#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 -0.02 -1.68 2.41 -5.35 -1.26 -4.82 119.36 108.65 3bwo n ILE 18 Ca 0.00 -0.20 -0.45 0.00 -0.27 0.00 0.00 62.75 61.83 3bwo n ILE 18 Cb 0.00 -0.88 -0.04 0.00 -1.74 0.00 0.00 39.64 36.98 3bwo n ILE 18 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3bwo n PRO 19 N 8.30 2.44 0.00 6.28 -0.04 -1.26 -4.81 135.00 145.90 3bwo n PRO 19 Ca 0.61 0.89 0.01 0.00 -0.04 0.00 0.00 63.50 64.97 3bwo n PRO 19 Cb 0.14 -2.75 0.07 0.00 -0.04 0.00 0.00 33.50 30.92 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 5.77 0.06 0.00 0.54 1.56 -1.26 -1.67 117.12 122.12 3bwo n MET 20 Ca 0.20 0.08 0.13 0.00 -0.27 0.00 0.00 57.70 57.84 3bwo n MET 20 Cb 0.33 -1.50 0.37 0.00 2.15 0.00 0.00 33.22 34.57 3bwo n MET 20 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 3bwo n SER 21 N -1.09 0.37 -1.30 6.12 3.41 -1.26 -3.41 113.62 116.46 3bwo n SER 21 Ca 0.02 -0.06 0.09 0.00 -0.26 0.00 0.00 58.87 58.65 3bwo n SER 21 Cb 0.01 0.02 0.29 0.00 -0.26 0.00 0.00 64.21 64.28 3bwo n SER 21 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3bwo n ASP 22 N -1.46 3.82 -4.52 4.04 9.92 -0.67 -4.88 116.55 122.79 3bwo n ASP 22 Ca 0.06 -2.24 -0.41 0.00 -0.53 0.00 0.00 54.79 51.68 3bwo n ASP 22 Cb 0.33 -0.49 -0.10 0.00 -0.64 0.00 0.00 41.12 40.23 3bwo n ASP 22 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 3bwo s PHE 23 N -1.57 3.22 -0.09 1.24 5.36 -1.22 -5.04 117.98 119.89 3bwo s PHE 23 Ca 0.43 -0.21 -0.30 0.00 -0.96 0.00 0.00 56.93 55.89 3bwo s PHE 23 Cb 0.26 -2.58 -0.02 0.00 -0.34 0.00 0.00 43.02 40.34 3bwo s PHE 23 CO 0.24 -0.43 1.11 0.08 -1.46 0.00 0.00 175.22 174.76 3bwo s VAL 24 N 1.83 4.51 -0.46 3.12 1.01 -1.26 -4.90 120.40 124.25 3bwo s VAL 24 Ca 0.08 1.81 -0.21 0.00 0.00 0.00 0.00 61.98 63.66 3bwo s VAL 24 Cb -0.17 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.08 3bwo s VAL 24 CO 0.11 -0.01 0.65 -0.69 0.00 0.00 0.00 175.10 175.16 3bwo s VAL 25 N 2.23 4.81 -0.67 2.92 1.01 -0.41 -4.98 120.40 125.31 3bwo s VAL 25 Ca 0.52 -0.02 -0.17 0.00 0.00 0.00 0.00 61.98 62.30 3bwo s VAL 25 Cb -0.21 -4.24 0.14 0.00 0.00 0.00 0.00 36.38 32.06 3bwo s VAL 25 CO 0.19 -0.67 0.73 0.21 0.00 0.00 0.00 175.10 175.55 3bwo s ASN 26 N 2.20 6.36 -0.25 3.32 3.84 -1.26 0.99 114.94 130.14 3bwo s ASN 26 Ca 0.21 -1.84 0.09 0.00 0.21 0.00 0.00 52.86 51.53 3bwo s ASN 26 Cb -0.15 -2.28 0.44 0.00 -0.55 0.00 0.00 41.25 38.71 3bwo s ASN 26 CO 0.17 -0.94 1.25 0.18 -2.79 0.00 0.00 177.10 174.97 3bwo n LEU 27 N 5.64 3.63 0.06 3.21 4.77 0.07 -4.66 117.00 129.73 3bwo n LEU 27 Ca -0.02 -4.17 -0.21 0.00 -0.03 0.00 0.00 56.01 51.59 3bwo n LEU 27 Cb 0.44 -0.49 -0.15 0.00 -2.33 0.00 0.00 43.42 40.89 3bwo n LEU 27 CO 0.51 1.62 0.00 -0.78 -1.33 0.00 0.00 177.39 177.42 3bwo h ASP 28 N 1.39 0.52 -2.88 -1.43 3.58 -1.72 -1.73 116.42 114.15 3bwo h ASP 28 Ca 0.15 -0.95 0.00 0.00 0.42 0.00 0.00 57.03 56.65 3bwo h ASP 28 Cb 1.23 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.11 3bwo h ASP 28 CO 0.30 1.44 0.00 0.00 -2.88 0.00 0.00 179.24 178.10 3bwo n HIS 29 N -4.07 -3.37 -2.32 0.28 1.44 -1.26 -4.22 115.22 101.71 3bwo n HIS 29 Ca -0.14 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.43 3bwo n HIS 29 Cb 0.86 0.00 0.04 0.00 0.12 0.00 0.00 29.99 31.01 3bwo n HIS 29 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3bwo n GLY 30 N 5.00 4.52 3.59 -1.39 0.00 -1.26 -4.40 105.19 111.25 3bwo n GLY 30 Ca 0.00 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 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 -3.62 5.58 -1.15 1.61 2.15 -1.26 -4.86 116.67 115.12 3bwo s ASP 31 Ca 0.41 1.20 -0.10 0.00 0.43 0.00 0.00 52.55 54.49 3bwo s ASP 31 Cb 0.37 -2.52 -0.07 0.00 -0.30 0.00 0.00 42.92 40.41 3bwo s ASP 31 CO 0.00 -1.97 2.34 -0.81 -0.17 0.00 0.00 175.17 174.56 3bwo n PRO 32 N 8.66 2.54 0.00 4.34 -0.04 -1.26 -4.30 135.00 144.94 3bwo n PRO 32 Ca 0.25 -1.84 0.12 0.00 -0.04 0.00 0.00 63.50 62.00 3bwo n PRO 32 Cb 0.48 -2.70 0.60 0.00 -0.04 0.00 0.00 33.50 31.85 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 4.37 0.21 0.28 0.52 -2.24 -0.50 -3.59 114.28 113.33 3bwo n THR 33 Ca 0.56 0.05 0.16 0.00 -2.27 0.00 0.00 64.05 62.55 3bwo n THR 33 Cb 0.22 -0.62 0.92 0.00 -2.10 0.00 0.00 70.33 68.75 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 3.07 1.55 -0.01 6.98 0.00 -0.95 -1.79 119.26 128.10 3bwo h ALA 34 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bwo h ALA 34 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3bwo h ALA 34 CO 0.00 -0.06 -0.06 0.66 0.00 0.00 0.00 179.25 179.79 3bwo n TYR 35 N -3.78 0.00 -0.10 0.00 4.01 -1.24 -4.41 117.16 111.64 3bwo n TYR 35 Ca -0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.63 3bwo n TYR 35 Cb 0.13 -0.04 -0.01 0.00 -0.31 0.00 0.00 39.34 39.11 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 1.79 0.46 0.04 -0.72 4.81 -1.58 -2.48 114.58 116.90 3bwo h GLU 36 Ca 0.00 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3bwo h GLU 36 Cb 0.45 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.69 3bwo h GLU 36 CO 0.00 0.36 -0.32 0.93 -0.73 0.00 0.00 179.01 179.24 3bwo h GLU 37 N 0.43 -0.48 -0.47 1.92 5.08 -1.80 -1.86 114.58 117.40 3bwo h GLU 37 Ca 0.12 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 3bwo h GLU 37 Cb 0.02 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.29 3bwo h GLU 37 CO -0.02 -0.32 -0.47 -0.92 -1.00 0.00 0.00 179.01 176.27 3bwo h TYR 38 N -0.50 -1.41 0.00 4.33 3.20 -1.77 -1.30 116.97 119.52 3bwo h TYR 38 Ca 0.05 0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 3bwo h TYR 38 Cb 0.57 0.68 -0.01 0.00 1.54 0.00 0.00 36.73 39.51 3bwo h TYR 38 CO -0.33 -0.45 -0.18 -1.49 -1.64 0.00 0.00 178.16 174.07 3bwo h TRP 39 N -0.31 0.00 -0.61 -3.82 4.06 -1.31 -1.93 115.95 112.03 3bwo h TRP 39 Ca 0.13 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.04 3bwo h TRP 39 Cb 0.58 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.71 3bwo h TRP 39 CO -0.69 0.18 0.22 -0.09 -3.56 0.00 0.00 178.44 174.50 3bwo h ARG 40 N 0.00 0.92 -0.28 0.49 2.43 -0.40 -2.79 114.38 114.75 3bwo h ARG 40 Ca -0.00 -0.18 -0.08 0.00 -0.81 0.00 0.00 59.98 58.91 3bwo h ARG 40 Cb 0.36 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3bwo h ARG 40 CO 0.02 0.80 -0.16 0.87 -1.51 0.00 0.00 179.97 180.00 3bwo h LYS 41 N 0.85 0.49 -0.75 0.20 1.57 -0.69 -2.76 116.57 115.47 3bwo h LYS 41 Ca 0.20 -0.15 0.22 0.00 -1.87 0.00 0.00 60.65 59.05 3bwo h LYS 41 Cb 0.24 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3bwo h LYS 41 CO -0.01 0.63 0.69 0.52 -0.57 0.00 0.00 179.45 180.71 3bwo h MET 42 N 0.45 0.00 0.00 3.15 2.86 -1.15 -3.46 114.93 116.77 3bwo h MET 42 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3bwo h MET 42 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3bwo h MET 42 CO 0.03 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.41 3bwo n GLY 43 N -1.62 -0.02 0.16 8.32 0.00 -1.04 -3.96 105.19 107.03 3bwo n GLY 43 Ca 0.15 -0.99 0.09 0.00 0.00 0.00 0.00 46.02 45.27 3bwo n GLY 43 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3bwo n ASP 44 N -1.54 0.47 0.16 1.61 9.92 -1.26 -2.01 116.55 123.90 3bwo n ASP 44 Ca 0.00 0.68 0.13 0.00 -0.53 0.00 0.00 54.79 55.07 3bwo n ASP 44 Cb 0.00 -0.70 0.55 0.00 -0.64 0.00 0.00 41.12 40.33 3bwo n ASP 44 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 3bwo h ARG 45 N 0.00 0.00 -0.00 -1.24 0.11 -1.98 -2.18 114.38 109.09 3bwo h ARG 45 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3bwo h ARG 45 Cb 0.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.32 3bwo h ARG 45 CO 0.00 0.00 -0.70 0.00 0.10 0.00 0.00 179.97 179.37 3bwo n THR 47 N -1.32 1.96 -5.18 0.00 -1.04 -0.82 -4.78 114.28 103.10 3bwo n THR 47 Ca 0.06 -0.49 -0.31 0.00 -2.04 0.00 0.00 64.05 61.26 3bwo n THR 47 Cb 0.34 -1.73 -0.17 0.00 -1.82 0.00 0.00 70.33 66.96 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 -1.06 1.99 -0.10 12.58 1.01 -1.26 -5.06 120.40 128.50 3bwo s VAL 48 Ca 0.55 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.57 3bwo s VAL 48 Cb -0.53 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.13 3bwo s VAL 48 CO 0.62 0.55 -0.19 -0.89 0.00 0.00 0.00 175.10 175.19 3bwo s THR 49 N 0.28 1.73 -0.16 3.92 2.01 -1.26 -5.11 115.64 117.05 3bwo s THR 49 Ca -0.16 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.03 3bwo s THR 49 Cb -0.17 -1.53 0.03 0.00 0.01 0.00 0.00 72.50 70.84 3bwo s THR 49 CO 0.08 0.49 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.77 3bwo s ILE 50 N 0.61 1.39 0.90 1.82 1.01 -1.26 -5.13 121.20 120.55 3bwo s ILE 50 Ca -0.14 -0.68 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 3bwo s ILE 50 Cb -0.17 -1.43 0.13 0.00 0.01 0.00 0.00 42.46 41.01 3bwo s ILE 50 CO 0.04 0.28 1.09 -0.13 0.00 0.00 0.00 174.94 176.22 3bwo s ARG 51 N 1.53 1.19 0.47 2.79 0.52 -1.26 -4.93 118.95 119.26 3bwo s ARG 51 Ca 0.02 0.84 0.22 0.00 -0.52 0.00 0.00 55.73 56.29 3bwo s ARG 51 Cb -0.14 -1.80 1.16 0.00 0.52 0.00 0.00 34.95 34.69 3bwo s ARG 51 CO -0.09 -2.29 1.98 0.78 0.02 0.00 0.00 175.30 175.70 3bwo h GLY 52 N -1.59 0.00 -1.91 -3.53 0.00 -2.05 -2.97 103.07 91.03 3bwo h GLY 52 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3bwo h GLY 52 CO 0.54 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.08 3bwo s ASP 54 N -1.54 5.93 -1.53 0.00 1.01 -1.12 -4.14 116.67 115.28 3bwo s ASP 54 Ca 0.30 1.76 -0.05 0.00 0.71 0.00 0.00 52.55 55.27 3bwo s ASP 54 Cb 0.19 -2.53 0.05 0.00 1.01 0.00 0.00 42.92 41.64 3bwo s ASP 54 CO 0.27 -1.06 0.40 0.18 0.21 0.00 0.00 175.17 175.18 3bwo n LEU 55 N -1.98 -1.73 0.07 1.23 4.77 -1.26 -4.90 117.00 113.21 3bwo n LEU 55 Ca 0.08 -1.09 -0.22 0.00 -0.03 0.00 0.00 56.01 54.75 3bwo n LEU 55 Cb 0.53 -2.00 -0.15 0.00 -2.33 0.00 0.00 43.42 39.47 3bwo n LEU 55 CO 0.47 0.39 -0.52 0.24 -1.33 0.00 0.00 177.39 176.65 3bwo h MET 56 N -1.70 0.39 -7.25 3.23 2.86 -1.95 -3.48 114.93 107.03 3bwo h MET 56 Ca -0.63 -0.66 -0.52 0.00 -2.06 0.00 0.00 59.70 55.83 3bwo h MET 56 Cb 1.38 0.25 0.16 0.00 0.06 0.00 0.00 31.60 33.45 3bwo h MET 56 CO 0.69 1.31 0.31 0.45 1.06 0.00 0.00 176.91 180.73 3bwo s SER 57 N -7.27 3.90 0.16 1.22 0.15 -1.26 -4.96 113.70 105.63 3bwo s SER 57 Ca -0.15 2.13 -0.09 0.00 0.70 0.00 0.00 55.95 58.54 3bwo s SER 57 Cb 0.05 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 3bwo s SER 57 CO 0.86 -2.45 1.47 1.88 1.20 0.00 0.00 173.24 176.20 3bwo h TYR 58 N -1.04 0.99 -3.46 3.44 -1.99 -1.98 -3.46 116.97 109.47 3bwo h TYR 58 Ca -0.45 -0.33 -0.53 0.00 2.00 0.00 0.00 58.73 59.42 3bwo h TYR 58 Cb 1.26 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.77 3bwo h TYR 58 CO 0.52 1.12 -0.08 -0.06 -0.00 0.00 0.00 178.16 179.66 3bwo s PHE 59 N -4.21 3.45 -0.18 4.88 0.08 -1.26 -4.83 117.98 115.91 3bwo s PHE 59 Ca -0.10 0.95 -0.05 0.00 0.12 0.00 0.00 56.93 57.86 3bwo s PHE 59 Cb 0.11 -2.32 -0.09 0.00 -0.57 0.00 0.00 43.02 40.15 3bwo s PHE 59 CO 0.87 0.27 -0.20 0.43 -0.10 0.00 0.00 175.22 176.49 3bwo n SER 60 N -0.02 1.83 -3.15 1.36 7.64 -0.01 -5.01 113.62 116.27 3bwo n SER 60 Ca -0.00 0.10 0.04 0.00 1.01 0.00 0.00 58.87 60.02 3bwo n SER 60 Cb 0.52 -0.43 -0.01 0.00 -1.01 0.00 0.00 64.21 63.28 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 -6.26 -1.08 0.00 6.43 2.15 -0.44 -4.91 116.67 112.57 3bwo s ASP 61 Ca -0.25 0.68 0.24 0.00 0.43 0.00 0.00 52.55 53.65 3bwo s ASP 61 Cb 0.08 1.90 1.23 0.00 -0.30 0.00 0.00 42.92 45.84 3bwo s ASP 61 CO 0.35 -0.20 1.79 0.23 -0.17 0.00 0.00 175.17 177.17 3bwo n MET 62 N 5.45 0.40 0.00 4.34 2.81 -1.26 -2.76 117.12 126.09 3bwo n MET 62 Ca -0.03 0.05 0.14 0.00 -1.81 0.00 0.00 57.70 56.05 3bwo n MET 62 Cb 0.52 -1.50 0.57 0.00 -0.71 0.00 0.00 33.22 32.10 3bwo n MET 62 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3bwo n THR 63 N -1.24 0.00 -4.18 2.03 -1.04 -1.26 -4.83 114.28 103.75 3bwo n THR 63 Ca 0.12 -0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.85 3bwo n THR 63 Cb 0.17 -0.35 -0.08 0.00 -1.82 0.00 0.00 70.33 68.25 3bwo n THR 63 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 3bwo s ASN 64 N -2.94 4.79 0.11 8.00 0.02 -1.11 -5.03 114.94 118.77 3bwo s ASN 64 Ca 0.15 -0.32 -0.26 0.00 -1.02 0.00 0.00 52.86 51.41 3bwo s ASN 64 Cb 0.19 -1.05 -0.08 0.00 0.02 