#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwo n ILE 18 N 0.00 0.00 0.00 2.41 3.06 -1.26 -5.17 119.36 118.40 3bwo n ILE 18 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 3bwo n ILE 18 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3bwo n ILE 18 CO 0.00 0.00 0.00 -0.81 -2.50 0.00 0.00 176.55 173.24 3bwo n PRO 19 N -0.04 0.50 0.00 9.51 -0.04 -1.26 -5.04 135.00 138.63 3bwo n PRO 19 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3bwo n PRO 19 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3bwo n PRO 19 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 3bwo n MET 20 N 0.00 0.00 0.15 0.54 1.56 -1.26 -4.89 117.12 113.22 3bwo n MET 20 Ca 0.00 0.00 0.11 0.00 -0.27 0.00 0.00 57.70 57.54 3bwo n MET 20 Cb 0.00 0.00 0.55 0.00 2.15 0.00 0.00 33.22 35.92 3bwo n MET 20 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 3bwo n SER 21 N 0.00 0.58 -1.59 6.12 2.88 -1.26 -1.74 113.62 118.61 3bwo n SER 21 Ca 0.00 0.73 0.05 0.00 -1.33 0.00 0.00 58.87 58.32 3bwo n SER 21 Cb 0.00 -0.82 0.31 0.00 -0.75 0.00 0.00 64.21 62.95 3bwo n SER 21 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3bwo n ASP 22 N -2.24 4.64 -4.63 -3.46 9.92 -1.26 -4.89 116.55 114.64 3bwo n ASP 22 Ca -0.01 -2.73 -0.40 0.00 -0.53 0.00 0.00 54.79 51.13 3bwo n ASP 22 Cb 0.08 -0.65 -0.08 0.00 -0.64 0.00 0.00 41.12 39.84 3bwo n ASP 22 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 3bwo s PHE 23 N -2.36 3.29 -0.29 1.24 2.99 -0.71 -5.05 117.98 117.09 3bwo s PHE 23 Ca 0.42 0.64 -0.25 0.00 0.00 0.00 0.00 56.93 57.74 3bwo s PHE 23 Cb 0.32 -2.68 0.00 0.00 0.00 0.00 0.00 43.02 40.66 3bwo s PHE 23 CO 0.12 -0.22 0.87 0.08 -0.00 0.00 0.00 175.22 176.07 3bwo s VAL 24 N 2.08 4.74 -0.38 -0.44 1.01 -1.26 -4.88 120.40 121.27 3bwo s VAL 24 Ca 0.21 1.41 -0.25 0.00 0.00 0.00 0.00 61.98 63.36 3bwo s VAL 24 Cb -0.16 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.03 3bwo s VAL 24 CO 0.09 -0.26 0.87 -0.69 0.00 0.00 0.00 175.10 175.11 3bwo s VAL 25 N 3.09 4.63 -0.47 2.92 1.01 -0.40 -4.97 120.40 126.20 3bwo s VAL 25 Ca 0.36 0.98 -0.14 0.00 0.00 0.00 0.00 61.98 63.17 3bwo s VAL 25 Cb -0.14 -4.30 0.08 0.00 0.00 0.00 0.00 36.38 32.02 3bwo s VAL 25 CO 0.12 -0.55 0.39 0.21 0.00 0.00 0.00 175.10 175.26 3bwo s ASN 26 N 1.93 6.06 -0.24 3.32 3.84 -1.26 0.48 114.94 129.07 3bwo s ASN 26 Ca 0.35 -1.45 0.12 0.00 0.21 0.00 0.00 52.86 52.09 3bwo s ASN 26 Cb -0.12 -2.15 0.45 0.00 -0.55 0.00 0.00 41.25 38.88 3bwo s ASN 26 CO 0.19 -0.66 1.19 0.18 -2.79 0.00 0.00 177.10 175.21 3bwo n LEU 27 N 5.15 3.48 0.01 3.21 4.77 -0.32 -4.71 117.00 128.59 3bwo n LEU 27 Ca -0.12 -4.04 -0.16 0.00 -0.03 0.00 0.00 56.01 51.66 3bwo n LEU 27 Cb 0.43 -0.27 -0.14 0.00 -2.33 0.00 0.00 43.42 41.11 3bwo n LEU 27 CO 0.47 1.62 -0.63 -0.78 -1.33 0.00 0.00 177.39 176.73 3bwo h ASP 28 N 1.76 0.27 -1.24 -1.43 3.58 -1.81 -2.34 116.42 115.21 3bwo h ASP 28 Ca 0.14 -0.56 -0.46 0.00 0.42 0.00 0.00 57.03 56.56 3bwo h ASP 28 Cb 1.36 -0.09 0.03 0.00 1.72 0.00 0.00 39.33 42.36 3bwo h ASP 28 CO 0.39 1.50 -0.12 -1.38 -2.88 0.00 0.00 179.24 176.75 3bwo s HIS 29 N -2.58 1.94 -0.57 0.28 -3.43 -1.26 -4.42 115.29 105.25 3bwo s HIS 29 Ca -0.14 -0.54 0.02 0.00 -0.80 0.00 0.00 55.06 53.60 3bwo s HIS 29 Cb 0.07 -2.38 0.42 0.00 -1.43 0.00 0.00 32.58 29.26 3bwo s HIS 29 CO 0.80 -0.98 1.63 0.41 -2.00 0.00 0.00 174.74 174.61 3bwo n GLY 30 N -2.20 5.96 3.60 -1.38 0.00 -1.26 -4.59 105.19 105.32 3bwo n GLY 30 Ca 0.13 -2.53 -0.43 0.00 0.00 0.00 0.00 46.02 43.19 3bwo n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3bwo s ASP 31 N -2.45 6.09 -0.72 1.61 2.15 -1.26 -4.89 116.67 117.20 3bwo s ASP 31 Ca 0.55 0.99 -0.07 0.00 0.43 0.00 0.00 52.55 54.45 3bwo s ASP 31 Cb 0.45 -2.53 -0.14 0.00 -0.30 0.00 0.00 42.92 40.39 3bwo s ASP 31 CO -0.13 -1.61 2.82 -0.81 -0.17 0.00 0.00 175.17 175.27 3bwo n PRO 32 N 8.31 2.40 0.00 4.34 -0.04 -1.26 -4.38 135.00 144.37 3bwo n PRO 32 Ca 0.19 -1.40 0.07 0.00 -0.04 0.00 0.00 63.50 62.32 3bwo n PRO 32 Cb 0.48 -2.31 0.43 0.00 -0.04 0.00 0.00 33.50 32.05 3bwo n PRO 32 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3bwo n THR 33 N 3.27 0.00 0.19 0.52 -2.24 -0.99 -3.47 114.28 111.55 3bwo n THR 33 Ca 0.51 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 62.35 3bwo n THR 33 Cb 0.45 -0.38 0.34 0.00 -2.10 0.00 0.00 70.33 68.64 3bwo n THR 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3bwo h ALA 34 N 3.17 1.00 -0.01 6.98 0.00 -1.61 -2.98 119.26 125.80 3bwo h ALA 34 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3bwo h ALA 34 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3bwo h ALA 34 CO 0.00 0.46 -0.02 0.66 0.00 0.00 0.00 179.25 180.35 3bwo n TYR 35 N -3.53 0.00 -0.29 0.00 4.01 -1.23 -4.34 117.16 111.79 3bwo n TYR 35 Ca -0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 3bwo n TYR 35 Cb 0.51 -0.02 0.12 0.00 -0.31 0.00 0.00 39.34 39.63 3bwo n TYR 35 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3bwo h GLU 36 N 1.56 1.16 0.61 -0.72 4.81 -1.77 -2.65 114.58 117.57 3bwo h GLU 36 Ca 0.00 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 3bwo h GLU 36 Cb 0.36 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3bwo h GLU 36 CO 0.00 0.88 -0.42 1.49 -0.73 0.00 0.00 179.01 180.22 3bwo h GLU 37 N 1.16 -0.96 -0.57 1.92 4.22 -1.82 -2.51 114.58 116.02 3bwo h GLU 37 Ca 0.28 0.07 0.11 0.00 0.08 0.00 0.00 59.36 59.90 3bwo h GLU 37 Cb 0.08 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 29.44 3bwo h GLU 37 CO -0.04 -0.64 -0.25 -0.92 -2.18 0.00 0.00 179.01 174.98 3bwo h TYR 38 N -0.99 -0.64 0.00 0.92 3.20 -1.77 -0.94 116.97 116.74 3bwo h TYR 38 Ca -0.07 0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 3bwo h TYR 38 Cb 0.82 0.37 -0.00 0.00 1.54 0.00 0.00 36.73 39.46 3bwo h TYR 38 CO -0.14 -0.33 -0.16 -1.49 -1.64 0.00 0.00 178.16 174.40 3bwo h TRP 39 N -0.11 0.00 -0.12 -3.82 4.06 -1.47 -2.55 115.95 111.95 3bwo h TRP 39 Ca 0.26 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 61.03 3bwo h TRP 39 Cb 0.51 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.67 3bwo h TRP 39 CO -0.56 0.16 -0.67 -0.09 -3.56 0.00 0.00 178.44 173.71 3bwo h ARG 40 N 0.00 0.47 0.00 0.49 2.43 -0.72 -3.06 114.38 113.99 3bwo h ARG 40 Ca -0.00 -0.35 -0.09 0.00 -0.81 0.00 0.00 59.98 58.73 3bwo h ARG 40 Cb 0.52 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3bwo h ARG 40 CO 0.02 0.98 -0.43 0.87 -1.51 0.00 0.00 179.97 179.90 3bwo h LYS 41 N 0.34 0.00 0.00 0.20 1.57 -1.08 -2.82 116.57 114.78 3bwo h LYS 41 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3bwo h LYS 41 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3bwo h LYS 41 CO 0.12 0.43 0.00 0.52 -0.57 0.00 0.00 179.45 179.95 3bwo h MET 42 N 0.00 0.00 0.00 3.15 2.86 -1.35 -3.47 114.93 116.11 3bwo h MET 42 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3bwo h MET 42 Cb 0.88 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 3bwo h MET 42 CO 0.06 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.44 3bwo n GLY 43 N -1.09 0.88 0.32 8.32 0.00 -1.07 -3.77 105.19 108.79 3bwo n GLY 43 Ca -0.02 -0.69 0.20 0.00 0.00 0.00 0.00 46.02 45.51 3bwo n GLY 43 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3bwo h ASP 44 N 7.16 0.00 0.09 1.61 5.19 -1.91 -2.76 116.42 125.80 3bwo h ASP 44 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3bwo h ASP 44 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 3bwo h ASP 44 CO 0.00 0.00 0.00 -2.11 -3.12 0.00 0.00 179.24 174.01 3bwo n ARG 45 N -3.38 0.06 -0.00 3.56 1.85 -1.25 -1.28 116.66 116.22 3bwo n ARG 45 Ca -0.03 0.52 0.10 0.00 -1.00 0.00 0.00 57.85 57.44 3bwo n ARG 45 Cb 0.08 -1.67 -0.13 0.00 -1.05 0.00 0.00 32.46 29.69 3bwo n ARG 45 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3bwo n THR 47 N -1.73 1.08 -4.68 0.00 -1.04 -0.40 -4.81 114.28 102.69 3bwo n THR 47 Ca 0.01 -0.27 -0.33 0.00 -2.04 0.00 0.00 64.05 61.42 3bwo n THR 47 Cb 0.39 -1.46 -0.13 0.00 -1.82 0.00 0.00 70.33 67.31 3bwo n THR 47 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3bwo s VAL 48 N -0.19 3.32 -0.15 12.58 1.01 -1.26 -5.09 120.40 130.62 3bwo s VAL 48 Ca 0.67 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 62.09 3bwo s VAL 48 Cb -0.65 -2.40 0.01 0.00 0.00 0.00 0.00 36.38 33.34 3bwo s VAL 48 CO 0.51 0.53 -0.21 -0.89 0.00 0.00 0.00 175.10 175.04 3bwo s THR 49 N 0.18 2.10 -0.13 3.92 2.01 -1.26 -5.11 115.64 117.34 3bwo s THR 49 Ca -0.06 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.01 3bwo s THR 49 Cb -0.15 -1.85 0.01 0.00 0.01 0.00 0.00 72.50 70.53 3bwo s THR 49 CO 0.04 0.55 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.67 3bwo s ILE 50 N 0.91 2.04 0.54 1.82 1.01 -1.26 -5.12 121.20 121.14 3bwo s ILE 50 Ca -0.05 -0.98 -0.14 0.00 0.00 0.00 0.00 60.65 59.48 3bwo s ILE 50 Cb -0.15 -1.79 -0.07 0.00 0.01 0.00 0.00 42.46 40.46 3bwo s ILE 50 CO -0.04 0.55 0.99 -0.13 0.00 0.00 0.00 174.94 176.31 3bwo s ARG 51 N 0.71 3.83 0.62 2.79 0.52 -1.26 -4.97 118.95 121.19 3bwo s ARG 51 Ca -0.10 0.87 0.35 0.00 -0.52 0.00 0.00 55.73 56.33 3bwo s ARG 51 Cb -0.16 -2.13 2.01 0.00 0.52 0.00 0.00 34.95 35.19 3bwo s ARG 51 CO 0.01 -0.36 2.26 0.78 0.02 0.00 0.00 175.30 178.01 3bwo h GLY 52 N 0.53 0.00 -1.68 -3.53 0.00 -2.05 -2.57 103.07 93.76 3bwo h GLY 52 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3bwo h GLY 52 CO 0.62 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.16 3bwo s ASP 54 N -1.39 6.35 -1.65 0.00 1.01 -0.97 -4.34 116.67 115.68 3bwo s ASP 54 Ca 0.27 1.22 -0.15 0.00 0.71 0.00 0.00 52.55 54.59 3bwo s ASP 54 Cb 0.17 -2.37 0.13 0.00 1.01 0.00 0.00 42.92 41.86 3bwo s ASP 54 CO 0.24 -0.64 0.74 0.18 0.21 0.00 0.00 175.17 175.91 3bwo n LEU 55 N -2.14 -1.84 -0.03 1.23 4.77 -1.26 -4.90 117.00 112.83 3bwo n LEU 55 Ca 0.04 -0.99 -0.18 0.00 -0.03 0.00 0.00 56.01 54.84 3bwo n LEU 55 Cb 0.54 -2.14 -0.13 0.00 -2.33 0.00 0.00 43.42 39.36 3bwo n LEU 55 CO 0.53 0.33 0.08 0.24 -1.33 0.00 0.00 177.39 177.24 3bwo h MET 56 N -1.60 0.11 -7.15 3.23 2.86 -1.96 -3.47 114.93 106.94 3bwo h MET 56 Ca -0.60 -0.19 -0.54 0.00 -2.06 0.00 0.00 59.70 56.31 3bwo h MET 56 Cb 1.38 0.07 0.18 0.00 0.06 0.00 0.00 31.60 33.29 3bwo h MET 56 CO 0.75 1.09 0.33 0.45 1.06 0.00 0.00 176.91 180.59 3bwo n SER 57 N -4.37 1.12 0.20 1.22 2.88 -1.26 -4.92 113.62 108.50 3bwo n SER 57 Ca -0.16 0.63 0.07 0.00 -1.33 0.00 0.00 58.87 58.08 3bwo n SER 57 Cb 0.65 -1.50 0.42 0.00 -0.75 0.00 0.00 64.21 63.03 3bwo n SER 57 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3bwo h TYR 58 N -0.61 0.00 -2.94 0.66 -1.99 -1.97 -3.44 116.97 106.68 3bwo h TYR 58 Ca -0.47 0.00 -0.63 0.00 2.00 0.00 0.00 58.73 59.63 3bwo h TYR 58 Cb 1.31 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 39.96 3bwo h TYR 58 CO 0.45 0.32 -0.38 -0.06 -0.00 0.00 0.00 178.16 178.49 3bwo s PHE 59 N -3.79 3.59 -0.24 4.88 0.08 -1.26 -4.75 117.98 116.48 3bwo s PHE 59 Ca -0.01 0.65 -0.11 0.00 0.12 0.00 0.00 56.93 57.58 3bwo s PHE 59 Cb 0.12 -2.14 -0.16 0.00 -0.57 0.00 0.00 43.02 40.26 3bwo s PHE 59 CO 0.67 0.56 -0.13 0.43 -0.10 0.00 0.00 175.22 176.66 3bwo n SER 60 N 2.43 1.96 -3.15 1.36 7.64 0.18 -4.97 113.62 119.08 3bwo n SER 60 Ca -0.16 0.23 0.04 0.00 1.01 0.00 0.00 58.87 59.99 3bwo n SER 60 Cb 0.53 -0.76 -0.01 0.00 -1.01 0.00 0.00 64.21 62.97 3bwo n SER 60 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3bwo s ASP 61 N -7.09 -1.24 0.44 6.43 2.15 -0.31 -4.89 116.67 112.17 3bwo s ASP 61 Ca -0.34 0.39 0.12 0.00 0.43 0.00 0.00 52.55 53.15 3bwo s ASP 61 Cb 0.11 1.88 0.98 0.00 -0.30 0.00 0.00 42.92 45.58 3bwo s ASP 61 CO 0.57 -0.23 2.02 0.24 -0.17 0.00 0.00 175.17 177.60 3bwo h MET 62 N 7.89 0.16 0.00 4.34 2.86 -1.94 -2.17 114.93 126.07 3bwo h MET 62 Ca -0.10 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 3bwo h MET 62 Cb 1.18 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.81 3bwo h MET 62 CO 0.12 0.23 0.12 2.41 1.06 0.00 0.00 176.91 180.85 3bwo n THR 63 N -4.39 1.28 -4.44 2.22 -1.04 -1.26 -4.61 114.28 102.04 3bwo n THR 63 Ca -0.01 0.59 -0.33 0.00 -2.04 0.00 0.00 64.05 62.26 3bwo n THR 63 Cb 0.18 -1.59 -0.10 0.00 -1.82 0.00 0.00 70.33 67.00 3bwo n THR 63 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3bwo s ASN 64 N -3.15 4.84 0.14 8.00 3.84 -0.82 -5.02 114.94 122.78 3bwo s ASN 64 Ca -0.01 -0.04 -0.22 0.00 0.21 0.00 0.00 52.86 52.80 3bwo s ASN 64 Cb 0.02 -1.22 0.01 0.00 -0.55 0.00 0.00 