 1bwk n ALA 193 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1bwk n ASN 194 N -1.50 -4.69 -0.41 0.00 3.02 -1.26 -2.74 115.26 107.67 1bwk n ASN 194 Ca -0.06 0.16 -0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1bwk n ASN 194 Cb 0.28 -4.01 -0.02 0.00 -0.61 0.00 0.00 39.78 35.42 1bwk n ASN 194 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bwk n GLY 195 N -0.77 0.79 3.97 7.41 0.00 -1.25 -4.56 105.19 110.77 1bwk n GLY 195 Ca -0.19 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 44.93 1bwk n GLY 195 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bwk s TYR 196 N -2.16 2.04 0.02 1.61 2.02 -1.11 -4.62 117.35 115.15 1bwk s TYR 196 Ca 0.00 -0.02 -0.03 0.00 -0.37 0.00 0.00 57.07 56.65 1bwk s TYR 196 Cb 0.00 -3.15 -0.01 0.00 -0.40 0.00 0.00 41.96 38.41 1bwk s TYR 196 CO 0.00 -1.65 0.57 -0.11 -1.57 0.00 0.00 175.55 172.79 1bwk n LEU 197 N -2.90 -0.10 -0.34 -1.29 7.94 -0.93 -0.58 117.00 118.79 1bwk n LEU 197 Ca 0.13 0.59 0.10 0.00 -1.11 0.00 0.00 56.01 55.72 1bwk n LEU 197 Cb 0.60 -0.23 0.29 0.00 0.53 0.00 0.00 43.42 44.61 1bwk n LEU 197 CO 0.45 -0.35 1.22 -0.07 -1.11 0.00 0.00 177.39 177.53 1bwk h LEU 198 N 0.00 0.83 -1.01 -1.96 3.38 -1.84 0.22 115.31 114.93 1bwk h LEU 198 Ca 0.02 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1bwk h LEU 198 Cb 0.04 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1bwk h LEU 198 CO -0.09 0.40 -0.15 -1.13 0.09 0.00 0.00 178.44 177.56 1bwk h ASN 199 N 0.87 0.53 0.30 -0.43 -0.00 -0.98 -1.23 115.58 114.65 1bwk h ASN 199 Ca 0.51 -0.15 -0.03 0.00 -0.00 0.00 0.00 56.30 56.63 1bwk h ASN 199 Cb 0.66 -0.14 -0.00 0.00 -0.00 0.00 0.00 38.32 38.83 1bwk h ASN 199 CO -0.29 0.71 -0.13 1.56 -0.00 0.00 0.00 177.43 179.28 1bwk h GLN 200 N 0.50 0.00 0.04 6.67 4.20 0.11 -0.03 115.11 126.60 1bwk h GLN 200 Ca 0.09 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 1bwk h GLN 200 Cb 0.55 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1bwk h GLN 200 CO 0.04 0.13 -1.33 0.74 -0.67 0.00 0.00 178.83 177.74 1bwk h PHE 201 N 0.00 0.14 -0.02 2.96 -1.00 -0.75 -3.22 116.94 115.05 1bwk h PHE 201 Ca -0.00 -0.10 -0.14 0.00 2.81 0.00 0.00 57.97 60.54 1bwk h PHE 201 Cb 0.32 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 1bwk h PHE 201 CO 0.00 1.11 -0.65 -0.07 -1.61 0.00 0.00 178.31 177.09 1bwk h LEU 202 N 0.02 0.08 -9.11 1.54 3.38 -0.35 -3.42 115.31 107.45 1bwk h LEU 202 Ca -0.15 -0.05 -0.58 0.00 0.09 0.00 0.00 57.88 57.19 1bwk h LEU 202 Cb 1.90 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 42.56 1bwk h LEU 202 CO 0.13 0.71 0.47 -0.62 0.09 0.00 0.00 178.44 179.22 1bwk s ASP 203 N -6.86 6.93 0.50 -0.43 -1.08 -0.11 -4.87 116.67 110.75 1bwk s ASP 203 Ca -0.02 1.15 0.34 0.00 -0.52 0.00 0.00 52.55 53.50 1bwk s ASP 203 Cb 0.12 -2.46 1.81 0.00 -1.46 0.00 0.00 42.92 40.93 1bwk s ASP 203 CO 0.78 -0.48 2.03 1.55 0.52 0.00 0.00 175.17 179.57 1bwk h PRO 204 N 7.47 0.00 0.12 4.34 0.13 -1.87 0.15 132.00 142.34 1bwk h PRO 204 Ca -0.26 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.62 1bwk h PRO 204 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1bwk h PRO 204 CO 0.87 0.00 -1.28 1.25 -0.23 0.00 0.00 178.00 178.61 1bwk h HIS 205 N 0.00 0.47 0.00 1.56 -0.00 -1.92 -3.37 115.15 111.88 1bwk h HIS 205 Ca 0.00 -0.34 0.00 0.00 -0.00 0.00 0.00 60.37 60.03 1bwk h HIS 205 Cb 0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 1bwk h HIS 205 CO 0.00 1.50 -0.33 0.66 -0.00 0.00 0.00 177.93 179.76 1bwk h SER 206 N -0.32 0.00 -3.65 3.26 4.64 -1.65 -3.43 113.55 112.39 1bwk h SER 206 Ca -0.27 -0.06 -0.68 0.00 -0.47 0.00 0.00 61.79 60.31 1bwk h SER 206 Cb 1.74 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.48 1bwk h SER 206 CO 0.08 0.03 -0.65 0.21 -0.87 0.00 0.00 176.83 175.63 1bwk s ASN 207 N -4.98 4.99 -0.28 4.97 3.84 0.46 -3.71 114.94 120.22 1bwk s ASN 207 Ca 0.07 -1.71 0.08 0.00 0.21 0.00 0.00 52.86 51.51 1bwk s ASN 207 Cb 0.10 -1.74 0.46 0.00 -0.55 0.00 0.00 41.25 39.53 1bwk s ASN 207 CO 0.68 -0.39 1.34 0.35 -2.79 0.00 0.00 177.10 176.29 1bwk n THR 208 N 4.54 2.49 -1.57 -5.21 -2.24 -1.26 -4.63 114.28 106.39 1bwk n THR 208 Ca -0.06 -3.33 -0.31 0.00 -2.27 0.00 0.00 64.05 58.08 1bwk n THR 208 Cb 0.42 -0.55 0.05 0.00 -2.10 0.00 0.00 70.33 68.16 1bwk n THR 208 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1bwk s ARG 209 N -3.37 2.94 0.00 -0.78 0.52 -1.26 -4.97 118.95 112.03 1bwk s ARG 209 Ca 0.45 0.95 0.00 0.00 -0.52 0.00 0.00 55.73 56.61 1bwk s ARG 209 Cb 0.40 -1.99 -0.00 0.00 0.52 0.00 0.00 34.95 33.88 1bwk s ARG 209 CO -0.02 -1.10 0.26 0.25 0.02 0.00 0.00 175.30 174.71 1bwk n THR 210 N -3.13 0.00 -0.94 0.02 -2.24 -1.26 -3.09 114.28 103.64 1bwk n THR 210 Ca 0.07 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1bwk n THR 210 Cb 0.54 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 1bwk n THR 210 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bwk n ASP 211 N -0.51 0.00 0.00 3.42 5.75 -1.26 -4.88 116.55 119.07 1bwk n ASP 211 Ca 0.00 -0.54 0.04 0.00 -0.01 0.00 0.00 54.79 54.28 1bwk n ASP 211 Cb 0.01 0.00 0.23 0.00 -1.03 0.00 0.00 41.12 40.32 1bwk n ASP 211 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1bwk n GLU 212 N -0.54 0.25 -0.06 0.11 2.13 -1.26 -2.31 120.64 118.96 1bwk n GLU 212 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 1bwk n GLU 212 Cb 0.00 -1.48 0.06 0.00 0.27 0.00 0.00 31.44 30.29 1bwk n GLU 212 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1bwk n TYR 213 N -0.98 0.13 -3.89 4.31 4.01 -1.26 -4.63 117.16 114.85 1bwk n TYR 213 Ca 0.06 -0.57 -0.08 0.00 -0.16 0.00 0.00 57.90 57.15 1bwk n TYR 213 Cb 0.03 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 38.97 1bwk n TYR 213 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1bwk s GLY 214 N -1.24 0.13 0.00 2.72 0.00 -0.98 -4.14 107.32 103.81 1bwk s GLY 214 Ca 0.10 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.31 1bwk s GLY 214 CO 0.04 -0.25 0.00 0.61 0.00 0.00 0.00 173.10 173.50 1bwk n GLY 215 N -0.45 1.04 3.60 0.20 0.00 -1.18 -4.47 105.19 103.93 1bwk n GLY 215 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 1bwk n GLY 215 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bwk s SER 216 N -2.24 -0.43 0.18 1.61 1.04 -1.26 -5.00 113.70 107.60 1bwk s SER 216 Ca 0.00 -0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.06 1bwk s SER 216 Cb 0.00 0.64 0.16 0.00 0.10 0.00 0.00 66.02 66.92 1bwk s SER 216 CO 0.00 -1.10 1.75 0.40 0.98 0.00 0.00 173.24 175.28 1bwk h ILE 217 N 2.00 0.86 -0.85 -1.02 2.04 -1.98 -1.22 117.51 117.33 1bwk h ILE 217 Ca -0.28 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 1bwk h ILE 217 Cb 1.28 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 1bwk h ILE 217 CO 0.32 0.07 0.52 -0.33 0.00 0.00 0.00 178.15 178.73 1bwk h GLU 218 N 0.37 1.15 0.06 2.37 3.07 -1.97 -2.82 114.58 116.81 1bwk h GLU 218 Ca 0.23 -0.10 -0.24 0.00 -0.50 0.00 0.00 59.36 58.75 1bwk h GLU 218 Cb 0.23 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1bwk h GLU 218 CO -0.22 0.79 -1.07 -0.91 -1.40 0.00 0.00 179.01 176.20 1bwk h ASN 219 N 1.17 0.40 0.14 1.42 2.35 -1.68 -3.04 115.58 116.34 1bwk h ASN 219 Ca 0.31 -0.37 -0.08 0.00 -0.55 0.00 0.00 56.30 55.60 1bwk