0.00 0.00 41.25 40.34 3bwo s ASN 64 CO 0.55 0.13 1.65 0.25 0.02 0.00 0.00 177.10 179.71 3bwo h LEU 65 N 3.11 -0.63 -8.00 0.60 5.85 -1.88 -3.19 115.31 111.17 3bwo h LEU 65 Ca -0.48 0.08 -0.69 0.00 0.84 0.00 0.00 57.88 57.63 3bwo h LEU 65 Cb 1.18 0.24 -0.18 0.00 0.37 0.00 0.00 40.66 42.28 3bwo h LEU 65 CO 0.57 -0.30 0.75 0.00 -0.34 0.00 0.00 178.44 179.12 3bwo n TRP 67 N 6.54 0.37 -0.03 0.00 4.27 -1.21 -2.61 117.44 124.77 3bwo n TRP 67 Ca 0.20 0.14 0.07 0.00 -3.89 0.00 0.00 57.50 54.02 3bwo n TRP 67 Cb 0.48 -0.73 0.26 0.00 -1.36 0.00 0.00 31.31 29.97 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 -1.83 1.11 -3.28 -2.67 -1.74 -1.26 -0.83 117.46 106.95 3bwo n PHE 68 Ca 0.03 -0.44 -0.41 0.00 -0.56 0.00 0.00 57.45 56.08 3bwo n PHE 68 Cb 0.22 -0.20 -0.08 0.00 1.52 0.00 0.00 39.48 40.94 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 -1.49 4.26 0.14 5.98 2.96 -1.07 -4.64 118.68 124.81 3bwo s LEU 69 Ca 0.38 0.09 -0.31 0.00 -0.22 0.00 0.00 54.13 54.06 3bwo s LEU 69 Cb 0.24 -2.54 -0.09 0.00 0.50 0.00 0.00 46.19 44.30 3bwo s LEU 69 CO 0.18 -0.38 1.45 -0.70 -1.32 0.00 0.00 176.35 175.57 3bwo s GLU 70 N 2.28 4.29 0.18 1.98 2.56 -1.26 -4.59 118.70 124.14 3bwo s GLU 70 Ca 0.18 2.18 -0.15 0.00 0.00 0.00 0.00 54.97 57.17 3bwo s GLU 70 Cb -0.16 -3.21 0.15 0.00 2.00 0.00 0.00 34.13 32.92 3bwo s GLU 70 CO 0.12 -0.48 1.66 -1.35 -0.56 0.00 0.00 175.26 174.65 3bwo h PRO 71 N 6.63 0.02 -0.48 4.30 0.11 -1.96 -1.49 132.00 139.12 3bwo h PRO 71 Ca -0.43 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.76 3bwo h PRO 71 Cb 1.21 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 3bwo h PRO 71 CO 0.87 0.01 0.32 0.93 -0.21 0.00 0.00 178.00 179.93 3bwo h GLU 72 N 0.02 0.31 -0.19 1.05 3.07 -1.97 -0.79 114.58 116.08 3bwo h GLU 72 Ca 0.23 -0.02 -0.20 0.00 -0.50 0.00 0.00 59.36 58.87 3bwo h GLU 72 Cb 0.36 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.20 3bwo h GLU 72 CO -0.48 0.20 -0.67 1.25 -1.40 0.00 0.00 179.01 177.91 3bwo h LEU 73 N 0.32 0.92 -1.17 1.33 5.85 -1.58 -2.58 115.31 118.39 3bwo h LEU 73 Ca 0.22 -0.60 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 3bwo h LEU 73 Cb 0.44 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 3bwo h LEU 73 CO -0.05 1.36 0.48 -0.08 -0.34 0.00 0.00 178.44 179.81 3bwo h GLU 74 N 0.53 1.04 -0.23 1.25 4.81 -0.33 -1.24 114.58 120.41 3bwo h GLU 74 Ca -0.03 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 3bwo h GLU 74 Cb 1.30 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 3bwo h GLU 74 CO 0.14 0.72 -0.26 -0.44 -0.73 0.00 0.00 179.01 178.44 3bwo h ASP 75 N 1.06 0.63 -0.62 1.04 3.32 -1.36 -2.86 116.42 117.64 3bwo h ASP 75 Ca 0.28 -0.49 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3bwo h ASP 75 Cb -0.07 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 3bwo h ASP 75 CO -0.06 0.99 0.30 0.00 -1.72 0.00 0.00 179.24 178.76 3bwo h ALA 76 N 0.66 1.33 -0.11 3.45 0.00 -1.01 0.25 119.26 123.82 3bwo h ALA 76 Ca 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3bwo h ALA 76 Cb 0.83 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3bwo h ALA 76 CO 0.06 0.52 0.01 0.82 0.00 0.00 0.00 179.25 180.66 3bwo h ILE 77 N 0.91 1.24 -0.54 0.00 2.04 -1.27 -1.58 117.51 118.31 3bwo h ILE 77 Ca 0.22 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.30 3bwo h ILE 77 Cb 0.10 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3bwo h ILE 77 CO -0.03 0.22 0.21 0.11 0.00 0.00 0.00 178.15 178.66 3bwo h LYS 78 N -0.07 0.80 -0.44 2.37 1.57 -1.23 -1.33 116.57 118.24 3bwo h LYS 78 Ca 0.03 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 3bwo h LYS 78 Cb 0.33 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 3bwo h LYS 78 CO 0.00 0.71 0.09 -0.44 -0.57 0.00 0.00 179.45 179.24 3bwo h ASP 79 N 0.73 0.69 0.19 0.86 3.32 -0.99 -0.01 116.42 121.22 3bwo h ASP 79 Ca 0.18 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3bwo h ASP 79 Cb 0.21 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3bwo h ASP 79 CO -0.01 0.76 -0.09 0.25 -1.72 0.00 0.00 179.24 178.42 3bwo h LEU 80 N 0.59 -0.22 -2.13 1.55 6.46 -1.07 0.50 115.31 120.98 3bwo h LEU 80 Ca 0.14 -0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 3bwo h LEU 80 Cb 0.35 0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.34 3bwo h LEU 80 CO 0.01 -0.10 -0.07 0.45 -0.62 0.00 0.00 178.44 178.11 3bwo h HIS 81 N -0.32 0.00 -0.14 1.25 3.86 -1.22 -0.44 115.15 118.13 3bwo h HIS 81 Ca -0.03 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.01 3bwo h HIS 81 Cb 0.25 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.72 3bwo h HIS 81 CO -0.05 0.07 -0.59 0.78 0.86 0.00 0.00 177.93 179.00 3bwo h GLY 82 N 0.76 0.72 1.02 2.45 0.00 -0.03 -0.51 103.07 107.48 3bwo h GLY 82 Ca -0.00 -0.98 -0.20 0.00 0.00 0.00 0.00 47.33 46.14 3bwo h GLY 82 CO 0.01 0.87 -0.76 -0.24 0.00 0.00 0.00 176.54 176.42 3bwo h VAL 83 N 0.32 1.33 0.00 4.60 3.04 -0.55 -3.27 116.25 121.72 3bwo h VAL 83 Ca -0.03 -2.06 -0.06 0.00 -1.01 0.00 0.00 66.70 63.54 3bwo h VAL 83 Cb 1.22 2.32 -0.01 0.00 -2.01 0.00 0.00 31.29 32.81 3bwo h VAL 83 CO 0.12 0.63 -0.28 0.58 -1.01 0.00 0.00 177.57 177.61 3bwo h VAL 84 N 0.24 0.49 -2.50 1.51 2.07 -1.20 -3.48 116.25 113.37 3bwo h VAL 84 Ca -0.08 -1.63 -0.38 0.00 0.82 0.00 0.00 66.70 65.43 3bwo h VAL 84 Cb 1.42 2.19 -0.04 0.00 -1.52 0.00 0.00 31.29 33.35 3bwo h VAL 84 CO 0.15 0.27 -0.47 0.61 0.02 0.00 0.00 177.57 178.15 3bwo n GLY 85 N 1.07 -0.13 0.01 2.17 0.00 -0.20 -4.64 105.19 103.47 3bwo n GLY 85 Ca 0.03 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3bwo n GLY 85 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3bwo n ASN 86 N -1.59 0.68 -3.75 1.61 6.94 -1.24 -3.84 115.26 114.06 3bwo n ASN 86 Ca -0.22 -0.49 -0.13 0.00 -0.02 0.00 0.00 54.58 53.72 3bwo n ASN 86 Cb 0.67 0.88 -0.11 0.00 -2.36 0.00 0.00 39.78 38.86 3bwo n ASN 86 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3bwo s ALA 87 N -3.12 -0.87 0.09 -2.53 0.00 -1.26 -1.69 121.76 112.38 3bwo s ALA 87 Ca 0.06 0.99 -0.29 0.00 0.00 0.00 0.00 51.96 52.71 3bwo s ALA 87 Cb 0.15 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.65 3bwo s ALA 87 CO 0.82 -0.17 0.92 0.00 0.00 0.00 0.00 175.76 177.33 3bwo s ALA 88 N 0.17 3.27 0.00 0.00 0.00 0.16 -4.74 121.76 120.62 3bwo s ALA 88 Ca -0.00 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.46 3bwo s ALA 88 Cb -0.02 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.88 3bwo s ALA 88 CO 0.01 -0.02 0.52 0.25 0.00 0.00 0.00 175.76 176.52 3bwo n THR 89 N 2.86 0.11 -2.93 0.00 -2.24 -1.26 -4.92 114.28 105.90 3bwo n THR 89 Ca 0.01 -0.52 -0.31 0.00 -2.27 0.00 0.00 64.05 60.97 3bwo n THR 89 Cb 0.49 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.69 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 -0.11 3.86 -1.46 -0.78 1.03 -1.26 -4.10 118.70 115.88 3bwo s GLU 90 Ca 0.00 0.56 -0.11 0.00 0.03 0.00 0.00 54.97 55.45 3bwo s GLU 90 Cb 0.00 -2.39 0.05 0.00 -0.80 0.00 0.00 34.13 30.99 3bwo s GLU 90 CO 0.00 0.02 1.02 -0.25 -1.33 0.00 0.00 175.26 174.72 3bwo n ASP 91 N -1.00 -4.90 -3.74 0.83 10.43 -1.26 -4.98 116.55 111.93 3bwo n ASP 91 Ca 0.03 -0.71 -0.10 0.00 2.57 0.00 0.00 54.79 56.59 3bwo n ASP 91 Cb 0.54 -4.27 -0.04 0.00 1.84 0.00 0.00 41.12 39.18 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 -6.44 1.37 -0.12 -1.24 1.70 -1.26 -4.80 118.95 108.15 3bwo s ARG 92 Ca 0.57 -0.87 -0.07 0.00 -0.47 0.00 0.00 55.73 54.89 3bwo s ARG 92 Cb -0.27 0.52 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 3bwo s ARG 92 CO 0.80 -0.58 0.13 0.71 -1.08 0.00 0.00 175.30 175.28 3bwo s TYR 93 N -3.87 3.57 -0.17 5.89 2.02 0.84 -4.90 117.35 120.72 3bwo s TYR 93 Ca 0.09 0.51 -0.07 0.00 -0.37 0.00 0.00 57.07 57.22 3bwo s TYR 93 Cb -0.01 -1.94 -0.04 0.00 -0.40 0.00 0.00 41.96 39.57 3bwo s TYR 93 CO -0.03 0.71 0.07 0.42 -1.57 0.00 0.00 175.55 175.15 3bwo s ILE 94 N -0.97 4.91 -0.14 2.71 1.01 -1.26 -0.80 121.20 126.65 3bwo s ILE 94 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.82 3bwo s ILE 94 Cb -0.12 -3.20 0.02 0.00 0.01 0.00 0.00 42.46 39.16 3bwo s ILE 94 CO 0.04 0.48 -0.18 -0.69 0.00 0.00 0.00 174.94 174.59 3bwo s VAL 95 N 0.19 1.76 0.14 2.92 1.01 0.04 -4.68 120.40 121.79 3bwo s VAL 95 Ca 0.05 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.16 3bwo s VAL 95 Cb -0.12 -1.60 -0.06 0.00 0.00 0.00 0.00 36.38 34.60 3bwo s VAL 95 CO 0.00 0.49 0.45 0.54 0.00 0.00 0.00 175.10 176.58 3bwo s VAL 96 N 1.12 5.05 0.06 2.92 0.11 -1.26 -0.27 120.40 128.11 3bwo s VAL 96 Ca -0.02 0.40 -0.10 0.00 -2.93 0.00 0.00 61.98 59.33 3bwo s VAL 96 Cb -0.14 -3.64 0.01 0.00 -1.53 0.00 0.00 36.38 31.07 3bwo s VAL 96 CO -0.06 0.14 0.22 -0.83 -3.33 0.00 0.00 175.10 171.24 3bwo s GLY 97 N -2.06 0.01 -0.72 6.54 0.00 -0.26 -4.86 107.32 105.96 3bwo s GLY 97 Ca 0.39 -0.30 -0.26 0.00 0.00 0.00 0.00 44.72 44.55 3bwo s GLY 97 CO 0.20 -0.49 1.88 -1.30 0.00 0.00 0.00 173.10 173.39 3bwo n THR 98 N 0.44 0.87 0.00 0.90 -2.24 -1.26 -1.42 114.28 111.57 3bwo n THR 98 Ca -0.18 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 60.77 3bwo n THR 98 Cb 0.60 -2.12 0.00 0.00 -2.10 0.00 0.00 70.33 66.72 3bwo n THR 98 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bwo n GLY 99 N 5.34 -0.85 0.20 3.38 0.00 -0.96 -4.03 105.19 108.27 3bwo n GLY 99 Ca 0.46 -1.63 0.05 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.89 1.61 0.87 -1.79 -2.79 113.55 110.56 3bwo h SER 100 Ca 0.00 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.63 3bwo h SER 100 Cb 0.00 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 3bwo h SER 100 CO 0.00 0.32 0.58 0.00 -0.53 0.00 0.00 176.83 177.19 3bwo h THR 101 N 0.00 1.04 0.00 2.23 1.03 -1.95 0.15 112.91 115.40 3bwo h THR 101 Ca -0.00 -0.33 -0.12 0.00 -0.01 0.00 0.00 66.41 65.95 3bwo h THR 101 Cb 0.64 -0.02 -0.02 0.00 -1.07 0.00 0.00 68.15 67.68 3bwo h THR 101 CO 0.04 0.18 -0.85 -0.61 -0.01 0.00 0.00 175.52 174.27 3bwo h GLN 102 N 0.97 0.00 -0.14 0.00 4.15 -1.66 -3.17 115.11 115.26 3bwo h GLN 102 Ca 0.39 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.66 3bwo h GLN 102 Cb 0.26 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 3bwo h GLN 102 CO -0.15 0.36 -0.54 -0.07 -1.93 0.00 0.00 178.83 176.51 3bwo h LEU 103 N 0.00 0.46 -0.14 -2.39 -0.00 -1.00 -1.93 115.31 110.30 3bwo h LEU 103 Ca -0.06 -0.24 -0.06 0.00 -0.00 0.00 0.00 57.88 57.52 3bwo h LEU 103 Cb 1.41 -0.13 -0.00 0.00 -0.00 0.00 0.00 40.66 41.94 3bwo h LEU 103 CO 0.05 0.91 -0.13 0.00 -0.00 0.00 0.00 178.44 179.27 3bwo h GLN 105 N -0.03 0.38 -0.31 0.00 4.20 -1.61 -0.50 115.11 117.24 3bwo h GLN 105 Ca 0.02 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 3bwo h GLN 105 Cb 0.65 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 3bwo h GLN 105 CO 0.03 0.36 -0.27 0.00 -0.67 0.00 0.00 178.83 178.28 3bwo h ALA 106 N 1.70 0.94 -0.09 3.87 0.00 -1.14 -1.74 119.26 122.80 3bwo h ALA 106 Ca 0.09 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.44 3bwo h ALA 106 Cb 0.15 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.82 3bwo h ALA 106 CO -0.00 0.61 -0.65 0.00 0.00 0.00 0.00 179.25 179.20 3bwo h ALA 107 N 1.15 0.20 -0.68 0.00 0.00 -0.58 -1.11 119.26 118.25 3bwo h ALA 107 Ca 0.07 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3bwo h ALA 107 Cb 0.75 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 3bwo h ALA 107 CO 0.06 0.49 0.43 0.28 0.00 0.00 0.00 179.25 180.51 3bwo h VAL 108 N 0.23 1.19 0.31 0.00 2.07 -1.10 0.22 116.25 119.18 3bwo h VAL 108 Ca -0.06 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 3bwo h VAL 108 Cb 1.30 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3bwo h VAL 108 CO 0.13 0.19 -0.25 -0.74 0.02 0.00 0.00 177.57 176.92 3bwo h HIS 109 N 0.92 -0.67 0.38 1.57 6.17 -1.27 -1.33 115.15 120.91 3bwo h HIS 109 Ca 0.25 0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.32 3bwo h HIS 109 Cb -0.06 0.25 -0.02 0.00 2.52 0.00 0.00 27.41 30.11 3bwo h HIS 109 CO -0.02 -0.38 -0.31 0.00 0.71 0.00 0.00 177.93 177.93 3bwo h ALA 110 N 0.03 -0.69 -0.99 5.26 0.00 -0.99 0.40 119.26 122.28 3bwo h ALA 110 Ca -0.02 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3bwo h ALA 110 Cb 0.51 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 