41.25 39.51 3bwo s ASN 64 CO 0.06 0.31 1.64 0.25 -2.79 0.00 0.00 177.10 176.58 3bwo h LEU 65 N 4.73 -0.67 -7.78 3.21 5.85 -1.86 -3.06 115.31 115.74 3bwo h LEU 65 Ca -0.49 0.12 -0.72 0.00 0.84 0.00 0.00 57.88 57.63 3bwo h LEU 65 Cb 1.17 0.31 -0.17 0.00 0.37 0.00 0.00 40.66 42.35 3bwo h LEU 65 CO 0.54 -0.25 1.32 0.00 -0.34 0.00 0.00 178.44 179.71 3bwo n TRP 67 N 6.01 0.00 -0.41 0.00 4.27 -1.16 -2.02 117.44 124.13 3bwo n TRP 67 Ca 0.35 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 54.05 3bwo n TRP 67 Cb 0.44 -0.20 0.28 0.00 -1.36 0.00 0.00 31.31 30.47 3bwo n TRP 67 CO 0.00 0.00 0.00 1.97 -2.29 0.00 0.00 177.69 177.37 3bwo n PHE 68 N -1.20 0.94 -3.33 -2.67 -1.74 -1.26 0.51 117.46 108.70 3bwo n PHE 68 Ca 0.07 -0.55 -0.41 0.00 -0.56 0.00 0.00 57.45 56.01 3bwo n PHE 68 Cb 0.09 -0.08 -0.09 0.00 1.52 0.00 0.00 39.48 40.92 3bwo n PHE 68 CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 3bwo s LEU 69 N -1.30 4.37 0.05 5.98 2.96 -0.86 -4.63 118.68 125.25 3bwo s LEU 69 Ca 0.41 -0.10 -0.31 0.00 -0.22 0.00 0.00 54.13 53.92 3bwo s LEU 69 Cb 0.24 -2.45 -0.07 0.00 0.50 0.00 0.00 46.19 44.41 3bwo s LEU 69 CO 0.25 -0.38 1.41 -0.70 -1.32 0.00 0.00 176.35 175.61 3bwo s GLU 70 N 2.17 4.29 0.26 1.98 2.56 -1.26 -4.52 118.70 124.19 3bwo s GLU 70 Ca 0.15 2.03 -0.03 0.00 0.00 0.00 0.00 54.97 57.12 3bwo s GLU 70 Cb -0.16 -3.46 0.54 0.00 2.00 0.00 0.00 34.13 33.05 3bwo s GLU 70 CO 0.12 -0.53 1.65 -1.35 -0.56 0.00 0.00 175.26 174.59 3bwo h PRO 71 N 7.50 0.18 -0.90 4.30 0.11 -1.96 -1.02 132.00 140.20 3bwo h PRO 71 Ca -0.40 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.80 3bwo h PRO 71 Cb 1.19 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.19 3bwo h PRO 71 CO 0.89 0.12 0.58 0.93 -0.21 0.00 0.00 178.00 180.31 3bwo h GLU 72 N 0.19 0.86 -0.17 1.05 5.08 -1.96 -0.96 114.58 118.67 3bwo h GLU 72 Ca 0.46 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.58 3bwo h GLU 72 Cb 0.85 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3bwo h GLU 72 CO -0.62 0.57 -0.66 1.25 -1.00 0.00 0.00 179.01 178.55 3bwo h LEU 73 N 0.89 0.75 -0.45 1.33 5.85 -1.46 -1.96 115.31 120.25 3bwo h LEU 73 Ca 0.42 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 3bwo h LEU 73 Cb 0.43 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 3bwo h LEU 73 CO -0.19 1.21 0.19 -0.08 -0.34 0.00 0.00 178.44 179.23 3bwo h GLU 74 N 0.47 0.67 -0.32 1.25 4.81 -0.85 -1.24 114.58 119.37 3bwo h GLU 74 Ca -0.02 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 3bwo h GLU 74 Cb 1.25 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 3bwo h GLU 74 CO 0.13 0.61 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.57 3bwo h ASP 75 N 0.59 0.56 -0.49 1.04 3.32 -1.18 -2.43 116.42 117.84 3bwo h ASP 75 Ca 0.15 -0.32 0.09 0.00 0.02 0.00 0.00 57.03 56.97 3bwo h ASP 75 Cb 0.18 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 3bwo h ASP 75 CO -0.01 0.74 0.06 0.00 -1.72 0.00 0.00 179.24 178.31 3bwo h ALA 76 N 0.84 0.51 0.07 3.45 0.00 -1.24 0.65 119.26 123.54 3bwo h ALA 76 Ca 0.09 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.13 3bwo h ALA 76 Cb 0.46 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3bwo h ALA 76 CO 0.02 -0.34 -0.10 0.82 0.00 0.00 0.00 179.25 179.64 3bwo h ILE 77 N 0.18 0.76 -0.34 0.00 2.04 -1.12 -0.41 117.51 118.62 3bwo h ILE 77 Ca 0.24 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.09 3bwo h ILE 77 Cb 0.35 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3bwo h ILE 77 CO -0.35 0.00 0.17 0.11 0.00 0.00 0.00 178.15 178.07 3bwo h LYS 78 N -0.21 0.49 -0.61 2.37 1.57 -1.21 -1.00 116.57 117.96 3bwo h LYS 78 Ca 0.02 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3bwo h LYS 78 Cb 0.22 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 3bwo h LYS 78 CO -0.05 0.44 0.37 -0.44 -0.57 0.00 0.00 179.45 179.20 3bwo h ASP 79 N 0.42 0.74 0.15 0.86 3.32 -0.80 -0.73 116.42 120.37 3bwo h ASP 79 Ca 0.12 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3bwo h ASP 79 Cb 0.11 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 3bwo h ASP 79 CO -0.02 0.58 -0.11 0.25 -1.72 0.00 0.00 179.24 178.22 3bwo h LEU 80 N 0.83 -0.29 -1.88 1.55 6.46 -0.64 -0.58 115.31 120.76 3bwo h LEU 80 Ca 0.22 0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.98 3bwo h LEU 80 Cb -0.02 0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.00 3bwo h LEU 80 CO -0.04 -0.18 -0.13 0.45 -0.62 0.00 0.00 178.44 177.92 3bwo h HIS 81 N -0.27 0.00 -0.07 1.25 3.86 -1.07 0.24 115.15 119.08 3bwo h HIS 81 Ca -0.01 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.04 3bwo h HIS 81 Cb 0.24 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 3bwo h HIS 81 CO -0.10 0.13 -0.68 0.78 0.86 0.00 0.00 177.93 178.92 3bwo h GLY 82 N 0.73 0.32 1.34 2.45 0.00 -0.22 0.91 103.07 108.60 3bwo h GLY 82 Ca -0.00 -0.44 -0.31 0.00 0.00 0.00 0.00 47.33 46.58 3bwo h GLY 82 CO 0.02 0.39 -1.45 -2.08 0.00 0.00 0.00 176.54 173.42 3bwo h VAL 83 N 0.21 1.27 0.00 4.60 2.07 -0.48 -3.29 116.25 120.63 3bwo h VAL 83 Ca -0.02 -2.83 -0.16 0.00 0.82 0.00 0.00 66.70 64.51 3bwo h VAL 83 Cb 1.22 2.89 -0.02 0.00 -1.52 0.00 0.00 31.29 33.86 3bwo h VAL 83 CO 0.11 0.85 -0.90 0.58 0.02 0.00 0.00 177.57 178.23 3bwo h VAL 84 N 0.09 1.02 -0.57 2.57 2.07 -0.93 -3.48 116.25 117.02 3bwo h VAL 84 Ca -0.22 -2.53 -0.25 0.00 0.82 0.00 0.00 66.70 64.52 3bwo h VAL 84 Cb 2.05 2.46 -0.10 0.00 -1.52 0.00 0.00 31.29 34.18 3bwo h VAL 84 CO 0.21 0.58 -0.22 0.61 0.02 0.00 0.00 177.57 178.76 3bwo n GLY 85 N 1.31 1.28 0.16 2.17 0.00 0.31 -4.66 105.19 105.77 3bwo n GLY 85 Ca -0.02 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.76 3bwo n GLY 85 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3bwo h ASN 86 N 0.00 0.00 -4.77 1.61 -1.07 -1.86 -3.34 115.58 106.15 3bwo h ASN 86 Ca -0.25 0.00 -0.15 0.00 0.07 0.00 0.00 56.30 55.97 3bwo h ASN 86 Cb 0.86 0.00 -0.22 0.00 -2.07 0.00 0.00 38.32 36.90 3bwo h ASN 86 CO 0.36 0.12 -0.50 0.00 0.07 0.00 0.00 177.43 177.48 3bwo s ALA 87 N -3.21 -0.33 0.08 4.14 0.00 -1.26 -1.27 121.76 119.92 3bwo s ALA 87 Ca 0.03 -0.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.72 3bwo s ALA 87 Cb 0.07 0.05 -0.07 0.00 0.00 0.00 0.00 23.12 23.17 3bwo s ALA 87 CO 0.73 -0.18 0.69 0.00 0.00 0.00 0.00 175.76 177.00 3bwo s ALA 88 N -1.13 3.47 0.00 0.00 0.00 0.10 -4.73 121.76 119.46 3bwo s ALA 88 Ca -0.12 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3bwo s ALA 88 Cb -0.07 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 20.20 3bwo s ALA 88 CO 0.01 0.24 0.25 0.25 0.00 0.00 0.00 175.76 176.51 3bwo n THR 89 N 2.14 0.00 -2.88 0.00 -2.24 -1.26 -4.95 114.28 105.08 3bwo n THR 89 Ca -0.06 -0.44 -0.34 0.00 -2.27 0.00 0.00 64.05 60.94 3bwo n THR 89 Cb 0.50 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.73 3bwo n THR 89 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3bwo s GLU 90 N -0.37 4.25 -1.28 -0.78 1.03 -1.26 -4.30 118.70 115.98 3bwo s GLU 90 Ca 0.00 1.06 -0.02 0.00 0.03 0.00 0.00 54.97 56.04 3bwo s GLU 90 Cb 0.00 -2.37 0.01 0.00 -0.80 0.00 0.00 34.13 30.97 3bwo s GLU 90 CO 0.00 0.08 0.94 -0.25 -1.33 0.00 0.00 175.26 174.70 3bwo n ASP 91 N -0.32 -2.61 -3.50 0.83 10.43 -1.26 -4.99 116.55 115.12 3bwo n ASP 91 Ca 0.05 -0.68 -0.10 0.00 2.57 0.00 0.00 54.79 56.63 3bwo n ASP 91 Cb 0.53 -4.71 -0.03 0.00 1.84 0.00 0.00 41.12 38.75 3bwo n ASP 91 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3bwo s ARG 92 N -5.77 0.87 -0.06 -1.24 1.70 -1.26 -4.76 118.95 108.43 3bwo s ARG 92 Ca 0.13 -0.20 -0.13 0.00 -0.47 0.00 0.00 55.73 55.06 3bwo s ARG 92 Cb -0.06 0.40 -0.05 0.00 -0.57 0.00 0.00 34.95 34.67 3bwo s ARG 92 CO 0.76 -0.36 0.34 0.71 -1.08 0.00 0.00 175.30 175.68 3bwo s TYR 93 N -2.70 3.64 -0.23 5.89 2.02 0.17 -4.86 117.35 121.29 3bwo s TYR 93 Ca 0.02 0.83 -0.12 0.00 -0.37 0.00 0.00 57.07 57.43 3bwo s TYR 93 Cb -0.01 -2.25 -0.05 0.00 -0.40 0.00 0.00 41.96 39.25 3bwo s TYR 93 CO -0.06 0.56 0.21 0.42 -1.57 0.00 0.00 175.55 175.10 3bwo s ILE 94 N -0.67 5.33 -0.10 2.71 1.01 -1.26 -0.18 121.20 128.04 3bwo s ILE 94 Ca 0.21 0.29 0.02 0.00 0.00 0.00 0.00 60.65 61.16 3bwo s ILE 94 Cb -0.15 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.79 3bwo s ILE 94 CO 0.10 0.33 -0.15 -0.69 0.00 0.00 0.00 174.94 174.52 3bwo s VAL 95 N 1.11 1.48 0.11 2.92 1.01 -0.51 -4.74 120.40 121.79 3bwo s VAL 95 Ca 0.10 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.45 3bwo s VAL 95 Cb -0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 3bwo s VAL 95 CO 0.05 0.44 0.27 0.54 0.00 0.00 0.00 175.10 176.39 3bwo s VAL 96 N 0.94 5.33 0.04 2.92 0.11 -1.26 0.13 120.40 128.61 3bwo s VAL 96 Ca -0.08 -0.49 -0.19 0.00 -2.93 0.00 0.00 61.98 58.30 3bwo s VAL 96 Cb -0.15 -3.69 0.04 0.00 -1.53 0.00 0.00 36.38 31.05 3bwo s VAL 96 CO -0.01 0.01 0.44 -0.83 -3.33 0.00 0.00 175.10 171.38 3bwo s GLY 97 N -2.86 -0.31 -0.82 6.54 0.00 -0.00 -4.93 107.32 104.93 3bwo s GLY 97 Ca 0.35 0.40 -0.25 0.00 0.00 0.00 0.00 44.72 45.22 3bwo s GLY 97 CO 0.28 0.13 2.17 -1.08 0.00 0.00 0.00 173.10 174.60 3bwo s THR 98 N -2.39 3.23 0.00 0.90 -1.32 -1.26 -1.70 115.64 113.10 3bwo s THR 98 Ca -0.06 -0.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 3bwo s THR 98 Cb -0.01 -3.51 0.00 0.00 -1.51 0.00 0.00 72.50 67.47 3bwo s THR 98 CO -0.02 -0.48 0.00 0.61 -2.21 0.00 0.00 174.62 172.52 3bwo n GLY 99 N 6.76 -2.31 0.19 6.08 0.00 -0.52 -3.93 105.19 111.45 3bwo n GLY 99 Ca 0.42 -1.43 0.03 0.00 0.00 0.00 0.00 46.02 45.05 3bwo n GLY 99 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3bwo h SER 100 N 0.00 0.00 -0.03 1.61 0.87 -1.80 -2.72 113.55 111.48 3bwo h SER 100 Ca 0.00 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3bwo h SER 100 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3bwo h SER 100 CO 0.00 0.37 0.03 0.00 -0.53 0.00 0.00 176.83 176.69 3bwo h THR 101 N 0.00 0.67 0.10 2.23 1.03 -1.94 -0.42 112.91 114.57 3bwo h THR 101 Ca -0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 66.41 66.10 3bwo h THR 101 Cb 0.67 0.98 -0.01 0.00 -1.07 0.00 0.00 68.15 68.72 3bwo h THR 101 CO 0.05 0.00 -1.50 -0.61 -0.01 0.00 0.00 175.52 173.44 3bwo h GLN 102 N 0.00 0.22 -0.45 0.00 4.15 -1.60 -3.23 115.11 114.20 3bwo h GLN 102 Ca 0.01 -0.37 -0.04 0.00 0.77 0.00 0.00 58.65 59.03 3bwo h GLN 102 Cb 0.07 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.88 3bwo h GLN 102 CO -0.00 1.07 0.14 -0.07 -1.93 0.00 0.00 178.83 178.03 3bwo h LEU 103 N 0.06 0.65 -0.63 -2.39 -0.00 -1.17 -0.28 115.31 111.56 3bwo h LEU 103 Ca -0.23 -0.21 -0.00 0.00 -0.00 0.00 0.00 57.88 57.44 3bwo h LEU 103 Cb 2.00 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 42.46 3bwo h LEU 103 CO 0.15 0.69 0.38 0.00 -0.00 0.00 0.00 178.44 179.66 3bwo h GLN 105 N 0.85 0.91 -0.62 0.00 4.20 -1.54 -0.93 115.11 117.98 3bwo h GLN 105 Ca 0.22 -0.29 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 3bwo h GLN 105 Cb -0.02 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.65 3bwo h GLN 105 CO -0.04 0.94 0.26 0.00 -0.67 0.00 0.00 178.83 179.32 3bwo h ALA 106 N 1.10 0.80 -0.07 3.87 0.00 -0.44 -0.85 119.26 123.67 3bwo h ALA 106 Ca 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3bwo h ALA 106 Cb 0.58 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3bwo h ALA 106 CO 0.03 0.41 0.02 0.00 0.00 0.00 0.00 179.25 179.71 3bwo h ALA 107 N 1.10 0.09 -0.83 0.00 0.00 -0.08 0.10 119.26 119.65 3bwo h ALA 107 Ca 0.21 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3bwo h ALA 107 Cb 0.19 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3bwo h ALA 107 CO -0.02 -0.29 0.54 0.28 0.00 0.00 0.00 179.25 179.76 3bwo h VAL 108 N -0.10 1.13 0.11 0.00 2.07 -1.18 -1.13 116.25 117.15 3bwo h VAL 108 Ca 0.02 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 3bwo h VAL 108 Cb 0.23 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 3bwo h VAL 108 CO -0.00 0.19 -0.05 -0.74 0.02 0.00 0.00 177.57 176.98 3bwo h HIS 109 N 1.02 -0.14 -0.04 1.57 6.17 -0.68 -1.99 115.15 121.06 3bwo h HIS 109 Ca 0.33 -0.00 0.02 0.00 0.71 0.00 0.00 60.37 61.43 3bwo h HIS 109 Cb 0.04 0.05 -0.03 0.00 2.52 0.00 0.00 27.41 29.99 3bwo h HIS 109 CO -0.00 0.16 -0.09 0.00 0.71 0.00 0.00 177.93 178.71 3bwo h ALA 110 N 0.40 -0.06 -1.00 5.26 0.00 -0.46 0.25 119.26 123.66 3bwo h ALA 110 Ca -0.02 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3bwo h ALA 110 Cb 0.36 