h ASN 219 Cb -0.06 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1bwk h ASN 219 CO -0.06 1.23 -0.28 0.03 -1.65 0.00 0.00 177.43 176.70 1bwk h ARG 220 N 0.12 0.22 0.00 0.81 3.08 -1.08 -2.83 114.38 114.70 1bwk h ARG 220 Ca -0.09 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1bwk h ARG 220 Cb 1.75 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.79 1bwk h ARG 220 CO 0.17 0.49 -0.34 0.00 -1.07 0.00 0.00 179.97 179.23 1bwk n ALA 221 N -2.48 2.73 -0.09 0.04 0.00 -1.08 -3.45 120.51 116.18 1bwk n ALA 221 Ca -0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 53.44 53.12 1bwk n ALA 221 Cb 0.38 -1.29 -0.09 0.00 0.00 0.00 0.00 19.45 18.44 1bwk n ALA 221 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1bwk h ARG 222 N 0.00 -0.45 -0.49 0.00 2.43 -1.38 -0.71 114.38 113.78 1bwk h ARG 222 Ca 0.00 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.29 1bwk h ARG 222 Cb 0.69 0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 30.26 1bwk h ARG 222 CO 0.00 -0.30 0.01 0.35 -1.51 0.00 0.00 179.97 178.53 1bwk h PHE 223 N -0.46 -0.01 -0.03 2.20 3.04 -1.78 0.31 116.94 120.21 1bwk h PHE 223 Ca 0.07 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.06 1bwk h PHE 223 Cb 0.63 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 39.21 1bwk h PHE 223 CO -0.66 -0.10 -0.01 1.15 -2.02 0.00 0.00 178.31 176.67 1bwk h THR 224 N 0.13 0.96 0.00 4.41 2.02 -1.72 -2.17 112.91 116.54 1bwk h THR 224 Ca 0.25 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.37 1bwk h THR 224 Cb 0.37 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1bwk h THR 224 CO -0.40 0.00 -0.30 -0.07 0.37 0.00 0.00 175.52 175.12 1bwk h LEU 225 N -0.00 0.00 -0.73 2.58 3.38 -0.58 -2.08 115.31 117.88 1bwk h LEU 225 Ca 0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1bwk h LEU 225 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1bwk h LEU 225 CO -0.04 0.30 -0.53 -0.33 0.09 0.00 0.00 178.44 177.93 1bwk h GLU 226 N 0.00 0.29 -0.37 1.13 5.08 -0.62 -1.09 114.58 119.00 1bwk h GLU 226 Ca -0.00 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1bwk h GLU 226 Cb 0.53 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1bwk h GLU 226 CO 0.04 0.75 -0.01 0.28 -1.00 0.00 0.00 179.01 179.07 1bwk h VAL 227 N 0.23 1.26 0.58 3.13 2.07 -0.97 -0.20 116.25 122.35 1bwk h VAL 227 Ca 0.01 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 1bwk h VAL 227 Cb 1.01 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1bwk h VAL 227 CO 0.08 0.33 -0.42 0.58 0.02 0.00 0.00 177.57 178.17 1bwk h VAL 228 N 0.47 0.00 -0.81 2.57 2.07 -1.16 -0.67 116.25 118.72 1bwk h VAL 228 Ca 0.10 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.75 1bwk h VAL 228 Cb 0.47 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.16 1bwk h VAL 228 CO 0.02 0.00 0.41 0.44 0.02 0.00 0.00 177.57 178.46 1bwk h ASP 229 N -0.95 0.50 -0.31 0.57 3.32 -1.18 0.16 116.42 118.53 1bwk h ASP 229 Ca -0.08 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1bwk h ASP 229 Cb 0.79 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1bwk h ASP 229 CO 0.04 0.23 0.12 0.00 -1.72 0.00 0.00 179.24 177.91 1bwk h ALA 230 N 1.52 0.40 -0.35 3.45 0.00 -0.90 -1.05 119.26 122.33 1bwk h ALA 230 Ca 0.43 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1bwk h ALA 230 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1bwk h ALA 230 CO -0.34 0.00 -0.27 -0.07 0.00 0.00 0.00 179.25 178.58 1bwk h LEU 231 N 0.34 0.74 -0.69 0.00 3.38 -0.11 -0.99 115.31 117.97 1bwk h LEU 231 Ca 0.10 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1bwk h LEU 231 Cb 0.20 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1bwk h LEU 231 CO -0.01 0.97 0.29 0.58 0.09 0.00 0.00 178.44 180.37 1bwk h VAL 232 N 0.62 1.24 -0.31 1.22 2.07 -0.55 0.02 116.25 120.56 1bwk h VAL 232 Ca 0.08 -0.73 -0.13 0.00 0.82 0.00 0.00 66.70 66.74 1bwk h VAL 232 Cb 0.78 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1bwk h VAL 232 CO 0.06 0.30 -0.34 1.05 0.02 0.00 0.00 177.57 178.66 1bwk h GLU 233 N 0.98 0.68 -0.10 1.57 -0.00 -0.95 -1.23 114.58 115.52 1bwk h GLU 233 Ca 0.23 -0.32 -0.07 0.00 -0.00 0.00 0.00 59.36 59.21 1bwk h GLU 233 Cb 0.18 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.93 1bwk h GLU 233 CO -0.02 0.92 -0.20 0.00 -0.00 0.00 0.00 179.01 179.71 1bwk h ALA 234 N 1.06 0.16 0.00 1.06 0.00 -0.70 -3.41 119.26 117.42 1bwk h ALA 234 Ca 0.06 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1bwk h ALA 234 Cb 0.85 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1bwk h ALA 234 CO 0.07 0.10 0.00 0.44 0.00 0.00 0.00 179.25 179.86 1bwk n ILE 235 N -4.53 0.06 0.00 0.00 -5.35 -0.05 -5.04 119.36 104.44 1bwk n ILE 235 Ca -0.07 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 1bwk n ILE 235 Cb 0.41 1.34 0.00 0.00 -1.74 0.00 0.00 39.64 39.65 1bwk n ILE 235 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bwk n GLY 236 N -0.03 1.42 0.28 3.28 0.00 -0.47 -4.68 105.19 105.00 1bwk n GLY 236 Ca 0.00 -1.46 0.13 0.00 0.00 0.00 0.00 46.02 44.69 1bwk n GLY 236 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1bwk h HIS 237 N 0.00 0.00 -0.03 1.61 2.07 -1.88 -1.51 115.15 115.41 1bwk h HIS 237 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1bwk h HIS 237 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1bwk h HIS 237 CO 0.00 0.01 0.00 -0.85 -3.07 0.00 0.00 177.93 174.02 1bwk n GLU 238 N -4.02 1.11 -0.01 5.12 0.00 -1.26 -2.37 120.64 119.22 1bwk n GLU 238 Ca -0.03 -0.17 0.01 0.00 0.00 0.00 0.00 57.16 56.97 1bwk n GLU 238 Cb 0.10 -1.24 0.02 0.00 0.00 0.00 0.00 31.44 30.32 1bwk n GLU 238 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1bwk n LYS 239 N -0.55 2.60 -4.98 3.44 5.02 -0.57 -3.89 118.16 119.23 1bwk n LYS 239 Ca 0.11 -1.60 -0.27 0.00 -2.02 0.00 0.00 58.31 54.53 1bwk n LYS 239 Cb 0.09 -1.04 -0.16 0.00 -0.02 0.00 0.00 35.03 33.90 1bwk n LYS 239 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bwk s VAL 240 N -1.21 1.60 0.11 -0.18 1.01 -1.09 -1.55 120.40 119.09 1bwk s VAL 240 Ca 0.04 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1bwk s VAL 240 Cb 0.04 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1bwk s VAL 240 CO 0.00 0.45 -0.11 -0.83 0.00 0.00 0.00 175.10 174.62 1bwk s GLY 241 N -0.40 0.92 -0.12 4.51 0.00 -0.77 -0.78 107.32 110.68 1bwk s GLY 241 Ca 0.06 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.54 1bwk s GLY 241 CO -0.00 -1.32 -0.12 -2.27 0.00 0.00 0.00 173.10 169.39 1bwk s LEU 242 N -2.52 1.51 -0.20 0.66 2.96 -1.21 -0.80 118.68 119.08 1bwk s LEU 242 Ca 0.07 -0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 53.49 1bwk s LEU 242 Cb -0.03 -1.00 -0.05 0.00 0.50 0.00 0.00 46.19 45.61 1bwk s LEU 242 CO 0.01 -0.05 0.16 -0.60 -1.32 0.00 0.00 176.35 174.54 1bwk s ARG 243 N 1.37 4.18 0.10 1.98 3.52 -0.48 -0.70 118.95 128.92 1bwk s ARG 243 Ca 0.00 -0.18 0.05 0.00 -0.13 0.00 0.00 55.73 55.47 1bwk s ARG 243 Cb -0.13 -3.44 -0.03 0.00 -1.56 0.00 0.00 34.95 29.78 1bwk s ARG 243 CO -0.06 0.25 -0.14 -0.51 -0.81 0.00 0.00 175.30 174.03 1bwk s LEU 244 N 0.49 2.35 -0.42 -0.88 1.02 0.57 -2.05 118.68 119.77 1bwk s LEU 244 Ca 0.09 -0.73 0.05 0.00 0.02 0.00 0.00 54.13 53.56 1bwk s LEU 244 Cb -0.12 -0.50 