3bwo h ALA 110 CO -0.02 -0.92 0.64 -0.07 0.00 0.00 0.00 179.25 178.88 3bwo h LEU 111 N -0.69 0.99 -0.51 0.00 3.38 -0.92 -0.94 115.31 116.61 3bwo h LEU 111 Ca -0.03 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3bwo h LEU 111 Cb 0.60 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3bwo h LEU 111 CO -0.02 0.60 -0.40 0.28 0.09 0.00 0.00 178.44 179.00 3bwo h SER 112 N 1.10 0.83 0.02 -0.43 0.02 -1.13 -2.16 113.55 111.80 3bwo h SER 112 Ca 0.45 -0.38 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 3bwo h SER 112 Cb 0.27 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 3bwo h SER 112 CO -0.19 1.12 -0.10 -1.28 -1.14 0.00 0.00 176.83 175.24 3bwo h SER 113 N 0.63 0.18 0.43 3.07 0.87 0.13 -2.66 113.55 116.21 3bwo h SER 113 Ca 0.05 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3bwo h SER 113 Cb 0.95 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 3bwo h SER 113 CO 0.09 0.30 -0.64 0.18 -0.53 0.00 0.00 176.83 176.23 3bwo n LEU 114 N -4.32 0.60 -4.60 2.23 4.77 -0.46 -4.96 117.00 110.26 3bwo n LEU 114 Ca -0.01 -0.07 -0.30 0.00 -0.03 0.00 0.00 56.01 55.60 3bwo n LEU 114 Cb 0.23 -0.19 0.20 0.00 -2.33 0.00 0.00 43.42 41.33 3bwo n LEU 114 CO 0.37 0.13 0.61 0.00 -1.33 0.00 0.00 177.39 177.17 3bwo s ALA 115 N -3.03 0.66 -0.88 -1.18 0.00 -0.82 -4.93 121.76 111.58 3bwo s ALA 115 Ca 0.09 0.28 0.25 0.00 0.00 0.00 0.00 51.96 52.58 3bwo s ALA 115 Cb 0.17 -3.36 0.47 0.00 0.00 0.00 0.00 23.12 20.40 3bwo s ALA 115 CO 0.74 -3.20 1.39 2.89 0.00 0.00 0.00 175.76 177.58 3bwo n ARG 116 N -4.51 0.10 -3.57 0.00 1.85 -1.26 -4.89 116.66 104.37 3bwo n ARG 116 Ca 0.08 0.02 -0.16 0.00 -1.00 0.00 0.00 57.85 56.79 3bwo n ARG 116 Cb 0.53 -1.56 -0.07 0.00 -1.05 0.00 0.00 32.46 30.32 3bwo n ARG 116 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3bwo s SER 117 N -3.40 -0.68 0.21 2.89 1.04 -1.26 -5.14 113.70 107.36 3bwo s SER 117 Ca 0.09 0.99 0.10 0.00 0.48 0.00 0.00 55.95 57.61 3bwo s SER 117 Cb 0.16 0.90 -0.05 0.00 0.10 0.00 0.00 66.02 67.14 3bwo s SER 117 CO 0.70 -0.46 -0.19 -1.10 0.98 0.00 0.00 173.24 173.17 3bwo s GLN 118 N -0.56 1.45 0.26 4.02 -0.21 -1.26 -4.19 119.66 119.17 3bwo s GLN 118 Ca -0.07 -1.56 -0.30 0.00 0.02 0.00 0.00 55.36 53.45 3bwo s GLN 118 Cb -0.02 -1.53 -0.09 0.00 1.00 0.00 0.00 33.01 32.37 3bwo s GLN 118 CO 0.06 0.30 1.05 -1.25 -2.12 0.00 0.00 175.29 173.33 3bwo s PRO 119 N -3.11 4.71 0.21 2.91 0.04 -1.21 -5.03 135.00 133.52 3bwo s PRO 119 Ca 0.22 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 62.65 3bwo s PRO 119 Cb -0.05 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 31.18 3bwo s PRO 119 CO 0.10 0.30 0.95 0.08 0.04 0.00 0.00 177.00 178.47 3bwo s VAL 120 N -1.11 4.13 0.14 -0.36 1.01 0.12 -4.74 120.40 119.60 3bwo s VAL 120 Ca 0.44 2.06 -0.30 0.00 0.00 0.00 0.00 61.98 64.18 3bwo s VAL 120 Cb -0.30 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 31.71 3bwo s VAL 120 CO 0.38 0.45 0.95 -0.44 0.00 0.00 0.00 175.10 176.44 3bwo s SER 121 N -0.91 7.53 -0.11 3.32 0.01 -0.73 -0.15 113.70 122.66 3bwo s SER 121 Ca 0.42 1.82 0.03 0.00 1.31 0.00 0.00 55.95 59.54 3bwo s SER 121 Cb -0.26 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.38 3bwo s SER 121 CO 0.32 -0.00 -0.23 -0.69 0.41 0.00 0.00 173.24 173.05 3bwo s VAL 122 N -0.32 2.14 0.15 3.43 1.01 0.26 0.97 120.40 128.05 3bwo s VAL 122 Ca 0.45 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.46 3bwo s VAL 122 Cb -0.24 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 3bwo s VAL 122 CO 0.30 0.55 0.02 0.68 0.00 0.00 0.00 175.10 176.66 3bwo s VAL 123 N 0.48 0.44 -0.19 2.92 -7.23 -0.40 -0.21 120.40 116.19 3bwo s VAL 123 Ca -0.15 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 57.92 3bwo s VAL 123 Cb -0.17 -2.07 0.05 0.00 0.56 0.00 0.00 36.38 34.76 3bwo s VAL 123 CO 0.06 -0.49 0.50 0.00 -0.31 0.00 0.00 175.10 174.86 3bwo s ALA 124 N -3.82 -1.27 0.29 1.32 0.00 -0.99 -0.41 121.76 116.88 3bwo s ALA 124 Ca 0.23 1.55 -0.30 0.00 0.00 0.00 0.00 51.96 53.44 3bwo s ALA 124 Cb 0.07 -0.91 -0.12 0.00 0.00 0.00 0.00 23.12 22.16 3bwo s ALA 124 CO 0.02 -0.26 1.61 0.00 0.00 0.00 0.00 175.76 177.13 3bwo n ALA 125 N 3.27 2.58 -2.29 0.00 0.00 -1.26 -1.69 120.51 121.12 3bwo n ALA 125 Ca -0.16 0.37 -0.38 0.00 0.00 0.00 0.00 53.44 53.27 3bwo n ALA 125 Cb 0.56 -2.47 -0.06 0.00 0.00 0.00 0.00 19.45 17.48 3bwo n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bwo s ALA 126 N 0.07 3.59 0.44 0.00 0.00 -1.26 -3.25 121.76 121.35 3bwo s ALA 126 Ca 0.65 0.01 -0.22 0.00 0.00 0.00 0.00 51.96 52.39 3bwo s ALA 126 Cb -0.50 -2.62 -0.09 0.00 0.00 0.00 0.00 23.12 19.92 3bwo s ALA 126 CO 0.47 0.41 1.05 -1.25 0.00 0.00 0.00 175.76 176.44 3bwo s PRO 127 N -1.19 4.00 0.30 0.00 0.04 -1.26 -5.04 135.00 131.85 3bwo s PRO 127 Ca 0.30 1.47 0.06 0.00 0.04 0.00 0.00 61.00 62.86 3bwo s PRO 127 Cb -0.19 -2.36 -0.06 0.00 0.04 0.00 0.00 34.50 31.93 3bwo s PRO 127 CO 0.19 -0.28 -0.02 -0.59 0.04 0.00 0.00 177.00 176.34 3bwo s PHE 128 N -1.78 1.96 -0.34 0.56 -0.12 -0.86 -4.61 117.98 112.79 3bwo s PHE 128 Ca 0.62 -0.78 -0.28 0.00 -0.05 0.00 0.00 56.93 56.44 3bwo s PHE 128 Cb -0.20 -1.18 -0.04 0.00 -0.63 0.00 0.00 43.02 40.96 3bwo s PHE 128 CO 0.25 0.19 2.13 -0.47 -0.05 0.00 0.00 175.22 177.28 3bwo s TYR 129 N -3.10 1.34 0.45 3.49 5.04 0.28 -4.34 117.35 120.49 3bwo s TYR 129 Ca 0.32 0.81 0.24 0.00 -2.44 0.00 0.00 57.07 55.99 3bwo s TYR 129 Cb 0.06 -3.91 1.25 0.00 0.35 0.00 0.00 41.96 39.70 3bwo s TYR 129 CO 0.13 -3.33 1.79 0.66 -1.34 0.00 0.00 175.55 173.46 3bwo h SER 130 N 15.54 0.30 0.51 4.32 4.64 -1.84 0.74 113.55 137.76 3bwo h SER 130 Ca -0.34 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3bwo h SER 130 Cb 1.22 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3bwo h SER 130 CO 1.04 0.06 0.00 0.74 -0.87 0.00 0.00 176.83 177.80 3bwo h THR 131 N 0.26 0.00 -0.71 2.95 2.02 -1.88 -2.58 112.91 112.97 3bwo h THR 131 Ca 0.57 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.47 3bwo h THR 131 Cb 1.71 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 69.32 3bwo h THR 131 CO -0.20 0.00 0.35 1.88 0.37 0.00 0.00 175.52 177.92 3bwo h TYR 132 N 0.00 1.00 0.44 3.16 0.05 -1.23 -2.62 116.97 117.78 3bwo h TYR 132 Ca 0.00 -0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 3bwo h TYR 132 Cb 0.26 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 37.69 3bwo h TYR 132 CO 0.00 0.73 -0.21 0.28 -1.05 0.00 0.00 178.16 177.90 3bwo h VAL 133 N 1.01 0.57 -0.68 -2.88 2.07 -1.63 -2.52 116.25 112.19 3bwo h VAL 133 Ca 0.25 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.72 3bwo h VAL 133 Cb 0.09 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 3bwo h VAL 133 CO -0.03 0.00 0.31 1.05 0.02 0.00 0.00 177.57 178.92 3bwo h GLU 134 N -0.60 0.98 -0.71 1.57 9.09 -1.69 -2.84 114.58 120.38 3bwo h GLU 134 Ca -0.06 -0.15 0.18 0.00 0.05 0.00 0.00 59.36 59.38 3bwo h GLU 134 Cb 0.46 -0.17 -0.04 0.00 -1.65 0.00 0.00 28.75 27.35 3bwo h GLU 134 CO 0.10 0.79 0.49 0.93 0.05 0.00 0.00 179.01 181.37 3bwo h GLU 135 N 0.94 0.14 -0.45 1.06 5.08 -1.29 0.18 114.58 120.24 3bwo h GLU 135 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3bwo h GLU 135 Cb 0.14 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3bwo h GLU 135 CO -0.03 0.10 0.00 0.25 -1.00 0.00 0.00 179.01 178.33 3bwo n THR 136 N -4.39 2.28 0.00 1.13 -2.24 -0.97 -4.56 114.28 105.53 3bwo n THR 136 Ca 0.14 -1.52 0.00 0.00 -2.27 0.00 0.00 64.05 60.40 3bwo n THR 136 Cb 0.68 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 0.28 0.00 0.19 4.28 -1.04 0.32 -4.32 114.28 113.99 3bwo n THR 137 Ca 0.24 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.37 3bwo n THR 137 Cb 0.97 -0.21 0.67 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 -0.01 -1.42 -0.00 -1.03 -2.22 116.97 112.29 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 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.03 3bwo h TYR 138 CO 0.00 0.00 -0.38 1.33 -0.00 0.00 0.00 178.16 179.11 3bwo n VAL 139 N -4.44 0.00 -3.55 -0.90 0.24 -1.26 -4.99 118.33 103.43 3bwo n VAL 139 Ca 0.01 -0.16 -0.25 0.00 -2.04 0.00 0.00 64.34 61.89 3bwo n VAL 139 Cb 0.24 0.72 0.05 0.00 -1.47 0.00 0.00 33.84 33.38 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 -0.52 -2.02 -3.27 7.34 1.74 -0.84 -4.96 116.66 114.14 3bwo n ARG 140 Ca 0.10 0.60 -0.39 0.00 -0.77 0.00 0.00 57.85 57.40 3bwo n ARG 140 Cb 0.39 -4.78 -0.06 0.00 -1.02 0.00 0.00 32.46 26.99 3bwo n ARG 140 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3bwo s SER 141 N -3.57 6.95 0.00 0.55 0.15 -1.26 -4.95 113.70 111.58 3bwo s SER 141 Ca 0.41 1.13 0.30 0.00 0.70 0.00 0.00 55.95 58.50 3bwo s SER 141 Cb -0.11 -2.34 1.57 0.00 -1.71 0.00 0.00 66.02 63.42 3bwo s SER 141 CO 0.82 0.16 2.04 0.61 1.20 0.00 0.00 173.24 178.07 3bwo n GLY 142 N 2.26 -0.74 0.19 9.45 0.00 -1.26 -3.65 105.19 111.45 3bwo n GLY 142 Ca -0.09 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.72 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 0.71 0.00 -3.53 1.61 2.86 -1.95 -3.20 114.93 111.42 3bwo h MET 143 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 3bwo h MET 143 Cb 0.20 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.79 3bwo h MET 143 CO 0.00 0.36 -0.02 1.52 1.06 0.00 0.00 176.91 179.83 3bwo s TYR 144 N -3.58 0.35 -0.20 -0.22 -0.85 -1.24 -0.70 117.35 110.90 3bwo s TYR 144 Ca 0.00 -0.75 -0.15 0.00 -0.52 0.00 0.00 57.07 55.66 3bwo s TYR 144 Cb 0.11 0.32 0.06 0.00 0.38 0.00 0.00 41.96 42.82 3bwo s TYR 144 CO 0.68 -1.13 0.51 0.21 -1.52 0.00 0.00 175.55 174.30 3bwo s LYS 145 N -3.63 0.55 -0.18 -3.49 2.20 0.78 -4.70 119.74 111.28 3bwo s LYS 145 Ca 0.21 0.83 -0.29 0.00 -0.36 0.00 0.00 55.97 56.36 3bwo s LYS 145 Cb -0.02 0.16 -0.03 0.00 -1.51 0.00 0.00 37.83 36.43 3bwo s LYS 145 CO 0.11 -0.11 1.52 -0.46 -0.36 0.00 0.00 175.35 176.04 3bwo s TRP 146 N 0.89 2.29 -1.60 4.03 -0.11 -1.26 -0.57 118.94 122.60 3bwo s TRP 146 Ca -0.05 0.60 0.16 0.00 1.22 0.00 0.00 56.10 58.03 3bwo s TRP 146 Cb -0.05 -3.86 0.33 0.00 -1.50 0.00 0.00 33.47 28.38 3bwo s TRP 146 CO -0.07 -2.75 1.24 0.39 -4.62 0.00 0.00 176.95 171.14 3bwo n GLU 147 N 7.30 2.24 0.00 5.86 -0.58 0.70 -4.90 120.64 131.27 3bwo n GLU 147 Ca 0.17 -2.00 0.00 0.00 -0.42 0.00 0.00 57.16 54.91 3bwo n GLU 147 Cb 0.45 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.95 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 0.96 0.30 3.54 0.62 0.00 -1.25 -4.86 105.19 104.50 3bwo n GLY 148 Ca 0.14 -0.90 -0.56 0.00 0.00 0.00 0.00 46.02 44.71 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 0.13 0.79 0.05 1.61 -0.08 -1.24 -2.35 116.55 115.46 3bwo n ASP 149 Ca 0.00 1.14 -0.07 0.00 -1.51 0.00 0.00 54.79 54.35 3bwo n ASP 149 Cb 0.00 -1.05 -0.12 0.00 2.34 0.00 0.00 41.12 42.29 3bwo n ASP 149 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3bwo h ALA 150 N 3.73 0.38 -1.00 -1.67 0.00 -1.65 -3.39 119.26 115.66 3bwo h ALA 150 Ca -0.49 -0.96 -0.48 0.00 0.00 0.00 0.00 54.91 52.98 3bwo h ALA 150 Cb 1.38 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 3bwo h ALA 150 CO 0.71 1.27 1.68 0.91 0.00 0.00 0.00 179.25 183.82 3bwo n TRP 151 N -3.33 1.11 -0.19 0.00 5.03 -1.26 0.38 117.44 119.17 3bwo n TRP 151 Ca -0.02 0.22 0.00 0.00 3.03 0.00 0.00 57.50 60.73 3bwo n TRP 151 Cb 0.95 -2.54 0.00 0.00 -1.03 0.00 0.00 31.31 28.69 3bwo n TRP 151 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3bwo n GLY 152 N 6.20 0.71 3.71 6.99 0.00 -1.26 -5.01 105.19 116.53 3bwo n GLY 152 Ca 0.48 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.24 3.22 0.00 1.61 2.19 0.16 -4.84 117.98 118.07 3bwo s PHE 153 Ca 0.00 1.00 0.11 0.00 0.33 0.00 0.00 56.93 58.37 3bwo s PHE 153 Cb 0.00 -3.63 0.18 0.00 -1.31 0.00 0.00 43.02 38.27 3bwo s PHE 153 CO 0.00 -2.17 1.01 -0.40 1.83 0.00 0.00 175.22 175.49 3bwo n ASP 154 N 4.19 0.11 -4.75 6.13 5.75 -1.26 -4.99 116.55 121.73 3bwo n ASP 154 Ca 0.11 -1.88 -0.31 0.00 -0.01 0.00 0.00 54.79 52.69 3bwo n ASP 154 Cb 0.43 -0.07 0.10 0.00 -1.03 0.00 0.00 41.12 40.56 3bwo n ASP 154 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 3bwo s LYS 155 N 0.00 2.10 0.12 0.11 2.20 -1.26 -5.01 119.74 118.00 3bwo s LYS 155 Ca 0.14 1.27 0.03 0.00 -0.36 0.00 0.00 55.97 57.05 3bwo s LYS 155 