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 3bwo h ALA 110 CO 0.03 -0.57 0.65 -0.07 0.00 0.00 0.00 179.25 179.28 3bwo h LEU 111 N -0.14 1.07 -0.37 0.00 3.38 -1.23 -0.97 115.31 117.06 3bwo h LEU 111 Ca 0.05 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 3bwo h LEU 111 Cb 0.21 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3bwo h LEU 111 CO -0.12 0.73 -0.53 0.28 0.09 0.00 0.00 178.44 178.88 3bwo h SER 112 N 1.24 0.89 0.89 -0.43 0.02 -0.68 -1.40 113.55 114.08 3bwo h SER 112 Ca 0.40 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3bwo h SER 112 Cb 0.04 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.32 3bwo h SER 112 CO -0.13 1.25 0.00 -1.28 -1.14 0.00 0.00 176.83 175.52 3bwo h SER 113 N 0.62 0.00 -0.02 3.07 0.87 0.12 -2.27 113.55 115.93 3bwo h SER 113 Ca 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3bwo h SER 113 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 3bwo h SER 113 CO 0.12 0.00 -0.13 0.18 -0.53 0.00 0.00 176.83 176.47 3bwo n LEU 114 N -3.06 2.34 -4.79 2.23 4.77 -0.43 -4.99 117.00 113.08 3bwo n LEU 114 Ca 0.00 -0.92 -0.32 0.00 -0.03 0.00 0.00 56.01 54.74 3bwo n LEU 114 Cb 0.27 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3bwo n LEU 114 CO 0.26 0.41 0.72 0.00 -1.33 0.00 0.00 177.39 177.45 3bwo s ALA 115 N -1.79 2.56 0.26 -1.18 0.00 -0.55 -4.96 121.76 116.10 3bwo s ALA 115 Ca 0.20 0.36 0.11 0.00 0.00 0.00 0.00 51.96 52.63 3bwo s ALA 115 Cb 0.16 -3.26 0.35 0.00 0.00 0.00 0.00 23.12 20.38 3bwo s ALA 115 CO 0.32 -1.21 1.61 0.07 0.00 0.00 0.00 175.76 176.55 3bwo h ARG 116 N -0.19 0.00 -4.16 0.00 0.11 -1.91 -3.46 114.38 104.77 3bwo h ARG 116 Ca -0.46 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.49 3bwo h ARG 116 Cb 1.23 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.17 3bwo h ARG 116 CO 0.55 0.62 -0.54 -1.54 0.10 0.00 0.00 179.97 179.16 3bwo s SER 117 N -6.83 0.26 0.08 0.08 1.04 -1.26 -5.17 113.70 101.90 3bwo s SER 117 Ca -0.01 -1.00 0.02 0.00 0.48 0.00 0.00 55.95 55.44 3bwo s SER 117 Cb 0.13 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 3bwo s SER 117 CO 0.76 -0.74 -0.07 -1.10 0.98 0.00 0.00 173.24 173.08 3bwo s GLN 118 N -3.97 0.76 0.16 4.02 -0.21 -1.26 -4.29 119.66 114.87 3bwo s GLN 118 Ca 0.16 -1.22 -0.30 0.00 0.02 0.00 0.00 55.36 54.02 3bwo s GLN 118 Cb 0.06 -0.20 -0.07 0.00 1.00 0.00 0.00 33.01 33.80 3bwo s GLN 118 CO -0.03 -0.01 0.99 -1.25 -2.12 0.00 0.00 175.29 172.87 3bwo s PRO 119 N -3.39 4.71 0.27 2.91 0.04 -1.22 -5.04 135.00 133.29 3bwo s PRO 119 Ca 0.07 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 3bwo s PRO 119 Cb 0.02 -3.33 -0.09 0.00 0.04 0.00 0.00 34.50 31.14 3bwo s PRO 119 CO -0.04 0.25 1.15 0.08 0.04 0.00 0.00 177.00 178.48 3bwo s VAL 120 N -0.33 3.37 0.09 -0.36 1.01 0.15 -4.69 120.40 119.63 3bwo s VAL 120 Ca 0.46 1.34 -0.27 0.00 0.00 0.00 0.00 61.98 63.51 3bwo s VAL 120 Cb -0.25 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.21 3bwo s VAL 120 CO 0.32 0.31 0.85 -0.44 0.00 0.00 0.00 175.10 176.13 3bwo s SER 121 N -0.67 7.35 -0.12 3.32 0.01 -0.85 0.11 113.70 122.86 3bwo s SER 121 Ca 0.46 1.62 0.02 0.00 1.31 0.00 0.00 55.95 59.36 3bwo s SER 121 Cb -0.33 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.37 3bwo s SER 121 CO 0.42 0.01 -0.18 -0.69 0.41 0.00 0.00 173.24 173.22 3bwo s VAL 122 N -0.18 2.64 0.13 3.43 1.01 0.64 0.11 120.40 128.18 3bwo s VAL 122 Ca 0.42 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 3bwo s VAL 122 Cb -0.22 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 3bwo s VAL 122 CO 0.26 0.54 0.11 0.68 0.00 0.00 0.00 175.10 176.70 3bwo s VAL 123 N 0.33 0.11 -0.10 2.92 -7.23 -0.53 -0.01 120.40 115.90 3bwo s VAL 123 Ca -0.14 -1.73 -0.19 0.00 -1.81 0.00 0.00 61.98 58.11 3bwo s VAL 123 Cb -0.17 -1.90 0.04 0.00 0.56 0.00 0.00 36.38 34.91 3bwo s VAL 123 CO 0.07 -0.48 0.47 0.00 -0.31 0.00 0.00 175.10 174.85 3bwo s ALA 124 N -4.00 -1.19 -0.07 1.32 0.00 -0.83 -0.79 121.76 116.19 3bwo s ALA 124 Ca 0.20 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 3bwo s ALA 124 Cb 0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 3bwo s ALA 124 CO -0.01 -0.27 1.43 0.00 0.00 0.00 0.00 175.76 176.91 3bwo s ALA 125 N -0.58 3.62 0.35 0.00 0.00 -1.26 -0.52 121.76 123.36 3bwo s ALA 125 Ca -0.07 0.75 -0.25 0.00 0.00 0.00 0.00 51.96 52.39 3bwo s ALA 125 Cb -0.03 -3.65 -0.09 0.00 0.00 0.00 0.00 23.12 19.34 3bwo s ALA 125 CO 0.04 -1.15 1.01 0.00 0.00 0.00 0.00 175.76 175.67 3bwo s ALA 126 N 3.27 3.17 0.20 0.00 0.00 -1.26 -3.52 121.76 123.62 3bwo s ALA 126 Ca 0.64 0.65 -0.30 0.00 0.00 0.00 0.00 51.96 52.95 3bwo s ALA 126 Cb -0.29 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 3bwo s ALA 126 CO 0.23 -0.05 1.19 -1.25 0.00 0.00 0.00 175.76 175.88 3bwo s PRO 127 N -2.19 4.50 0.44 0.00 0.04 -1.26 -5.04 135.00 131.48 3bwo s PRO 127 Ca 0.53 1.88 0.07 0.00 0.04 0.00 0.00 61.00 63.52 3bwo s PRO 127 Cb -0.22 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.06 3bwo s PRO 127 CO 0.28 -0.06 0.24 -0.59 0.04 0.00 0.00 177.00 176.90 3bwo s PHE 128 N -0.21 2.47 -0.58 0.56 -0.12 0.79 -4.45 117.98 116.44 3bwo s PHE 128 Ca 0.52 -0.62 -0.27 0.00 -0.05 0.00 0.00 56.93 56.51 3bwo s PHE 128 Cb -0.33 -1.98 -0.02 0.00 -0.63 0.00 0.00 43.02 40.06 3bwo s PHE 128 CO 0.38 0.05 1.89 -0.47 -0.05 0.00 0.00 175.22 177.01 3bwo s TYR 129 N -2.61 1.64 0.33 3.49 5.04 -0.32 -4.32 117.35 120.60 3bwo s TYR 129 Ca 0.40 0.82 0.10 0.00 -2.44 0.00 0.00 57.07 55.95 3bwo s TYR 129 Cb 0.02 -4.06 1.00 0.00 0.35 0.00 0.00 41.96 39.26 3bwo s TYR 129 CO 0.22 -2.37 1.56 -1.13 -1.34 0.00 0.00 175.55 172.49 3bwo n SER 130 N 12.74 0.08 0.09 4.32 3.41 -1.26 -0.44 113.62 132.56 3bwo n SER 130 Ca 0.22 1.67 0.20 0.00 -0.26 0.00 0.00 58.87 60.69 3bwo n SER 130 Cb 0.52 -0.69 0.75 0.00 -0.26 0.00 0.00 64.21 64.53 3bwo n SER 130 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3bwo h THR 131 N 0.00 0.50 -0.96 6.66 2.02 -1.89 -0.75 112.91 118.49 3bwo h THR 131 Ca 0.70 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.94 3bwo h THR 131 Cb 1.65 0.72 -0.06 0.00 -1.74 0.00 0.00 68.15 68.72 3bwo h THR 131 CO -0.86 0.00 0.62 1.88 0.37 0.00 0.00 175.52 177.53 3bwo h TYR 132 N 0.00 1.14 0.07 3.16 0.05 -1.15 -2.58 116.97 117.67 3bwo h TYR 132 Ca 0.18 0.03 0.02 0.00 0.05 0.00 0.00 58.73 59.02 3bwo h TYR 132 Cb 0.91 -0.38 -0.05 0.00 1.01 0.00 0.00 36.73 38.22 3bwo h TYR 132 CO 0.00 0.62 -0.36 0.28 -1.05 0.00 0.00 178.16 177.64 3bwo h VAL 133 N 1.14 0.24 -0.17 -2.88 2.07 -1.29 -2.22 116.25 113.13 3bwo h VAL 133 Ca 0.40 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.84 3bwo h VAL 133 Cb 0.12 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3bwo h VAL 133 CO -0.15 0.00 -0.26 1.05 0.02 0.00 0.00 177.57 178.24 3bwo h GLU 134 N -0.56 0.32 0.00 1.57 9.09 -1.66 -2.79 114.58 120.53 3bwo h GLU 134 Ca 0.04 -0.11 -0.00 0.00 0.05 0.00 0.00 59.36 59.34 3bwo h GLU 134 Cb 0.62 -0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 27.69 3bwo h GLU 134 CO -0.24 0.56 -0.02 0.93 0.05 0.00 0.00 179.01 180.28 3bwo h GLU 135 N 0.28 0.00 -0.24 1.06 5.08 -1.07 0.07 114.58 119.76 3bwo h GLU 135 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3bwo h GLU 135 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3bwo h GLU 135 CO 0.04 0.02 0.00 0.25 -1.00 0.00 0.00 179.01 178.32 3bwo n THR 136 N -3.17 1.86 0.00 1.13 -2.24 -0.87 -4.72 114.28 106.27 3bwo n THR 136 Ca -0.01 -1.66 0.00 0.00 -2.27 0.00 0.00 64.05 60.11 3bwo n THR 136 Cb 0.20 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 3bwo n THR 136 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3bwo n THR 137 N -0.35 0.00 0.22 4.28 -1.04 -0.67 -4.28 114.28 112.43 3bwo n THR 137 Ca 0.17 0.00 0.18 0.00 -2.04 0.00 0.00 64.05 62.36 3bwo n THR 137 Cb 0.72 -0.10 0.82 0.00 -1.82 0.00 0.00 70.33 69.94 3bwo n THR 137 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 3bwo h TYR 138 N 0.00 0.00 -0.02 -1.42 -0.00 -1.28 -1.80 116.97 112.46 3bwo h TYR 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3bwo h TYR 138 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.92 3bwo h TYR 138 CO 0.00 0.00 -0.40 1.33 -0.00 0.00 0.00 178.16 179.09 3bwo n VAL 139 N -3.42 0.00 -3.67 -0.90 0.24 -1.26 -5.00 118.33 104.32 3bwo n VAL 139 Ca 0.02 -0.25 -0.24 0.00 -2.04 0.00 0.00 64.34 61.83 3bwo n VAL 139 Cb 0.44 1.11 0.03 0.00 -1.47 0.00 0.00 33.84 33.95 3bwo n VAL 139 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3bwo n ARG 140 N -0.05 -3.27 -3.12 7.34 5.12 -0.68 -4.95 116.66 117.05 3bwo n ARG 140 Ca 0.10 0.57 -0.31 0.00 -1.93 0.00 0.00 57.85 56.28 3bwo n ARG 140 Cb 0.45 -4.85 -0.05 0.00 -1.16 0.00 0.00 32.46 26.85 3bwo n ARG 140 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3bwo s SER 141 N -3.98 6.64 0.00 0.55 0.15 -1.26 -4.98 113.70 110.82 3bwo s SER 141 Ca 0.20 1.12 0.25 0.00 0.70 0.00 0.00 55.95 58.22 3bwo s SER 141 Cb -0.06 -2.31 0.41 0.00 -1.71 0.00 0.00 66.02 62.35 3bwo s SER 141 CO 0.83 -0.24 1.36 0.61 1.20 0.00 0.00 173.24 177.00 3bwo n GLY 142 N -0.65 0.23 0.17 9.45 0.00 -1.26 -4.24 105.19 108.89 3bwo n GLY 142 Ca 0.02 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.39 3bwo n GLY 142 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3bwo h MET 143 N 2.94 0.33 -4.26 1.61 2.86 -1.95 -3.22 114.93 113.24 3bwo h MET 143 Ca 0.00 -0.26 -0.19 0.00 -2.06 0.00 0.00 59.70 57.20 3bwo h MET 143 Cb 0.74 0.05 -0.13 0.00 0.06 0.00 0.00 31.60 32.32 3bwo h MET 143 CO 0.00 0.89 -0.43 1.52 1.06 0.00 0.00 176.91 179.95 3bwo s TYR 144 N -3.64 0.90 -0.19 -0.22 -0.85 -1.26 0.30 117.35 112.39 3bwo s TYR 144 Ca -0.05 -1.16 -0.10 0.00 -0.52 0.00 0.00 57.07 55.24 3bwo s TYR 144 Cb 0.11 -0.29 0.07 0.00 0.38 0.00 0.00 41.96 42.23 3bwo s TYR 144 CO 0.82 -0.79 0.44 0.21 -1.52 0.00 0.00 175.55 174.72 3bwo s LYS 145 N -4.05 0.41 -0.27 -3.49 2.20 0.12 -4.71 119.74 109.96 3bwo s LYS 145 Ca 0.33 0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 56.53 3bwo s LYS 145 Cb 0.04 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 3bwo s LYS 145 CO 0.12 -0.17 1.52 -0.46 -0.36 0.00 0.00 175.35 175.99 3bwo s TRP 146 N 1.64 2.28 -2.13 4.03 -0.11 -1.26 -0.26 118.94 123.12 3bwo s TRP 146 Ca -0.08 0.65 0.22 0.00 1.22 0.00 0.00 56.10 58.11 3bwo s TRP 146 Cb -0.09 -4.00 0.03 0.00 -1.50 0.00 0.00 33.47 27.91 3bwo s TRP 146 CO -0.14 -2.50 1.08 0.39 -4.62 0.00 0.00 176.95 171.17 3bwo n GLU 147 N 7.65 1.47 0.00 5.86 -0.58 0.99 -4.91 120.64 131.11 3bwo n GLU 147 Ca 0.18 -1.15 0.00 0.00 -0.42 0.00 0.00 57.16 55.77 3bwo n GLU 147 Cb 0.46 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 3bwo n GLU 147 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3bwo n GLY 148 N 1.36 -0.32 3.63 0.62 0.00 -1.24 -4.93 105.19 104.30 3bwo n GLY 148 Ca 0.10 -1.34 -0.48 0.00 0.00 0.00 0.00 46.02 44.30 3bwo n GLY 148 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3bwo n ASP 149 N 0.68 2.24 0.10 1.61 2.03 -1.24 -1.96 116.55 120.01 3bwo n ASP 149 Ca 0.00 1.12 -0.05 0.00 0.52 0.00 0.00 54.79 56.38 3bwo n ASP 149 Cb 0.00 -1.31 0.07 0.00 -0.72 0.00 0.00 41.12 39.16 3bwo n ASP 149 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3bwo h ALA 150 N 4.66 0.74 -0.85 -1.67 0.00 -1.13 -3.31 119.26 117.69 3bwo h ALA 150 Ca -0.45 -0.64 0.17 0.00 0.00 0.00 0.00 54.91 53.98 3bwo h ALA 150 Cb 1.30 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 3bwo h ALA 150 CO 0.79 0.85 0.40 -1.49 0.00 0.00 0.00 179.25 179.81 3bwo h TRP 151 N 0.08 0.69 -0.72 0.00 -0.00 -1.85 -0.64 115.95 113.51 3bwo h TRP 151 Ca -0.02 0.04 -0.33 0.00 -0.00 0.00 0.00 58.89 58.58 3bwo h TRP 151 Cb 1.30 -0.18 -0.20 0.00 -0.00 0.00 0.00 29.16 30.08 3bwo h TRP 151 CO 0.01 0.09 0.33 0.41 -0.00 0.00 0.00 178.44 179.29 3bwo n GLY 152 N -1.33 4.44 3.59 1.49 0.00 -1.25 -4.95 105.19 107.19 3bwo n GLY 152 Ca 0.18 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.68 3bwo n GLY 152 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3bwo s PHE 153 N -3.20 3.23 -0.01 1.61 2.19 -0.25 -4.87 117.98 116.68 3bwo s PHE 153 Ca 0.52 0.42 0.01 0.00 0.33 0.00 0.00 56.93 58.21 3bwo s PHE 153 Cb 0.44 -2.79 0.02 0.00 -1.31 0.00 0.00 43.02 39.38 3bwo s PHE 153 CO 0.08 -0.38 0.72 -0.40 1.83 0.00 0.00 175.22 177.07 3bwo n ASP 154 N 5.60 0.41 -4.65 6.13 3.85 -1.26 -5.05 116.55 121.58 3bwo n ASP 154 Ca -0.05 -1.49 -0.31 0.00 -0.71 0.00 0.00 54.79 52.23 3bwo n ASP 154 Cb 0.50 -0.07 0.18 0.00 -1.35 0.00 0.00 41.12 40.37 3bwo n ASP 154 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3bwo s LYS 155 N -0.31 0.80 0.30 0.11 1.02 -1.26 -5.02 119.74 115.38 3bwo s LYS 155 Ca 0.02 1.48 0.08 0.00 0.02 0.00 0.00 55.97 57.57 3bwo s LYS 155 Cb 0.02 -1.71 -0.04 0.00 -0.52 0.00 0.00 37.83 35.58 3bwo s LYS 155 CO 0.00 -2.76 0.18 -1.59 -0.92 0.00 0.00 175.35 170.26 3bwo s LYS 156 N -4.63 2.64 0.00 1.68 0.00 -1.26 -5.04 119.74 113.14 3bwo s LYS 156 Ca 0.67 -1.29 0.00 0.00 0.00 0.00 0.00 55.97 55.35 3bwo s LYS 156 Cb -0.23 -2.39 0.00 0.00 0.00 0.00 0.00 37.83 35.21 3bwo s LYS 156 CO 0.59 0.25 0.00 0.41 0.00 0.00 0.00 175.35 176.60 3bwo n GLY 157 N -1.18 0.87 3.74 0.59 0.00 -1.26 -5.01 105.19 102.95 3bwo n GLY 157 Ca -0.05 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 3bwo n GLY 157 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3bwo s PRO 158 N -1.33 4.19 0.12 1.61 0.02 -1.26 -4.79 135.00 133.57 3bwo s PRO 158 Ca 0.00 2.44 -0.04 0.00 0.02 0.00 0.00 61.00 63.42 3bwo s PRO 158 Cb 0.00 -3.09 -0.03 0.00 0.02 0.00 0.00 34.50 31.40 3bwo s PRO 158 CO 0.00 -0.58 0.11 1.52 -0.33 0.00 0.00 177.00 177.73 3bwo s TYR 159 N 0.46 0.62 -0.11 6.54 1.13 -1.26 -2.00 117.35 122.73 3bwo s TYR 159 Ca 0.65 -1.03 0.02 0.00 -1.41 0.00 0.00 57.07 55.31 3bwo s TYR 159 Cb -0.45 -0.32 0.01 0.00 -1.10 0.00 0.00 41.96 40.10 3bwo s TYR 159 CO 0.40 -0.55 -0.17 0.42 -2.51 0.00 0.00 175.55 173.14 3bwo s ILE 160 N -3.99 1.61 -0.21 -3.49 1.01 0.31 -0.27 121.20 116.16 3bwo s ILE 160 Ca 0.18 -0.72 -0.06 0.00 0.00 0.00 0.00 60.65 60.05 3bwo s ILE 160 Cb 0.06 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 3bwo s ILE 160 CO -0.02 0.46 0.02 -0.70 0.00 0.00 0.00 174.94 174.71 3bwo s GLU 161 N 0.86 3.67 -0.27 2.79 2.12 -0.09 -1.45 118.70 126.34 3bwo s GLU 161 Ca -0.09 -0.49 -0.19 0.00 0.36 0.00 0.00 54.97 54.57 3bwo s GLU 161 Cb -0.15 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.07 3bwo s GLU 161 CO 0.00 0.01 0.56 -0.51 -0.54 0.00 0.00 175.26 174.78 3bwo s LEU 162 N 1.03 4.07 -0.21 2.70 1.43 0.03 -1.56 118.68 126.18 3bwo s LEU 162 Ca 0.03 0.55 -0.00 0.00 -1.03 0.00 0.00 54.13 53.67 3bwo s LEU 162 Cb -0.14 -2.73 0.02 0.00 0.03 0.00 0.00 46.19 43.37 3bwo s LEU 162 CO 0.02 -0.33 -0.14 -0.69 0.23 0.00 0.00 176.35 175.44 3bwo s VAL 163 N 2.39 2.47 -0.19 -1.59 1.01 -0.20 -4.37 120.40 119.92 3bwo s VAL 163 Ca 0.23 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 3bwo s VAL 163 Cb -0.16 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 3bwo s VAL 163 CO 0.09 0.42 0.03 -0.89 0.00 0.00 0.00 175.10 174.75 3bwo s THR 164 N 1.32 4.34 -0.26 3.92 2.01 -1.26 -0.10 115.64 125.61 3bwo s THR 164 Ca 0.03 -0.19 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 3bwo s THR 164 Cb -0.14 -2.96 0.14 0.00 0.01 0.00 0.00 72.50 69.55 3bwo s THR 164 CO -0.09 0.44 0.48 -0.55 -0.69 0.00 0.00 174.62 174.21 3bwo s SER 165 N 0.74 -0.51 0.24 3.53 0.15 -0.88 -2.55 113.70 114.42 3bwo s SER 165 Ca 0.02 0.70 -0.31 0.00 0.70 0.00 0.00 55.95 57.05 3bwo s SER 165 Cb -0.14 1.62 -0.13 0.00 -1.71 0.00 0.00 66.02 65.66 3bwo s SER 165 CO 0.02 -0.27 1.44 -2.65 1.20 0.00 0.00 173.24 172.99 3bwo n PRO 166 N 5.40 2.11 -1.86 5.44 -0.02 -1.26 -4.22 135.00 140.59 3bwo n PRO 166 Ca -0.04 0.75 -0.34 0.00 -2.02 0.00 0.00 63.50 61.85 3bwo n PRO 166 Cb 0.50 -2.43 0.04 0.00 -0.02 0.00 0.00 33.50 31.59 3bwo n PRO 166 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3bwo s ASN 167 N 0.38 5.17 -0.18 2.55 2.47 -0.83 -4.65 114.94 119.83 3bwo s ASN 167 Ca 0.69 2.10 -0.02 0.00 0.42 0.00 0.00 52.86 56.05 3bwo s ASN 167 Cb -0.64 -2.56 -0.01 0.00 -1.45 0.00 0.00 41.25 36.59 3bwo s ASN 167 CO 0.48 -1.59 -0.08 0.21 -3.72 0.00 0.00 177.10 172.39 3bwo s ASN 168 N -2.28 4.14 -0.04 -4.21 3.84 -1.26 0.29 114.94 115.43 3bwo s ASN 168 Ca 0.70 -0.37 0.11 0.00 0.21 0.00 0.00 52.86 53.50 3bwo s ASN 168 Cb -0.23 -1.68 -0.23 0.00 -0.55 0.00 0.00 41.25 38.56 3bwo s ASN 168 CO 0.38 0.06 0.69 1.55 -2.79 0.00 0.00 177.10 176.99 3bwo h PRO 169 N 7.52 0.02 0.00 0.43 0.13 -1.78 -0.84 132.00 137.48 3bwo h PRO 169 Ca -0.36 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 3bwo h PRO 169 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3bwo h PRO 169 CO 0.59 0.58 0.00 -0.40 -0.23 0.00 0.00 178.00 178.54 3bwo n ASP 170 N -3.10 0.49 -0.66 1.44 5.68 -1.25 -4.38 116.55 114.77 3bwo n ASP 170 Ca -0.17 0.62 -0.08 0.00 -0.50 0.00 0.00 54.79 54.67 3bwo n ASP 170 Cb 1.04 -0.73 -0.03 0.00 -1.14 0.00 0.00 41.12 40.27 3bwo n ASP 170 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3bwo n GLY 171 N -0.02 0.82 3.74 6.12 0.00 0.15 -4.81 105.19 111.18 3bwo n GLY 171 Ca 0.02 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 3bwo n GLY 171 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bwo s THR 172 N -2.31 4.57 0.16 2.61 2.01 -1.26 -4.23 115.64 117.19 3bwo s THR 172 Ca 0.00 1.86 -0.31 0.00 0.31 0.00 0.00 61.69 63.55 3bwo s THR 172 Cb 0.00 -4.22 -0.10 0.00 0.01 0.00 0.00 72.50 68.19 3bwo s THR 172 CO 0.00 0.36 1.55 -0.63 -0.69 0.00 0.00 174.62 175.21 3bwo s ILE 173 N -0.17 2.68 0.31 1.82 -1.09 -1.26 -1.97 121.20 121.52 3bwo s ILE 173 Ca 0.42 0.49 0.04 0.00 -2.23 0.00 0.00 60.65 59.37 3bwo s ILE 173 Cb -0.22 -3.31 -0.06 0.00 -1.58 0.00 0.00 42.46 37.28 3bwo s ILE 173 CO 0.27 0.04 0.05 -0.13 -1.23 0.00 0.00 174.94 173.94 3bwo s ARG 174 N 1.11 1.60 0.23 2.79 0.52 -1.26 -4.98 118.95 118.96 3bwo s ARG 174 Ca 0.69 -1.87 -0.14 0.00 -0.52 0.00 0.00 55.73 53.89 3bwo s ARG 174 Cb -0.43 -0.80 0.01 0.00 0.52 0.00 0.00 34.95 34.24 3bwo s ARG 174 CO 0.31 -0.18 0.49 -1.21 0.02 0.00 0.00 175.30 174.73 3bwo s GLU 175 N -3.89 1.48 0.01 3.54 2.02 -1.26 -4.88 118.70 115.72 3bwo s GLU 175 Ca 0.36 -1.11 -0.32 0.00 0.02 0.00 0.00 54.97 53.91 3bwo s GLU 175 Cb 0.08 0.49 -0.11 0.00 0.10 0.00 0.00 34.13 34.69 3bwo s GLU 175 CO 0.15 -0.62 1.87 0.25 0.02 0.00 0.00 175.26 176.93 3bwo n THR 176 N -0.36 0.54 -0.29 3.63 -2.24 -1.26 -4.86 114.28 109.44 3bwo n THR 176 Ca -0.05 -0.10 0.10 0.00 -2.27 0.00 0.00 64.05 61.73 3bwo n THR 176 Cb 0.62 -2.02 0.32 0.00 -2.10 0.00 0.00 70.33 67.15 3bwo n THR 176 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3bwo n VAL 177 N 5.02 1.26 0.00 2.28 0.24 -1.26 -5.21 118.33 120.66 3bwo n VAL 177 Ca 0.20 -0.99 0.00 0.00 -2.04 0.00 0.00 64.34 61.51 3bwo n VAL 177 Cb 0.34 0.29 0.00 0.00 -1.47 0.00 0.00 33.84 33.01 3bwo n VAL 177 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 3bwo n VAL 178 N 1.30 0.00 0.00 3.34 3.14 -1.26 -4.75 118.33 120.10 3bwo n VAL 178 Ca 0.23 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.61 3bwo n VAL 178 Cb 0.69 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.47 3bwo n VAL 178 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3bwo n ALA 186 N -3.00 0.00 -2.39 1.55 0.00 -1.26 -5.20 120.51 110.22 3bwo n ALA 186 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 3bwo n ALA 186 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 3bwo n ALA 186 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3bwo s LYS 187 N -0.26 1.45 -0.03 0.00 -0.14 0.62 -4.95 119.74 116.44 3bwo s LYS 187 Ca 0.00 -1.69 -0.02 0.00 -1.36 0.00 0.00 55.97 52.89 3bwo s LYS 187 Cb 0.00 -1.14 0.01 0.00 -1.68 0.00 0.00 37.83 35.02 3bwo s LYS 187 CO 0.00 0.11 0.07 0.54 -0.76 0.00 0.00 175.35 175.31 3bwo s VAL 188 N -3.00 -0.01 -0.13 3.17 0.11 -1.26 -0.91 120.40 118.38 3bwo s VAL 188 Ca 0.26 0.03 0.01 0.00 -2.93 0.00 0.00 61.98 59.35 3bwo s VAL 188 Cb 0.02 -0.12 -0.01 0.00 -1.53 0.00 0.00 36.38 34.74 3bwo s VAL 188 CO 0.10 0.01 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.08 3bwo s ILE 189 N 0.19 2.67 -0.23 7.04 1.01 -0.60 -4.48 121.20 126.81 3bwo s ILE 189 Ca -0.01 -0.79 -0.09 0.00 0.00 0.00 0.00 60.65 59.75 3bwo s ILE 189 Cb -0.02 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 3bwo s ILE 189 CO -0.01 0.53 0.12 -1.00 0.00 0.00 0.00 174.94 174.58 3bwo s HIS 190 N 0.47 3.25 -0.48 3.97 3.76 -0.48 -1.03 115.29 124.74 3bwo s HIS 190 Ca -0.12 0.05 -0.09 0.00 -0.15 0.00 0.00 55.06 54.76 3bwo s HIS 190 Cb -0.16 -2.22 0.12 0.00 1.11 0.00 0.00 32.58 31.43 3bwo s HIS 190 CO 0.05 -0.00 0.35 0.34 -0.85 0.00 0.00 174.74 174.63 3bwo s ASP 191 N 1.01 5.68 -0.74 1.40 -1.08 0.86 -0.49 116.67 123.31 3bwo s ASP 191 Ca 0.06 -1.98 -0.02 0.00 -0.52 0.00 0.00 52.55 50.09 3bwo s ASP 191 Cb -0.14 -2.00 0.40 0.00 -1.46 0.00 0.00 42.92 39.73 3bwo s ASP 191 CO 0.04 -0.67 1.99 0.49 0.52 0.00 0.00 175.17 177.54 3bwo n PHE 192 N 4.81 3.11 -0.06 -5.34 3.72 -0.16 -2.06 117.46 121.47 3bwo n PHE 192 Ca -0.06 -2.68 0.15 0.00 -0.05 0.00 0.00 57.45 54.81 3bwo n PHE 192 Cb 0.41 -1.27 0.56 0.00 -0.94 0.00 0.00 39.48 38.24 3bwo n PHE 192 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3bwo h ALA 193 N 2.50 2.18 -0.19 4.37 0.00 -1.84 -2.46 119.26 123.82 3bwo h ALA 193 Ca 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.48 3bwo h ALA 193 Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3bwo h ALA 193 CO 1.49 -0.33 0.00 0.66 0.00 0.00 0.00 179.25 181.07 3bwo n TYR 194 N -4.45 0.29 -1.62 0.00 4.01 -1.26 -4.63 117.16 109.50 3bwo n TYR 194 Ca 0.10 -0.55 -0.41 0.00 -0.16 0.00 0.00 57.90 56.88 3bwo n TYR 194 Cb 0.46 -0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.42 3bwo n TYR 194 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3bwo n TYR 195 N -0.04 3.10 -4.16 -0.72 9.36 -0.93 -4.54 117.16 119.24 3bwo n TYR 195 Ca 0.08 -3.01 -0.14 0.00 3.32 0.00 0.00 57.90 58.15 3bwo n TYR 195 Cb 0.40 -2.49 -0.11 0.00 -0.63 0.00 0.00 39.34 36.51 3bwo n TYR 195 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 3bwo s TRP 196 N 2.59 1.01 0.50 2.98 0.52 -1.26 -4.96 118.94 120.32 3bwo s TRP 196 Ca 0.55 -0.62 0.34 0.00 0.02 0.00 0.00 56.10 56.39 3bwo s TRP 196 Cb 0.15 -0.56 1.47 0.00 -1.15 0.00 0.00 33.47 33.38 3bwo s TRP 196 CO -0.08 -0.01 1.72 -1.35 0.02 0.00 0.00 176.95 177.25 3bwo h PRO 197 N 3.77 0.09 -0.01 4.98 0.11 -1.89 0.45 132.00 139.51 3bwo h PRO 197 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3bwo h PRO 197 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3bwo h PRO 197 CO 0.50 0.06 -0.04 -2.39 -0.21 0.00 0.00 178.00 175.92 3bwo n HIS 198 N -4.33 0.00 -0.04 0.65 1.44 -1.26 -3.98 115.22 107.70 3bwo n HIS 198 Ca 0.31 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.98 3bwo n HIS 198 Cb 1.36 -0.06 -0.05 0.00 0.12 0.00 0.00 29.99 31.36 3bwo n HIS 198 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3bwo n TYR 199 N -0.59 0.00 -3.50 -1.40 4.01 0.12 -4.10 117.16 111.69 3bwo n TYR 199 Ca 0.19 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.79 3bwo n TYR 199 Cb 0.25 -0.34 -0.04 0.00 -0.31 0.00 0.00 39.34 38.90 3bwo n TYR 199 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3bwo s THR 200 N -2.17 0.00 0.24 -0.72 -1.32 -0.99 -1.16 115.64 109.52 3bwo s THR 200 Ca -0.07 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.11 3bwo s THR 200 Cb 0.03 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.92 3bwo s THR 200 CO 0.24 0.00 1.26 -2.16 -2.21 0.00 0.00 174.62 171.75 3bwo s PRO 201 N -2.13 4.44 -0.82 7.08 0.04 -1.26 -3.86 135.00 138.48 3bwo s PRO 201 Ca -0.04 2.03 -0.25 0.00 0.04 0.00 0.00 61.00 62.78 3bwo s PRO 201 Cb -0.00 -3.17 0.05 0.00 0.04 0.00 0.00 34.50 31.41 3bwo s PRO 201 CO -0.00 -0.14 1.27 0.42 0.04 0.00 0.00 177.00 178.59 3bwo s ILE 202 N -0.41 3.94 0.12 0.56 -1.09 -1.26 -4.82 121.20 118.23 3bwo s ILE 202 Ca 0.52 -0.18 -0.02 0.00 -2.23 0.00 0.00 60.65 58.74 3bwo s ILE 202 Cb -0.36 -4.92 -0.22 0.00 -1.58 0.00 0.00 42.46 35.39 3bwo s ILE 202 CO 0.42 -1.80 1.26 0.71 -1.23 0.00 0.00 174.94 174.30 3bwo h THR 203 N 6.23 1.49 -3.19 2.92 1.35 -1.93 -1.00 112.91 118.78 3bwo h THR 203 Ca -0.11 -2.81 -0.13 0.00 -0.55 0.00 0.00 66.41 62.82 3bwo h THR 203 Cb 1.04 2.67 -0.20 0.00 -1.73 0.00 0.00 68.15 69.93 3bwo h THR 203 CO 1.30 0.82 -0.35 0.00 -0.25 0.00 0.00 175.52 177.04 3bwo s ARG 204 N -2.97 0.60 -1.05 4.72 1.70 -1.26 -4.82 118.95 115.86 3bwo s ARG 204 Ca -0.04 -0.24 -0.21 0.00 -0.47 0.00 0.00 55.73 54.78 3bwo s ARG 204 Cb 0.09 0.26 0.08 0.00 -0.57 0.00 0.00 34.95 34.81 3bwo s ARG 204 CO 0.86 -0.16 1.42 0.50 -1.08 0.00 0.00 175.30 176.84 3bwo s ARG 205 N -1.30 3.69 0.22 3.89 3.52 -1.25 -4.77 118.95 122.95 3bwo s ARG 205 Ca -0.14 -1.50 -0.27 0.00 -0.13 0.00 0.00 55.73 53.69 3bwo s ARG 205 Cb -0.06 -5.27 -0.17 0.00 -1.56 0.00 0.00 34.95 27.90 3bwo s ARG 205 CO 0.03 -2.09 0.53 1.04 -0.81 0.00 0.00 175.30 174.00 3bwo n GLN 206 N 8.07 0.11 -2.91 5.12 1.13 -0.40 -4.46 117.38 124.05 3bwo n GLN 206 Ca 0.34 0.04 -0.14 0.00 -1.94 0.00 0.00 57.00 55.30 3bwo n GLN 206 Cb 0.49 -1.07 0.01 0.00 0.11 0.00 0.00 30.24 29.78 3bwo n GLN 206 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3bwo n ASP 207 N 1.95 -1.70 -4.96 1.08 2.03 -1.26 -0.72 116.55 112.96 3bwo n ASP 207 Ca 0.17 -3.14 -0.24 0.00 0.52 0.00 0.00 54.79 52.10 3bwo n ASP 207 Cb 0.27 0.95 0.03 0.00 -0.72 0.00 0.00 41.12 41.64 3bwo n ASP 207 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 3bwo s HIS 208 N -0.09 1.35 0.16 -0.67 3.76 -1.26 -5.05 115.29 113.49 3bwo s HIS 208 Ca 0.32 -0.85 -0.02 0.00 -0.15 0.00 0.00 55.06 54.37 3bwo s HIS 208 Cb 0.22 -2.00 0.01 0.00 1.11 0.00 0.00 32.58 31.92 3bwo s HIS 208 CO -0.18 -0.84 1.39 -0.44 -0.85 0.00 0.00 174.74 173.83 3bwo h ASP 209 N 0.45 0.48 -3.20 1.40 3.32 -1.88 -3.42 116.42 113.57 3bwo h ASP 209 Ca -0.33 -0.34 -0.51 0.00 0.02 0.00 0.00 57.03 55.88 3bwo h ASP 209 Cb 1.30 -0.14 -0.40 0.00 0.22 0.00 0.00 39.33 40.31 3bwo h ASP 209 CO 0.50 1.10 -0.76 -0.63 -1.72 0.00 0.00 179.24 177.73 3bwo s ILE 210 N -3.48 0.36 -0.14 0.35 1.01 -1.25 -1.84 121.20 116.21 3bwo s ILE 210 Ca -0.05 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.12 3bwo s ILE 210 Cb 0.10 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.64 3bwo s ILE 210 CO 0.85 -0.26 -0.22 -0.04 0.00 0.00 0.00 174.94 175.26 3bwo s MET 211 N 1.93 3.02 -0.09 2.79 -1.94 -0.89 -1.38 119.30 122.73 3bwo s MET 211 Ca 0.01 -0.85 -0.03 0.00 -1.71 0.00 0.00 55.69 53.10 3bwo s MET 211 Cb -0.17 -2.43 -0.04 0.00 2.01 0.00 0.00 34.83 34.20 3bwo s MET 211 CO -0.10 -0.02 0.06 -0.51 -0.01 0.00 0.00 175.02 174.44 3bwo s LEU 212 N 0.82 3.88 -0.03 -0.03 1.02 0.36 -0.28 118.68 124.42 3bwo s LEU 212 Ca -0.07 0.25 -0.03 0.00 0.02 0.00 0.00 54.13 54.31 3bwo s LEU 212 Cb -0.15 -1.95 0.01 0.00 0.02 0.00 0.00 46.19 44.11 3bwo s LEU 212 CO -0.02 0.38 0.07 -0.36 0.02 0.00 0.00 176.35 176.44 3bwo s PHE 213 N -0.97 -0.07 -0.09 0.29 0.08 -0.73 -0.99 117.98 115.51 3bwo s PHE 213 Ca 0.15 0.16 0.04 0.00 0.12 0.00 0.00 56.93 57.40 3bwo s PHE 213 Cb -0.12 0.02 -0.01 0.00 -0.57 0.00 0.00 43.02 42.35 3bwo s PHE 213 CO 0.04 -0.05 -0.23 -0.08 -0.10 0.00 0.00 175.22 174.80 3bwo s THR 214 N -0.06 2.22 0.41 0.64 -1.32 -1.26 -1.34 115.64 114.93 3bwo s THR 214 Ca -0.01 -0.98 0.14 0.00 -1.21 0.00 0.00 61.69 59.63 3bwo s THR 214 Cb -0.01 -1.85 0.15 0.00 -1.51 0.00 0.00 72.50 69.28 3bwo s THR 214 CO 0.00 0.56 1.92 0.15 -2.21 0.00 0.00 174.62 175.04 3bwo h PHE 215 N 6.47 0.00 0.00 9.09 -0.00 -1.51 -3.27 116.94 127.73 3bwo h PHE 215 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.72 3bwo h PHE 215 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 3bwo h PHE 215 CO 0.46 0.26 0.00 0.43 -0.00 0.00 0.00 178.31 179.46 3bwo n SER 216 N -4.20 0.00 0.00 0.41 7.64 -1.26 -3.00 113.62 113.22 3bwo n SER 216 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 3bwo n SER 216 Cb 0.31 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 3bwo n SER 216 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3bwo n ILE 218 N -0.26 0.00 0.18 0.44 5.41 -1.23 -1.23 119.36 122.67 3bwo n ILE 218 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.86 3bwo n ILE 218 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 38.89 3bwo n ILE 218 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3bwo n THR 219 N 0.00 0.34 0.00 1.39 -2.24 -1.16 -4.96 114.28 107.65 3bwo n THR 219 Ca 0.00 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 3bwo n THR 219 Cb 0.00 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 3bwo n THR 219 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bwo n GLY 220 N 1.25 0.73 3.06 3.38 0.00 -0.37 -4.69 105.19 108.55 3bwo n GLY 220 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3bwo n GLY 220 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3bwo n HIS 221 N -1.36 3.79 0.09 1.61 8.25 -1.22 -4.68 115.22 121.71 3bwo n HIS 221 Ca 0.00 -2.96 -0.04 0.00 -0.26 0.00 0.00 57.72 54.46 3bwo n HIS 221 Cb 0.00 -2.29 -0.00 0.00 1.12 0.00 0.00 29.99 28.82 3bwo n HIS 221 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3bwo h ALA 222 N 6.39 0.59 0.00 -1.41 0.00 -1.86 -3.15 119.26 119.82 3bwo h ALA 222 Ca 0.44 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3bwo h ALA 222 Cb 0.72 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3bwo h ALA 222 CO 1.61 1.03 0.00 0.41 0.00 0.00 0.00 179.25 182.30 3bwo n GLY 223 N 0.95 -0.75 0.07 0.00 0.00 -1.26 -1.90 105.19 102.31 3bwo n GLY 223 Ca -0.00 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3bwo n GLY 223 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3bwo n SER 224 N -1.37 0.72 -3.67 1.61 7.64 -1.19 -4.98 113.62 112.38 3bwo n SER 224 Ca 0.04 0.23 -0.31 0.00 1.01 0.00 0.00 58.87 59.84 3bwo n SER 224 Cb 0.11 -0.08 0.04 0.00 -1.01 0.00 0.00 64.21 63.27 3bwo n SER 224 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3bwo n ARG 225 N -2.13 -1.26 -4.24 1.43 3.00 -0.80 -4.84 116.66 107.82 3bwo n ARG 225 Ca 0.04 0.46 -0.23 0.00 -0.01 0.00 0.00 57.85 58.12 3bwo n ARG 225 Cb 0.43 -4.16 -0.17 0.00 0.00 0.00 0.00 32.46 28.57 3bwo n ARG 225 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 3bwo s ILE 226 N -3.46 0.81 0.03 0.55 -1.09 -1.26 -1.44 121.20 115.33 3bwo s ILE 226 Ca 0.47 -0.25 -0.12 0.00 -2.23 0.00 0.00 60.65 58.52 3bwo s ILE 226 Cb -0.17 -0.80 0.02 0.00 -1.58 0.00 0.00 42.46 39.93 3bwo s ILE 226 CO 0.86 0.30 0.27 -0.83 -1.23 0.00 0.00 174.94 174.30 3bwo s GLY 227 N 1.02 -0.08 0.04 6.18 0.00 -0.69 -1.21 107.32 112.59 3bwo s GLY 227 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.62 3bwo s GLY 227 CO -0.00 -0.22 -0.04 0.66 0.00 0.00 0.00 173.10 173.50 3bwo s TRP 228 N -2.27 0.44 -0.02 1.90 -2.14 -0.45 -0.82 118.94 115.57 3bwo s TRP 228 Ca -0.07 -0.69 0.07 0.00 2.66 0.00 0.00 56.10 58.07 3bwo s TRP 228 Cb -0.02 -0.30 -0.02 0.00 -3.10 0.00 0.00 33.47 30.03 3bwo s TRP 228 CO -0.02 -0.22 -0.23 0.00 -2.66 0.00 0.00 176.95 173.83 3bwo s ALA 229 N -2.24 1.88 -0.38 2.67 0.00 0.35 -1.77 121.76 122.27 3bwo s ALA 229 Ca -0.07 -0.97 -0.13 0.00 0.00 0.00 0.00 51.96 50.79 3bwo s ALA 229 Cb -0.04 -0.49 0.02 0.00 0.00 0.00 0.00 23.12 22.61 3bwo s ALA 229 CO -0.03 0.45 0.25 -0.51 0.00 0.00 0.00 175.76 175.92 3bwo s LEU 230 N -0.49 4.84 -0.11 0.00 1.43 0.61 -1.42 118.68 123.55 3bwo s LEU 230 Ca 0.08 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.34 3bwo s LEU 230 Cb -0.09 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 3bwo s LEU 230 CO -0.01 -0.39 -0.15 -0.69 0.23 0.00 0.00 176.35 175.34 3bwo s VAL 231 N 1.64 2.86 -0.17 -1.59 1.01 0.75 -2.09 120.40 122.81 3bwo s VAL 231 Ca 0.04 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 61.04 3bwo s VAL 231 Cb -0.19 -2.17 -0.23 0.00 0.00 0.00 0.00 36.38 33.80 3bwo s VAL 231 CO 0.09 0.54 0.47 0.11 0.00 0.00 0.00 175.10 176.31 3bwo h LYS 232 N 6.43 0.03 -6.35 2.72 1.57 -1.66 0.50 116.57 119.81 3bwo h LYS 232 Ca -0.29 -0.05 -0.57 0.00 -1.87 0.00 0.00 60.65 57.88 3bwo h LYS 232 Cb 1.20 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.49 3bwo h LYS 232 CO 0.53 1.02 1.02 0.34 -0.57 0.00 0.00 179.45 181.79 3bwo s ASP 233 N -6.63 6.56 0.35 0.86 -1.08 -1.26 -4.74 116.67 110.73 3bwo s ASP 233 Ca -0.24 1.26 0.03 0.00 -0.52 0.00 0.00 52.55 53.09 3bwo s ASP 233 Cb 0.02 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 39.60 3bwo s ASP 233 CO 0.65 -1.16 1.97 0.50 0.52 0.00 0.00 175.17 177.65 3bwo h LYS 234 N 9.80 0.83 -0.21 4.34 3.64 -1.99 -1.41 116.57 131.56 3bwo h LYS 234 Ca -0.28 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.02 3bwo h LYS 234 Cb 1.11 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3bwo h LYS 234 CO 1.03 0.55 0.03 1.49 -2.27 0.00 0.00 179.45 180.28 3bwo h GLU 235 N 0.85 0.35 -0.19 1.90 4.57 -1.99 -0.10 114.58 119.96 3bwo h GLU 235 Ca 0.29 -0.10 0.01 0.00 -1.18 0.00 0.00 59.36 58.39 3bwo h GLU 235 Cb 0.08 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 3bwo h GLU 235 CO -0.08 0.50 0.09 0.28 -1.18 0.00 0.00 179.01 178.62 3bwo h VAL 236 N 0.14 0.99 -0.11 0.32 2.07 -1.82 -1.91 116.25 115.92 3bwo h VAL 236 Ca 0.06 -0.07 0.04 0.00 0.82 0.00 0.00 66.70 67.56 3bwo h VAL 236 Cb 0.33 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 3bwo h VAL 236 CO 0.00 0.04 -0.16 0.00 0.02 0.00 0.00 177.57 177.47 3bwo h ALA 237 N 1.10 -0.10 -0.31 1.67 0.00 -1.12 -0.10 119.26 120.41 3bwo h ALA 237 Ca 0.08 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.10 3bwo h ALA 237 Cb 0.03 0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 3bwo h ALA 237 CO -0.06 -0.62 -0.25 -0.22 0.00 0.00 0.00 179.25 178.10 3bwo h LYS 238 N -0.21 -0.21 -0.87 0.00 3.64 -0.79 0.03 116.57 118.16 3bwo h LYS 238 Ca 0.09 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 3bwo h LYS 238 Cb 0.34 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.16 3bwo h LYS 238 CO -0.24 -0.14 0.57 0.87 -2.27 0.00 0.00 179.45 178.24 3bwo h LYS 239 N -0.22 1.06 -0.69 1.90 1.79 -1.05 -0.79 116.57 118.57 3bwo h LYS 239 Ca 0.16 -0.06 -0.05 0.00 -2.18 0.00 0.00 60.65 58.52 3bwo h LYS 239 Cb 0.47 -0.24 -0.03 0.00 -1.58 0.00 0.00 32.23 30.85 3bwo h LYS 239 CO -0.44 0.70 0.25 0.52 -1.08 0.00 0.00 179.45 179.40 3bwo h MET 240 N 1.09 1.05 0.11 3.15 2.86 0.71 -0.29 114.93 123.62 3bwo h MET 240 Ca 0.34 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 3bwo h MET 240 Cb 0.01 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.51 3bwo h MET 240 CO -0.10 0.89 -0.05 0.28 1.06 0.00 0.00 176.91 178.98 3bwo h VAL 241 N 0.99 1.01 -0.77 -2.22 2.07 -0.37 -2.49 116.25 114.48 3bwo h VAL 241 Ca 0.23 -0.51 0.14 0.00 0.82 0.00 0.00 66.70 67.38 3bwo h VAL 241 Cb 0.25 1.34 -0.09 0.00 -1.52 0.00 0.00 31.29 31.27 3bwo h VAL 241 CO -0.01 0.12 0.34 -0.33 0.02 0.00 0.00 177.57 177.71 3bwo h GLU 242 N -0.39 0.49 0.05 1.57 5.08 -1.02 0.78 114.58 121.14 3bwo h GLU 242 Ca -0.02 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3bwo h GLU 242 Cb 0.32 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3bwo h GLU 242 CO 0.03 0.33 -0.15 -0.92 -1.00 0.00 0.00 179.01 177.30 3bwo h TYR 243 N 0.51 -0.38 -0.12 4.33 3.20 -0.92 -2.06 116.97 121.53 3bwo h TYR 243 Ca 0.42 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.25 3bwo h TYR 243 Cb 0.60 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 3bwo h TYR 243 CO -0.14 -0.22 -0.12 0.82 -1.64 0.00 0.00 178.16 176.86 3bwo h ILE 244 N -0.27 1.16 -0.63 1.81 2.04 -0.82 0.19 117.51 120.98 3bwo h ILE 244 Ca 0.03 -0.71 -0.08 0.00 1.00 0.00 0.00 64.86 65.10 3bwo h ILE 244 Cb 0.31 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3bwo h ILE 244 CO -0.11 0.22 0.09 0.40 0.00 0.00 0.00 178.15 178.75 3bwo h ILE 245 N 0.19 1.26 0.06 -0.67 2.04 -0.34 -1.38 117.51 118.66 3bwo h ILE 245 Ca 0.04 -1.03 -0.26 0.00 1.00 0.00 0.00 64.86 64.60 3bwo h ILE 245 Cb 0.34 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3bwo h ILE 245 CO 0.02 0.38 -1.10 0.58 0.00 0.00 0.00 178.15 178.04 3bwo h VAL 246 N 0.97 1.37 -0.38 1.67 2.07 -0.96 0.15 116.25 121.13 3bwo h VAL 246 Ca 0.19 -2.53 -0.08 0.00 0.82 0.00 0.00 66.70 65.10 3bwo h VAL 246 Cb 0.45 2.