0.19 0.00 0.02 0.00 0.00 46.19 45.78 1bwk s LEU 244 CO -0.00 -0.13 0.41 -1.54 0.02 0.00 0.00 176.35 175.10 1bwk n SER 245 N 0.85 -0.65 -0.26 2.29 3.41 -1.26 -1.24 113.62 116.76 1bwk n SER 245 Ca -0.18 -2.48 -0.04 0.00 -0.26 0.00 0.00 58.87 55.91 1bwk n SER 245 Cb 0.56 -0.36 0.01 0.00 -0.26 0.00 0.00 64.21 64.16 1bwk n SER 245 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1bwk h PRO 246 N 5.29 -0.11 -0.32 4.33 0.11 -1.98 -2.74 132.00 136.58 1bwk h PRO 246 Ca 0.22 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1bwk h PRO 246 Cb 0.92 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1bwk h PRO 246 CO 0.36 -0.07 0.00 0.66 -0.21 0.00 0.00 178.00 178.73 1bwk n TYR 247 N -5.44 0.42 -1.98 0.65 4.01 -1.26 -4.42 117.16 109.14 1bwk n TYR 247 Ca 0.06 -0.21 -0.38 0.00 -0.16 0.00 0.00 57.90 57.21 1bwk n TYR 247 Cb 0.37 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.42 1bwk n TYR 247 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1bwk s GLY 248 N -1.43 2.85 0.00 2.72 0.00 -1.03 -4.27 107.32 106.16 1bwk s GLY 248 Ca 0.35 1.19 0.00 0.00 0.00 0.00 0.00 44.72 46.26 1bwk s GLY 248 CO 0.28 1.70 0.25 3.33 0.00 0.00 0.00 173.10 178.66 1bwk n VAL 249 N -0.69 0.00 -1.75 1.40 0.24 -1.06 -3.15 118.33 113.32 1bwk n VAL 249 Ca 0.08 -0.49 -0.42 0.00 -2.04 0.00 0.00 64.34 61.48 1bwk n VAL 249 Cb 0.46 1.01 -0.01 0.00 -1.47 0.00 0.00 33.84 33.83 1bwk n VAL 249 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1bwk n PHE 250 N -0.48 2.79 -2.06 6.34 7.35 -1.03 -2.30 117.46 128.08 1bwk n PHE 250 Ca 0.00 0.41 -0.11 0.00 -0.76 0.00 0.00 57.45 56.99 1bwk n PHE 250 Cb 0.00 -2.53 -0.01 0.00 0.35 0.00 0.00 39.48 37.29 1bwk n PHE 250 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1bwk n ASN 251 N 1.06 -3.68 -1.66 -2.13 3.02 -1.26 -3.75 115.26 106.86 1bwk n ASN 251 Ca 0.04 0.03 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 1bwk n ASN 251 Cb 0.37 -2.79 0.03 0.00 -0.61 0.00 0.00 39.78 36.78 1bwk n ASN 251 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1bwk n SER 252 N -0.02 -3.55 -4.95 6.41 7.64 -1.07 -4.85 113.62 113.23 1bwk n SER 252 Ca -0.13 -0.20 -0.23 0.00 1.01 0.00 0.00 58.87 59.32 1bwk n SER 252 Cb 0.56 -2.18 -0.02 0.00 -1.01 0.00 0.00 64.21 61.56 1bwk n SER 252 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1bwk s MET 253 N -5.44 3.47 0.02 1.43 -1.94 -0.97 -4.78 119.30 111.10 1bwk s MET 253 Ca 0.21 -0.46 -0.26 0.00 -1.71 0.00 0.00 55.69 53.46 1bwk s MET 253 Cb -0.09 -2.74 -0.16 0.00 2.01 0.00 0.00 34.83 33.84 1bwk s MET 253 CO 0.27 0.25 1.28 0.77 -0.01 0.00 0.00 175.02 177.57 1bwk h SER 254 N 0.94 -0.46 0.00 3.03 0.02 -1.88 -3.41 113.55 111.79 1bwk h SER 254 Ca -0.50 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1bwk h SER 254 Cb 1.22 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1bwk h SER 254 CO 0.62 -0.13 0.00 0.61 -1.14 0.00 0.00 176.83 176.79 1bwk n GLY 255 N -0.53 -0.34 0.34 -3.77 0.00 -1.19 -3.86 105.19 95.84 1bwk n GLY 255 Ca -0.10 -1.06 0.17 0.00 0.00 0.00 0.00 46.02 45.03 1bwk n GLY 255 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bwk h GLY 256 N 0.00 0.00 1.60 -0.02 0.00 -1.86 -2.45 103.07 100.34 1bwk h GLY 256 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1bwk h GLY 256 CO 0.00 0.00 0.01 0.00 0.00 0.00 0.00 176.54 176.55 1bwk h ALA 257 N 1.49 1.41 -1.62 3.60 0.00 -1.97 -3.39 119.26 118.78 1bwk h ALA 257 Ca 0.03 -0.19 -0.55 0.00 0.00 0.00 0.00 54.91 54.20 1bwk h ALA 257 Cb 0.59 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1bwk h ALA 257 CO -0.00 0.42 1.05 -2.00 0.00 0.00 0.00 179.25 178.72 1bwk s GLU 258 N -4.99 3.42 0.43 0.00 2.56 -0.93 -4.86 118.70 114.33 1bwk s GLU 258 Ca -0.07 0.46 0.14 0.00 0.00 0.00 0.00 54.97 55.50 1bwk s GLU 258 Cb 0.16 -4.07 1.02 0.00 2.00 0.00 0.00 34.13 33.24 1bwk s GLU 258 CO 0.76 -1.79 1.94 1.79 -0.56 0.00 0.00 175.26 177.40 1bwk h THR 259 N 6.32 0.85 -0.26 -1.70 1.35 -1.88 -0.21 112.91 117.38 1bwk h THR 259 Ca -0.26 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1bwk h THR 259 Cb 1.08 0.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.88 1bwk h THR 259 CO 1.17 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 177.13 1bwk n GLY 260 N -1.52 0.42 0.30 5.82 0.00 -1.26 -4.28 105.19 104.67 1bwk n GLY 260 Ca 0.12 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 1bwk n GLY 260 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1bwk h ILE 261 N 1.52 1.26 -0.52 -0.61 6.09 -1.34 -2.12 117.51 121.79 1bwk h ILE 261 Ca 0.00 -1.00 -0.07 0.00 -1.37 0.00 0.00 64.86 62.42 1bwk h ILE 261 Cb 0.42 0.68 -0.02 0.00 0.47 0.00 0.00 36.82 38.37 1bwk h ILE 261 CO 0.02 0.37 0.04 0.58 -3.07 0.00 0.00 178.15 176.09 1bwk h VAL 262 N 0.95 1.24 -0.34 2.19 2.07 -1.80 -2.44 116.25 118.13 1bwk h VAL 262 Ca 0.19 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.63 1bwk h VAL 262 Cb 0.42 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1bwk h VAL 262 CO 0.01 0.35 -0.21 0.00 0.02 0.00 0.00 177.57 177.75 1bwk h ALA 263 N 1.24 1.01 -0.65 1.67 0.00 -1.79 0.23 119.26 120.96 1bwk h ALA 263 Ca 0.16 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1bwk h ALA 263 Cb 0.42 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1bwk h ALA 263 CO 0.01 0.59 0.43 0.37 0.00 0.00 0.00 179.25 180.65 1bwk h GLN 264 N 0.57 0.84 0.04 0.00 5.75 -0.91 -2.03 115.11 119.37 1bwk h GLN 264 Ca 0.09 -0.05 -0.25 0.00 -0.15 0.00 0.00 58.65 58.29 1bwk h GLN 264 Cb 0.67 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.00 1bwk h GLN 264 CO 0.05 0.56 -1.21 1.88 -2.65 0.00 0.00 178.83 177.45 1bwk h TYR 265 N 0.87 0.16 -0.20 3.99 0.05 -1.29 -3.22 116.97 117.32 1bwk h TYR 265 Ca 0.24 -0.11 -0.05 0.00 0.05 0.00 0.00 58.73 58.86 1bwk h TYR 265 Cb -0.08 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 1bwk h TYR 265 CO -0.03 1.11 -0.11 0.00 -1.05 0.00 0.00 178.16 178.07 1bwk h ALA 266 N 0.85 1.45 -0.36 3.88 0.00 -0.75 -1.45 119.26 122.88 1bwk h ALA 266 Ca -0.10 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1bwk h ALA 266 Cb 1.88 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 1bwk h ALA 266 CO 0.14 0.38 0.04 -0.92 0.00 0.00 0.00 179.25 178.89 1bwk h TYR 267 N 0.30 0.66 0.01 0.00 3.20 -1.41 -0.73 116.97 119.01 1bwk h TYR 267 Ca 0.06 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1bwk h TYR 267 Cb 0.38 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1bwk h TYR 267 CO 0.01 0.69 -0.01 0.28 -1.64 0.00 0.00 178.16 177.49 1bwk h VAL 268 N 0.45 1.03 -0.54 1.81 2.07 -1.46 -1.92 116.25 117.69 1bwk h VAL 268 Ca 0.11 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1bwk h VAL 268 Cb 0.40 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1bwk h VAL 268 CO 0.01 0.04 0.36 0.00 0.02 0.00 0.00 177.57 178.00 1bwk h ALA 269 N 0.90 1.80 -0.16 1.67 0.00 -1.18 -1.66 119.26 120.63 1bwk h ALA 269 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1bwk h ALA 269 Cb 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1bwk h ALA 269 CO 0.00 0.13 -0.23 0.78 0.00 0.00 0.00 179.25 179.93 1bwk h GLY 270 N 0.57 0.47 1.50 0.00 0.00 -0.75 -2.28 103.07 102.58 1bwk h GLY 270 Ca 0.23 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 1bwk h GLY 270 