#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bwx n GLU 2 N 0.00 0.16 -4.27 1.43 0.28 -1.26 -4.75 120.64 112.23 2bwx n GLU 2 Ca 0.00 -0.56 -0.34 0.00 -0.16 0.00 0.00 57.16 56.10 2bwx n GLU 2 Cb 0.00 0.55 -0.12 0.00 1.43 0.00 0.00 31.44 33.31 2bwx n GLU 2 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2bwx s ILE 3 N -2.56 4.12 0.42 3.84 -1.09 -1.26 -4.88 121.20 119.80 2bwx s ILE 3 Ca 0.06 -0.27 -0.02 0.00 -2.23 0.00 0.00 60.65 58.18 2bwx s ILE 3 Cb -0.00 -2.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 2bwx s ILE 3 CO 0.04 0.48 0.68 -0.55 -1.23 0.00 0.00 174.94 174.36 2bwx s SER 4 N 0.43 6.22 0.27 3.58 0.15 -1.26 -4.96 113.70 118.13 2bwx s SER 4 Ca -0.02 0.66 0.00 0.00 0.70 0.00 0.00 55.95 57.30 2bwx s SER 4 Cb -0.14 -2.08 0.61 0.00 -1.71 0.00 0.00 66.02 62.70 2bwx s SER 4 CO 0.02 -0.48 1.71 -0.09 1.20 0.00 0.00 173.24 175.60 2bwx h ARG 5 N 0.45 0.40 -0.56 5.44 2.43 -1.93 -1.43 114.38 119.19 2bwx h ARG 5 Ca -0.48 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.63 2bwx h ARG 5 Cb 1.22 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 2bwx h ARG 5 CO 0.61 0.26 0.19 1.96 -1.51 0.00 0.00 179.97 181.49 2bwx h GLN 6 N 0.41 0.82 -0.30 0.20 7.50 -1.94 -1.02 115.11 120.79 2bwx h GLN 6 Ca 0.50 -0.14 -0.09 0.00 0.50 0.00 0.00 58.65 59.41 2bwx h GLN 6 Cb 0.87 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 28.26 2bwx h GLN 6 CO -0.49 0.70 -0.18 1.49 -1.50 0.00 0.00 178.83 178.84 2bwx h GLU 7 N 0.80 0.65 -0.74 1.46 4.81 -1.67 -0.37 114.58 119.52 2bwx h GLU 7 Ca 0.19 -0.30 0.07 0.00 -0.13 0.00 0.00 59.36 59.18 2bwx h GLU 7 Cb 0.21 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.52 2bwx h GLU 7 CO -0.01 0.90 0.42 0.74 -0.73 0.00 0.00 179.01 180.32 2bwx h PHE 8 N 0.40 0.77 -0.60 0.92 0.04 -1.03 -0.87 116.94 116.58 2bwx h PHE 8 Ca 0.06 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 2bwx h PHE 8 Cb 0.72 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.61 2bwx h PHE 8 CO 0.06 0.36 0.35 0.37 -0.60 0.00 0.00 178.31 178.85 2bwx h GLN 9 N 0.76 0.82 -0.91 1.51 5.75 -1.01 -1.12 115.11 120.91 2bwx h GLN 9 Ca 0.33 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 58.77 2bwx h GLN 9 Cb 0.22 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.56 2bwx h GLN 9 CO -0.20 0.60 0.60 0.00 -2.65 0.00 0.00 178.83 177.18 2bwx h ARG 10 N 0.81 1.16 -0.14 1.69 3.08 -0.54 -0.43 114.38 120.00 2bwx h ARG 10 Ca 0.21 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 2bwx h ARG 10 Cb 0.01 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 2bwx h ARG 10 CO -0.04 0.76 0.07 0.00 -1.07 0.00 0.00 179.97 179.70 2bwx h ARG 11 N 1.19 0.19 -0.61 0.04 3.08 -0.81 0.57 114.38 118.03 2bwx h ARG 11 Ca 0.35 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.45 2bwx h ARG 11 Cb -0.07 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 29.88 2bwx h ARG 11 CO -0.10 0.22 0.27 0.00 -1.07 0.00 0.00 179.97 179.29 2bwx h ARG 12 N 0.11 0.47 -0.60 0.04 3.08 -0.87 -1.59 114.38 115.01 2bwx h ARG 12 Ca 0.05 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 2bwx h ARG 12 Cb 0.09 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 2bwx h ARG 12 CO -0.01 0.31 0.15 1.96 -1.07 0.00 0.00 179.97 181.32 2bwx h GLN 13 N 0.48 0.94 -0.45 0.04 1.08 -0.79 -0.87 115.11 115.54 2bwx h GLN 13 Ca 0.29 -0.20 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 2bwx h GLN 13 Cb 0.31 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 2bwx h GLN 13 CO -0.26 0.83 -0.02 0.00 -0.95 0.00 0.00 178.83 178.44 2bwx h ALA 14 N 1.26 1.12 -0.15 3.87 0.00 -0.46 0.71 119.26 125.62 2bwx h ALA 14 Ca 0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2bwx