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 3bwo h VAL 246 CO 0.01 0.76 -0.10 -1.13 0.02 0.00 0.00 177.57 177.14 3bwo h ASN 247 N 0.24 0.64 0.00 0.57 -0.00 -0.54 -3.40 115.58 113.08 3bwo h ASN 247 Ca -0.13 -0.17 0.00 0.00 -0.00 0.00 0.00 56.30 56.00 3bwo h ASN 247 Cb 1.76 -0.17 0.00 0.00 -0.00 0.00 0.00 38.32 39.91 3bwo h ASN 247 CO 0.20 0.77 0.00 -1.54 -0.00 0.00 0.00 177.43 176.86 3bwo n SER 248 N -4.19 0.00 -3.99 1.15 3.41 -0.56 -5.03 113.62 104.41 3bwo n SER 248 Ca 0.01 -0.78 -0.31 0.00 -0.26 0.00 0.00 58.87 57.54 3bwo n SER 248 Cb 0.33 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 3bwo n SER 248 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3bwo n ILE 249 N 0.00 -3.20 0.00 -1.33 5.41 0.52 -4.69 119.36 116.06 3bwo n ILE 249 Ca 0.00 -0.61 0.00 0.00 1.00 0.00 0.00 62.75 63.14 3bwo n ILE 249 Cb 0.39 -2.64 0.00 0.00 -0.71 0.00 0.00 39.64 36.68 3bwo n ILE 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3bwo n GLY 250 N -2.05 -1.74 3.02 7.39 0.00 -1.19 -4.96 105.19 105.65 3bwo n GLY 250 Ca -0.24 -2.04 -0.18 0.00 0.00 0.00 0.00 46.02 43.56 3bwo n GLY 250 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bwo s VAL 251 N 0.00 0.65 -0.41 1.61 1.01 -1.26 -4.78 120.40 117.21 3bwo s VAL 251 Ca 0.00 -0.42 -0.38 0.00 0.00 0.00 0.00 61.98 61.18 3bwo s VAL 251 Cb 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 36.38 35.66 3bwo s VAL 251 CO 0.00 0.13 1.47 -0.24 0.00 0.00 0.00 175.10 176.46 3bwo n SER 252 N 2.74 0.88 0.23 3.32 2.88 -1.26 -4.87 113.62 117.54 3bwo n SER 252 Ca -0.14 0.85 -0.15 0.00 -1.33 0.00 0.00 58.87 58.09 3bwo n SER 252 Cb 0.57 -0.73 -0.08 0.00 -0.75 0.00 0.00 64.21 63.22 3bwo n SER 252 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3bwo h LYS 253 N 5.20 -0.51 -0.76 -1.46 6.56 -1.93 -2.47 116.57 121.18 3bwo h LYS 253 Ca -0.27 0.04 0.15 0.00 -1.06 0.00 0.00 60.65 59.50 3bwo h LYS 253 Cb 1.15 0.12 -0.05 0.00 -0.57 0.00 0.00 32.23 32.87 3bwo h LYS 253 CO 0.84 -0.33 0.51 1.05 -2.06 0.00 0.00 179.45 179.46 3bwo h GLU 254 N -0.56 0.41 -0.70 3.15 9.09 -1.91 -0.23 114.58 123.83 3bwo h GLU 254 Ca -0.05 -0.02 -0.03 0.00 0.05 0.00 0.00 59.36 59.30 3bwo h GLU 254 Cb 0.43 -0.09 -0.03 0.00 -1.65 0.00 0.00 28.75 27.40 3bwo h GLU 254 CO 0.09 0.27 0.33 0.77 0.05 0.00 0.00 179.01 180.52 3bwo h SER 255 N 0.42 0.92 -0.27 3.06 0.02 -1.81 -1.12 113.55 114.77 3bwo h SER 255 Ca 0.38 -0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 61.13 3bwo h SER 255 Cb 0.86 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 3bwo h SER 255 CO -0.12 0.80 -0.06 1.56 -1.14 0.00 0.00 176.83 177.87 3bwo h GLN 256 N 0.98 0.51 -0.81 3.45 4.20 -0.67 0.94 115.11 123.71 3bwo h GLN 256 Ca 0.24 -0.19 0.02 0.00 0.06 0.00 0.00 58.65 58.77 3bwo h GLN 256 Cb 0.13 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 3bwo h GLN 256 CO -0.03 0.72 0.54 0.28 -0.67 0.00 0.00 178.83 179.67 3bwo h VAL 257 N 0.27 1.18 0.02 -0.54 2.07 -0.93 -1.37 116.25 116.95 3bwo h VAL 257 Ca 0.07 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3bwo h VAL 257 Cb 0.52 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 3bwo h VAL 257 CO 0.02 0.20 -0.01 -0.09 0.02 0.00 0.00 177.57 177.71 3bwo h ARG 258 N 1.07 -0.02 -1.02 1.57 2.43 -1.03 -2.40 114.38 114.97 3bwo h ARG 258 Ca 0.31 0.00 0.27 0.00 -0.81 0.00 0.00 59.98 59.75 3bwo h ARG 258 Cb -0.07 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.41 3bwo h ARG 258 CO -0.07 0.72 0.69 1.15 -1.51 0.00 0.00 179.97 180.95 3bwo h THR 259 N -0.85 0.53 -0.06 0.20 2.02 -0.74 0.05 112.91 114.06 3bwo h THR 259 Ca -0.00 -0.08 -0.18 0.00 0.77 0.00 0.00 66.41 66.91 3bwo h THR 259 Cb 0.76 0.26 0.01 0.00 -1.74 0.00 0.00 68.15 67.44 3bwo h THR 259 CO 0.00 0.05 -0.68 0.00 0.37 0.00 0.00 175.52 175.26 3bwo h ALA 260 N 1.56 0.17 0.03 6.16 0.00 -1.23 -2.44 119.26 123.51 3bwo h ALA 260 Ca 0.54 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3bwo h ALA 260 Cb 1.64 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 3bwo h ALA 260 CO -0.17 0.48 -0.03 -0.22 0.00 0.00 0.00 179.25 179.32 3bwo h LYS 261 N 0.18 -0.06 -0.11 0.00 1.63 -0.53 -1.81 116.57 115.87 3bwo h LYS 261 Ca -0.07 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.61 3bwo h LYS 261 Cb 1.34 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.97 3bwo h LYS 261 CO 0.14 -0.04 -0.49 -0.84 -3.45 0.00 0.00 179.45 174.77 3bwo h ILE 262 N -0.06 1.34 -0.60 2.00 -0.00 -1.16 -1.85 117.51 117.17 3bwo h ILE 262 Ca -0.00 -1.71 -0.05 0.00 -0.00 0.00 0.00 64.86 63.10 3bwo h ILE 262 Cb 0.06 1.80 -0.03 0.00 -0.00 0.00 0.00 36.82 38.64 3bwo h ILE 262 CO -0.00 0.51 0.17 -0.07 -0.00 0.00 0.00 178.15 178.76 3bwo h LEU 263 N 0.22 0.86 -0.37 0.16 3.38 -1.36 0.17 115.31 118.38 3bwo h LEU 263 Ca 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3bwo h LEU 263 Cb 0.94 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 3bwo h LEU 263 CO 0.08 0.82 0.06 0.78 0.09 0.00 0.00 178.44 180.27 3bwo h ASN 264 N 0.89 0.58 -0.82 -0.43 2.35 -0.86 -0.34 115.58 116.96 3bwo h ASN 264 Ca 0.20 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.71 3bwo h ASN 264 Cb 0.29 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 3bwo h ASN 264 CO -0.00 0.69 0.54 0.58 -1.65 0.00 0.00 177.43 177.59 3bwo h VAL 265 N 0.45 1.18 -0.56 2.81 2.07 -1.02 -0.87 116.25 120.31 3bwo h VAL 265 Ca 0.11 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.29 3bwo h VAL 265 Cb 0.36 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.10 3bwo h VAL 265 CO 0.01 0.20 0.33 0.25 0.02 0.00 0.00 177.57 178.37 3bwo h LEU 266 N 1.07 0.52 -0.11 2.57 6.46 -0.10 -1.10 115.31 124.62 3bwo h LEU 266 Ca 0.31 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 58.08 3bwo h LEU 266 Cb -0.07 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.75 3bwo h LEU 266 CO -0.09 0.37 0.06 0.50 -0.62 0.00 0.00 178.44 178.66 3bwo h LYS 267 N 0.65 0.16 -0.47 1.25 3.64 -0.59 -1.32 116.57 119.88 3bwo h LYS 267 Ca 0.23 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.72 3bwo h LYS 267 Cb 0.05 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 3bwo h LYS 267 CO -0.11 0.17 0.34 0.93 -2.27 0.00 0.00 179.45 178.51 3bwo h GLU 268 N 0.10 0.03 0.00 1.90 5.08 -0.87 0.45 114.58 121.27 3bwo h GLU 268 Ca 0.04 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3bwo h GLU 268 Cb 0.06 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3bwo h GLU 268 CO -0.01 0.02 -0.21 1.15 -1.00 0.00 0.00 179.01 178.97 3bwo h THR 269 N 0.03 0.48 0.00 1.13 2.02 -0.06 -3.21 112.91 113.30 3bwo h THR 269 Ca 0.22 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.28 3bwo h THR 269 Cb 0.85 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 3bwo h THR 269 CO -0.01 0.20 0.00 0.00 0.37 0.00 0.00 175.52 176.08 3bwo n LYS 271 N -3.08 2.50 -3.34 0.00 2.85 -1.21 -4.91 118.16 110.97 3bwo n LYS 271 Ca 0.01 -2.26 -0.30 0.00 -1.05 0.00 0.00 58.31 54.70 3bwo n LYS 271 Cb 0.31 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.14 3bwo n LYS 271 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3bwo s SER 272 N -0.99 6.54 -0.02 -5.58 0.15 -0.91 -5.01 113.70 107.87 3bwo s SER 272 Ca 0.42 0.84 0.14 0.00 0.70 0.00 0.00 55.95 58.05 3bwo s SER 272 Cb 0.22 -2.20 -0.21 0.00 -1.71 0.00 0.00 66.02 62.13 3bwo s SER 272 CO 0.28 -0.15 0.33 -1.84 1.20 0.00 0.00 173.24 173.05 3bwo n GLU 273 N -0.58 0.63 -1.67 5.44 0.00 -1.26 -4.57 120.64 118.62 3bwo n GLU 273 Ca -0.00 -0.11 -0.47 0.00 0.00 0.00 0.00 57.16 56.57 3bwo n GLU 273 Cb 0.53 -1.31 -0.04 0.00 0.00 0.00 0.00 31.44 30.62 3bwo n GLU 273 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3bwo n SER 274 N -1.91 3.30 0.00 -1.84 2.88 -1.26 -4.81 113.62 109.98 3bwo n SER 274 Ca -0.02 1.03 0.10 0.00 -1.33 0.00 0.00 58.87 58.64 3bwo n SER 274 Cb 0.34 -1.40 0.55 0.00 -0.75 0.00 0.00 64.21 62.94 3bwo n SER 274 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3bwo n GLU 275 N 5.06 0.50 -0.00 -1.46 1.02 -1.26 -0.95 120.64 123.56 3bwo n GLU 275 Ca 0.20 0.04 0.07 0.00 -0.02 0.00 0.00 57.16 57.44 3bwo n GLU 275 Cb 0.29 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.13 3bwo n GLU 275 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3bwo n SER 276 N -1.09 1.05 -0.03 1.62 2.88 -1.26 -3.70 113.62 113.09 3bwo n SER 276 Ca 0.13 -0.53 -0.03 0.00 -1.33 0.00 0.00 58.87 57.11 3bwo n SER 276 Cb 0.09 1.23 -0.01 0.00 -0.75 0.00 0.00 64.21 64.78 3bwo n SER 276 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3bwo n GLU 277 N -1.56 0.20 -1.68 -1.46 -0.58 -0.29 -4.92 120.64 110.34 3bwo n GLU 277 Ca 0.01 0.23 -0.49 0.00 -0.42 0.00 0.00 57.16 56.48 3bwo n GLU 277 Cb 0.27 -1.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.09 3bwo n GLU 277 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3bwo n ASN 278 N -3.24 3.13 -0.03 1.62 2.85 -0.12 -4.89 115.26 114.59 3bwo n ASN 278 Ca -0.04 1.02 -0.13 0.00 -0.11 0.00 0.00 54.58 55.32 3bwo n ASN 278 Cb 0.15 -1.35 -0.11 0.00 1.24 0.00 0.00 39.78 39.72 3bwo n ASN 278 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 3bwo h PHE 279 N 7.93 0.02 0.00 1.20 3.04 -1.87 -1.53 116.94 125.73 3bwo h PHE 279 Ca -0.47 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.45 3bwo h PHE 279 Cb 1.28 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.78 3bwo h PHE 279 CO 0.79 0.61 -0.08 0.74 -2.02 0.00 0.00 178.31 178.35 3bwo h PHE 280 N -0.58 0.00 0.06 0.41 0.05 -1.93 0.19 116.94 115.14 3bwo h PHE 280 Ca -0.00 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.79 3bwo h PHE 280 Cb 0.61 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.56 3bwo h PHE 280 CO 0.14 0.08 -0.03 -0.22 -0.18 0.00 0.00 178.31 178.10 3bwo h LYS 281 N 0.00 -0.08 -0.83 1.51 3.11 -1.90 -2.48 116.57 115.89 3bwo h LYS 281 Ca -0.00 0.01 0.15 0.00 -2.81 0.00 0.00 60.65 57.99 3bwo h LYS 281 Cb 0.15 0.02 -0.09 0.00 -1.00 0.00 0.00 32.23 31.31 3bwo h LYS 281 CO 0.01 0.50 0.42 -0.92 -2.81 0.00 0.00 179.45 176.65 3bwo h TYR 282 N -0.80 0.73 -0.33 1.91 5.03 -0.79 -0.84 116.97 121.87 3bwo h TYR 282 Ca -0.01 0.03 -0.12 0.00 2.58 0.00 0.00 58.73 61.21 3bwo h TYR 282 Cb 0.62 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.70 3bwo h TYR 282 CO 0.14 0.16 -0.27 0.78 -1.32 0.00 0.00 178.16 177.65 3bwo h GLY 283 N 0.60 0.83 1.00 1.82 0.00 -0.67 -1.84 103.07 104.81 3bwo h GLY 283 Ca 0.46 -0.82 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 3bwo h GLY 283 CO -0.37 0.74 0.17 -0.09 0.00 0.00 0.00 176.54 177.00 3bwo h ARG 284 N 0.53 0.91 -0.82 4.80 2.43 -0.91 -0.09 114.38 121.23 3bwo h ARG 284 Ca 0.06 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 3bwo h ARG 284 Cb 0.84 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 3bwo h ARG 284 CO 0.07 0.82 0.41 1.49 -1.51 0.00 0.00 179.97 181.25 3bwo h GLU 285 N 0.82 1.17 -0.12 0.20 4.57 -1.09 0.84 114.58 120.98 3bwo h GLU 285 Ca 0.19 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 3bwo h GLU 285 Cb 0.30 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3bwo h GLU 285 CO -0.00 0.89 0.04 1.98 -1.18 0.00 0.00 179.01 180.74 3bwo h MET 286 N 1.16 0.18 -0.49 1.92 4.05 -1.06 -0.27 114.93 120.42 3bwo h MET 286 Ca 0.28 -0.04 -0.07 0.00 -0.28 0.00 0.00 59.70 59.59 3bwo h MET 286 Cb 0.10 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.85 3bwo h MET 286 CO -0.04 0.31 0.01 0.52 0.23 0.00 0.00 176.91 177.93 3bwo h MET 287 N 0.02 0.82 0.56 0.39 2.86 -0.80 -1.59 114.93 117.19 3bwo h MET 287 Ca 0.04 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.43 3bwo h MET 287 Cb 0.20 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.77 3bwo h MET 287 CO -0.00 0.82 -0.27 -0.22 1.06 0.00 0.00 176.91 178.29 3bwo h LYS 288 N 0.76 -0.73 -0.51 1.72 3.64 -0.71 -0.46 116.57 120.29 3bwo h LYS 288 Ca 0.15 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.67 3bwo h LYS 288 Cb 0.45 0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 32.36 3bwo h LYS 288 CO 0.02 -0.45 0.08 -0.97 -2.27 0.00 0.00 179.45 175.85 3bwo h ASN 289 N -0.85 -0.06 -0.49 4.20 -0.73 -0.92 -0.30 115.58 116.44 3bwo h ASN 289 Ca -0.08 0.10 -0.04 0.00 1.87 0.00 0.00 56.30 58.15 3bwo h ASN 289 Cb 0.62 0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.34 3bwo h ASN 289 CO 0.13 -0.00 0.14 0.03 -0.37 0.00 0.00 177.43 177.36 3bwo h ARG 290 N 0.20 0.77 0.00 6.67 3.08 -1.22 -2.50 114.38 121.39 3bwo h ARG 290 Ca 0.26 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 60.07 3bwo h ARG 290 Cb 0.36 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3bwo h ARG 290 CO -0.36 0.73 -0.31 -1.49 -1.07 0.00 0.00 179.97 177.47 3bwo h TRP 291 N 0.67 0.00 -0.05 3.04 4.06 -0.50 -2.26 115.95 120.90 3bwo h TRP 291 Ca 0.16 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.08 3bwo h TRP 291 Cb 0.29 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.45 3bwo h TRP 291 CO 0.02 0.31 -0.07 0.93 -3.56 0.00 0.00 178.44 176.07 3bwo h GLU 292 N 0.00 0.14 0.11 0.49 5.08 -0.84 -1.31 114.58 118.24 3bwo h GLU 292 Ca -0.00 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3bwo h GLU 292 Cb 0.62 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 3bwo h GLU 292 CO 0.04 0.62 -0.29 0.87 -1.00 0.00 0.00 179.01 179.25 3bwo h LYS 293 N -0.33 -0.48 -0.30 2.33 1.57 -1.36 0.41 116.57 118.40 3bwo h LYS 293 Ca 0.01 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3bwo h LYS 293 Cb 0.60 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.95 3bwo h LYS 293 CO 0.02 -0.32 -0.15 1.25 -0.57 