CO -0.06 0.47 0.16 0.83 0.00 0.00 0.00 176.54 177.95 1bwk h GLU 271 N 0.06 0.64 0.01 4.80 4.39 -0.95 0.79 114.58 124.33 1bwk h GLU 271 Ca 0.02 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1bwk h GLU 271 Cb 0.80 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1bwk h GLU 271 CO 0.05 0.54 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.37 1bwk h LEU 272 N 0.64 -0.01 -1.86 1.33 4.07 -1.27 -2.35 115.31 115.85 1bwk h LEU 272 Ca 0.15 -0.22 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 1bwk h LEU 272 Cb 0.15 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.89 1bwk h LEU 272 CO -0.01 0.21 -0.11 -0.08 -1.08 0.00 0.00 178.44 177.37 1bwk h GLU 273 N -0.24 0.00 0.26 1.13 4.57 -1.02 -1.08 114.58 118.20 1bwk h GLU 273 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1bwk h GLU 273 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1bwk h GLU 273 CO 0.00 0.11 -0.13 -0.22 -1.18 0.00 0.00 179.01 177.60 1bwk h LYS 274 N 0.00 -0.34 -0.06 1.92 3.64 -0.41 -2.06 116.57 119.26 1bwk h LYS 274 Ca -0.00 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1bwk h LYS 274 Cb 0.37 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1bwk h LYS 274 CO 0.01 -0.14 -0.15 0.00 -2.27 0.00 0.00 179.45 176.90 1bwk h ARG 275 N -0.47 0.10 -0.95 1.90 3.08 -0.93 -1.88 114.38 115.23 1bwk h ARG 275 Ca -0.04 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.03 1bwk h ARG 275 Cb 0.35 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.33 1bwk h ARG 275 CO 0.06 0.26 0.62 0.00 -1.07 0.00 0.00 179.97 179.84 1bwk h ALA 276 N 1.75 1.26 -0.34 0.04 0.00 -0.65 -0.70 119.26 120.63 1bwk h ALA 276 Ca 0.02 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1bwk h ALA 276 Cb 0.33 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1bwk h ALA 276 CO 0.02 0.50 -0.16 0.87 0.00 0.00 0.00 179.25 180.48 1bwk h LYS 277 N 1.20 0.71 -0.06 0.00 1.57 -0.68 -1.91 116.57 117.39 1bwk h LYS 277 Ca 0.38 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1bwk h LYS 277 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1bwk h LYS 277 CO -0.12 0.91 0.00 0.00 -0.57 0.00 0.00 179.45 179.67 1bwk n ALA 278 N -2.46 1.81 0.00 3.86 0.00 -0.40 -4.76 120.51 118.56 1bwk n ALA 278 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1bwk n ALA 278 Cb 0.40 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.85 1bwk n ALA 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwk n GLY 279 N -0.06 2.88 2.54 0.00 0.00 -0.72 -4.98 105.19 104.85 1bwk n GLY 279 Ca 0.00 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1bwk n GLY 279 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bwk n LYS 280 N 0.00 3.66 -2.85 1.61 4.01 -0.42 -4.89 118.16 119.28 1bwk n LYS 280 Ca 0.00 -2.76 -0.41 0.00 -0.51 0.00 0.00 58.31 54.63 1bwk n LYS 280 Cb 0.00 -2.91 -0.04 0.00 -0.51 0.00 0.00 35.03 31.57 1bwk n LYS 280 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1bwk s ARG 281 N 1.49 4.40 0.86 1.97 3.52 -1.26 -4.03 118.95 125.90 1bwk s ARG 281 Ca 0.56 1.14 -0.12 0.00 -0.13 0.00 0.00 55.73 57.18 1bwk s ARG 281 Cb 0.16 -3.52 0.11 0.00 -1.56 0.00 0.00 34.95 30.14 1bwk s ARG 281 CO -0.07 -0.19 1.17 -0.51 -0.81 0.00 0.00 175.30 174.90 1bwk s LEU 282 N 1.62 2.99 0.28 -0.88 1.43 -1.26 -4.35 118.68 118.51 1bwk s LEU 282 Ca 0.43 2.27 -0.02 0.00 -1.03 0.00 0.00 54.13 55.77 1bwk s LEU 282 Cb -0.18 -4.58 0.43 0.00 0.03 0.00 0.00 46.19 41.90 1bwk s LEU 282 CO 0.18 -2.87 1.90 0.00 0.23 0.00 0.00 176.35 175.79 1bwk h ALA 283 N -1.39 1.42 -2.27 4.21 0.00 -0.57 -3.46 119.26 117.20 1bwk h ALA 283 Ca -0.45 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 54.61 1bwk h ALA 283 Cb 1.28 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1bwk h ALA 283 CO 0.44 0.45 0.56 1.97 0.00 0.00 0.00 179.25 182.67 1bwk n PHE 284 N -4.48 -0.97 -4.24 0.00 -1.74 -1.25 -4.37 117.46 100.41 1bwk n PHE 284 Ca 0.14 -0.92 -0.20 0.00 -0.56 0.00 0.00 57.45 55.91 1bwk n PHE 284 Cb 0.16 0.44 -0.16 0.00 1.52 0.00 0.00 39.48 41.44 1bwk n PHE 284 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1bwk s VAL 285 N -2.12 0.62 -0.19 1.97 1.01 -1.02 -3.30 120.40 117.37 1bwk s VAL 285 Ca 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 61.97 1bwk s VAL 285 Cb -0.02 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.73 1bwk s VAL 285 CO 0.03 0.24 -0.05 -2.28 0.00 0.00 0.00 175.10 173.03 1bwk s HIS 286 N 0.77 2.95 -0.07 5.22 2.46 0.12 -0.61 115.29 126.13 1bwk s HIS 286 Ca -0.11 -0.75 0.05 0.00 0.47 0.00 0.00 55.06 54.72 1bwk s HIS 286 Cb -0.14 -2.03 -0.01 0.00 -0.13 0.00 0.00 32.58 30.27 1bwk s HIS 286 CO 0.01 -0.38 -0.24 -0.51 -2.47 0.00 0.00 174.74 171.14 1bwk s LEU 287 N 1.07 2.10 -0.23 8.88 1.43 0.17 -0.32 118.68 131.78 1bwk s LEU 287 Ca 0.01 -0.52 -0.21 0.00 -1.03 0.00 0.00 54.13 52.38 1bwk s LEU 287 Cb -0.15 -1.39 -0.02 0.00 0.03 0.00 0.00 46.19 44.66 1bwk s LEU 287 CO -0.00 0.21 0.66 -0.69 0.23 0.00 0.00 176.35 176.76 1bwk s VAL 288 N 0.02 4.97 0.56 -1.59 1.01 -0.37 -1.24 120.40 123.76 1bwk s VAL 288 Ca -0.09 1.22 -0.19 0.00 0.00 0.00 0.00 61.98 62.92 1bwk s VAL 288 Cb -0.15 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1bwk s VAL 288 CO 0.06 0.04 1.15 -1.61 0.00 0.00 0.00 175.10 174.74 1bwk s GLU 289 N 2.33 3.21 0.00 2.72 0.41 0.31 -4.50 118.70 123.18 1bwk s GLU 289 Ca 0.28 1.66 0.17 0.00 -0.41 0.00 0.00 54.97 56.67 1bwk s GLU 289 Cb -0.16 -1.98 0.84 0.00 -1.78 0.00 0.00 34.13 31.06 1bwk s GLU 289 CO 0.09 -0.97 1.50 -0.35 -0.49 0.00 0.00 175.26 175.04 1bwk n PRO 290 N -1.45 0.23 0.26 0.39 -0.04 -1.26 -2.41 135.00 130.72 1bwk n PRO 290 Ca 0.12 0.13 0.14 0.00 -0.04 0.00 0.00 63.50 63.86 1bwk n PRO 290 Cb 0.51 -1.50 0.84 0.00 -0.04 0.00 0.00 33.50 33.31 1bwk n PRO 290 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bwk h ARG 291 N 0.00 0.00 -3.10 0.54 3.08 -1.84 -0.99 114.38 112.07 1bwk h ARG 291 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 1bwk h ARG 291 Cb 0.17 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 29.82 1bwk h ARG 291 CO 0.00 0.00 -0.77 0.08 -1.07 0.00 0.00 179.97 178.21 1bwk s VAL 292 N -4.73 0.61 -0.74 2.04 1.01 -1.01 -4.07 120.40 113.50 1bwk s VAL 292 Ca -0.05 -1.49 0.26 0.00 0.00 0.00 0.00 61.98 60.70 1bwk s VAL 292 Cb 0.16 -1.46 0.20 0.00 0.00 0.00 0.00 36.38 35.28 1bwk s VAL 292 CO 0.58 -0.78 1.65 0.35 0.00 0.00 0.00 175.10 176.89 1bwk n THR 293 N 4.59 0.45 -3.45 3.92 -2.24 -0.65 -4.68 114.28 112.21 1bwk n THR 293 Ca 0.01 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.42 1bwk n THR 293 Cb 0.40 -0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 68.11 1bwk n THR 293 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1bwk s ASN 294 N -4.24 0.61 0.00 3.42 3.84 -1.26 -2.45 114.94 114.85 1bwk s ASN 294 Ca 0.10 0.16 0.02 0.00 0.21 0.00 0.00 52.86 53.35 1bwk s ASN 294 Cb 0.13 0.84 0.08 0.00 -0.55 0.00 0.00 41.25 41.75 1bwk s ASN 294 CO 0.63 -0.30 0.96 -0.81 -2.79 0.00 0.00 177.10 174.79 1bwk n PRO 295 N 5.35 0.01 -0.73 0.43 -0.04 -1.26 -2.09 135.00 136.67 1bwk n PRO 295 Ca -0.05 0.37 0.02 0.00 -0.04 0.00 0.00 63.50 63.81 1bwk n PRO 295 Cb 0.50 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.75 1bwk n PRO 295 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1bwk