Cb 0.16 -1.87 -0.04 0.00 -1.51 0.00 0.00 37.83 34.57 3bwo s LYS 155 CO -0.07 -1.77 0.20 -1.59 -0.36 0.00 0.00 175.35 171.76 3bwo s LYS 156 N -4.75 3.23 0.00 4.03 0.00 -1.26 -4.98 119.74 116.01 3bwo s LYS 156 Ca 0.63 -0.64 0.00 0.00 0.00 0.00 0.00 55.97 55.96 3bwo s LYS 156 Cb -0.19 -2.87 0.00 0.00 0.00 0.00 0.00 37.83 34.77 3bwo s LYS 156 CO 0.55 0.54 0.00 0.41 0.00 0.00 0.00 175.35 176.85 3bwo n GLY 157 N -0.15 -1.81 3.76 0.59 0.00 -1.26 -5.03 105.19 101.28 3bwo n GLY 157 Ca -0.07 -2.16 -0.38 0.00 0.00 0.00 0.00 46.02 43.40 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 -0.47 3.55 0.11 1.61 0.02 -1.26 -4.80 135.00 133.76 3bwo s PRO 158 Ca 0.00 2.11 -0.14 0.00 0.02 0.00 0.00 61.00 62.99 3bwo s PRO 158 Cb 0.00 -2.45 0.02 0.00 0.02 0.00 0.00 34.50 32.10 3bwo s PRO 158 CO 0.00 -0.82 0.33 1.52 -0.33 0.00 0.00 177.00 177.70 3bwo s TYR 159 N -1.35 -0.10 -0.11 6.54 1.13 -1.26 -1.76 117.35 120.44 3bwo s TYR 159 Ca 0.65 -0.23 0.01 0.00 -1.41 0.00 0.00 57.07 56.09 3bwo s TYR 159 Cb -0.37 0.16 0.02 0.00 -1.10 0.00 0.00 41.96 40.66 3bwo s TYR 159 CO 0.45 -0.64 -0.13 0.42 -2.51 0.00 0.00 175.55 173.15 3bwo s ILE 160 N -3.70 1.33 -0.19 -3.49 1.01 0.27 -0.15 121.20 116.29 3bwo s ILE 160 Ca 0.03 -0.53 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 3bwo s ILE 160 Cb 0.02 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 3bwo s ILE 160 CO -0.11 0.41 0.07 -0.70 0.00 0.00 0.00 174.94 174.61 3bwo s GLU 161 N 1.17 3.96 -0.33 2.79 2.12 0.05 -1.28 118.70 127.17 3bwo s GLU 161 Ca -0.04 -0.35 -0.17 0.00 0.36 0.00 0.00 54.97 54.77 3bwo s GLU 161 Cb -0.14 -3.25 -0.01 0.00 0.26 0.00 0.00 34.13 30.98 3bwo s GLU 161 CO -0.03 0.21 0.48 -0.51 -0.54 0.00 0.00 175.26 174.87 3bwo s LEU 162 N 0.54 4.29 -0.31 2.70 1.43 0.45 -1.35 118.68 126.44 3bwo s LEU 162 Ca 0.04 0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.14 3bwo s LEU 162 Cb -0.13 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.58 3bwo s LEU 162 CO 0.01 -0.41 0.04 -0.69 0.23 0.00 0.00 176.35 175.52 3bwo s VAL 163 N 2.31 3.33 -0.29 -1.59 1.01 0.21 -4.38 120.40 120.99 3bwo s VAL 163 Ca 0.18 -1.22 -0.11 0.00 0.00 0.00 0.00 61.98 60.83 3bwo s VAL 163 Cb -0.16 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 3bwo s VAL 163 CO 0.12 -0.09 0.20 -0.89 0.00 0.00 0.00 175.10 174.44 3bwo s THR 164 N 1.33 5.27 -0.15 3.92 2.01 -1.26 -0.37 115.64 126.39 3bwo s THR 164 Ca -0.03 0.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.99 3bwo s THR 164 Cb -0.19 -3.55 0.07 0.00 0.01 0.00 0.00 72.50 68.84 3bwo s THR 164 CO 0.00 0.19 0.28 -0.55 -0.69 0.00 0.00 174.62 173.86 3bwo s SER 165 N 1.75 0.38 0.37 3.53 0.15 -0.86 -2.50 113.70 116.52 3bwo s SER 165 Ca 0.07 0.54 -0.27 0.00 0.70 0.00 0.00 55.95 56.99 3bwo s SER 165 Cb -0.16 0.76 -0.11 0.00 -1.71 0.00 0.00 66.02 64.79 3bwo s SER 165 CO 0.11 -0.25 1.22 -2.65 1.20 0.00 0.00 173.24 172.86 3bwo n PRO 166 N 5.35 1.89 -1.38 5.44 -0.02 -1.26 -4.23 135.00 140.79 3bwo n PRO 166 Ca -0.06 0.67 -0.31 0.00 -2.02 0.00 0.00 63.50 61.77 3bwo n PRO 166 Cb 0.50 -2.26 0.08 0.00 -0.02 0.00 0.00 33.50 31.80 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 -0.46 4.79 -0.15 2.55 2.47 -0.28 -4.65 114.94 119.22 3bwo s ASN 167 Ca 0.58 1.77 0.02 0.00 0.42 0.00 0.00 52.86 55.65 3bwo s ASN 167 Cb -0.56 -2.52 0.02 0.00 -1.45 0.00 0.00 41.25 36.74 3bwo s ASN 167 CO 0.60 -1.84 -0.20 0.21 -3.72 0.00 0.00 177.10 172.15 3bwo s ASN 168 N -3.47 2.99 0.13 -4.21 3.84 -1.26 -0.77 114.94 112.19 3bwo s ASN 168 Ca 0.60 -0.58 0.21 0.00 0.21 0.00 0.00 52.86 53.30 3bwo s ASN 168 Cb -0.16 -1.38 -0.07 0.00 -0.55 0.00 0.00 41.25 39.08 3bwo s ASN 168 CO 0.55 0.03 0.91 -0.81 -2.79 0.00 0.00 177.10 174.99 3bwo n PRO 169 N 4.36 0.62 0.00 0.43 -0.04 -1.26 -0.56 135.00 138.55 3bwo n PRO 169 Ca -0.20 0.12 0.11 0.00 -0.04 0.00 0.00 63.50 63.50 3bwo n PRO 169 Cb 0.51 -1.79 0.51 0.00 -0.04 0.00 0.00 33.50 32.69 3bwo n PRO 169 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3bwo n ASP 170 N -2.70 0.00 -0.48 3.54 5.68 -1.26 -4.30 116.55 117.04 3bwo n ASP 170 Ca -0.04 0.49 -0.06 0.00 -0.50 0.00 0.00 54.79 54.68 3bwo n ASP 170 Cb 0.65 -0.50 -0.03 0.00 -1.14 0.00 0.00 41.12 40.10 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 0.96 0.80 3.76 6.12 0.00 0.05 -4.81 105.19 112.08 3bwo n GLY 171 Ca 0.06 -0.31 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.01 3.19 0.06 2.61 2.01 -1.26 -4.12 115.64 116.11 3bwo s THR 172 Ca 0.00 1.18 -0.31 0.00 0.31 0.00 0.00 61.69 62.87 3bwo s THR 172 Cb 0.00 -3.74 -0.06 0.00 0.01 0.00 0.00 72.50 68.72 3bwo s THR 172 CO 0.00 0.26 1.20 -0.63 -0.69 0.00 0.00 174.62 174.76 3bwo s ILE 173 N -1.19 4.04 0.33 1.82 -1.09 -1.26 -1.12 121.20 122.73 3bwo s ILE 173 Ca 0.47 1.46 0.03 0.00 -2.23 0.00 0.00 60.65 60.39 3bwo s ILE 173 Cb -0.34 -3.94 -0.06 0.00 -1.58 0.00 0.00 42.46 36.54 3bwo s ILE 173 CO 0.45 0.11 0.07 -0.13 -1.23 0.00 0.00 174.94 174.21 3bwo s ARG 174 N 1.11 1.68 0.29 2.79 0.52 -1.26 -4.99 118.95 119.10 3bwo s ARG 174 Ca 0.59 -1.95 -0.12 0.00 -0.52 0.00 0.00 55.73 53.74 3bwo s ARG 174 Cb -0.29 -0.77 0.01 0.00 0.52 0.00 0.00 34.95 34.42 3bwo s ARG 174 CO 0.29 -0.25 0.55 -1.21 0.02 0.00 0.00 175.30 174.70 3bwo s GLU 175 N -3.88 1.76 0.31 3.54 2.02 -1.26 -4.86 118.70 116.33 3bwo s GLU 175 Ca 0.34 -1.38 -0.30 0.00 0.02 0.00 0.00 54.97 53.66 3bwo s GLU 175 Cb 0.08 0.50 -0.11 0.00 0.10 0.00 0.00 34.13 34.69 3bwo s GLU 175 CO 0.15 -0.76 1.59 0.95 0.02 0.00 0.00 175.26 177.21 3bwo s THR 176 N -3.52 2.01 -0.83 3.63 -4.23 -1.26 -4.90 115.64 106.54 3bwo s THR 176 Ca 0.22 0.01 0.11 0.00 -1.18 0.00 0.00 61.69 60.86 3bwo s THR 176 Cb -0.02 -3.01 -0.05 0.00 1.34 0.00 0.00 72.50 70.77 3bwo s THR 176 CO 0.12 0.00 0.59 1.33 -0.54 0.00 0.00 174.62 176.12 3bwo n VAL 177 N 1.87 0.00 0.00 2.29 0.24 -1.26 -5.20 118.33 116.27 3bwo n VAL 177 Ca 0.07 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 3bwo n VAL 177 Cb 0.37 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.83 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 -0.62 0.00 0.00 3.34 3.14 -1.26 -4.80 118.33 118.13 3bwo n VAL 178 Ca 0.04 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 3bwo n VAL 178 Cb 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.99 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 -2.49 1.55 0.00 -1.26 -5.16 120.51 110.15 3bwo n ALA 186 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 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 0.00 1.71 0.02 0.00 -0.14 0.79 -4.97 119.74 117.14 3bwo s LYS 187 Ca 0.00 -1.83 0.01 0.00 -1.36 0.00 0.00 55.97 52.79 3bwo s LYS 187 Cb 0.00 -1.66 -0.02 0.00 -1.68 0.00 0.00 37.83 34.47 3bwo s LYS 187 CO 0.00 0.23 -0.04 0.08 -0.76 0.00 0.00 175.35 174.85 3bwo s VAL 188 N -2.61 0.26 -0.08 3.17 1.01 -1.26 -0.77 120.40 120.12 3bwo s VAL 188 Ca 0.31 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.55 3bwo s VAL 188 Cb -0.01 -0.34 0.02 0.00 0.00 0.00 0.00 36.38 36.04 3bwo s VAL 188 CO 0.15 -0.32 -0.11 -0.63 0.00 0.00 0.00 175.10 174.18 3bwo s ILE 189 N -1.07 1.13 -0.29 2.22 1.01 -0.46 -4.45 121.20 119.29 3bwo s ILE 189 Ca -0.10 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.01 3bwo s ILE 189 Cb -0.08 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 3bwo s ILE 189 CO -0.00 0.36 0.13 -1.00 0.00 0.00 0.00 174.94 174.43 3bwo s HIS 190 N 0.88 3.16 -0.52 3.97 3.76 -0.36 -0.62 115.29 125.55 3bwo s HIS 190 Ca -0.10 -0.46 -0.16 0.00 -0.15 0.00 0.00 55.06 54.19 3bwo s HIS 190 Cb -0.15 -2.33 0.11 0.00 1.11 0.00 0.00 32.58 31.33 3bwo s HIS 190 CO 0.01 -0.40 0.47 0.34 -0.85 0.00 0.00 174.74 174.31 3bwo s ASP 191 N 1.63 6.17 -0.66 1.40 -1.08 0.50 0.33 116.67 124.97 3bwo s ASP 191 Ca 0.05 -1.67 -0.00 0.00 -0.52 0.00 0.00 52.55 50.41 3bwo s ASP 191 Cb -0.16 -2.20 0.42 0.00 -1.46 0.00 0.00 42.92 39.51 3bwo s ASP 191 CO 0.06 -0.80 1.83 0.49 0.52 0.00 0.00 175.17 177.27 3bwo n PHE 192 N 5.23 3.11 -0.26 -5.34 3.72 -0.33 -2.03 117.46 121.56 3bwo n PHE 192 Ca -0.14 -2.70 0.04 0.00 -0.05 0.00 0.00 57.45 54.61 3bwo n PHE 192 Cb 0.41 -1.08 0.18 0.00 -0.94 0.00 0.00 39.48 38.05 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 2.41 1.09 -0.64 4.37 0.00 -1.82 -1.88 119.26 122.80 3bwo h ALA 193 Ca 0.53 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.53 3bwo h ALA 193 Cb 0.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3bwo h ALA 193 CO 1.36 -0.11 0.00 0.66 0.00 0.00 0.00 179.25 181.16 3bwo n TYR 194 N -4.91 1.02 -1.65 0.00 4.01 -1.26 -4.61 117.16 109.76 3bwo n TYR 194 Ca 0.14 -0.54 -0.41 0.00 -0.16 0.00 0.00 57.90 56.93 3bwo n TYR 194 Cb 0.36 -0.07 -0.01 0.00 -0.31 0.00 0.00 39.34 39.31 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 1.29 3.07 -4.20 -0.72 9.36 -0.71 -4.47 117.16 120.77 3bwo n TYR 195 Ca 0.23 -3.00 -0.17 0.00 3.32 0.00 0.00 57.90 58.28 3bwo n TYR 195 Cb 0.66 -2.46 -0.11 0.00 -0.63 0.00 0.00 39.34 36.80 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 2.42 1.22 0.39 2.98 0.52 -1.26 -4.98 118.94 120.23 3bwo s TRP 196 Ca 0.55 -0.57 0.19 0.00 0.02 0.00 0.00 56.10 56.28 3bwo s TRP 196 Cb 0.15 -0.66 1.13 0.00 -1.15 0.00 0.00 33.47 32.95 3bwo s TRP 196 CO -0.07 0.07 1.72 -1.35 0.02 0.00 0.00 176.95 177.34 3bwo h PRO 197 N 3.70 0.34 0.00 4.98 0.11 -1.90 0.28 132.00 139.52 3bwo h PRO 197 Ca -0.39 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3bwo h PRO 197 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3bwo h PRO 197 CO 0.49 0.23 0.00 -2.39 -0.21 0.00 0.00 178.00 176.12 3bwo n HIS 198 N -4.74 0.00 -0.09 0.65 1.44 -1.26 -3.88 115.22 107.34 3bwo n HIS 198 Ca 0.29 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.84 3bwo n HIS 198 Cb 0.98 -0.44 -0.07 0.00 0.12 0.00 0.00 29.99 30.58 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 -1.44 0.00 -3.77 -1.40 4.01 0.01 -4.22 117.16 110.36 3bwo n TYR 199 Ca 0.08 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.71 3bwo n TYR 199 Cb 0.27 -0.65 -0.07 0.00 -0.31 0.00 0.00 39.34 38.58 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 -2.33 0.09 0.37 -0.72 -1.32 -0.75 0.28 115.64 111.25 3bwo s THR 200 Ca -0.24 -0.72 -0.26 0.00 -1.21 0.00 0.00 61.69 59.26 3bwo s THR 200 Cb 0.08 -0.94 -0.09 0.00 -1.51 0.00 0.00 72.50 70.04 3bwo s THR 200 CO 0.35 -0.40 1.10 -2.16 -2.21 0.00 0.00 174.62 171.30 3bwo s PRO 201 N -2.60 4.26 -0.96 7.08 0.04 -1.26 -3.77 135.00 137.79 3bwo s PRO 201 Ca -0.05 1.70 -0.20 0.00 0.04 0.00 0.00 61.00 62.50 3bwo s PRO 201 Cb -0.01 -2.77 0.11 0.00 0.04 0.00 0.00 34.50 31.87 3bwo s PRO 201 CO -0.04 -0.10 1.23 0.42 0.04 0.00 0.00 177.00 178.55 3bwo s ILE 202 N -1.44 4.50 -0.10 0.56 -1.09 -1.26 -4.81 121.20 117.57 3bwo s ILE 202 Ca 0.54 -1.37 0.24 0.00 -2.23 0.00 0.00 60.65 57.83 3bwo s ILE 202 Cb -0.28 -4.86 0.26 0.00 -1.58 0.00 0.00 42.46 35.99 3bwo s ILE 202 CO 0.35 -1.64 1.71 0.71 -1.23 0.00 0.00 174.94 174.85 3bwo h THR 203 N 6.09 0.36 -1.81 2.92 1.35 -1.94 -0.79 112.91 119.09 3bwo h THR 203 Ca 0.17 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 3bwo h THR 203 Cb 1.02 1.93 -0.21 0.00 -1.73 0.00 0.00 68.15 69.15 3bwo h THR 203 CO 1.20 0.18 0.34 0.00 -0.25 0.00 0.00 175.52 176.99 3bwo s ARG 204 N -3.38 0.85 -0.78 4.72 1.70 -1.26 -4.91 118.95 115.89 3bwo s ARG 204 Ca 0.03 0.26 -0.26 0.00 -0.47 0.00 0.00 55.73 55.29 3bwo s ARG 204 Cb 0.08 0.40 0.03 0.00 -0.57 0.00 0.00 34.95 34.89 3bwo s ARG 204 CO 0.65 -0.25 1.36 0.50 -1.08 0.00 0.00 175.30 176.48 3bwo s ARG 205 N -1.03 3.20 0.47 3.89 3.52 -1.25 -4.78 118.95 122.98 3bwo s ARG 205 Ca -0.06 -0.32 -0.23 0.00 -0.13 0.00 0.00 55.73 54.99 3bwo s ARG 205 Cb -0.01 -4.39 -0.09 0.00 -1.56 0.00 0.00 34.95 28.90 3bwo s ARG 205 CO 0.06 -2.22 1.00 1.04 -0.81 0.00 0.00 175.30 174.37 3bwo n GLN 206 N 9.28 1.27 -2.76 5.12 1.13 -0.68 -4.54 117.38 126.20 3bwo n GLN 206 Ca 0.09 0.46 -0.07 0.00 -1.94 0.00 0.00 57.00 55.54 3bwo n GLN 206 Cb 0.49 -2.10 0.04 0.00 0.11 0.00 0.00 30.24 28.79 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 0.16 -3.00 -3.54 1.08 2.03 -1.26 0.37 116.55 112.38 3bwo n ASP 207 Ca 0.10 -3.21 -0.15 0.00 0.52 0.00 0.00 54.79 52.05 3bwo n ASP 207 Cb 0.42 1.79 -0.01 0.00 -0.72 0.00 0.00 41.12 42.60 3bwo n ASP 207 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 