0.00 0.00 179.45 179.68 3bwo h LEU 294 N -0.50 -0.49 -1.05 2.94 5.85 -1.47 -0.40 115.31 120.18 3bwo h LEU 294 Ca 0.03 0.12 0.19 0.00 0.84 0.00 0.00 57.88 59.06 3bwo h LEU 294 Cb 0.53 0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.73 3bwo h LEU 294 CO -0.18 -0.18 0.61 -0.09 -0.34 0.00 0.00 178.44 178.27 3bwo h ARG 295 N -0.10 0.73 -0.55 1.25 9.65 -0.38 0.14 114.38 125.11 3bwo h ARG 295 Ca 0.16 -0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.93 3bwo h ARG 295 Cb 0.34 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 3bwo h ARG 295 CO -0.37 0.48 0.08 0.93 2.80 0.00 0.00 179.97 183.90 3bwo h GLU 296 N 0.75 0.92 0.32 0.20 5.08 0.71 -1.93 114.58 120.62 3bwo h GLU 296 Ca 0.57 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.66 3bwo h GLU 296 Cb 0.91 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3bwo h GLU 296 CO -0.36 0.89 -0.15 0.28 -1.00 0.00 0.00 179.01 178.67 3bwo h VAL 297 N 0.81 0.71 -0.46 3.13 2.07 0.03 -2.73 116.25 119.80 3bwo h VAL 297 Ca 0.17 -0.41 0.08 0.00 0.82 0.00 0.00 66.70 67.37 3bwo h VAL 297 Cb 0.42 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3bwo h VAL 297 CO 0.01 0.08 0.32 0.58 0.02 0.00 0.00 177.57 178.58 3bwo h VAL 298 N -0.65 0.90 -0.37 2.57 2.07 -1.07 -2.26 116.25 117.43 3bwo h VAL 298 Ca -0.04 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 3bwo h VAL 298 Cb 0.46 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3bwo h VAL 298 CO 0.07 0.05 0.22 0.50 0.02 0.00 0.00 177.57 178.43 3bwo h LYS 299 N 0.26 0.49 0.00 1.57 1.63 -1.05 -2.09 116.57 117.39 3bwo h LYS 299 Ca 0.21 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.97 3bwo h LYS 299 Cb 0.50 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 3bwo h LYS 299 CO -0.04 0.37 0.00 0.39 -3.45 0.00 0.00 179.45 176.71 3bwo n GLU 300 N -4.80 0.17 -2.17 1.90 -0.58 -0.89 -4.84 120.64 109.42 3bwo n GLU 300 Ca -0.00 0.06 -0.27 0.00 -0.42 0.00 0.00 57.16 56.53 3bwo n GLU 300 Cb 0.05 -1.50 0.11 0.00 -0.57 0.00 0.00 31.44 29.53 3bwo n GLU 300 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3bwo s SER 301 N -2.79 4.19 -0.20 1.62 1.04 -0.79 -5.03 113.70 111.74 3bwo s SER 301 Ca 0.18 0.26 0.05 0.00 0.48 0.00 0.00 55.95 56.92 3bwo s SER 301 Cb 0.16 -0.66 -0.16 0.00 0.10 0.00 0.00 66.02 65.46 3bwo s SER 301 CO 0.42 -2.02 -0.12 0.47 0.98 0.00 0.00 173.24 172.97 3bwo n ASP 302 N -3.19 1.92 -0.00 7.02 8.00 -1.26 -4.76 116.55 124.27 3bwo n ASP 302 Ca 0.12 -0.08 0.06 0.00 0.71 0.00 0.00 54.79 55.59 3bwo n ASP 302 Cb 0.60 -0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.62 3bwo n ASP 302 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bwo n ALA 303 N -2.99 2.75 -1.77 2.24 0.00 -1.26 -4.93 120.51 114.55 3bwo n ALA 303 Ca -0.35 -0.29 -0.38 0.00 0.00 0.00 0.00 53.44 52.42 3bwo n ALA 303 Cb 0.95 -0.40 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 3bwo n ALA 303 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3bwo s PHE 304 N -2.55 3.67 0.35 0.00 0.08 -1.26 -0.14 117.98 118.13 3bwo s PHE 304 Ca -0.01 1.78 0.07 0.00 0.12 0.00 0.00 56.93 58.88 3bwo s PHE 304 Cb 0.08 -3.02 -0.07 0.00 -0.57 0.00 0.00 43.02 39.44 3bwo s PHE 304 CO 0.47 0.03 -0.02 0.95 -0.10 0.00 0.00 175.22 176.54 3bwo s THR 305 N -1.47 1.86 -0.21 0.64 -4.23 0.59 -4.90 115.64 107.92 3bwo s THR 305 Ca 0.49 -2.08 -0.19 0.00 -1.18 0.00 0.00 61.69 58.73 3bwo s THR 305 Cb -0.22 -2.77 0.06 0.00 1.34 0.00 0.00 72.50 70.90 3bwo s THR 305 CO 0.28 -0.11 0.57 -0.22 -0.54 0.00 0.00 174.62 174.60 3bwo s LEU 306 N -3.60 -0.20 0.66 4.79 2.96 -1.26 -2.55 118.68 119.48 3bwo s LEU 306 Ca 0.34 1.15 -0.17 0.00 -0.22 0.00 0.00 54.13 55.22 3bwo s LEU 306 Cb 0.07 1.95 -0.01 0.00 0.50 0.00 0.00 46.19 48.70 3bwo s LEU 306 CO 0.16 -0.20 1.17 -2.65 -1.32 0.00 0.00 176.35 173.51 3bwo n PRO 307 N 2.86 0.92 -4.14 0.98 -0.02 -1.26 -5.01 135.00 129.33 3bwo n PRO 307 Ca -0.14 0.37 -0.35 0.00 -2.02 0.00 0.00 63.50 61.36 3bwo n PRO 307 Cb 0.56 -2.40 -0.12 0.00 -0.02 0.00 0.00 33.50 31.52 3bwo n PRO 307 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3bwo s LYS 308 N -3.28 3.66 -0.15 -0.52 1.02 -1.26 -5.09 119.74 114.12 3bwo s LYS 308 Ca 0.80 -0.51 -0.04 0.00 0.02 0.00 0.00 55.97 56.25 3bwo s LYS 308 Cb -0.38 -3.06 -0.03 0.00 -0.52 0.00 0.00 37.83 33.85 3bwo s LYS 308 CO 0.43 0.08 -0.03 0.71 -0.92 0.00 0.00 175.35 175.62 3bwo s TYR 309 N 0.81 3.04 0.72 3.18 2.02 -1.26 -5.11 117.35 120.75 3bwo s TYR 309 Ca 0.00 -0.25 -0.13 0.00 -0.37 0.00 0.00 57.07 56.33 3bwo s TYR 309 Cb -0.14 -1.94 0.03 0.00 -0.40 0.00 0.00 41.96 39.50 3bwo s TYR 309 CO 0.02 0.01 1.10 -1.25 -1.57 0.00 0.00 175.55 173.86 3bwo s PRO 310 N 0.25 2.54 0.30 -1.71 0.04 -1.26 -4.83 135.00 130.32 3bwo s PRO 310 Ca -0.02 1.27 -0.15 0.00 0.04 0.00 0.00 61.00 62.13 3bwo s PRO 310 Cb -0.14 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 3bwo s PRO 310 CO 0.03 -1.44 0.71 -2.00 0.04 0.00 0.00 177.00 174.34 3bwo s GLU 311 N -4.52 4.01 0.07 4.56 2.12 -1.26 -4.53 118.70 119.14 3bwo s GLU 311 Ca 0.64 0.64 -0.15 0.00 0.36 0.00 0.00 54.97 56.46 3bwo s GLU 311 Cb -0.19 -2.52 0.03 0.00 0.26 0.00 0.00 34.13 31.71 3bwo s GLU 311 CO 0.49 0.21 0.35 0.00 -0.54 0.00 0.00 175.26 175.77 3bwo s ALA 312 N -1.90 -0.81 -0.14 6.30 0.00 -1.12 -4.96 121.76 119.13 3bwo s ALA 312 Ca 0.52 0.04 -0.25 0.00 0.00 0.00 0.00 51.96 52.26 3bwo s ALA 312 Cb -0.11 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.42 3bwo s ALA 312 CO 0.18 -0.49 0.82 0.12 0.00 0.00 0.00 175.76 176.39 3bwo s PHE 313 N -2.95 3.47 -0.29 0.00 2.19 -1.26 -0.86 117.98 118.28 3bwo s PHE 313 Ca -0.02 1.29 -0.17 0.00 0.33 0.00 0.00 56.93 58.35 3bwo s PHE 313 Cb 0.00 -2.98 -0.02 0.00 -1.31 0.00 0.00 43.02 38.71 3bwo s PHE 313 CO -0.06 -0.16 0.47 0.00 1.83 0.00 0.00 175.22 177.30 3bwo h ASN 315 N 8.18 0.00 0.00 0.00 2.35 -1.47 0.31 115.58 124.96 3bwo h ASN 315 Ca -0.30 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 3bwo h ASN 315 Cb 1.14 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.51 3bwo h ASN 315 CO 0.70 0.00 -0.23 0.22 -1.65 0.00 0.00 177.43 176.47 3bwo h TYR 316 N 0.00 0.00 0.00 1.19 3.20 -1.83 -3.37 116.97 116.16 3bwo h TYR 316 Ca 0.00 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 3bwo h TYR 316 Cb 0.44 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3bwo h TYR 316 CO 0.00 0.25 -0.30 0.74 -1.64 0.00 0.00 178.16 177.20 3bwo h PHE 317 N -1.00 0.00 -0.03 -3.82 0.04 -1.95 -3.47 116.94 106.71 3bwo h PHE 317 Ca -0.03 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 3bwo h PHE 317 Cb 0.37 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.52 3bwo h PHE 317 CO -0.01 0.30 -0.01 0.41 -0.60 0.00 0.00 178.31 178.40 3bwo n GLY 318 N 0.45 0.47 3.55 -1.45 0.00 0.11 -5.02 105.19 103.29 3bwo n GLY 318 Ca 0.01 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.19 3bwo n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bwo s LYS 319 N -1.19 1.86 -0.29 1.61 1.02 -1.19 -4.92 119.74 116.65 3bwo s LYS 319 Ca 0.00 -2.08 -0.09 0.00 0.02 0.00 0.00 55.97 53.81 3bwo s LYS 319 Cb 0.00 -1.13 -0.02 0.00 -0.52 0.00 0.00 37.83 36.15 3bwo s LYS 319 CO 0.00 -0.22 0.14 0.45 -0.92 0.00 0.00 175.35 174.80 3bwo s SER 320 N -3.63 5.57 0.22 2.83 0.15 -1.26 0.27 113.70 117.86 3bwo s SER 320 Ca 0.29 -0.30 -0.14 0.00 0.70 0.00 0.00 55.95 56.51 3bwo s SER 320 Cb 0.07 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.37 3bwo s SER 320 CO 0.14 -0.12 0.46 -1.48 1.20 0.00 0.00 173.24 173.45 3bwo s LEU 321 N 1.66 0.36 0.55 3.45 2.34 -0.04 -4.88 118.68 122.11 3bwo s LEU 321 Ca 0.06 -0.80 -0.14 0.00 0.06 0.00 0.00 54.13 53.31 3bwo s LEU 321 Cb -0.16 1.78 -0.06 0.00 -0.56 0.00 0.00 46.19 47.19 3bwo s LEU 321 CO 0.07 -1.08 1.00 -1.61 -1.06 0.00 0.00 176.35 173.67 3bwo s GLU 322 N -3.97 3.82 -0.07 1.48 2.02 -1.26 -2.81 118.70 117.90 3bwo s GLU 322 Ca 0.18 0.87 -0.05 0.00 0.02 0.00 0.00 54.97 55.99 3bwo s GLU 322 Cb -0.00 -2.12 -0.04 0.00 0.10 0.00 0.00 34.13 32.07 3bwo s GLU 322 CO 0.04 -0.37 0.15 -1.54 0.02 0.00 0.00 175.26 173.56 3bwo s SER 323 N -3.47 6.33 -0.47 -0.19 1.04 -1.26 -4.74 113.70 110.94 3bwo s SER 323 Ca 0.57 0.41 0.03 0.00 0.48 0.00 0.00 55.95 57.44 3bwo s SER 323 Cb -0.10 -2.01 0.13 0.00 0.10 0.00 0.00 66.02 64.14 3bwo s SER 323 CO 0.39 0.35 0.25 -0.31 0.98 0.00 0.00 173.24 174.91 3bwo s TYR 324 N -1.14 2.43 0.74 5.02 1.51 -0.31 -4.92 117.35 120.68 3bwo s TYR 324 Ca 0.20 -2.71 -0.16 0.00 -1.01 0.00 0.00 57.07 53.39 3bwo s TYR 324 Cb -0.12 -2.22 -0.01 0.00 -0.11 0.00 0.00 41.96 39.50 3bwo s TYR 324 CO 0.10 -0.76 0.73 -2.30 -1.11 0.00 0.00 175.55 172.21 3bwo n PRO 325 N 3.34 0.33 0.00 -1.71 -0.02 -1.26 -4.68 135.00 131.01 3bwo n PRO 325 Ca 0.08 0.16 0.14 0.00 -2.02 0.00 0.00 63.50 61.86 3bwo n PRO 325 Cb 0.34 -2.02 0.72 0.00 -0.02 0.00 0.00 33.50 32.52 3bwo n PRO 325 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bwo n ALA 326 N -2.57 2.40 -2.72 3.55 0.00 -1.26 -4.69 120.51 115.22 3bwo n ALA 326 Ca 0.11 -0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.24 3bwo n ALA 326 Cb 0.50 -1.44 -0.15 0.00 0.00 0.00 0.00 19.45 18.36 3bwo n ALA 326 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3bwo s PHE 327 N -2.42 0.64 -0.36 0.00 0.08 -1.26 -1.31 117.98 113.35 3bwo s PHE 327 Ca 0.30 -0.12 -0.12 0.00 0.12 0.00 0.00 56.93 57.11 3bwo s PHE 327 Cb 0.18 -0.41 0.00 0.00 -0.57 0.00 0.00 43.02 42.22 3bwo s PHE 327 CO 0.39 -0.01 0.23 0.00 -0.10 0.00 0.00 175.22 175.73 3bwo s ALA 328 N -0.16 3.41 -1.19 5.36 0.00 0.68 -4.80 121.76 125.07 3bwo s ALA 328 Ca 0.03 -1.54 -0.18 0.00 0.00 0.00 0.00 51.96 50.27 3bwo s ALA 328 Cb -0.03 -2.66 0.10 0.00 0.00 0.00 0.00 23.12 20.53 3bwo s ALA 328 CO -0.00 -1.17 1.55 -0.46 0.00 0.00 0.00 175.76 175.67 3bwo s TRP 329 N 1.66 2.94 0.29 0.00 -0.00 -1.26 -1.43 118.94 121.13 3bwo s TRP 329 Ca 0.05 -1.58 -0.29 0.00 -0.00 0.00 0.00 56.10 54.27 3bwo s TRP 329 Cb -0.18 -4.59 -0.10 0.00 -0.00 0.00 0.00 33.47 28.60 3bwo s TRP 329 CO 0.09 -1.70 1.23 -1.17 -0.00 0.00 0.00 176.95 175.40 3bwo s LEU 330 N 3.57 4.47 0.16 5.86 2.96 -0.64 -4.30 118.68 130.76 3bwo s LEU 330 Ca 0.48 2.48 0.04 0.00 -0.22 0.00 0.00 54.13 56.90 3bwo s LEU 330 Cb 0.01 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 3bwo s LEU 330 CO 0.01 -0.39 -0.07 -0.83 -1.32 0.00 0.00 176.35 173.76 3bwo s GLY 331 N -0.48 1.16 -0.01 7.98 0.00 -1.06 -2.14 107.32 112.78 3bwo s GLY 331 Ca 0.49 -1.55 0.03 0.00 0.00 0.00 0.00 44.72 43.68 3bwo s GLY 331 CO 0.46 -1.59 -0.09 -1.08 0.00 0.00 0.00 173.10 170.80 3bwo s THR 332 N -3.41 0.71 0.18 0.90 -1.32 -0.71 -0.30 115.64 111.69 3bwo s THR 332 Ca 0.20 -0.37 0.05 0.00 -1.21 0.00 0.00 61.69 60.36 3bwo s THR 332 Cb 0.04 -0.61 -0.14 0.00 -1.51 0.00 0.00 72.50 70.28 3bwo s THR 332 CO 0.02 0.21 1.40 0.11 -2.21 0.00 0.00 174.62 174.15 3bwo h LYS 333 N 6.03 0.10 -7.44 7.08 1.57 -0.88 -3.46 116.57 119.58 3bwo h LYS 333 Ca -0.31 -0.12 -0.43 0.00 -1.87 0.00 0.00 60.65 57.92 3bwo h LYS 333 Cb 1.18 0.03 0.18 0.00 0.08 0.00 0.00 32.23 33.70 3bwo h LYS 333 CO 0.49 0.90 0.19 -1.21 -0.57 0.00 0.00 179.45 179.25 3bwo s GLU 334 N -3.16 -0.55 -1.04 3.15 2.02 -1.26 -4.99 118.70 112.87 3bwo s GLU 334 Ca -0.02 0.03 -0.06 0.00 0.02 0.00 0.00 54.97 54.95 3bwo s GLU 334 Cb 0.11 -1.67 0.27 0.00 0.10 0.00 0.00 34.13 32.94 3bwo s GLU 334 CO 0.81 -3.29 1.07 0.39 0.02 0.00 0.00 175.26 174.26 3bwo n GLU 335 N -4.48 3.39 -4.48 1.61 -0.58 -1.26 -4.95 120.64 109.89 3bwo n GLU 335 Ca 0.11 -4.49 -0.24 0.00 -0.42 0.00 0.00 57.16 52.13 3bwo n GLU 335 Cb 0.59 -2.50 -0.09 0.00 -0.57 0.00 0.00 31.44 28.87 3bwo n GLU 335 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3bwo s THR 336 N -1.57 0.90 -1.13 2.62 -4.23 -1.26 -5.05 115.64 105.92 3bwo s THR 336 Ca 0.30 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.73 3bwo s THR 336 Cb -0.06 -2.57 0.27 0.00 1.34 0.00 0.00 72.50 71.48 3bwo s THR 336 CO -0.07 0.00 1.22 -0.67 -0.54 0.00 0.00 174.62 174.56 3bwo n ASP 337 N -0.96 5.62 -0.32 3.99 4.64 -1.26 -4.11 116.55 124.15 3bwo n ASP 337 Ca -0.04 -3.09 0.18 0.00 -1.38 0.00 0.00 54.79 50.46 3bwo n ASP 337 Cb 0.66 -1.39 0.37 0.00 -1.04 0.00 0.00 41.12 39.72 3bwo n ASP 337 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 3bwo h LEU 338 N 6.79 0.10 -0.76 -2.67 5.85 -1.76 0.30 115.31 123.16 3bwo h LEU 338 Ca 0.20 0.21 -0.05 0.00 0.84 0.00 0.00 57.88 59.08 3bwo h LEU 338 Cb 0.83 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 3bwo h LEU 338 CO 1.10 -0.21 0.28 1.62 -0.34 0.00 0.00 178.44 180.90 3bwo h VAL 339 N 0.19 1.26 -0.08 1.05 3.04 -1.85 -0.29 116.25 119.57 3bwo h VAL 339 Ca 0.63 -0.84 -0.05 0.00 -1.01 0.00 0.00 66.70 65.43 3bwo h VAL 339 Cb 1.39 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 3bwo h VAL 339 CO -0.69 0.34 -0.15 0.28 -1.01 0.00 0.00 177.57 176.34 3bwo h SER 340 N 1.11 0.27 -0.95 3.17 0.02 -0.91 -2.25 113.55 114.01 3bwo h SER 340 Ca 0.25 -0.56 0.07 0.00 -0.84 0.00 0.00 61.79 60.71 3bwo h SER 340 Cb 0.25 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.64 3bwo h SER 340 CO -0.02 0.78 0.61 -0.33 -1.14 0.00 0.00 176.83 176.73 3bwo h GLU 341 N -0.23 1.05 -0.21 3.45 4.39 -0.70 -0.74 114.58 121.59 3bwo h GLU 341 Ca 0.00 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.49 3bwo h GLU 341 Cb 0.73 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 3bwo h GLU 341 CO 0.03 0.69 -0.49 1.25 -1.16 0.00 0.00 179.01 179.34 3bwo h LEU 342 N 1.08 0.61 -1.46 1.33 5.85 -1.06 -2.34 115.31 119.31 3bwo h LEU 342 Ca 0.42 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 3bwo h LEU 342 Cb 0.22 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3bwo h LEU 342 CO -0.19 1.00 -0.26 -0.09 -0.34 0.00 0.00 178.44 178.57 3bwo h ARG 343 N 0.45 0.00 0.00 1.25 2.43 -0.71 -1.52 114.38 116.28 3bwo h ARG 343 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3bwo h ARG 343 Cb 1.