n PHE 296 N -1.40 1.59 -4.87 0.54 3.72 -1.26 -4.91 117.46 110.87 1bwk n PHE 296 Ca 0.01 -1.05 -0.31 0.00 -0.05 0.00 0.00 57.45 56.04 1bwk n PHE 296 Cb 0.02 -0.48 -0.13 0.00 -0.94 0.00 0.00 39.48 37.94 1bwk n PHE 296 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1bwk s LEU 297 N -2.93 2.53 0.53 4.37 1.43 -0.89 -5.10 118.68 118.62 1bwk s LEU 297 Ca 0.48 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 53.01 1bwk s LEU 297 Cb 0.39 -1.49 -0.06 0.00 0.03 0.00 0.00 46.19 45.06 1bwk s LEU 297 CO 0.10 0.30 1.29 0.41 0.23 0.00 0.00 176.35 178.68 1bwk n THR 298 N 2.00 3.54 -1.67 5.49 -1.04 -1.26 -4.80 114.28 116.53 1bwk n THR 298 Ca -0.16 -0.50 -0.56 0.00 -2.04 0.00 0.00 64.05 60.78 1bwk n THR 298 Cb 0.52 -1.58 -0.07 0.00 -1.82 0.00 0.00 70.33 67.38 1bwk n THR 298 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1bwk n GLU 299 N -0.78 1.07 0.00 -2.82 4.71 -1.26 -0.64 120.64 120.93 1bwk n GLU 299 Ca 0.10 0.39 0.00 0.00 -0.01 0.00 0.00 57.16 57.64 1bwk n GLU 299 Cb 0.44 -2.05 0.00 0.00 -1.01 0.00 0.00 31.44 28.82 1bwk n GLU 299 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1bwk n GLY 300 N 3.59 0.47 3.61 0.62 0.00 -1.26 -5.07 105.19 107.15 1bwk n GLY 300 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1bwk n GLY 300 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bwk s GLU 301 N -0.69 3.67 0.00 1.61 2.02 0.19 -4.40 118.70 121.10 1bwk s GLU 301 Ca 0.00 -0.40 0.00 0.00 0.02 0.00 0.00 54.97 54.59 1bwk s GLU 301 Cb 0.00 -3.04 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1bwk s GLU 301 CO 0.00 0.37 0.00 0.41 0.02 0.00 0.00 175.26 176.06 1bwk n GLY 302 N 3.20 0.68 3.66 -1.39 0.00 -1.26 -4.62 105.19 105.45 1bwk n GLY 302 Ca -0.17 -0.74 -0.40 0.00 0.00 0.00 0.00 46.02 44.71 1bwk n GLY 302 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bwk s GLU 303 N -3.97 4.22 -0.26 1.61 2.12 -1.26 -1.64 118.70 119.52 1bwk s GLU 303 Ca 0.00 0.62 -0.11 0.00 0.36 0.00 0.00 54.97 55.84 1bwk s GLU 303 Cb 0.00 -3.57 -0.05 0.00 0.26 0.00 0.00 34.13 30.77 1bwk s GLU 303 CO 0.00 -0.23 0.18 -0.47 -0.54 0.00 0.00 175.26 174.20 1bwk s TYR 304 N 1.88 3.27 -0.92 5.30 5.04 -0.37 -4.96 117.35 126.59 1bwk s TYR 304 Ca 0.29 0.18 0.12 0.00 -2.44 0.00 0.00 57.07 55.22 1bwk s TYR 304 Cb -0.16 -2.32 -0.06 0.00 0.35 0.00 0.00 41.96 39.78 1bwk s TYR 304 CO 0.10 -0.04 0.64 0.39 -1.34 0.00 0.00 175.55 175.31 1bwk n GLU 305 N 4.64 2.36 -0.06 4.97 4.71 -1.26 -4.46 120.64 131.53 1bwk n GLU 305 Ca -0.14 -0.41 0.06 0.00 -0.01 0.00 0.00 57.16 56.66 1bwk n GLU 305 Cb 0.52 -1.13 0.27 0.00 -1.01 0.00 0.00 31.44 30.09 1bwk n GLU 305 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1bwk n GLY 306 N 1.12 -0.28 3.35 0.62 0.00 -1.26 -4.86 105.19 103.89 1bwk n GLY 306 Ca 0.04 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 1bwk n GLY 306 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bwk s GLY 307 N -1.29 -0.35 0.02 -0.02 0.00 -1.26 -5.09 107.32 99.33 1bwk s GLY 307 Ca 0.21 0.42 0.01 0.00 0.00 0.00 0.00 44.72 45.36 1bwk s GLY 307 CO 0.16 0.15 -0.04 -0.45 0.00 0.00 0.00 173.10 172.91 1bwk s SER 308 N -2.04 0.42 0.00 1.64 0.15 -1.26 -4.91 113.70 107.69 1bwk s SER 308 Ca -0.05 -0.46 0.30 0.00 0.70 0.00 0.00 55.95 56.44 1bwk s SER 308 Cb -0.01 0.07 1.40 0.00 -1.71 0.00 0.00 66.02 65.77 1bwk s SER 308 CO -0.03 -0.23 1.96 0.59 1.20 0.00 0.00 173.24 176.73 1bwk n ASN 309 N 1.74 0.37 0.12 5.45 3.02 -1.26 -4.21 115.26 120.49 1bwk n ASN 309 Ca -0.22 -0.65 0.18 0.00 -0.03 0.00 0.00 54.58 53.86 1bwk n ASN 309 Cb 0.55 -0.09 0.75 0.00 -0.61 0.00 0.00 39.78 40.38 1bwk n ASN 309 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1bwk h ASP 310 N 0.49 0.00 -0.07 6.41 3.32 -2.03 -2.20 116.42 122.32 1bwk h ASP 310 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1bwk h ASP 310 Cb 0.28 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 1bwk h ASP 310 CO 0.00 0.00 0.08 2.19 -1.72 0.00 0.00 179.24 179.79 1bwk h PHE 311 N 0.00 0.00 -0.77 4.55 -0.00 -2.03 -1.08 116.94 117.62 1bwk h PHE 311 Ca 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.11 1bwk h PHE 311 Cb 0.74 0.00 -0.04 0.00 -0.00 0.00 0.00 35.95 36.65 1bwk h PHE 311 CO 0.00 0.00 0.42 0.28 -0.00 0.00 0.00 178.31 179.01 1bwk h VAL 312 N 0.00 1.23 0.00 0.88 2.07 -1.74 -2.50 116.25 116.19 1bwk h VAL 312 Ca 0.03 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1bwk h VAL 312 Cb 0.20 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1bwk h VAL 312 CO -0.00 0.25 -0.13 1.88 0.02 0.00 0.00 177.57 179.59 1bwk h TYR 313 N 1.07 0.00 0.00 1.57 -1.99 -1.39 0.12 116.97 116.35 1bwk h TYR 313 Ca 0.27 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.94 1bwk h TYR 313 Cb 0.02 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.74 1bwk h TYR 313 CO 0.01 0.13 -0.31 0.77 -0.00 0.00 0.00 178.16 178.76 1bwk h SER 314 N 0.00 0.00 0.00 3.88 0.02 -1.54 -3.38 113.55 112.53 1bwk h SER 314 Ca -0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1bwk h SER 314 Cb 0.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1bwk h SER 314 CO 0.02 0.31 -1.15 -0.38 -1.14 0.00 0.00 176.83 174.48 1bwk n ILE 315 N -3.67 1.45 -2.90 3.27 5.41 -0.52 -4.97 119.36 117.43 1bwk n ILE 315 Ca -0.01 0.08 -0.41 0.00 1.00 0.00 0.00 62.75 63.41 1bwk n ILE 315 Cb 0.42 -2.19 -0.04 0.00 -0.71 0.00 0.00 39.64 37.12 1bwk n ILE 315 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 176.55 177.41 1bwk s TRP 316 N -2.75 3.67 -1.23 1.39 -0.11 0.32 -4.83 118.94 115.40 1bwk s TRP 316 Ca -0.27 1.49 0.12 0.00 1.22 0.00 0.00 56.10 58.66 1bwk s TRP 316 Cb 0.05 -2.92 0.28 0.00 -1.50 0.00 0.00 33.47 29.38 1bwk s TRP 316 CO 0.39 0.13 1.18 1.63 -4.62 0.00 0.00 176.95 175.66 1bwk n LYS 317 N 3.44 2.25 -0.65 5.86 4.76 -1.26 -4.45 118.16 128.11 1bwk n LYS 317 Ca 0.01 -1.88 0.00 0.00 -2.87 0.00 0.00 58.31 53.56 1bwk n LYS 317 Cb 0.51 -1.29 0.00 0.00 -1.84 0.00 0.00 35.03 32.41 1bwk n LYS 317 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1bwk n GLY 318 N 0.69 0.91 3.77 0.72 0.00 -1.26 -5.06 105.19 104.96 1bwk n GLY 318 Ca 0.12 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.80 1bwk n GLY 318 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1bwk s PRO 319 N -2.20 3.57 -0.07 1.61 0.02 -1.26 -4.97 135.00 131.70 1bwk s PRO 319 Ca 0.00 1.79 -0.01 0.00 0.02 0.00 0.00 61.00 62.79 1bwk s PRO 319 Cb 0.00 -2.28 0.03 0.00 0.02 0.00 0.00 34.50 32.27 1bwk s PRO 319 CO 0.00 -0.71 0.01 0.54 -0.33 0.00 0.00 177.00 176.51 1bwk s VAL 320 N -1.57 0.30 -0.17 3.83 0.11 -0.65 -2.45 120.40 119.80 1bwk s VAL 320 Ca 0.67 0.16 -0.18 0.00 -2.93 0.00 0.00 61.98 59.70 1bwk s VAL 320 Cb -0.29 -0.48 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 1bwk s VAL 320 CO 0.34 0.24 0.51 -0.63 -3.33 0.00 0.00 175.10 172.23 1bwk s ILE 321 N 2.00 5.14 -0.14 7.04 1.01 0.22 -1.74 121.20 134.74 1bwk s ILE 321 Ca 0.05 0.96 0.00 0.00 0.00 0.00 0.00 60.65 61.66 1bwk s ILE 321 Cb -0.12 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 1bwk s ILE 321 CO -0.05 0.23 -0.14 -0.13 0.00 0.00 0.00 174.94 174.85 1bwk s ARG 322 N 1.25 3.33 0.00 2.79 0.52 -0.05 0.46 118.95 127.25 1bwk s ARG 322 Ca 0.25 -0.71 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 