3bwo n HIS 208 N 1.95 -0.59 0.02 -0.67 8.25 -1.26 -5.06 115.22 117.86 3bwo n HIS 208 Ca 0.11 -1.31 -0.14 0.00 -0.26 0.00 0.00 57.72 56.12 3bwo n HIS 208 Cb 0.61 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 31.46 3bwo n HIS 208 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3bwo h ASP 209 N 0.44 0.74 -3.10 0.41 3.32 -1.90 -3.43 116.42 112.90 3bwo h ASP 209 Ca -0.20 -0.50 -0.48 0.00 0.02 0.00 0.00 57.03 55.87 3bwo h ASP 209 Cb 0.70 -0.22 -0.41 0.00 0.22 0.00 0.00 39.33 39.63 3bwo h ASP 209 CO 0.32 1.28 -0.76 -0.63 -1.72 0.00 0.00 179.24 177.74 3bwo s ILE 210 N -3.63 0.09 -0.16 0.35 1.01 -1.26 -1.71 121.20 115.89 3bwo s ILE 210 Ca -0.08 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.27 3bwo s ILE 210 Cb 0.09 -0.73 0.01 0.00 0.01 0.00 0.00 42.46 41.84 3bwo s ILE 210 CO 0.88 -0.28 -0.17 -0.04 0.00 0.00 0.00 174.94 175.32 3bwo s MET 211 N 2.05 3.12 -0.13 2.79 -1.94 -0.41 -1.23 119.30 123.56 3bwo s MET 211 Ca 0.02 -0.79 -0.07 0.00 -1.71 0.00 0.00 55.69 53.14 3bwo s MET 211 Cb -0.16 -2.59 -0.04 0.00 2.01 0.00 0.00 34.83 34.04 3bwo s MET 211 CO -0.10 -0.07 0.13 -0.51 -0.01 0.00 0.00 175.02 174.45 3bwo s LEU 212 N 1.00 4.29 0.02 -0.03 1.02 0.15 -0.58 118.68 124.56 3bwo s LEU 212 Ca -0.02 0.41 0.01 0.00 0.02 0.00 0.00 54.13 54.55 3bwo s LEU 212 Cb -0.15 -2.05 -0.02 0.00 0.02 0.00 0.00 46.19 44.00 3bwo s LEU 212 CO -0.04 0.38 -0.05 -0.36 0.02 0.00 0.00 176.35 176.29 3bwo s PHE 213 N -0.84 0.47 -0.03 0.29 0.08 -0.44 -1.19 117.98 116.33 3bwo s PHE 213 Ca 0.14 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 56.90 3bwo s PHE 213 Cb -0.12 -0.30 -0.01 0.00 -0.57 0.00 0.00 43.02 42.02 3bwo s PHE 213 CO 0.03 -0.07 -0.22 -0.08 -0.10 0.00 0.00 175.22 174.78 3bwo s THR 214 N -0.92 1.75 0.06 0.64 -1.32 -1.26 -1.21 115.64 113.38 3bwo s THR 214 Ca -0.07 -0.92 0.20 0.00 -1.21 0.00 0.00 61.69 59.69 3bwo s THR 214 Cb -0.07 -1.47 0.17 0.00 -1.51 0.00 0.00 72.50 69.62 3bwo s THR 214 CO -0.00 0.49 1.71 0.15 -2.21 0.00 0.00 174.62 174.76 3bwo h PHE 215 N 5.85 0.00 0.00 9.09 -0.00 -1.63 -3.29 116.94 126.96 3bwo h PHE 215 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.60 3bwo h PHE 215 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 3bwo h PHE 215 CO 0.41 0.32 0.00 0.43 -0.00 0.00 0.00 178.31 179.47 3bwo n SER 216 N -3.39 0.01 0.00 0.41 7.64 -1.26 -3.19 113.62 113.85 3bwo n SER 216 Ca 0.01 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.83 3bwo n SER 216 Cb 0.52 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 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 -0.10 0.00 0.65 0.44 5.41 -1.24 -2.01 119.36 122.51 3bwo n ILE 218 Ca 0.00 0.00 0.10 0.00 1.00 0.00 0.00 62.75 63.85 3bwo n ILE 218 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.80 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 0.00 -0.29 1.39 -2.24 -1.19 -4.99 114.28 106.96 3bwo n THR 219 Ca 0.00 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3bwo n THR 219 Cb 0.00 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 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 1.43 0.73 2.46 3.38 0.00 -0.85 -4.76 105.19 107.58 3bwo n GLY 220 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.12 2.68 0.03 1.61 8.25 -1.25 -4.65 115.22 119.77 3bwo n HIS 221 Ca 0.00 -2.98 -0.01 0.00 -0.26 0.00 0.00 57.72 54.47 3bwo n HIS 221 Cb 0.00 -2.29 0.29 0.00 1.12 0.00 0.00 29.99 29.10 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 5.11 1.31 0.00 -1.41 0.00 -1.84 -2.34 119.26 120.10 3bwo h ALA 222 Ca 0.75 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.41 3bwo h ALA 222 Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3bwo h ALA 222 CO 1.71 0.46 0.00 0.41 0.00 0.00 0.00 179.25 181.83 3bwo n GLY 223 N -0.70 -0.75 0.18 0.00 0.00 -1.26 -1.64 105.19 101.00 3bwo n GLY 223 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.13 3bwo n GLY 223 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3bwo h SER 224 N 0.00 0.00 -6.08 1.61 0.02 -1.81 -3.48 113.55 103.81 3bwo h SER 224 Ca 0.00 -0.01 -0.25 0.00 -0.84 0.00 0.00 61.79 60.69 3bwo h SER 224 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 3bwo h SER 224 CO 0.00 0.00 -0.57 0.54 -1.14 0.00 0.00 176.83 175.67 3bwo n ARG 225 N -2.80 -1.43 -3.77 3.45 5.12 -0.65 -4.83 116.66 111.74 3bwo n ARG 225 Ca 0.04 1.11 -0.14 0.00 -1.93 0.00 0.00 57.85 56.92 3bwo n ARG 225 Cb 0.50 -3.99 -0.15 0.00 -1.16 0.00 0.00 32.46 27.66 3bwo n ARG 225 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3bwo s ILE 226 N -3.01 -0.05 0.11 0.55 -1.09 -1.26 -2.26 121.20 114.20 3bwo s ILE 226 Ca 0.01 0.18 -0.09 0.00 -2.23 0.00 0.00 60.65 58.52 3bwo s ILE 226 Cb -0.00 -0.14 -0.00 0.00 -1.58 0.00 0.00 42.46 40.73 3bwo s ILE 226 CO 0.83 0.08 0.23 -0.83 -1.23 0.00 0.00 174.94 174.01 3bwo s GLY 227 N 1.01 0.19 0.03 6.18 0.00 -0.51 -1.48 107.32 112.74 3bwo s GLY 227 Ca -0.08 -0.66 0.01 0.00 0.00 0.00 0.00 44.72 43.98 3bwo s GLY 227 CO -0.04 -0.79 -0.05 0.66 0.00 0.00 0.00 173.10 172.89 3bwo s TRP 228 N -3.89 0.44 -0.01 1.90 -2.14 -0.35 -1.11 118.94 113.78 3bwo s TRP 228 Ca 0.08 -0.56 0.07 0.00 2.66 0.00 0.00 56.10 58.35 3bwo s TRP 228 Cb 0.04 -0.29 -0.02 0.00 -3.10 0.00 0.00 33.47 30.11 3bwo s TRP 228 CO -0.08 -0.16 -0.23 0.00 -2.66 0.00 0.00 176.95 173.82 3bwo s ALA 229 N -1.64 1.92 -0.34 2.67 0.00 0.62 -1.32 121.76 123.66 3bwo s ALA 229 Ca -0.12 -1.00 -0.09 0.00 0.00 0.00 0.00 51.96 50.74 3bwo s ALA 229 Cb -0.08 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.57 3bwo s ALA 229 CO -0.01 0.47 0.16 -0.51 0.00 0.00 0.00 175.76 175.87 3bwo s LEU 230 N -0.59 4.41 -0.07 0.00 1.43 0.26 -0.78 118.68 123.34 3bwo s LEU 230 Ca 0.09 -0.88 0.05 0.00 -1.03 0.00 0.00 54.13 52.37 3bwo s LEU 230 Cb -0.09 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 3bwo s LEU 230 CO -0.01 -0.31 -0.24 -0.69 0.23 0.00 0.00 176.35 175.33 3bwo s VAL 231 N 1.54 2.09 -0.17 -1.59 1.01 0.01 -1.29 120.40 122.00 3bwo s VAL 231 Ca 0.02 -1.04 -0.17 0.00 0.00 0.00 0.00 61.98 60.79 3bwo s VAL 231 Cb -0.18 -1.76 -0.14 0.00 0.00 0.00 0.00 36.38 34.29 3bwo s VAL 231 CO 0.05 0.57 0.18 0.11 0.00 0.00 0.00 175.10 176.01 3bwo h LYS 232 N 6.25 0.00 -6.07 2.72 1.57 -1.62 0.24 116.57 119.66 3bwo h LYS 232 Ca -0.28 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.94 3bwo h LYS 232 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 3bwo h LYS 232 CO 0.47 0.62 1.40 0.34 -0.57 0.00 0.00 179.45 181.71 3bwo s ASP 233 N -6.30 5.51 0.43 0.86 -1.08 -1.26 -4.73 116.67 110.11 3bwo s ASP 233 Ca -0.20 1.41 0.14 0.00 -0.52 0.00 0.00 52.55 53.39 3bwo s ASP 233 Cb 0.03 -2.52 1.04 0.00 -1.46 0.00 0.00 42.92 40.01 3bwo s ASP 233 CO 0.44 -1.99 1.97 0.50 0.52 0.00 0.00 175.17 176.61 3bwo h LYS 234 N 14.62 0.40 0.00 4.34 3.64 -1.99 0.13 116.57 137.70 3bwo h LYS 234 Ca -0.35 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.91 3bwo h LYS 234 Cb 1.20 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 3bwo h LYS 234 CO 1.03 0.26 -0.45 1.49 -2.27 0.00 0.00 179.45 179.51 3bwo h GLU 235 N 0.41 0.00 0.02 1.90 4.57 -1.99 -0.79 114.58 118.70 3bwo h GLU 235 Ca 0.30 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.48 3bwo h GLU 235 Cb 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 3bwo h GLU 235 CO -0.08 0.45 -0.01 0.28 -1.18 0.00 0.00 179.01 178.47 3bwo h VAL 236 N 0.00 1.44 -0.98 0.32 2.07 -1.39 -2.88 116.25 114.82 3bwo h VAL 236 Ca -0.00 -1.57 0.11 0.00 0.82 0.00 0.00 66.70 66.05 3bwo h VAL 236 Cb 0.82 2.47 -0.08 0.00 -1.52 0.00 0.00 31.29 32.98 3bwo h VAL 236 CO 0.06 0.39 0.62 0.00 0.02 0.00 0.00 177.57 178.67 3bwo h ALA 237 N 0.18 1.54 -0.73 1.67 0.00 -1.26 -0.41 119.26 120.26 3bwo h ALA 237 Ca -0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3bwo h ALA 237 Cb 0.67 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3bwo h ALA 237 CO 0.01 0.24 0.31 -0.22 0.00 0.00 0.00 179.25 179.58 3bwo h LYS 238 N 0.99 1.08 -0.06 0.00 3.64 -1.16 -1.65 116.57 119.41 3bwo h LYS 238 Ca 0.47 -0.18 -0.15 0.00 -1.27 0.00 0.00 60.65 59.52 3bwo h LYS 238 Cb 0.44 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 3bwo h LYS 238 CO -0.23 0.87 -0.61 0.87 -2.27 0.00 0.00 179.45 178.08 3bwo h LYS 239 N 1.04 0.22 -0.41 1.90 1.79 -1.09 -2.32 116.57 117.69 3bwo h LYS 239 Ca 0.25 -0.15 -0.08 0.00 -2.18 0.00 0.00 60.65 58.49 3bwo h LYS 239 Cb 0.18 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3bwo h LYS 239 CO -0.02 0.76 -0.04 0.52 -1.08 0.00 0.00 179.45 179.58 3bwo h MET 240 N 0.16 0.74 -0.40 3.15 2.86 -0.75 -0.04 114.93 120.65 3bwo h MET 240 Ca -0.01 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 3bwo h MET 240 Cb 1.11 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 3bwo h MET 240 CO 0.09 0.85 0.20 0.28 1.06 0.00 0.00 176.91 179.39 3bwo h VAL 241 N 0.57 1.17 -1.00 -2.22 2.07 -1.28 -1.23 116.25 114.33 3bwo h VAL 241 Ca 0.11 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.19 3bwo h VAL 241 Cb 0.54 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 3bwo h VAL 241 CO 0.03 0.18 0.66 -0.33 0.02 0.00 0.00 177.57 178.12 3bwo h GLU 242 N 0.50 1.27 -0.17 1.57 5.08 -1.20 -0.37 114.58 121.27 3bwo h GLU 242 Ca 0.14 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3bwo h GLU 242 Cb 0.10 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3bwo h GLU 242 CO -0.02 0.84 0.10 -0.92 -1.00 0.00 0.00 179.01 178.01 3bwo h TYR 243 N 1.31 0.22 -0.54 4.33 3.20 -0.55 -2.31 116.97 122.63 3bwo h TYR 243 Ca 0.38 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.19 3bwo h TYR 243 Cb -0.08 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.09 3bwo h TYR 243 CO -0.00 0.18 0.10 0.82 -1.64 0.00 0.00 178.16 177.62 3bwo h ILE 244 N 0.20 1.23 -0.28 1.81 2.04 -0.60 0.17 117.51 122.07 3bwo h ILE 244 Ca 0.06 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.06 3bwo h ILE 244 Cb 0.02 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 3bwo h ILE 244 CO -0.01 0.33 0.12 0.40 0.00 0.00 0.00 178.15 178.98 3bwo h ILE 245 N 0.82 0.95 -0.14 -0.67 2.04 -0.87 -0.68 117.51 118.96 3bwo h ILE 245 Ca 0.17 -0.09 -0.19 0.00 1.00 0.00 0.00 64.86 65.75 3bwo h ILE 245 Cb 0.35 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3bwo h ILE 245 CO 0.00 0.05 -0.70 0.58 0.00 0.00 0.00 178.15 178.08 3bwo h VAL 246 N 0.26 1.32 0.00 1.67 2.07 -1.23 0.28 116.25 120.63 3bwo h VAL 246 Ca 0.12 -1.98 -0.06 0.00 0.82 0.00 0.00 66.70 65.60 3bwo h VAL 246 Cb 0.07 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 3bwo h VAL 246 CO -0.11 0.62 -0.29 -1.13 0.02 0.00 0.00 177.57 176.68 3bwo h ASN 247 N 0.43 0.00 0.00 0.57 -0.00 -0.80 -3.41 115.58 112.37 3bwo h ASN 247 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.27 3bwo h ASN 247 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.61 3bwo h ASN 247 CO 0.13 0.29 0.00 -1.54 -0.00 0.00 0.00 177.43 176.31 3bwo n SER 248 N -3.68 0.00 -4.11 1.15 3.41 -0.31 -5.03 113.62 105.05 3bwo n SER 248 Ca -0.01 -0.34 -0.34 0.00 -0.26 0.00 0.00 58.87 57.92 3bwo n SER 248 Cb 0.40 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.39 0.00 -1.33 5.41 0.99 -4.71 119.36 117.33 3bwo n ILE 249 Ca 0.00 -0.57 0.00 0.00 1.00 0.00 0.00 62.75 63.18 3bwo n ILE 249 Cb 0.17 -2.04 0.00 0.00 -0.71 0.00 0.00 39.64 37.06 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 -2.24 -1.83 3.31 7.39 0.00 -1.22 -4.92 105.19 105.68 3bwo n GLY 250 Ca -0.24 -2.10 -0.22 0.00 0.00 0.00 0.00 46.02 43.45 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 -0.17 1.75 -0.24 1.61 1.01 -1.26 -4.84 120.40 118.26 3bwo s VAL 251 Ca 0.00 -1.75 -0.38 0.00 0.00 0.00 0.00 61.98 59.85 3bwo s VAL 251 Cb 0.00 -1.71 -0.14 0.00 0.00 0.00 0.00 36.38 34.53 3bwo s VAL 251 CO 0.00 -0.21 1.87 -0.24 0.00 0.00 0.00 175.10 176.51 3bwo n SER 252 N 0.64 2.64 -0.25 3.32 2.88 -1.26 -4.89 113.62 116.70 3bwo n SER 252 Ca -0.16 0.93 -0.05 0.00 -1.33 0.00 0.00 58.87 58.26 3bwo n SER 252 Cb 0.56 -1.22 0.06 0.00 -0.75 0.00 0.00 64.21 62.85 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 8.68 0.94 -0.17 -1.46 6.56 -1.94 -2.57 116.57 126.63 3bwo h LYS 253 Ca -0.44 -0.07 -0.06 0.00 -1.06 0.00 0.00 60.65 59.02 3bwo h LYS 253 Cb 1.31 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 