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3bwo h ARG 343 CO 0.09 0.26 0.00 0.54 -1.51 0.00 0.00 179.97 179.35 3bwo n ARG 344 N -3.82 0.09 -0.37 0.20 1.74 -0.36 -1.41 116.66 112.72 3bwo n ARG 344 Ca -0.02 0.30 0.09 0.00 -0.77 0.00 0.00 57.85 57.45 3bwo n ARG 344 Cb 0.35 -1.66 0.23 0.00 -1.02 0.00 0.00 32.46 30.37 3bwo n ARG 344 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3bwo n HIS 345 N -1.82 0.76 -3.58 -1.55 8.25 -0.69 -4.97 115.22 111.62 3bwo n HIS 345 Ca 0.03 -0.89 -0.22 0.00 -0.26 0.00 0.00 57.72 56.39 3bwo n HIS 345 Cb 0.22 -0.28 0.07 0.00 1.12 0.00 0.00 29.99 31.12 3bwo n HIS 345 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3bwo n LYS 346 N -0.64 -6.89 -3.95 -0.41 5.02 -0.50 -4.94 118.16 105.85 3bwo n LYS 346 Ca 0.20 0.79 -0.30 0.00 -2.02 0.00 0.00 58.31 56.98 3bwo n LYS 346 Cb 0.83 -5.76 -0.16 0.00 -0.02 0.00 0.00 35.03 29.92 3bwo n LYS 346 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3bwo s VAL 347 N -3.37 1.52 0.12 -0.18 1.01 -0.66 -1.28 120.40 117.56 3bwo s VAL 347 Ca 0.32 -1.07 -0.26 0.00 0.00 0.00 0.00 61.98 60.96 3bwo s VAL 347 Cb -0.14 -1.71 -0.07 0.00 0.00 0.00 0.00 36.38 34.46 3bwo s VAL 347 CO 0.75 0.02 0.80 -0.04 0.00 0.00 0.00 175.10 176.63 3bwo s MET 348 N 1.42 4.57 0.23 2.72 -1.94 0.18 -3.09 119.30 123.38 3bwo s MET 348 Ca -0.03 1.17 -0.11 0.00 -1.71 0.00 0.00 55.69 55.00 3bwo s MET 348 Cb -0.17 -3.31 -0.01 0.00 2.01 0.00 0.00 34.83 33.34 3bwo s MET 348 CO -0.07 0.42 0.41 -1.54 -0.01 0.00 0.00 175.02 174.23 3bwo s SER 349 N -0.62 -0.05 -0.26 3.03 1.04 -1.26 -1.17 113.70 114.41 3bwo s SER 349 Ca 0.38 -0.96 -0.16 0.00 0.48 0.00 0.00 55.95 55.69 3bwo s SER 349 Cb -0.22 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.40 3bwo s SER 349 CO 0.26 -1.06 0.42 -0.60 0.98 0.00 0.00 173.24 173.23 3bwo s ARG 350 N -4.02 4.05 0.07 4.02 6.06 -0.51 -4.72 118.95 123.91 3bwo s ARG 350 Ca 0.23 0.15 -0.33 0.00 -2.50 0.00 0.00 55.73 53.28 3bwo s ARG 350 Cb 0.01 -3.64 -0.12 0.00 0.06 0.00 0.00 34.95 31.26 3bwo s ARG 350 CO 0.08 -0.27 1.73 0.00 -2.50 0.00 0.00 175.30 174.34 3bwo n ALA 351 N 5.27 1.39 -0.04 6.12 0.00 -1.26 -0.52 120.51 131.47 3bwo n ALA 351 Ca -0.07 0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.85 3bwo n ALA 351 Cb 0.50 -2.45 0.53 0.00 0.00 0.00 0.00 19.45 18.03 3bwo n ALA 351 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3bwo h GLY 352 N 7.55 0.46 1.71 0.00 0.00 -0.88 0.03 103.07 111.95 3bwo h GLY 352 Ca -0.46 -0.14 0.03 0.00 0.00 0.00 0.00 47.33 46.76 3bwo h GLY 352 CO 0.92 0.09 0.12 -2.09 0.00 0.00 0.00 176.54 175.58 3bwo h GLU 353 N 0.34 0.08 -0.27 4.80 4.81 -1.71 0.29 114.58 122.91 3bwo h GLU 353 Ca 0.24 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.37 3bwo h GLU 353 Cb 0.51 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3bwo h GLU 353 CO -0.06 0.05 -0.24 0.00 -0.73 0.00 0.00 179.01 178.03 3bwo h ARG 354 N 0.08 0.52 -0.17 1.92 2.47 -1.30 -2.80 114.38 115.10 3bwo h ARG 354 Ca 0.08 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 3bwo h ARG 354 Cb 0.21 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 3bwo h ARG 354 CO -0.01 0.73 0.00 0.00 0.56 0.00 0.00 179.97 181.25 3bwo n GLY 356 N 0.88 0.86 0.00 0.00 0.00 -1.06 -0.15 105.19 105.72 3bwo n GLY 356 Ca 0.09 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3bwo n GLY 356 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3bwo n SER 357 N 0.99 0.40 -4.63 1.61 2.88 -0.23 -4.51 113.62 110.13 3bwo n SER 357 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 3bwo n SER 357 Cb 0.49 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.87 3bwo n SER 357 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 3bwo s ASP 358 N 1.00 4.16 0.57 -3.46 3.84 -1.26 -4.09 116.67 117.44 3bwo s ASP 358 Ca 0.00 -1.01 0.28 0.00 -0.00 0.00 0.00 52.55 51.82 3bwo s ASP 358 Cb 0.00 -0.52 1.54 0.00 -1.38 0.00 0.00 42.92 42.56 3bwo s ASP 358 CO 0.00 -0.25 1.85 0.11 -0.00 0.00 0.00 175.17 176.88 3bwo h LYS 359 N 1.80 0.00 0.00 2.11 1.57 -1.92 -1.81 116.57 118.33 3bwo h LYS 359 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3bwo h LYS 359 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 3bwo h LYS 359 CO 0.67 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 181.18 3bwo n LYS 360 N -2.71 0.82 -4.25 3.15 5.02 -1.26 -2.16 118.16 116.78 3bwo n LYS 360 Ca -0.02 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.06 3bwo n LYS 360 Cb 0.30 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.68 3bwo n LYS 360 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3bwo s HIS 361 N -2.01 1.55 0.04 2.13 3.76 -0.68 -1.74 115.29 118.34 3bwo s HIS 361 Ca 0.40 -0.43 -0.09 0.00 -0.15 0.00 0.00 55.06 54.79 3bwo s HIS 361 Cb 0.18 -0.86 0.00 0.00 1.11 0.00 0.00 32.58 33.01 3bwo s HIS 361 CO 0.31 0.14 0.17 0.14 -0.85 0.00 0.00 174.74 174.65 3bwo s VAL 362 N -1.19 0.11 -0.21 -0.90 -7.23 -0.91 -0.33 120.40 109.75 3bwo s VAL 362 Ca 0.03 -0.94 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 3bwo s VAL 362 Cb -0.10 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 3bwo s VAL 362 CO 0.03 -0.52 0.09 -0.60 -0.31 0.00 0.00 175.10 173.79 3bwo s ARG 363 N -2.57 3.92 -0.11 4.82 3.52 0.32 -1.62 118.95 127.23 3bwo s ARG 363 Ca -0.05 -0.36 0.03 0.00 -0.13 0.00 0.00 55.73 55.22 3bwo s ARG 363 Cb -0.01 -3.31 0.01 0.00 -1.56 0.00 0.00 34.95 30.07 3bwo s ARG 363 CO -0.04 0.12 -0.22 0.54 -0.81 0.00 0.00 175.30 174.89 3bwo s VAL 364 N 0.82 1.96 0.21 7.11 0.11 -0.52 -1.42 120.40 128.67 3bwo s VAL 364 Ca 0.04 -0.95 -0.31 0.00 -2.93 0.00 0.00 61.98 57.84 3bwo s VAL 364 Cb -0.13 -1.72 -0.10 0.00 -1.53 0.00 0.00 36.38 32.90 3bwo s VAL 364 CO 0.02 0.54 1.46 -0.55 -3.33 0.00 0.00 175.10 173.24 3bwo s SER 365 N 0.56 6.67 0.00 3.54 0.15 -0.88 -0.23 113.70 123.51 3bwo s SER 365 Ca -0.14 2.60 0.22 0.00 0.70 0.00 0.00 55.95 59.33 3bwo s SER 365 Cb -0.17 -2.61 0.26 0.00 -1.71 0.00 0.00 66.02 61.79 3bwo s SER 365 CO 0.04 -0.72 1.26 0.23 1.20 0.00 0.00 173.24 175.26 3bwo n MET 366 N 2.96 2.20 -1.34 5.44 2.81 -0.43 -4.53 117.12 124.23 3bwo n MET 366 Ca 0.09 -1.98 -0.26 0.00 -1.81 0.00 0.00 57.70 53.75 3bwo n MET 366 Cb 0.40 -1.45 0.11 0.00 -0.71 0.00 0.00 33.22 31.58 3bwo n MET 366 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3bwo n LEU 367 N 1.30 6.43 0.00 4.03 4.77 -1.25 -5.00 117.00 127.28 3bwo n LEU 367 Ca 0.15 -4.14 -0.18 0.00 -0.03 0.00 0.00 56.01 51.81 3bwo n LEU 367 Cb 0.56 -0.78 0.09 0.00 -2.33 0.00 0.00 43.42 40.96 3bwo n LEU 367 CO 0.14 1.46 0.44 -1.54 -1.33 0.00 0.00 177.39 176.56 3bwo n SER 368 N -0.97 1.02 -4.76 -1.43 3.41 -1.26 -2.36 113.62 107.28 3bwo n SER 368 Ca 0.54 -1.87 -0.31 0.00 -0.26 0.00 0.00 58.87 56.97 3bwo n SER 368 Cb 1.00 -0.51 0.09 0.00 -0.26 0.00 0.00 64.21 64.53 3bwo n SER 368 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3bwo s ARG 369 N -4.53 2.18 0.00 4.33 0.52 -1.26 -3.84 118.95 116.36 3bwo s ARG 369 Ca 0.52 1.24 0.00 0.00 -0.52 0.00 0.00 55.73 56.97 3bwo s ARG 369 Cb -0.03 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.56 3bwo s ARG 369 CO 0.34 -1.71 0.87 0.39 0.02 0.00 0.00 175.30 175.22 3bwo n GLU 370 N -3.48 0.00 -0.34 3.54 -0.58 -1.26 -1.04 120.64 117.48 3bwo n GLU 370 Ca 0.10 0.74 0.16 0.00 -0.42 0.00 0.00 57.16 57.73 3bwo n GLU 370 Cb 0.53 -1.37 0.37 0.00 -0.57 0.00 0.00 31.44 30.39 3bwo n GLU 370 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 3bwo h ASP 371 N 0.00 0.70 -0.47 1.62 -0.00 -1.99 0.23 116.42 116.51 3bwo h ASP 371 Ca 0.00 0.11 -0.01 0.00 -0.00 0.00 0.00 57.03 57.13 3bwo h ASP 371 Cb 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 39.33 39.30 3bwo h ASP 371 CO 0.00 0.19 0.26 0.58 -0.00 0.00 0.00 179.24 180.27 3bwo h VAL 372 N 0.65 1.17 0.20 4.15 2.07 -1.87 -1.60 116.25 121.03 3bwo h VAL 372 Ca 0.60 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 3bwo h VAL 372 Cb 1.08 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3bwo h VAL 372 CO -0.40 0.18 -0.10 0.15 0.02 0.00 0.00 177.57 177.42 3bwo h PHE 373 N 0.63 -0.25 -0.30 1.57 3.57 0.69 -2.42 116.94 120.43 3bwo h PHE 373 Ca 0.17 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.73 3bwo h PHE 373 Cb 0.05 0.08 -0.08 0.00 2.79 0.00 0.00 35.95 38.80 3bwo h PHE 373 CO -0.02 -0.15 -0.28 -0.91 -2.23 0.00 0.00 178.31 174.72 3bwo h ASN 374 N -0.28 -0.91 -0.91 0.41 2.35 -0.96 -1.05 115.58 114.23 3bwo h ASN 374 Ca -0.03 0.16 0.15 0.00 -0.55 0.00 0.00 56.30 56.04 3bwo h ASN 374 Cb 0.22 0.43 -0.07 0.00 0.05 0.00 0.00 38.32 38.94 3bwo h ASN 374 CO 0.05 -0.30 0.58 0.58 -1.65 0.00 0.00 177.43 176.69 3bwo h VAL 375 N -0.26 0.81 -0.23 2.81 2.07 -1.19 0.28 116.25 120.54 3bwo h VAL 375 Ca 0.15 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3bwo h VAL 375 Cb 0.50 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3bwo h VAL 375 CO -0.45 0.13 0.10 0.15 0.02 0.00 0.00 177.57 177.51 3bwo h PHE 376 N 0.69 0.35 -0.09 1.57 3.04 -0.73 -2.22 116.94 119.54 3bwo h PHE 376 Ca 0.46 -0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.40 3bwo h PHE 376 Cb 0.76 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 3bwo h PHE 376 CO -0.00 0.37 0.00 -0.07 -2.02 0.00 0.00 178.31 176.59 3bwo h LEU 377 N 0.22 -0.03 -0.06 0.59 3.38 0.22 -0.64 115.31 119.00 3bwo h LEU 377 Ca 0.08 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3bwo h LEU 377 Cb 0.17 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3bwo h LEU 377 CO -0.01 0.00 -0.11 -0.33 0.09 0.00 0.00 178.44 178.08 3bwo h GLU 378 N 0.04 -0.09 -0.88 1.13 5.08 -1.30 -1.55 114.58 117.01 3bwo h GLU 378 Ca 0.04 0.01 0.25 0.00 -1.00 0.00 0.00 59.36 58.66 3bwo h GLU 378 Cb 0.05 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 3bwo h GLU 378 CO -0.07 -0.06 0.62 0.00 -1.00 0.00 0.00 179.01 178.50 3bwo h ARG 379 N -0.09 0.04 -0.52 2.33 3.08 -1.27 0.42 114.38 118.37 3bwo h ARG 379 Ca 0.01 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 3bwo h ARG 379 Cb 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3bwo h ARG 379 CO -0.11 0.03 -0.00 1.25 -1.07 0.00 0.00 179.97 180.07 3bwo h LEU 380 N 0.04 0.90 -0.03 3.04 6.46 -0.13 -2.32 115.31 123.29 3bwo h LEU 380 Ca 0.42 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 3bwo h LEU 380 Cb 1.61 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 41.30 3bwo h LEU 380 CO -0.03 0.99 0.00 0.00 -0.62 0.00 0.00 178.44 178.79 3bwo h ALA 381 N 0.94 1.00 -0.02 1.25 0.00 -0.41 -3.19 119.26 118.83 3bwo h ALA 381 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3bwo h ALA 381 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3bwo h ALA 381 CO 0.03 0.00 0.01 0.09 0.00 0.00 0.00 179.25 179.38 3bwo n ASN 382 N -3.01 2.70 0.00 0.00 5.03 -0.41 -5.07 115.26 114.50 3bwo n ASN 382 Ca 0.04 -2.04 0.00 0.00 0.87 0.00 0.00 54.58 53.45 3bwo n ASN 382 Cb 0.51 -0.51 0.00 0.00 -1.02 0.00 0.00 39.78 38.77 3bwo n ASN 382 CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.26 176.58