1bwk s ARG 322 Cb -0.15 -2.62 -0.02 0.00 0.52 0.00 0.00 34.95 32.68 1bwk s ARG 322 CO 0.10 0.15 -0.19 0.00 0.02 0.00 0.00 175.30 175.39 1bwk s ALA 323 N 0.49 1.55 0.00 2.13 0.00 -0.37 -0.67 121.76 124.89 1bwk s ALA 323 Ca -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1bwk s ALA 323 Cb -0.16 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.60 1bwk s ALA 323 CO 0.04 0.37 0.00 0.41 0.00 0.00 0.00 175.76 176.58 1bwk n GLY 324 N 2.43 1.93 3.68 0.00 0.00 -1.25 -0.53 105.19 111.45 1bwk n GLY 324 Ca -0.15 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 1bwk n GLY 324 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bwk n ASN 325 N 0.00 -4.72 0.06 1.61 5.15 -1.26 -4.78 115.26 111.32 1bwk n ASN 325 Ca 0.00 -0.63 0.03 0.00 -0.60 0.00 0.00 54.58 53.38 1bwk n ASN 325 Cb 0.00 -3.80 -0.05 0.00 -0.53 0.00 0.00 39.78 35.40 1bwk n ASN 325 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1bwk h PHE 326 N -1.73 0.00 -0.38 1.20 0.04 -1.91 -3.40 116.94 110.76 1bwk h PHE 326 Ca -0.54 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.28 1bwk h PHE 326 Cb 1.35 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.46 1bwk h PHE 326 CO 0.59 0.43 0.14 0.00 -0.60 0.00 0.00 178.31 178.87 1bwk h ALA 327 N 1.57 0.45 -0.20 2.45 0.00 -1.92 -2.13 119.26 119.49 1bwk h ALA 327 Ca -0.11 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1bwk h ALA 327 Cb 1.42 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1bwk h ALA 327 CO 0.04 -0.25 0.00 1.28 0.00 0.00 0.00 179.25 180.32 1bwk n LEU 328 N -5.01 1.44 -3.19 0.00 4.77 -1.26 -4.32 117.00 109.43 1bwk n LEU 328 Ca 0.02 -0.72 -0.22 0.00 -0.03 0.00 0.00 56.01 55.06 1bwk n LEU 328 Cb 0.13 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1bwk n LEU 328 CO 0.27 0.30 -0.24 1.41 -1.33 0.00 0.00 177.39 177.80 1bwk n HIS 329 N 0.13 0.19 -0.21 -1.77 8.25 -0.80 -4.95 115.22 116.05 1bwk n HIS 329 Ca 0.07 -3.71 0.02 0.00 -0.26 0.00 0.00 57.72 53.84 1bwk n HIS 329 Cb 0.27 -0.39 0.27 0.00 1.12 0.00 0.00 29.99 31.25 1bwk n HIS 329 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1bwk h PRO 330 N 3.57 0.94 -0.68 -0.41 0.13 -1.75 -1.37 132.00 132.43 1bwk h PRO 330 Ca 0.09 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 65.18 1bwk h PRO 330 Cb 0.89 -0.21 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 1bwk h PRO 330 CO 0.51 0.62 0.45 1.05 -0.23 0.00 0.00 178.00 180.39 1bwk h GLU 331 N 0.97 0.83 -0.06 0.86 9.09 -1.92 0.36 114.58 124.71 1bwk h GLU 331 Ca 0.28 -0.05 -0.03 0.00 0.05 0.00 0.00 59.36 59.61 1bwk h GLU 331 Cb -0.06 -0.19 -0.00 0.00 -1.65 0.00 0.00 28.75 26.85 1bwk h GLU 331 CO -0.07 0.55 -0.06 0.28 0.05 0.00 0.00 179.01 179.76 1bwk h VAL 332 N 0.86 1.38 -0.83 -1.06 2.07 -1.65 -3.14 116.25 113.88 1bwk h VAL 332 Ca 0.26 -1.24 0.07 0.00 0.82 0.00 0.00 66.70 66.61 1bwk h VAL 332 Cb -0.01 2.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.77 1bwk h VAL 332 CO -0.07 0.34 0.50 0.58 0.02 0.00 0.00 177.57 178.94 1bwk h VAL 333 N -0.31 0.99 -0.78 2.57 2.07 -0.57 -1.60 116.25 118.61 1bwk h VAL 333 Ca 0.01 -0.30 0.16 0.00 0.82 0.00 0.00 66.70 67.38 1bwk h VAL 333 Cb 0.58 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 1bwk h VAL 333 CO 0.02 0.16 0.52 -0.09 0.02 0.00 0.00 177.57 178.20 1bwk h ARG 334 N 0.88 0.41 0.14 1.57 2.43 -0.30 -0.45 114.38 119.07 1bwk h ARG 334 Ca 0.38 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 59.26 1bwk h ARG 334 Cb 0.24 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1bwk h ARG 334 CO -0.20 0.27 -1.30 0.93 -1.51 0.00 0.00 179.97 178.16 1bwk h GLU 335 N 0.43 0.31 -0.38 0.20 4.39 -1.28 -3.32 114.58 114.92 1bwk h GLU 335 Ca 0.39 -0.52 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 1bwk h GLU 335 Cb 0.88 0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1bwk h GLU 335 CO -0.13 1.25 0.21 0.93 -1.16 0.00 0.00 179.01 180.12 1bwk h GLU 336 N -0.23 0.51 -0.00 2.33 4.39 -0.72 -2.03 114.58 118.83 1bwk h GLU 336 Ca -0.26 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1bwk h GLU 336 Cb 1.81 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.35 1bwk h GLU 336 CO 0.12 0.37 -0.11 1.33 -1.16 0.00 0.00 179.01 179.56 1bwk n VAL 337 N -4.44 0.00 0.28 3.13 0.24 -0.24 -3.42 118.33 113.88 1bwk n VAL 337 Ca 0.03 -0.06 0.11 0.00 -2.04 0.00 0.00 64.34 62.38 1bwk n VAL 337 Cb 0.09 -0.11 0.77 0.00 -1.47 0.00 0.00 33.84 33.13 1bwk n VAL 337 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1bwk h LYS 338 N 0.54 0.00 -6.79 7.34 1.57 -1.46 -3.39 116.57 114.37 1bwk h LYS 338 Ca 0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 1bwk h LYS 338 Cb 0.36 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.70 1bwk h LYS 338 CO 0.00 0.00 0.55 0.34 -0.57 0.00 0.00 179.45 179.77 1bwk s ASP 339 N -6.62 7.07 0.00 0.86 2.15 -1.22 -4.95 116.67 113.96 1bwk s ASP 339 Ca -0.05 2.39 0.27 0.00 0.43 0.00 0.00 52.55 55.59 1bwk s ASP 339 Cb 0.16 -2.63 1.26 0.00 -0.30 0.00 0.00 42.92 41.41 1bwk s ASP 339 CO 0.61 -0.32 1.91 2.29 -0.17 0.00 0.00 175.17 179.49 1bwk n LYS 340 N 1.41 0.17 -1.29 4.34 2.85 -1.26 -3.98 118.16 120.40 1bwk n LYS 340 Ca 0.01 0.03 -0.02 0.00 -1.05 0.00 0.00 58.31 57.27 1bwk n LYS 340 Cb 0.44 -1.50 0.12 0.00 -0.65 0.00 0.00 35.03 33.43 1bwk n LYS 340 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 1bwk n ARG 341 N -1.41 1.85 -4.75 -1.58 1.85 -1.26 -5.04 116.66 106.33 1bwk n ARG 341 Ca 0.09 -3.33 -0.33 0.00 -1.00 0.00 0.00 57.85 53.29 1bwk n ARG 341 Cb 0.27 -1.52 -0.15 0.00 -1.05 0.00 0.00 32.46 30.02 1bwk n ARG 341 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1bwk s THR 342 N -3.10 2.92 0.12 8.89 2.01 -1.26 -1.64 115.64 123.59 1bwk s THR 342 Ca 0.40 -0.70 0.08 0.00 0.31 0.00 0.00 61.69 61.77 1bwk s THR 342 Cb 0.38 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.63 1bwk s THR 342 CO -0.06 0.52 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.53 1bwk s LEU 343 N 0.45 3.00 -0.17 4.42 1.02 -0.71 -4.87 118.68 121.82 1bwk s LEU 343 Ca -0.10 -0.44 -0.02 0.00 0.02 0.00 0.00 54.13 53.59 1bwk s LEU 343 Cb -0.16 -1.78 -0.01 0.00 0.02 0.00 0.00 46.19 44.26 1bwk s LEU 343 CO 0.05 0.16 -0.09 -0.63 0.02 0.00 0.00 176.35 175.86 1bwk s ILE 344 N -1.32 3.16 -0.22 -0.59 -1.09 -0.72 -0.87 121.20 119.55 1bwk s ILE 344 Ca 0.22 -0.59 -0.13 0.00 -2.23 0.00 0.00 60.65 57.91 1bwk s ILE 344 Cb -0.11 -2.38 -0.04 0.00 -1.58 0.00 0.00 42.46 38.35 1bwk s ILE 344 CO 0.14 0.48 0.29 -0.83 -1.23 0.00 0.00 174.94 173.79 1bwk s GLY 345 N 0.92 2.04 -0.36 6.18 0.00 0.16 -1.03 107.32 115.23 1bwk s GLY 345 Ca -0.02 -0.69 -0.08 0.00 0.00 0.00 0.00 44.72 43.93 1bwk s GLY 345 CO -0.00 0.61 0.15 -0.19 0.00 0.00 0.00 173.10 173.67 1bwk s TYR 346 N 1.17 3.27 0.00 1.90 2.02 -0.97 -3.79 117.35 120.95 1bwk s TYR 346 Ca 0.14 -1.35 0.00 0.00 -0.37 0.00 0.00 57.07 55.49 1bwk s TYR 346 Cb -0.14 -2.42 0.00 0.00 -0.40 0.00 0.00 41.96 39.00 1bwk s TYR 346 CO 0.06 -0.73 0.00 0.41 -1.57 0.00 0.00 175.55 173.72 1bwk n GLY 347 N 4.87 1.68 0.54 0.71 0.00 -1.26 -4.00 105.19 107.72 1bwk n GLY 347 Ca -0.12 0.00 0.39 0.00 0.00 0.00 0.00 46.02 46.29 1bwk n GLY 347 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1bwk h ARG 348 N 0.00 0.08 -0.00 1.61 3.08 -1.98 0.20 114.38 117.36 1bwk h ARG 348 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bwk h ARG 348 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1bwk h ARG 348 CO 0.00 0.05 -0.13 1.19 -1.07 0.00 0.00 179.97 180.01 1bwk n PHE 349 N -4.33 0.00 1.03 3.04 3.72 -1.26 -3.05 117.46 116.61 1bwk n PHE 349 Ca 0.34 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.86 1bwk n PHE 349 Cb 1.44 -0.21 0.25 0.00 -0.94 0.00 0.00 39.48 40.01 1bwk n PHE 349 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1bwk n PHE 350 N -1.03 0.00 -0.03 1.38 -0.00 0.70 -2.28 117.46 116.20 1bwk n PHE 350 Ca 0.13 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.49 1bwk n PHE 350 Cb 0.29 -0.22 -0.08 0.00 -0.00 0.00 0.00 39.48 39.47 1bwk n PHE 350 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1bwk h ILE 351 N 0.16 1.07 -0.00 -2.13 2.04 -1.55 -3.36 117.51 113.73 1bwk h ILE 351 Ca 0.00 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.23 1bwk h ILE 351 Cb 0.50 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1bwk h ILE 351 CO 0.00 0.34 -0.17 -1.54 0.00 0.00 0.00 178.15 176.78 1bwk n SER 352 N -4.75 0.49 -3.62 1.72 3.41 -1.24 -4.63 113.62 104.99 1bwk n SER 352 Ca -0.07 -0.44 -0.29 0.00 -0.26 0.00 0.00 58.87 57.81 1bwk n SER 352 Cb 0.29 -0.06 -0.12 0.00 -0.26 0.00 0.00 64.21 64.06 1bwk n SER 352 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1bwk s ASN 353 N -2.61 3.27 0.64 4.04 0.01 -0.97 -4.63 114.94 114.69 1bwk s ASN 353 Ca 0.24 -2.67 0.38 0.00 -0.71 0.00 0.00 52.86 50.09 1bwk s ASN 353 Cb 0.19 -0.85 2.12 0.00 0.41 0.00 0.00 41.25 43.13 1bwk s ASN 353 CO 0.52 -0.25 2.28 1.55 -1.51 0.00 0.00 177.10 179.68 1bwk h PRO 354 N 6.55 0.00 -0.90 -0.60 0.13 -1.82 -1.73 132.00 133.63 1bwk h PRO 354 Ca 0.06 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.62 1bwk h PRO 354 Cb 0.92 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.63 1bwk h PRO 354 CO 0.43 0.00 -0.68 -0.40 -0.23 0.00 0.00 178.00 177.12 1bwk n ASP 355 N -3.36 5.10 0.04 1.44 5.75 -1.26 -4.34 116.55 119.91 1bwk n ASP 355 Ca -0.02 -3.75 -0.11 0.00 -0.01 0.00 0.00 54.79 50.90 1bwk n ASP 355 Cb 0.13 -0.41 -0.04 0.00 -1.03 0.00 0.00 41.12 39.77 1bwk n ASP 355 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1bwk h LEU 356 N 2.24 -0.72 -0.80 -2.12 5.85 -1.64 -2.77 115.31 115.35 1bwk h LEU 356 Ca 0.38 0.11 0.16 0.00 0.84 0.00 0.00 57.88 59.36 1bwk h LEU 356 Cb 1.38 0.31 -0.15 0.00 0.37 0.00 0.00 40.66 42.57 1bwk h LEU 356 CO 0.83 -0.30 -0.20 0.58 -0.34 0.00 0.00 178.44 179.01 1bwk h VAL 357 N -0.35 0.20 -0.53 1.05 2.07 -1.88 0.20 116.25 117.00 1bwk h VAL 357 Ca 0.08 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 1bwk h VAL 357 Cb 0.46 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1bwk h VAL 357 CO -0.25 0.00 0.06 0.44 0.02 0.00 0.00 177.57 177.84 1bwk h ASP 358 N -0.00 0.82 0.79 0.57 3.32 -1.92 -1.23 116.42 118.77 1bwk h ASP 358 Ca 0.38 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.19 1bwk h ASP 358 Cb 0.58 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1bwk h ASP 358 CO -0.82 0.85 -0.27 0.03 -1.72 0.00 0.00 179.24 177.32 1bwk h ARG 359 N 0.81 0.00 0.17 3.56 3.08 -0.46 -1.77 114.38 119.78 1bwk h ARG 359 Ca 0.16 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.98 1bwk h ARG 359 Cb 0.41 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.49 1bwk h ARG 359 CO 0.01 0.27 -1.04 -0.07 -1.07 0.00 0.00 179.97 178.07 1bwk h LEU 360 N 0.00 0.62 -0.38 3.04 4.07 -0.36 0.43 115.31 122.73 1bwk h LEU 360 Ca -0.00 -0.93 -0.04 0.00 0.08 0.00 0.00 57.88 56.99 1bwk h LEU 360 Cb 0.73 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.26 1bwk h LEU 360 CO 0.03 1.50 0.08 -0.08 -1.08 0.00 0.00 178.44 178.90 1bwk h GLU 361 N -0.15 0.62 -0.01 1.13 4.81 -1.14 -0.62 114.58 119.23 1bwk h GLU 361 Ca -0.18 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1bwk h GLU 361 Cb 1.81 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 31.11 1bwk h GLU 361 CO 0.20 0.66 -0.35 1.63 -0.73 0.00 0.00 179.01 180.42 1bwk n LYS 362 N -4.56 0.61 -3.17 1.92 5.02 -0.67 -2.61 118.16 114.69 1bwk n LYS 362 Ca -0.01 -0.37 -0.15 0.00 -2.02 0.00 0.00 58.31 55.76 1bwk n LYS 362 Cb 0.21 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 33.79 1bwk n LYS 362 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bwk n GLY 363 N 1.39 -0.08 3.92 0.72 0.00 -0.48 -4.61 105.19 106.05 1bwk n GLY 363 Ca 0.10 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1bwk n GLY 363 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwk s LEU 364 N -5.23 4.12 0.86 0.99 1.43 0.02 -4.53 118.68 116.34 1bwk s LEU 364 Ca 0.28 0.51 -0.13 0.00 -1.03 0.00 0.00 54.13 53.77 1bwk s LEU 364 Cb -0.13 -3.32 0.06 0.00 0.03 0.00 0.00 46.19 42.84 1bwk s LEU 364 CO 0.50 -0.16 0.85 -0.81 0.23 0.00 0.00 176.35 176.96 1bwk n PRO 365 N -1.05 -0.08 -4.45 1.29 -0.04 -1.26 -4.76 135.00 124.65 1bwk n PRO 365 Ca -0.04 0.04 -0.34 0.00 -0.04 0.00 0.00 63.50 63.13 1bwk n PRO 365 Cb 0.54 -2.16 -0.12 0.00 -0.04 0.00 0.00 33.50 31.72 1bwk n PRO 365 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bwk s LEU 366 N -3.64 3.16 0.35 1.53 1.02 -1.26 -4.99 118.68 114.84 1bwk s LEU 366 Ca 0.66 -0.17 -0.28 0.00 0.02 0.00 0.00 54.13 54.36 1bwk s LEU 366 Cb -0.26 -1.76 -0.10 0.00 0.02 0.00 0.00 46.19 44.09 1bwk s LEU 366 CO 0.58 0.16 1.34 0.20 0.02 0.00 0.00 176.35 178.66 1bwk s ASN 367 N 0.39 6.66 0.63 2.29 0.01 -1.26 0.56 114.94 124.22 1bwk s ASN 367 Ca -0.05 2.76 -0.15 0.00 -0.71 0.00 0.00 52.86 54.71 1bwk s ASN 367 Cb -0.14 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 38.85 1bwk s ASN 367 CO 0.03 -0.62 1.08 -0.54 -1.51 0.00 0.00 177.10 175.54 1bwk s LYS 368 N -1.88 3.04 -0.12 -0.60 1.02 -0.34 -4.71 119.74 116.16 1bwk s LYS 368 Ca 0.50 1.27 -0.05 0.00 0.02 0.00 0.00 55.97 57.71 1bwk s LYS 368 Cb -0.41 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.87 1bwk s LYS 368 CO 0.55 -1.04 0.08 1.52 -0.92 0.00 0.00 175.35 175.54 1bwk s TYR 369 N -2.44 3.38 -0.45 3.18 -0.85 -1.26 -4.81 117.35 114.11 1bwk s TYR 369 Ca 0.65 0.34 -0.22 0.00 -0.52 0.00 0.00 57.07 57.32 1bwk s TYR 369 Cb -0.18 -1.90 0.02 0.00 0.38 0.00 0.00 41.96 40.28 1bwk s TYR 369 CO 0.40 0.56 0.73 0.34 -1.52 0.00 0.00 175.55 176.06 1bwk s ASP 370 N -0.77 6.38 0.53 -0.18 2.15 -1.26 -4.91 116.67 118.60 1bwk s ASP 370 Ca 0.13 -0.19 0.17 0.00 0.43 0.00 0.00 52.55 53.09 1bwk s ASP 370 Cb -0.12 -2.36 1.32 0.00 -0.30 0.00 0.00 42.92 41.46 1bwk s ASP 370 CO 0.03 -0.87 2.16 0.08 -0.17 0.00 0.00 175.17 176.40 1bwk h ARG 371 N 8.94 0.00 0.00 4.34 -0.00 -2.00 -2.99 114.38 122.67 1bwk h ARG 371 Ca -0.25 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.67 1bwk h ARG 371 Cb 1.09 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.05 1bwk h ARG 371 CO 0.94 0.01 -0.27 -0.44 -0.00 0.00 0.00 179.97 180.20 1bwk h ASP 372 N 0.00 0.00 -0.66 0.08 3.32 -2.00 -3.05 116.42 114.11 1bwk h ASP 372 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bwk h ASP 372 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1bwk h ASP 372 CO 0.00 0.27 0.00 0.35 -1.72 0.00 0.00 179.24 178.14 1bwk n THR 373 N -3.46 0.88 -0.29 0.35 -2.24 -1.13 -4.34 114.28 104.05 