32.75 3bwo h LYS 253 CO 0.97 0.64 -0.18 1.05 -2.06 0.00 0.00 179.45 179.88 3bwo h GLU 254 N 0.96 0.28 -0.57 3.15 9.09 -1.92 0.61 114.58 126.17 3bwo h GLU 254 Ca 0.26 -0.08 -0.03 0.00 0.05 0.00 0.00 59.36 59.56 3bwo h GLU 254 Cb -0.08 -0.03 -0.03 0.00 -1.65 0.00 0.00 28.75 26.96 3bwo h GLU 254 CO -0.05 0.46 0.23 0.77 0.05 0.00 0.00 179.01 180.46 3bwo h SER 255 N 0.26 0.79 0.19 3.06 0.02 -1.82 0.29 113.55 116.34 3bwo h SER 255 Ca 0.05 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3bwo h SER 255 Cb 0.47 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.81 3bwo h SER 255 CO 0.03 0.74 -0.09 1.56 -1.14 0.00 0.00 176.83 177.93 3bwo h GLN 256 N 0.78 -0.24 -0.93 3.45 4.20 -0.91 0.82 115.11 122.29 3bwo h GLN 256 Ca 0.19 0.02 0.11 0.00 0.06 0.00 0.00 58.65 59.02 3bwo h GLN 256 Cb 0.20 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 3bwo h GLN 256 CO -0.02 0.04 0.60 0.28 -0.67 0.00 0.00 178.83 179.06 3bwo h VAL 257 N -0.52 0.95 0.01 -0.54 2.07 -0.84 0.39 116.25 117.76 3bwo h VAL 257 Ca -0.03 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 3bwo h VAL 257 Cb 0.40 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 3bwo h VAL 257 CO 0.04 0.17 -0.01 -0.09 0.02 0.00 0.00 177.57 177.70 3bwo h ARG 258 N 0.91 -0.02 -0.90 1.57 2.43 -0.76 -2.83 114.38 114.78 3bwo h ARG 258 Ca 0.44 0.00 0.21 0.00 -0.81 0.00 0.00 59.98 59.82 3bwo h ARG 258 Cb 0.45 0.00 -0.12 0.00 -0.42 0.00 0.00 29.97 29.89 3bwo h ARG 258 CO -0.20 0.68 0.42 1.15 -1.51 0.00 0.00 179.97 180.51 3bwo h THR 259 N -0.75 0.53 -0.73 0.20 2.02 -0.53 0.14 112.91 113.79 3bwo h THR 259 Ca -0.00 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 3bwo h THR 259 Cb 0.71 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3bwo h THR 259 CO 0.00 0.08 0.25 0.00 0.37 0.00 0.00 175.52 176.22 3bwo h ALA 260 N 1.68 0.96 0.96 6.16 0.00 -0.94 -1.44 119.26 126.63 3bwo h ALA 260 Ca 0.55 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 3bwo h ALA 260 Cb 1.00 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.51 3bwo h ALA 260 CO -0.49 0.62 -0.47 -0.22 0.00 0.00 0.00 179.25 178.69 3bwo h LYS 261 N 1.07 -1.25 -0.54 0.00 1.63 -0.48 -2.13 116.57 114.89 3bwo h LYS 261 Ca 0.24 0.09 -0.08 0.00 -0.85 0.00 0.00 60.65 60.05 3bwo h LYS 261 Cb 0.28 0.28 -0.02 0.00 -0.60 0.00 0.00 32.23 32.17 3bwo h LYS 261 CO -0.01 -0.83 0.03 -0.84 -3.45 0.00 0.00 179.45 174.34 3bwo h ILE 262 N -1.29 1.25 -0.39 2.00 3.07 -1.44 -1.09 117.51 119.63 3bwo h ILE 262 Ca -0.13 -1.02 0.07 0.00 1.55 0.00 0.00 64.86 65.32 3bwo h ILE 262 Cb 0.99 0.81 -0.02 0.00 -0.27 0.00 0.00 36.82 38.33 3bwo h ILE 262 CO 0.21 0.37 0.26 -0.07 -1.05 0.00 0.00 178.15 177.87 3bwo h LEU 263 N 0.83 0.21 -0.18 0.16 3.38 -1.25 0.38 115.31 118.84 3bwo h LEU 263 Ca 0.16 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 3bwo h LEU 263 Cb 0.46 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3bwo h LEU 263 CO 0.02 0.14 -0.20 0.78 0.09 0.00 0.00 178.44 179.26 3bwo h ASN 264 N 0.24 0.49 -0.59 -0.43 2.35 -0.53 -1.57 115.58 115.53 3bwo h ASN 264 Ca 0.17 -0.49 -0.01 0.00 -0.55 0.00 0.00 56.30 55.42 3bwo h ASN 264 Cb 0.38 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 3bwo h ASN 264 CO -0.03 0.88 0.33 0.58 -1.65 0.00 0.00 177.43 177.54 3bwo h VAL 265 N 0.10 1.19 0.00 2.81 2.07 -0.33 -0.87 116.25 121.21 3bwo h VAL 265 Ca 0.02 -0.47 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 3bwo h VAL 265 Cb 0.76 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3bwo h VAL 265 CO 0.05 0.21 -0.22 0.25 0.02 0.00 0.00 177.57 177.88 3bwo h LEU 266 N 0.85 0.00 0.10 2.57 6.46 0.01 -1.55 115.31 123.76 3bwo h LEU 266 Ca 0.22 0.00 -0.27 0.00 -0.12 0.00 0.00 57.88 57.70 3bwo h LEU 266 Cb 0.03 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 39.98 3bwo h LEU 266 CO -0.04 0.22 -1.14 0.50 -0.62 0.00 0.00 178.44 177.37 3bwo h LYS 267 N 0.00 0.59 -0.11 1.25 3.64 -0.18 -3.04 116.57 118.73 3bwo h LYS 267 Ca -0.00 -0.77 -0.05 0.00 -1.27 0.00 0.00 60.65 58.56 3bwo h LYS 267 Cb 0.55 0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 3bwo h LYS 267 CO 0.03 1.34 -0.15 0.93 -2.27 0.00 0.00 179.45 179.33 3bwo h GLU 268 N 0.20 0.17 0.00 1.90 5.08 -1.09 -1.89 114.58 118.95 3bwo h GLU 268 Ca -0.17 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.12 3bwo h GLU 268 Cb 1.82 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 31.04 3bwo h GLU 268 CO 0.22 0.33 -0.13 0.00 -1.00 0.00 0.00 179.01 178.43 3bwo h THR 269 N 0.16 0.41 0.00 1.13 1.03 -1.18 -2.92 112.91 111.54 3bwo h THR 269 Ca 0.03 -0.71 0.00 0.00 -0.01 0.00 0.00 66.41 65.72 3bwo h THR 269 Cb 0.37 1.51 0.00 0.00 -1.07 0.00 0.00 68.15 68.96 3bwo h THR 269 CO 0.02 0.13 0.00 0.00 -0.01 0.00 0.00 175.52 175.66 3bwo n LYS 271 N -1.33 2.29 -3.71 0.00 2.85 -1.10 -5.00 118.16 112.16 3bwo n LYS 271 Ca 0.08 -2.44 -0.33 0.00 -1.05 0.00 0.00 58.31 54.57 3bwo n LYS 271 Cb 0.17 -1.51 -0.05 0.00 -0.65 0.00 0.00 35.03 32.99 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 -2.05 6.51 -0.00 -5.58 0.15 -1.00 -5.01 113.70 106.72 3bwo s SER 272 Ca 0.29 0.59 0.21 0.00 0.70 0.00 0.00 55.95 57.75 3bwo s SER 272 Cb 0.24 -2.10 -0.22 0.00 -1.71 0.00 0.00 66.02 62.23 3bwo s SER 272 CO 0.06 0.16 0.86 -1.84 1.20 0.00 0.00 173.24 173.68 3bwo n GLU 273 N 0.65 0.09 -1.85 5.44 0.28 -1.26 -4.57 120.64 119.43 3bwo n GLU 273 Ca -0.07 -0.03 -0.38 0.00 -0.16 0.00 0.00 57.16 56.53 3bwo n GLU 273 Cb 0.52 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 31.93 3bwo n GLU 273 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3bwo s SER 274 N -3.22 5.21 0.26 -1.84 0.15 -1.26 -4.92 113.70 108.07 3bwo s SER 274 Ca 0.06 2.65 0.23 0.00 0.70 0.00 0.00 55.95 59.59 3bwo s SER 274 Cb 0.16 -2.62 0.19 0.00 -1.71 0.00 0.00 66.02 62.03 3bwo s SER 274 CO 0.87 -1.60 1.28 -0.08 1.20 0.00 0.00 173.24 174.91 3bwo h GLU 275 N 1.26 0.00 -0.16 5.44 4.57 -1.91 -2.93 114.58 120.85 3bwo h GLU 275 Ca -0.51 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 3bwo h GLU 275 Cb 1.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 3bwo h GLU 275 CO 0.56 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 177.26 3bwo n SER 276 N -2.69 3.12 -0.05 1.04 3.41 -1.26 -3.57 113.62 113.61 3bwo n SER 276 Ca 0.02 -1.98 -0.06 0.00 -0.26 0.00 0.00 58.87 56.60 3bwo n SER 276 Cb 0.52 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 3bwo n SER 276 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3bwo n GLU 277 N 1.37 0.33 -1.57 4.33 -0.58 -1.22 -4.90 120.64 118.39 3bwo n GLU 277 Ca 0.16 0.13 -0.42 0.00 -0.42 0.00 0.00 57.16 56.60 3bwo n GLU 277 Cb 0.59 -1.06 -0.04 0.00 -0.57 0.00 0.00 31.44 30.36 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 -3.78 2.94 0.06 1.62 2.85 -1.11 -4.87 115.26 112.97 3bwo n ASN 278 Ca -0.09 0.07 -0.12 0.00 -0.11 0.00 0.00 54.58 54.33 3bwo n ASN 278 Cb 0.32 -1.53 -0.05 0.00 1.24 0.00 0.00 39.78 39.76 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 15.77 -0.94 -0.63 1.20 3.04 -1.88 0.12 116.94 133.62 3bwo h PHE 279 Ca -0.36 0.03 0.04 0.00 3.98 0.00 0.00 57.97 61.66 3bwo h PHE 279 Cb 1.25 0.41 -0.04 0.00 2.56 0.00 0.00 35.95 40.14 3bwo h PHE 279 CO 0.95 -0.43 0.42 0.74 -2.02 0.00 0.00 178.31 177.97 3bwo h PHE 280 N -0.49 0.70 0.24 0.41 0.05 -1.92 0.88 116.94 116.80 3bwo h PHE 280 Ca 0.06 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.86 3bwo h PHE 280 Cb 0.58 -0.23 0.00 0.00 2.00 0.00 0.00 35.95 38.30 3bwo h PHE 280 CO -0.36 0.40 -0.11 -0.22 -0.18 0.00 0.00 178.31 177.83 3bwo h LYS 281 N 0.71 -0.31 -0.58 1.51 3.11 -1.74 -1.21 116.57 118.07 3bwo h LYS 281 Ca 0.26 0.02 0.11 0.00 -2.81 0.00 0.00 60.65 58.23 3bwo h LYS 281 Cb 0.13 0.07 -0.08 0.00 -1.00 0.00 0.00 32.23 31.34 3bwo h LYS 281 CO -0.07 0.05 0.11 -0.92 -2.81 0.00 0.00 179.45 175.80 3bwo h TYR 282 N -0.75 0.17 0.04 1.91 5.03 -0.10 -1.94 116.97 121.33 3bwo h TYR 282 Ca -0.03 0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.33 3bwo h TYR 282 Cb 0.50 0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.77 3bwo h TYR 282 CO 0.04 -0.04 -0.15 0.78 -1.32 0.00 0.00 178.16 177.47 3bwo h GLY 283 N 0.24 -0.22 0.59 1.82 0.00 0.84 -1.78 103.07 104.55 3bwo h GLY 283 Ca 0.30 0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.86 3bwo h GLY 283 CO -0.40 -0.15 0.12 3.21 0.00 0.00 0.00 176.54 179.32 3bwo h ARG 284 N -0.27 0.25 -0.65 4.80 3.08 -0.66 -0.75 114.38 120.19 3bwo h ARG 284 Ca 0.04 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 3bwo h ARG 284 Cb 0.31 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3bwo h ARG 284 CO -0.12 0.17 0.34 1.49 -1.07 0.00 0.00 179.97 180.78 3bwo h GLU 285 N 0.26 0.92 -0.52 0.04 4.57 -1.25 0.43 114.58 119.03 3bwo h GLU 285 Ca 0.19 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 3bwo h GLU 285 Cb 0.19 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 3bwo h GLU 285 CO -0.21 0.71 0.29 1.98 -1.18 0.00 0.00 179.01 180.60 3bwo h MET 286 N 0.89 0.73 -0.41 1.92 4.05 -0.89 -0.06 114.93 121.17 3bwo h MET 286 Ca 0.23 -0.08 -0.11 0.00 -0.28 0.00 0.00 59.70 59.46 3bwo h MET 286 Cb 0.07 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 3bwo h MET 286 CO -0.03 0.55 -0.19 1.98 0.23 0.00 0.00 176.91 179.45 3bwo h MET 287 N 0.70 0.78 -0.06 0.39 -1.53 -0.82 -2.60 114.93 111.80 3bwo h MET 287 Ca 0.19 -0.30 -0.01 0.00 -3.44 0.00 0.00 59.70 56.14 3bwo h MET 287 Cb 0.03 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.04 3bwo h MET 287 CO -0.03 0.91 -0.00 -0.22 0.14 0.00 0.00 176.91 177.71 3bwo h LYS 288 N 0.69 0.11 0.29 0.39 3.64 0.27 -2.04 116.57 119.92 3bwo h LYS 288 Ca 0.10 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3bwo h LYS 288 Cb 0.69 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 3bwo h LYS 288 CO 0.05 0.39 -0.24 -0.97 -2.27 0.00 0.00 179.45 176.41 3bwo h ASN 289 N -0.19 -0.63 -0.84 4.20 -0.73 -1.01 -0.86 115.58 115.52 3bwo h ASN 289 Ca 0.02 0.05 0.11 0.00 1.87 0.00 0.00 56.30 58.35 3bwo h ASN 289 Cb 0.34 0.21 -0.08 0.00 0.27 0.00 0.00 38.32 39.06 3bwo h ASN 289 CO 0.00 -0.36 0.47 0.03 -0.37 0.00 0.00 177.43 177.20 3bwo h ARG 290 N -0.54 0.73 0.00 6.67 3.08 -1.46 -0.87 114.38 121.98 3bwo h ARG 290 Ca -0.02 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3bwo h ARG 290 Cb 0.48 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 3bwo h ARG 290 CO -0.02 0.48 -0.35 -1.49 -1.07 0.00 0.00 179.97 177.51 3bwo h TRP 291 N 0.75 0.00 -0.06 3.04 4.06 -1.04 -1.79 115.95 120.91 3bwo h TRP 291 Ca 0.42 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 61.16 3bwo h TRP 291 Cb 0.45 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.63 3bwo h TRP 291 CO -0.07 0.35 -0.77 0.93 -3.56 0.00 0.00 178.44 175.32 3bwo h GLU 292 N 0.00 0.62 -0.18 0.49 5.08 0.15 -0.77 114.58 119.97 3bwo h GLU 292 Ca -0.00 -0.59 -0.01 0.00 -1.00 0.00 0.00 59.36 57.75 3bwo h GLU 292 Cb 0.76 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 3bwo h GLU 292 CO 0.05 1.21 0.08 0.87 -1.00 0.00 0.00 179.01 180.21 3bwo h LYS 293 N 0.26 0.27 -0.96 2.33 1.57 -1.16 -1.85 116.57 117.02 3bwo h LYS 293 Ca -0.08 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3bwo h LYS 293 Cb 1.43 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.65 3bwo h LYS 293 CO 0.16 0.33 0.63 1.25 -0.57 0.00 0.00 179.45 181.24 3bwo h LEU 294 N 0.15 1.11 -0.80 2.94 5.85 -1.38 -2.27 115.31 120.92 3bwo h LEU 294 Ca 0.06 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3bwo h LEU 294 Cb 0.15 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 3bwo h LEU 294 CO -0.01 0.81 0.52 -0.09 -0.34 0.00 0.00 178.44 179.33 3bwo h ARG 295 N 1.31 0.99 0.87 1.25 9.65 -0.81 -1.08 114.38 126.56 3bwo h ARG 295 Ca 0.35 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 59.13 3bwo h ARG 295 Cb -0.13 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.22 3bwo h ARG 295 CO -0.07 0.66 -0.49 0.93 2.80 0.00 0.00 179.97 183.79 3bwo h GLU 296 N 1.02 -1.22 -0.42 0.20 4.39 -0.80 -0.45 114.58 117.31 3bwo h GLU 296 Ca 0.31 0.08 0.09 0.00 0.34 0.00 0.00 59.36 60.18 3bwo h GLU 296 Cb -0.04 0.28 -0.09 0.00 -0.10 0.00 0.00 28.75 28.80 3bwo h GLU 296 CO -0.09 -0.81 -0.16 0.28 -1.16 0.00 0.00 179.01 177.06 3bwo h VAL 297 N -1.26 0.47 -0.46 3.13 