1bwk n THR 373 Ca -0.00 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 60.88 1bwk n THR 373 Cb 0.44 0.50 0.13 0.00 -2.10 0.00 0.00 70.33 69.31 1bwk n THR 373 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1bwk h PHE 374 N 4.04 0.89 -2.80 4.78 -1.00 -1.64 -3.27 116.94 117.94 1bwk h PHE 374 Ca 0.00 0.03 -0.61 0.00 2.81 0.00 0.00 57.97 60.20 1bwk h PHE 374 Cb 0.92 -0.28 -0.41 0.00 3.61 0.00 0.00 35.95 39.80 1bwk h PHE 374 CO 0.44 0.43 -0.72 0.66 -1.61 0.00 0.00 178.31 177.51 1bwk n TYR 375 N -4.68 1.82 -3.89 -0.55 4.01 -1.26 -4.49 117.16 108.12 1bwk n TYR 375 Ca 0.11 -3.96 -0.11 0.00 -0.16 0.00 0.00 57.90 53.78 1bwk n TYR 375 Cb 0.19 -0.32 -0.13 0.00 -0.31 0.00 0.00 39.34 38.77 1bwk n TYR 375 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1bwk s GLN 376 N -1.00 0.15 -1.34 -0.72 -1.52 -1.23 -5.01 119.66 108.98 1bwk s GLN 376 Ca 0.28 -0.15 -0.14 0.00 -1.95 0.00 0.00 55.36 53.40 1bwk s GLN 376 Cb -0.00 0.06 0.09 0.00 -0.22 0.00 0.00 33.01 32.94 1bwk s GLN 376 CO -0.17 -0.03 1.90 -0.12 -0.25 0.00 0.00 175.29 176.62 1bwk n MET 377 N 2.56 3.18 -3.62 2.91 0.00 -1.26 -4.65 117.12 116.24 1bwk n MET 377 Ca -0.16 -3.16 -0.11 0.00 -0.00 0.00 0.00 57.70 54.27 1bwk n MET 377 Cb 0.58 -3.25 -0.04 0.00 0.00 0.00 0.00 33.22 30.51 1bwk n MET 377 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1bwk s SER 378 N 3.04 -0.27 -0.02 6.12 1.04 -1.26 -5.02 113.70 117.33 1bwk s SER 378 Ca 0.47 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.66 1bwk s SER 378 Cb 0.08 0.49 -0.24 0.00 0.10 0.00 0.00 66.02 66.44 1bwk s SER 378 CO -0.01 -0.87 0.75 0.00 0.98 0.00 0.00 173.24 174.10 1bwk h ALA 379 N 2.33 0.55 -2.64 5.32 0.00 -2.00 -3.42 119.26 119.40 1bwk h ALA 379 Ca -0.34 -1.30 -0.52 0.00 0.00 0.00 0.00 54.91 52.75 1bwk h ALA 379 Cb 1.26 0.38 0.05 0.00 0.00 0.00 0.00 17.79 19.48 1bwk h ALA 379 CO 0.46 1.40 0.88 -1.58 0.00 0.00 0.00 179.25 180.40 1bwk s HIS 380 N -2.61 3.02 -0.09 0.00 5.65 -1.26 -0.71 115.29 119.29 1bwk s HIS 380 Ca -0.07 0.65 0.00 0.00 0.25 0.00 0.00 55.06 55.89 1bwk s HIS 380 Cb 0.08 -3.95 0.00 0.00 -1.18 0.00 0.00 32.58 27.53 1bwk s HIS 380 CO 0.82 -3.44 0.00 0.41 -0.65 0.00 0.00 174.74 171.88 1bwk n GLY 381 N 3.49 0.49 1.36 1.59 0.00 -1.26 -4.83 105.19 106.02 1bwk n GLY 381 Ca 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1bwk n GLY 381 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1bwk n TYR 382 N -2.91 -0.59 0.04 1.61 9.36 0.11 -4.69 117.16 120.09 1bwk n TYR 382 Ca -0.01 0.10 0.01 0.00 3.32 0.00 0.00 57.90 61.33 1bwk n TYR 382 Cb 0.06 0.19 0.02 0.00 -0.63 0.00 0.00 39.34 38.99 1bwk n TYR 382 CO 0.00 0.00 0.00 0.44 0.22 0.00 0.00 176.86 177.52 1bwk n ILE 383 N -3.16 0.47 -0.30 2.97 -5.35 -0.35 -4.67 119.36 108.97 1bwk n ILE 383 Ca 0.00 -0.73 0.11 0.00 -0.27 0.00 0.00 62.75 61.86 1bwk n ILE 383 Cb 0.00 0.80 0.31 0.00 -1.74 0.00 0.00 39.64 39.00 1bwk n ILE 383 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1bwk n ASP 384 N -0.03 3.86 -4.71 7.28 5.75 -1.25 -4.93 116.55 122.52 1bwk n ASP 384 Ca 0.02 -2.00 -0.42 0.00 -0.01 0.00 0.00 54.79 52.38 1bwk n ASP 384 Cb 0.17 -0.46 -0.03 0.00 -1.03 0.00 0.00 41.12 39.78 1bwk n ASP 384 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1bwk s TYR 385 N -1.04 3.28 0.56 2.11 2.02 -1.26 -4.97 117.35 118.04 1bwk s TYR 385 Ca 0.47 1.02 -0.13 0.00 -0.37 0.00 0.00 57.07 58.05 1bwk s TYR 385 Cb 0.25 -3.63 -0.06 0.00 -0.40 0.00 0.00 41.96 38.12 1bwk s TYR 385 CO 0.32 -2.18 0.98 -1.25 -1.57 0.00 0.00 175.55 171.85 1bwk s PRO 386 N 1.11 3.75 0.76 -1.71 0.04 -1.26 -4.77 135.00 132.92 1bwk s PRO 386 Ca 0.63 0.78 -0.12 0.00 0.04 0.00 0.00 61.00 62.34 1bwk s PRO 386 Cb -0.35 -2.14 0.05 0.00 0.04 0.00 0.00 34.50 32.10 1bwk s PRO 386 CO 0.30 -0.39 1.14 0.95 0.04 0.00 0.00 177.00 179.04 1bwk s THR 387 N -2.88 2.64 0.25 1.26 -4.23 -1.26 -4.67 115.64 106.75 1bwk s THR 387 Ca 0.56 0.19 -0.04 0.00 -1.18 0.00 0.00 61.69 61.22 1bwk s THR 387 Cb -0.10 -3.20 0.23 0.00 1.34 0.00 0.00 72.50 70.76 1bwk s THR 387 CO 0.43 -0.27 1.71 0.22 -0.54 0.00 0.00 174.62 176.17 1bwk h TYR 388 N -0.87 0.41 -0.02 3.99 3.20 -1.95 0.53 116.97 122.25 1bwk h TYR 388 Ca -0.46 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.47 1bwk h TYR 388 Cb 1.30 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.48 1bwk h TYR 388 CO 0.39 -0.01 -0.08 0.93 -1.64 0.00 0.00 178.16 177.75 1bwk h GLU 389 N 0.36 -0.12 -0.68 1.82 4.39 -1.99 -1.33 114.58 117.02 1bwk h GLU 389 Ca 0.42 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 60.09 1bwk h GLU 389 Cb 0.69 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.34 1bwk h GLU 389 CO -0.46 -0.08 0.25 0.93 -1.16 0.00 0.00 179.01 178.49 1bwk h GLU 390 N -0.13 1.02 -0.17 2.33 5.08 -1.76 -1.17 114.58 119.77 1bwk h GLU 390 Ca 0.04 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 1bwk h GLU 390 Cb 0.18 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1bwk h GLU 390 CO -0.10 0.85 -0.07 0.00 -1.00 0.00 0.00 179.01 178.69 1bwk h ALA 391 N 1.28 1.56 -0.06 3.43 0.00 -0.60 -0.31 119.26 124.56 1bwk h ALA 391 Ca 0.23 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1bwk h ALA 391 Cb 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1bwk h ALA 391 CO -0.02 0.32 -0.15 -0.07 0.00 0.00 0.00 179.25 179.33 1bwk h LEU 392 N 0.26 0.23 -1.96 0.00 3.38 -0.38 -1.12 115.31 115.72 1bwk h LEU 392 Ca 0.06 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.42 1bwk h LEU 392 Cb 0.29 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1bwk h LEU 392 CO 0.01 0.78 -0.09 0.11 0.09 0.00 0.00 178.44 179.35 1bwk h LYS 393 N -0.31 0.00 0.00 1.13 1.57 -0.88 0.12 116.57 118.20 1bwk h LYS 393 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1bwk h LYS 393 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1bwk h LYS 393 CO 0.03 0.09 -0.11 -0.07 -0.57 0.00 0.00 179.45 178.82 1bwk h LEU 394 N 0.00 0.00 -0.95 2.94 3.38 -0.99 -3.48 115.31 116.22 1bwk h LEU 394 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1bwk h LEU 394 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1bwk h LEU 394 CO 0.01 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1bwk n GLY 395 N 1.26 0.96 2.02 0.83 0.00 0.03 -4.88 105.19 105.41 1bwk n GLY 395 Ca 0.05 -0.64 -0.07 0.00 0.00 0.00 0.00 46.02 45.35 1bwk n GLY 395 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1bwk n TRP 396 N -2.37 0.00 -2.74 1.61 7.02 -0.47 -4.44 117.44 116.06 1bwk n TRP 396 Ca 0.00 -1.06 -0.05 0.00 -1.02 0.00 0.00 57.50 55.37 1bwk n TRP 396 Cb 0.47 -1.14 0.01 0.00 -2.42 0.00 0.00 31.31 28.23 1bwk n TRP 396 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1bwk n ASP 397 N 2.43 -7.68 0.00 -0.99 8.00 -1.26 -4.59 116.55 112.45 1bwk n ASP 397 Ca 0.26 0.78 0.00 0.00 0.71 0.00 0.00 54.79 56.54 1bwk n ASP 397 Cb 0.63 -5.16 0.00 0.00 -0.02 0.00 0.00 41.12 36.57 1bwk n ASP 397 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1bwk n LYS 398 N -0.01 0.00 0.00 -1.24 0.00 -1.26 -5.09 118.16 110.56 1bwk n LYS 398 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 58.31 58.53 1bwk n LYS 398 Cb 0.30 0.00 0.47 0.00 0.00 0.00 0.00 35.03 35.80 1bwk n LYS 398 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83