2.07 -1.25 -0.68 116.25 118.28 3bwo h VAL 297 Ca -0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3bwo h VAL 297 Cb 1.00 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 3bwo h VAL 297 CO 0.15 0.00 0.24 0.58 0.02 0.00 0.00 177.57 178.55 3bwo h VAL 298 N -0.07 1.15 0.19 2.57 2.07 -1.14 -2.56 116.25 118.46 3bwo h VAL 298 Ca 0.20 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.34 3bwo h VAL 298 Cb 0.39 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 3bwo h VAL 298 CO -0.47 0.17 -0.39 0.50 0.02 0.00 0.00 177.57 177.39 3bwo h LYS 299 N 0.63 -0.61 -0.03 1.57 1.63 0.52 -2.45 116.57 117.84 3bwo h LYS 299 Ca 0.16 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 3bwo h LYS 299 Cb 0.04 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 3bwo h LYS 299 CO -0.03 -0.41 0.00 -0.85 -3.45 0.00 0.00 179.45 174.72 3bwo n GLU 300 N -4.71 1.14 -1.82 1.90 0.28 -1.13 -4.82 120.64 111.47 3bwo n GLU 300 Ca -0.07 -0.21 -0.31 0.00 -0.16 0.00 0.00 57.16 56.41 3bwo n GLU 300 Cb 0.32 -1.35 0.03 0.00 1.43 0.00 0.00 31.44 31.87 3bwo n GLU 300 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 3bwo s SER 301 N -1.67 5.80 -0.05 -1.84 1.04 -0.92 -5.00 113.70 111.06 3bwo s SER 301 Ca 0.33 1.35 -0.08 0.00 0.48 0.00 0.00 55.95 58.03 3bwo s SER 301 Cb 0.16 -2.29 -0.29 0.00 0.10 0.00 0.00 66.02 63.69 3bwo s SER 301 CO 0.26 -1.14 0.66 0.44 0.98 0.00 0.00 173.24 174.44 3bwo h ASP 302 N -0.51 0.52 -0.00 7.02 3.32 -1.88 -3.42 116.42 121.48 3bwo h ASP 302 Ca -0.44 -0.83 0.00 0.00 0.02 0.00 0.00 57.03 55.78 3bwo h ASP 302 Cb 1.22 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.60 3bwo h ASP 302 CO 0.62 1.70 -0.02 0.00 -1.72 0.00 0.00 179.24 179.82 3bwo n ALA 303 N -2.83 2.20 -1.91 3.45 0.00 -1.26 -4.98 120.51 115.18 3bwo n ALA 303 Ca -0.24 -0.16 -0.39 0.00 0.00 0.00 0.00 53.44 52.66 3bwo n ALA 303 Cb 1.06 -0.02 -0.06 0.00 0.00 0.00 0.00 19.45 20.43 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 -0.76 3.85 0.30 0.00 0.08 -1.26 -1.47 117.98 118.71 3bwo s PHE 304 Ca 0.00 1.69 0.10 0.00 0.12 0.00 0.00 56.93 58.85 3bwo s PHE 304 Cb 0.00 -2.82 -0.06 0.00 -0.57 0.00 0.00 43.02 39.57 3bwo s PHE 304 CO 0.02 0.42 -0.15 0.95 -0.10 0.00 0.00 175.22 176.36 3bwo s THR 305 N -1.31 2.28 -0.10 0.64 -4.23 -0.95 -4.85 115.64 107.11 3bwo s THR 305 Ca 0.41 -2.30 -0.08 0.00 -1.18 0.00 0.00 61.69 58.53 3bwo s THR 305 Cb -0.22 -2.42 0.03 0.00 1.34 0.00 0.00 72.50 71.23 3bwo s THR 305 CO 0.26 -0.33 0.26 -0.22 -0.54 0.00 0.00 174.62 174.05 3bwo s LEU 306 N -3.53 0.87 0.49 4.79 2.96 -1.26 -2.84 118.68 120.16 3bwo s LEU 306 Ca 0.30 0.54 -0.24 0.00 -0.22 0.00 0.00 54.13 54.51 3bwo s LEU 306 Cb -0.01 0.89 -0.07 0.00 0.50 0.00 0.00 46.19 47.49 3bwo s LEU 306 CO 0.15 -0.11 1.41 -2.84 -1.32 0.00 0.00 176.35 173.64 3bwo s PRO 307 N 0.36 3.46 -0.15 0.98 0.02 -1.26 -5.01 135.00 133.41 3bwo s PRO 307 Ca -0.02 2.36 -0.07 0.00 0.02 0.00 0.00 61.00 63.29 3bwo s PRO 307 Cb -0.03 -2.50 -0.04 0.00 0.02 0.00 0.00 34.50 31.95 3bwo s PRO 307 CO -0.01 -0.97 0.10 0.15 -0.33 0.00 0.00 177.00 175.93 3bwo s LYS 308 N -2.63 3.67 -0.13 5.54 1.02 -1.26 -5.08 119.74 120.86 3bwo s LYS 308 Ca 0.65 -0.24 -0.00 0.00 0.02 0.00 0.00 55.97 56.40 3bwo s LYS 308 Cb -0.43 -3.19 -0.01 0.00 -0.52 0.00 0.00 37.83 33.68 3bwo s LYS 308 CO 0.53 0.55 -0.13 0.71 -0.92 0.00 0.00 175.35 176.09 3bwo s TYR 309 N -0.39 2.81 0.75 3.18 2.02 -1.26 -5.12 117.35 119.35 3bwo s TYR 309 Ca 0.11 -0.67 -0.13 0.00 -0.37 0.00 0.00 57.07 56.01 3bwo s TYR 309 Cb -0.12 -1.85 0.05 0.00 -0.40 0.00 0.00 41.96 39.64 3bwo s TYR 309 CO 0.01 -0.23 1.13 -1.25 -1.57 0.00 0.00 175.55 173.64 3bwo s PRO 310 N 0.40 2.20 0.36 -1.71 0.04 -1.26 -4.81 135.00 130.22 3bwo s PRO 310 Ca -0.10 1.42 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 3bwo s PRO 310 Cb -0.16 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 3bwo s PRO 310 CO 0.05 -1.72 0.81 -2.00 0.04 0.00 0.00 177.00 174.18 3bwo s GLU 311 N -4.41 4.07 0.12 4.56 2.12 -1.26 -4.57 118.70 119.33 3bwo s GLU 311 Ca 0.66 0.81 -0.10 0.00 0.36 0.00 0.00 54.97 56.71 3bwo s GLU 311 Cb -0.21 -2.35 0.00 0.00 0.26 0.00 0.00 34.13 31.83 3bwo s GLU 311 CO 0.50 0.09 0.26 0.00 -0.54 0.00 0.00 175.26 175.57 3bwo s ALA 312 N -2.06 -0.26 0.08 6.30 0.00 -1.10 -4.94 121.76 119.78 3bwo s ALA 312 Ca 0.57 -0.62 -0.26 0.00 0.00 0.00 0.00 51.96 51.65 3bwo s ALA 312 Cb -0.10 0.65 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 3bwo s ALA 312 CO 0.16 -0.58 0.79 0.12 0.00 0.00 0.00 175.76 176.25 3bwo s PHE 313 N -3.89 3.79 -0.29 0.00 2.19 -1.26 0.12 117.98 118.64 3bwo s PHE 313 Ca 0.09 1.55 -0.08 0.00 0.33 0.00 0.00 56.93 58.82 3bwo s PHE 313 Cb 0.04 -2.83 -0.01 0.00 -1.31 0.00 0.00 43.02 38.90 3bwo s PHE 313 CO -0.07 0.33 0.11 0.00 1.83 0.00 0.00 175.22 177.41 3bwo h ASN 315 N 8.28 0.00 0.00 0.00 2.35 -1.42 0.88 115.58 125.67 3bwo h ASN 315 Ca -0.34 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.38 3bwo h ASN 315 Cb 1.15 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.52 3bwo h ASN 315 CO 0.60 0.00 -0.23 0.22 -1.65 0.00 0.00 177.43 176.37 3bwo h TYR 316 N 0.00 0.00 0.00 1.19 3.20 -1.82 -3.37 116.97 116.16 3bwo h TYR 316 Ca 0.00 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 3bwo h TYR 316 Cb 0.35 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3bwo h TYR 316 CO 0.00 0.48 -0.48 0.74 -1.64 0.00 0.00 178.16 177.26 3bwo h PHE 317 N -1.00 0.00 0.00 -3.82 0.04 -1.95 -3.48 116.94 106.73 3bwo h PHE 317 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3bwo h PHE 317 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 3bwo h PHE 317 CO 0.06 0.48 0.00 0.41 -0.60 0.00 0.00 178.31 178.66 3bwo n GLY 318 N 0.88 0.54 3.60 -1.45 0.00 0.30 -5.03 105.19 104.03 3bwo n GLY 318 Ca 0.01 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.11 1.92 -0.25 1.61 1.02 -1.17 -4.87 119.74 117.89 3bwo s LYS 319 Ca 0.00 -2.11 -0.08 0.00 0.02 0.00 0.00 55.97 53.80 3bwo s LYS 319 Cb 0.00 -1.39 -0.03 0.00 -0.52 0.00 0.00 37.83 35.89 3bwo s LYS 319 CO 0.00 -0.15 0.09 -1.54 -0.92 0.00 0.00 175.35 172.83 3bwo s SER 320 N -3.68 5.29 0.24 2.83 1.04 -1.26 0.13 113.70 118.30 3bwo s SER 320 Ca 0.30 -0.17 -0.07 0.00 0.48 0.00 0.00 55.95 56.49 3bwo s SER 320 Cb 0.08 -1.96 -0.02 0.00 0.10 0.00 0.00 66.02 64.23 3bwo s SER 320 CO 0.15 -0.04 0.34 -1.48 0.98 0.00 0.00 173.24 173.20 3bwo s LEU 321 N 1.64 0.72 0.74 2.42 2.34 0.32 -4.83 118.68 122.04 3bwo s LEU 321 Ca 0.06 -1.17 -0.11 0.00 0.06 0.00 0.00 54.13 52.97 3bwo s LEU 321 Cb -0.15 1.20 0.04 0.00 -0.56 0.00 0.00 46.19 46.71 3bwo s LEU 321 CO 0.05 -1.04 1.08 -1.61 -1.06 0.00 0.00 176.35 173.77 3bwo s GLU 322 N -3.97 2.54 -0.07 1.48 0.41 -1.26 -2.70 118.70 115.13 3bwo s GLU 322 Ca 0.30 0.73 -0.03 0.00 -0.41 0.00 0.00 54.97 55.56 3bwo s GLU 322 Cb 0.02 -1.96 -0.04 0.00 -1.78 0.00 0.00 34.13 30.37 3bwo s GLU 322 CO 0.12 -1.32 0.07 -1.12 -0.49 0.00 0.00 175.26 172.52 3bwo s SER 323 N -3.94 5.77 -0.54 -0.19 0.01 -1.26 -4.59 113.70 108.96 3bwo s SER 323 Ca 0.59 0.26 0.04 0.00 1.31 0.00 0.00 55.95 58.15 3bwo s SER 323 Cb -0.14 -1.73 0.17 0.00 0.21 0.00 0.00 66.02 64.54 3bwo s SER 323 CO 0.54 0.35 0.41 -1.22 0.41 0.00 0.00 173.24 173.74 3bwo n TYR 324 N 1.78 0.88 -1.04 2.43 4.02 0.14 -4.93 117.16 120.44 3bwo n TYR 324 Ca -0.17 -3.74 -0.35 0.00 -0.01 0.00 0.00 57.90 53.63 3bwo n TYR 324 Cb 0.54 -0.12 0.10 0.00 -0.02 0.00 0.00 39.34 39.83 3bwo n TYR 324 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 3bwo n PRO 325 N 2.43 0.03 0.00 -0.72 -0.02 -1.26 -4.67 135.00 130.80 3bwo n PRO 325 Ca 0.26 0.06 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 3bwo n PRO 325 Cb 0.42 -1.87 0.58 0.00 -0.02 0.00 0.00 33.50 32.62 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 -2.98 2.26 -2.68 3.55 0.00 -1.26 -4.72 120.51 114.68 3bwo n ALA 326 Ca 0.09 -0.09 -0.19 0.00 0.00 0.00 0.00 53.44 53.24 3bwo n ALA 326 Cb 0.52 -1.45 -0.15 0.00 0.00 0.00 0.00 19.45 18.37 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 -3.00 0.84 -0.36 0.00 0.08 -1.26 -0.96 117.98 113.32 3bwo s PHE 327 Ca 0.13 -0.16 -0.13 0.00 0.12 0.00 0.00 56.93 56.89 3bwo s PHE 327 Cb 0.18 -0.55 -0.00 0.00 -0.57 0.00 0.00 43.02 42.08 3bwo s PHE 327 CO 0.50 -0.02 0.25 0.00 -0.10 0.00 0.00 175.22 175.85 3bwo s ALA 328 N -0.21 3.46 -1.30 5.36 0.00 -0.19 -4.72 121.76 124.16 3bwo s ALA 328 Ca 0.03 -1.49 -0.17 0.00 0.00 0.00 0.00 51.96 50.33 3bwo s ALA 328 Cb -0.04 -2.70 0.08 0.00 0.00 0.00 0.00 23.12 20.47 3bwo s ALA 328 CO -0.00 -1.12 1.74 1.87 0.00 0.00 0.00 175.76 178.25 3bwo n TRP 329 N 5.10 4.59 -2.34 0.00 -0.00 -1.26 -1.65 117.44 121.89 3bwo n TRP 329 Ca -0.12 -2.92 -0.42 0.00 -0.00 0.00 0.00 57.50 54.04 3bwo n TRP 329 Cb 0.49 -2.57 -0.03 0.00 -0.00 0.00 0.00 31.31 29.20 3bwo n TRP 329 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 3bwo s LEU 330 N 3.66 4.39 0.46 5.87 2.96 -0.64 -4.28 118.68 131.11 3bwo s LEU 330 Ca 0.52 2.17 0.03 0.00 -0.22 0.00 0.00 54.13 56.62 3bwo s LEU 330 Cb 0.04 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 3bwo s LEU 330 CO 0.06 -0.49 0.03 -0.83 -1.32 0.00 0.00 176.35 173.79 3bwo s GLY 331 N 0.81 2.81 -0.15 7.98 0.00 -1.13 -1.11 107.32 116.53 3bwo s GLY 331 Ca 0.59 -0.97 -0.09 0.00 0.00 0.00 0.00 44.72 44.24 3bwo s GLY 331 CO 0.32 -2.09 0.37 -1.08 0.00 0.00 0.00 173.10 170.62 3bwo s THR 332 N -2.94 -0.02 0.23 0.90 -1.32 -0.54 -2.25 115.64 109.70 3bwo s THR 332 Ca 0.16 0.08 0.20 0.00 -1.21 0.00 0.00 61.69 60.92 3bwo s THR 332 Cb 0.04 -0.55 0.17 0.00 -1.51 0.00 0.00 72.50 70.64 3bwo s THR 332 CO 0.08 0.03 1.81 0.11 -2.21 0.00 0.00 174.62 174.45 3bwo h LYS 333 N 6.79 0.00 -7.31 7.08 1.57 -1.60 -3.45 116.57 119.65 3bwo h LYS 333 Ca -0.35 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 57.94 3bwo h LYS 333 Cb 1.18 0.00 0.16 0.00 0.08 0.00 0.00 32.23 33.64 3bwo h LYS 333 CO 0.30 0.32 0.23 -1.21 -0.57 0.00 0.00 179.45 178.52 3bwo s GLU 334 N -3.78 1.14 -1.19 3.15 2.02 -1.26 -4.94 118.70 113.84 3bwo s GLU 334 Ca -0.01 0.94 -0.07 0.00 0.02 0.00 0.00 54.97 55.85 3bwo s GLU 334 Cb 0.12 -1.79 0.23 0.00 0.10 0.00 0.00 34.13 32.79 3bwo s GLU 334 CO 0.67 -2.35 1.72 0.39 0.02 0.00 0.00 175.26 175.70 3bwo n GLU 335 N -3.98 4.05 -4.37 1.61 -0.58 -1.26 -4.91 120.64 111.21 3bwo n GLU 335 Ca 0.07 -3.99 -0.22 0.00 -0.42 0.00 0.00 57.16 52.61 3bwo n GLU 335 Cb 0.55 -2.73 -0.11 0.00 -0.57 0.00 0.00 31.44 28.58 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 -1.12 1.95 -1.19 2.62 -4.23 -1.26 -5.04 115.64 107.36 3bwo s THR 336 Ca 0.36 -2.08 -0.16 0.00 -1.18 0.00 0.00 61.69 58.63 3bwo s THR 336 Cb 0.08 -1.99 0.13 0.00 1.34 0.00 0.00 72.50 72.05 3bwo s THR 336 CO 0.05 -0.38 1.50 -0.62 -0.54 0.00 0.00 174.62 174.63 3bwo s ASP 337 N -2.97 6.91 0.33 3.99 3.68 -1.26 -4.05 116.67 123.30 3bwo s ASP 337 Ca 0.20 -2.61 0.10 0.00 2.13 0.00 0.00 52.55 52.38 3bwo s ASP 337 Cb -0.05 -2.47 0.90 0.00 -1.45 0.00 0.00 42.92 39.85 3bwo s ASP 337 CO 0.08 -0.97 1.75 0.25 0.13 0.00 0.00 175.17 176.41 3bwo h LEU 338 N 10.94 0.66 -0.89 -1.34 5.85 -1.55 0.13 115.31 129.09 3bwo h LEU 338 Ca 0.33 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 59.17 3bwo h LEU 338 Cb 0.90 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 3bwo h LEU 338 CO 1.31 0.13 0.56 1.62 -0.34 0.00 0.00 178.44 181.72 3bwo h VAL 339 N 0.58 1.24 -0.01 1.05 3.04 -1.84 0.13 116.25 120.45 3bwo h VAL 339 Ca 0.62 -0.50 -0.00 0.00 -1.01 0.00 0.00 66.70 65.82 3bwo h VAL 339 Cb 1.21 -0.03 -0.00 0.00 -2.01 0.00 0.00 31.29 30.46 3bwo h VAL 339 CO -0.43 0.25 -0.00 0.28 -1.01 0.00 0.00 177.57 176.65 3bwo h SER 340 N 1.22 0.01 -0.69 3.17 0.02 -1.19 -0.98 113.55 115.11 3bwo h SER 340 Ca 0.32 -0.44 0.10 0.00 -0.84 0.00 0.00 61.79 60.93 3bwo h SER 340 Cb -0.08 -0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.38 3bwo h SER 340 CO -0.06 0.45 0.31 -0.33 -1.14 0.00 0.00 176.83 176.06 3bwo h GLU 341 N -0.43 0.50 -0.21 3.45 4.39 -1.04 0.13 114.58 121.38 3bwo h GLU 341 Ca 0.00 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 3bwo h GLU 341 Cb 0.45 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 3bwo h GLU 341 CO 0.00 0.33 -0.28 -0.07 -1.16 0.00 0.00 179.01 177.83 3bwo h LEU 342 N 0.52 0.41 -0.68 1.33 4.07 -0.96 -2.92 115.31 117.07 3bwo h LEU 342 Ca 0.35 -0.14 -0.13 0.00 0.08 0.00 0.00 57.88 58.04 3bwo h LEU 342 Cb 0.42 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 3bwo h LEU 342 CO -0.30 0.68 -0.42 -0.09 -1.08 0.00 0.00 178.44 177.23 3bwo h ARG 343 N 0.35 0.53 0.00 1.13 2.43 0.34 -0.84 114.38 118.33 3bwo h ARG 343 Ca 0.05 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 3bwo h ARG 343 Cb 0.68 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3bwo h ARG 343 CO 0.05 0.86 0.00 2.89 -1.51 0.00 0.00 179.97 182.26 3bwo n ARG 344 N -4.02 0.94 -0.25 0.20 1.85 0.28 -1.72 116.66 113.94 3bwo n ARG 344 Ca -0.02 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 56.92 3bwo n ARG 344 Cb 0.52 -1.28 0.20 0.00 -1.05 0.00 0.00 32.46 30.84 3bwo n ARG 344 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3bwo n HIS 345 N -0.78 0.46 -3.33 2.89 8.25 -1.00 -4.98 115.22 116.73 3bwo n HIS 345 Ca 0.13 -0.92 -0.16 0.00 -0.26 0.00 0.00 57.72 56.51 3bwo n HIS 345 Cb 0.06 -0.23 0.08 0.00 1.12 0.00 0.00 29.99 31.03 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 -0.94 -5.48 -3.72 -0.41 5.02 -0.70 -4.94 118.16 106.98 3bwo n LYS 346 Ca 0.18 0.82 -0.27 0.00 -2.02 0.00 0.00 58.31 57.02 3bwo n LYS 346 Cb 0.75 -5.71 -0.17 0.00 -0.02 0.00 0.00 35.03 29.88 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 -3.35 0.40 0.10 -0.18 1.01 -0.35 -1.28 120.40 116.74 3bwo s VAL 347 Ca 0.09 -0.38 -0.25 0.00 0.00 0.00 0.00 61.98 61.44 3bwo s VAL 347 Cb -0.01 -0.87 -0.07 0.00 0.00 0.00 0.00 36.38 35.43 3bwo s VAL 347 CO 0.70 -0.15 0.77 -0.04 0.00 0.00 0.00 175.10 176.38 3bwo s MET 348 N 1.92 4.52 0.18 2.72 -1.94 0.28 -3.19 119.30 123.80 3bwo s MET 348 Ca 0.00 1.10 -0.15 0.00 -1.71 0.00 0.00 55.69 54.93 3bwo s MET 348 Cb -0.16 -3.32 0.02 0.00 2.01 0.00 0.00 34.83 33.38 3bwo s MET 348 CO -0.08 0.42 0.46 -1.54 -0.01 0.00 0.00 175.02 174.27 3bwo s SER 349 N -0.55 -0.19 -0.32 3.03 1.04 -1.26 -0.75 113.70 114.70 3bwo s SER 349 Ca 0.37 -0.55 -0.24 0.00 0.48 0.00 0.00 55.95 56.00 3bwo s SER 349 Cb -0.22 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3bwo s SER 349 CO 0.24 -1.00 0.83 -0.60 0.98 0.00 0.00 173.24 173.70 3bwo s ARG 350 N -3.89 3.95 0.21 4.02 6.06 -0.84 -4.75 118.95 123.70 3bwo s ARG 350 Ca 0.10 0.62 -0.32 0.00 -2.50 0.00 0.00 55.73 53.63 3bwo s ARG 350 Cb 0.00 -3.74 -0.14 0.00 0.06 0.00 0.00 34.95 31.13 3bwo s ARG 350 CO -0.03 -0.74 1.34 0.00 -2.50 0.00 0.00 175.30 173.38 3bwo n ALA 351 N 6.34 0.48 0.08 6.12 0.00 -1.26 -1.17 120.51 131.10 3bwo n ALA 351 Ca 0.05 0.43 0.02 0.00 0.00 0.00 0.00 53.44 53.94 3bwo n ALA 351 Cb 0.48 -2.20 0.36 0.00 0.00 0.00 0.00 19.45 18.10 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 4.10 0.36 1.98 0.00 0.00 -1.50 -1.70 103.07 106.32 3bwo h GLY 352 Ca -0.45 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.67 3bwo h GLY 352 CO 0.75 0.20 0.01 0.83 0.00 0.00 0.00 176.54 178.33 3bwo h GLU 353 N 0.32 0.00 0.00 4.80 5.08 -1.73 0.17 114.58 123.22 3bwo h GLU 353 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3bwo h GLU 353 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3bwo h GLU 353 CO 0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 179.01 177.97 3bwo h ARG 354 N 0.00 0.00 -0.49 2.33 3.08 -1.64 -3.16 114.38 114.50 3bwo h ARG 354 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 3bwo h ARG 354 Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3bwo h ARG 354 CO 0.00 0.00 0.05 0.00 -1.07 0.00 0.00 179.97 178.95 3bwo n GLY 356 N -0.02 -0.06 0.00 0.00 0.00 -1.11 -2.03 105.19 101.97 3bwo n GLY 356 Ca 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.66 0.00 -4.38 1.61 2.88 0.30 -4.67 113.62 108.70 3bwo n SER 357 Ca -0.09 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.21 3bwo n SER 357 Cb 0.58 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.95 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 0.67 2.72 0.00 -3.46 3.84 -1.26 -4.18 116.67 115.00 3bwo s ASP 358 Ca 0.00 -1.50 0.05 0.00 -0.00 0.00 0.00 52.55 51.10 3bwo s ASP 358 Cb 0.00 0.15 0.23 0.00 -1.38 0.00 0.00 42.92 41.92 3bwo s ASP 358 CO 0.00 -0.73 1.09 0.29 -0.00 0.00 0.00 175.17 175.82 3bwo n LYS 359 N -0.82 0.03 0.00 2.11 5.02 -1.26 -2.22 118.16 121.02 3bwo n LYS 359 Ca -0.05 0.34 0.13 0.00 -2.02 0.00 0.00 58.31 56.71 3bwo n LYS 359 Cb 0.66 -1.50 0.45 0.00 -0.02 0.00 0.00 35.03 34.62 3bwo n LYS 359 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3bwo n LYS 360 N -1.41 0.71 -4.40 1.97 5.02 -1.26 -1.38 118.16 117.41 3bwo n LYS 360 Ca 0.02 -0.36 -0.22 0.00 -2.02 0.00 0.00 58.31 55.73 3bwo n LYS 360 Cb 0.05 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.46 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 -2.54 2.04 -0.00 2.13 3.76 -0.94 -1.47 115.29 118.26 3bwo s HIS 361 Ca 0.25 -0.43 -0.17 0.00 -0.15 0.00 0.00 55.06 54.56 3bwo s HIS 361 Cb 0.19 -0.94 0.03 0.00 1.11 0.00 0.00 32.58 32.98 3bwo s HIS 361 CO 0.52 0.52 0.35 0.14 -0.85 0.00 0.00 174.74 175.42 3bwo s VAL 362 N -2.46 0.05 -0.26 -0.90 -7.23 -0.26 -1.71 120.40 107.63 3bwo s VAL 362 Ca 0.24 -0.45 -0.07 0.00 -1.81 0.00 0.00 61.98 59.88 3bwo s VAL 362 Cb -0.04 -0.72 -0.02 0.00 0.56 0.00 0.00 36.38 36.15 3bwo s VAL 362 CO 0.11 -0.25 0.08 -0.60 -0.31 0.00 0.00 175.10 174.12 3bwo s ARG 363 N -1.57 3.60 -0.16 4.82 3.52 -0.31 -1.61 118.95 127.23 3bwo s ARG 363 Ca -0.12 -0.52 -0.01 0.00 -0.13 0.00 0.00 55.73 54.96 3bwo s ARG 363 Cb -0.04 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 30.00 3bwo s ARG 363 CO 0.03 -0.22 -0.12 0.54 -0.81 0.00 0.00 175.30 174.73 3bwo s VAL 364 N 1.61 3.02 0.48 7.11 0.11 -0.66 -1.99 120.40 130.08 3bwo s VAL 364 Ca 0.06 -0.65 -0.24 0.00 -2.93 0.00 0.00 61.98 58.22 3bwo s VAL 364 Cb -0.15 -2.30 -0.07 0.00 -1.53 0.00 0.00 36.38 32.33 3bwo s VAL 364 CO 0.04 0.50 1.38 -0.55 -3.33 0.00 0.00 175.10 173.13 3bwo s SER 365 N 0.76 5.70 0.00 3.54 0.15 -0.65 -1.03 113.70 122.18 3bwo s SER 365 Ca -0.05 2.81 0.06 0.00 0.70 0.00 0.00 55.95 59.47 3bwo s SER 365 Cb -0.15 -2.64 0.13 0.00 -1.71 0.00 0.00 66.02 61.64 3bwo s SER 365 CO 0.01 -1.28 0.98 0.23 1.20 0.00 0.00 173.24 174.38 3bwo n MET 366 N -0.49 1.80 -0.72 5.44 2.81 -0.13 -4.63 117.12 121.20 3bwo n MET 366 Ca 0.07 -1.47 0.00 0.00 -1.81 0.00 0.00 57.70 54.49 3bwo n MET 366 Cb 0.43 -1.14 0.25 0.00 -0.71 0.00 0.00 33.22 32.05 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 0.19 4.59 0.00 4.03 4.77 -1.26 -4.98 117.00 124.34 3bwo n LEU 367 Ca 0.06 -3.32 -0.05 0.00 -0.03 0.00 0.00 56.01 52.67 3bwo n LEU 367 Cb 0.28 -0.63 0.04 0.00 -2.33 0.00 0.00 43.42 40.77 3bwo n LEU 367 CO 0.04 0.89 0.15 -1.54 -1.33 0.00 0.00 177.39 175.61 3bwo n SER 368 N -0.64 -0.03 -4.81 -1.43 3.41 -1.26 -1.06 113.62 107.79 3bwo n SER 368 Ca 0.31 -1.06 -0.32 0.00 -0.26 0.00 0.00 58.87 57.54 3bwo n SER 368 Cb 1.08 -0.17 0.03 0.00 -0.26 0.00 0.00 64.21 64.89 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 -3.50 3.13 0.06 4.33 0.52 -1.26 -2.87 118.95 119.36 3bwo s ARG 369 Ca 0.13 1.07 -0.17 0.00 -0.52 0.00 0.00 55.73 56.23 3bwo s ARG 369 Cb -0.00 -2.01 -0.06 0.00 0.52 0.00 0.00 34.95 33.39 3bwo s ARG 369 CO 0.09 -0.95 1.28 0.93 0.02 0.00 0.00 175.30 176.67 3bwo h GLU 370 N -0.17 -0.24 -0.88 3.54 4.39 -1.92 0.10 114.58 119.41 3bwo h GLU 370 Ca -0.45 0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.38 3bwo h GLU 370 Cb 1.21 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.85 3bwo h GLU 370 CO 0.57 -0.16 0.57 0.38 -1.16 0.00 0.00 179.01 179.21 3bwo h ASP 371 N -0.25 0.71 -0.65 1.42 2.03 -1.99 -0.26 116.42 117.43 3bwo h ASP 371 Ca 0.03 0.03 -0.06 0.00 -0.73 0.00 0.00 57.03 56.30 3bwo h ASP 371 Cb 0.33 -0.11 -0.03 0.00 -0.83 0.00 0.00 39.33 38.69 3bwo h ASP 371 CO -0.27 0.39 0.18 0.58 -1.03 0.00 0.00 179.24 179.08 3bwo h VAL 372 N 0.77 1.25 0.10 4.15 2.07 -1.78 -1.57 116.25 121.24 3bwo h VAL 372 Ca 0.43 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3bwo h VAL 372 Cb 0.57 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3bwo h VAL 372 CO -0.19 0.34 -0.05 0.15 0.02 0.00 0.00 177.57 177.85 3bwo h PHE 373 N 0.95 -0.13 -0.41 1.57 3.57 0.61 -2.53 116.94 120.57 3bwo h PHE 373 Ca 0.21 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.77 3bwo h PHE 373 Cb 0.33 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 3bwo h PHE 373 CO 0.02 0.08 0.04 -0.91 -2.23 0.00 0.00 178.31 175.31 3bwo h ASN 374 N -0.32 -0.09 -1.00 0.41 2.35 -1.05 -1.08 115.58 114.80 3bwo h ASN 374 Ca -0.01 0.08 0.10 0.00 -0.55 0.00 0.00 56.30 55.92 3bwo h ASN 374 Cb 0.27 0.13 -0.08 0.00 0.05 0.00 0.00 38.32 38.69 3bwo h ASN 374 CO 0.02 -0.01 0.63 0.58 -1.65 0.00 0.00 177.43 177.01 3bwo h VAL 375 N 0.15 0.97 -0.23 2.81 2.07 -1.27 -1.55 116.25 119.20 3bwo h VAL 375 Ca 0.20 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3bwo h VAL 375 Cb 0.27 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 3bwo h VAL 375 CO -0.30 0.19 0.15 0.15 0.02 0.00 0.00 177.57 177.78 3bwo h PHE 376 N 1.05 0.30 -0.29 1.57 3.04 -0.77 -2.09 116.94 119.75 3bwo h PHE 376 Ca 0.48 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.42 3bwo h PHE 376 Cb 0.39 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.79 3bwo h PHE 376 CO -0.00 0.21 0.14 -0.07 -2.02 0.00 0.00 178.31 176.56 3bwo h LEU 377 N 0.30 0.37 -0.32 0.59 3.38 -0.87 0.59 115.31 119.36 3bwo h LEU 377 Ca 0.08 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.99 3bwo h LEU 377 Cb -0.01 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.56 3bwo h LEU 377 CO -0.02 0.39 -0.48 -0.08 0.09 0.00 0.00 178.44 178.34 3bwo h GLU 378 N 0.34 -0.40 0.00 1.13 4.57 -1.13 -0.87 114.58 118.22 3bwo h GLU 378 Ca 0.10 0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.27 3bwo h GLU 378 Cb 0.11 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 3bwo h GLU 378 CO -0.01 -0.27 -0.18 0.00 -1.18 0.00 0.00 179.01 177.37 3bwo h ARG 379 N -0.41 0.00 -0.69 1.92 3.08 -1.17 -0.08 114.38 117.03 3bwo h ARG 379 Ca 0.10 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 3bwo h ARG 379 Cb 0.61 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 3bwo h ARG 379 CO -0.53 0.18 0.30 1.25 -1.07 0.00 0.00 179.97 180.10 3bwo h LEU 380 N 0.00 0.94 0.00 3.04 6.46 0.48 -2.14 115.31 124.09 3bwo h LEU 380 Ca -0.00 -0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 57.59 3bwo h LEU 380 Cb 0.34 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.03 3bwo h LEU 380 CO 0.02 0.83 -0.07 0.00 -0.62 0.00 0.00 178.44 178.61 3bwo h ALA 381 N 1.14 0.01 0.00 1.25 0.00 -1.09 -3.33 119.26 117.25 3bwo h ALA 381 Ca 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3bwo h ALA 381 Cb 0.17 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3bwo h ALA 381 CO -0.02 0.04 0.38 -1.71 0.00 0.00 0.00 179.25 177.94 3bwo n ASN 382 N -4.67 0.09 -4.98 0.00 4.05 -0.06 -4.62 115.26 105.07 3bwo n ASN 382 Ca -0.07 0.29 -0.19 0.00 0.45 0.00 0.00 54.58 55.05 3bwo n ASN 382 Cb 0.30 -0.23 -0.01 0.00 1.23 0.00 0.00 39.78 41.07 3bwo n ASN 382 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3bwo s MET 383 N -2.71 3.14 -0.44 1.20 0.23 -0.81 -3.24 119.30 116.68 3bwo s MET 383 Ca -0.00 -0.99 0.00 0.00 -1.03 0.00 0.00 55.69 53.67 3bwo s MET 383 Cb 0.01 -2.81 0.00 0.00 -1.53 0.00 0.00 34.83 30.50 3bwo s MET 383 CO 0.03 0.13 0.00 1.63 -2.03 0.00 0.00 175.02 174.78 3bwo n LYS 384 N -1.58 -1.86 -1.74 3.16 4.76 -1.26 -4.56 118.16 115.08 3bwo n LYS 384 Ca -0.02 0.64 -0.04 0.00 -2.87 0.00 0.00 58.31 56.02 3bwo n LYS 384 Cb 0.58 -5.09 0.02 0.00 -1.84 0.00 0.00 35.03 28.69 3bwo n LYS 384 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3bwo n LEU 385 N -0.47 -0.85 0.00 -0.35 4.77 -1.26 -5.06 117.00 113.78 3bwo n LEU 385 Ca -0.04 -2.49 0.00 0.00 -0.03 0.00 0.00 56.01 53.45 3bwo n LEU 385 Cb 0.53 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3bwo n LEU 385 CO 0.06 1.47 0.00 -0.38 -1.33 0.00 0.00 177.39 177.21 3bwo n ILE 386 N -0.54 0.00 -0.99 -0.08 5.41 -1.20 -4.91 119.36 117.05 3bwo n ILE 386 Ca -0.20 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.55 3bwo n ILE 386 Cb 0.81 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.74 3bwo n ILE 386 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84