h ALA 14 Cb 0.31 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2bwx h ALA 14 CO -0.00 0.56 -0.03 1.25 0.00 0.00 0.00 179.25 181.03 2bwx h LEU 15 N 0.70 0.28 -1.09 0.00 5.85 -0.92 -3.08 115.31 117.06 2bwx h LEU 15 Ca 0.14 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.56 2bwx h LEU 15 Cb 0.45 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 2bwx h LEU 15 CO 0.02 0.57 0.62 0.58 -0.34 0.00 0.00 178.44 179.89 2bwx h VAL 16 N -0.01 1.09 -0.54 1.05 2.07 -0.85 -0.93 116.25 118.13 2bwx h VAL 16 Ca 0.04 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.25 2bwx h VAL 16 Cb 0.44 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 2bwx h VAL 16 CO 0.01 0.20 0.36 -0.08 0.02 0.00 0.00 177.57 178.09 2bwx h GLU 17 N 1.11 0.40 0.00 1.57 4.22 -0.78 -1.83 114.58 119.28 2bwx h GLU 17 Ca 0.40 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.82 2bwx h GLU 17 Cb 0.15 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2bwx h GLU 17 CO -0.15 0.27 -0.34 1.04 -2.18 0.00 0.00 179.01 177.64 2bwx n GLN 18 N -4.47 0.03 -2.85 1.92 6.02 -0.39 -4.92 117.38 112.72 2bwx n GLN 18 Ca 0.08 0.01 -0.32 0.00 -0.01 0.00 0.00 57.00 56.76 2bwx n GLN 18 Cb 0.30 -1.53 -0.05 0.00 1.02 0.00 0.00 30.24 29.98 2bwx n GLN 18 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 2bwx s MET 19 N -3.02 4.03 0.51 -1.09 -1.94 -0.69 -5.05 119.30 112.05 2bwx s MET 19 Ca 0.11 0.84 -0.21 0.00 -1.71 0.00 0.00 55.69 54.72 2bwx s MET 19 Cb 0.17 -2.29 -0.06 0.00 2.01 0.00 0.00 34.83 34.66 2bwx s MET 19 CO 0.65 -0.02 1.15 -0.65 -0.01 0.00 0.00 175.02 176.15 2bwx s GLN 20 N -3.39 3.53 0.60 2.03 -0.21 -1.26 -5.00 119.66 115.96 2bwx s GLN 20 Ca 0.57 1.71 -0.19 0.00 0.02 0.00 0.00 55.36 57.47 2bwx s GLN 20 Cb -0.10 -2.20 -0.03 0.00 1.00 0.00 0.00 33.01 31.68 2bwx s GLN 20 CO 0.21 -0.73 1.27 -1.25 -2.12 0.00 0.00 175.29 172.67 2bwx s PRO 21 N -3.00 2.86 -0.52 2.91 0.04 -1.26 -3.46 135.00 132.56 2bwx s PRO 21 Ca 0.69 2.01 -0.01 0.00 0.04 0.00 0.00 61.00 63.73 2bwx s PRO 21 Cb -0.27 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2bwx s PRO 21 CO 0.31 -1.34 0.44 0.41 0.04 0.00 0.00 177.00 176.86 2bwx n GLY 22 N 0.72 0.13 3.18 0.56 0.00 0.22 -4.81 105.19 105.19 2bwx n GLY 22 Ca 0.14 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.83 2bwx n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bwx s SER 23 N -3.52 0.24 -0.01 1.61 1.04 -0.58 -0.34 113.70 112.15 2bwx s SER 23 Ca 0.04 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.64 2bwx s SER 23 Cb -0.02 0.30 -0.00 0.00 0.10 0.00 0.00 66.02 66.41 2bwx s SER 23 CO 0.31 -0.71 -0.06 0.00 0.98 0.00 0.00 173.24 173.76 2bwx s ALA 24 N -3.91 0.56 -0.14 5.32 0.00 -0.84 0.00 121.76 122.76 2bwx s ALA 24 Ca 0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 51.96 51.76 2bwx s ALA 24 Cb 0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 2bwx s ALA 24 CO -0.08 0.12 0.01 0.00 0.00 0.00 0.00 175.76 175.81 2bwx s ALA 25 N -0.02 3.25 -0.20 0.00 0.00 0.12 -0.06 121.76 124.85 2bwx s ALA 25 Ca 0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 2bwx s ALA 25 Cb -0.04 -1.66 0.01 0.00 0.00 0.00 0.00 23.12 21.44 2bwx s ALA 25 CO -0.00 0.34 -0.13 -0.51 0.00 0.00 0.00 175.76 175.46 2bwx s LEU 26 N -0.10 2.55 -0.17 0.00 1.43 -0.11 -1.17 118.68 121.11 2bwx s LEU 26 Ca 0.04 -0.62 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2bwx s LEU 26 Cb -0.13 -1.59 0.03 0.00 0.03 0.00 0.00 46.19 44.53 2bwx s LEU 26 CO 0.02 -0.03 -0.15 -0.63 0.23 0.00 0.00 176.35 175.79 2bwx s ILE 27 N 1.35 1.73 -0.06 -0.59 1.01 0.11 -4.53 121.20 120.22 2bwx s ILE 27 Ca 0.04 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 2bwx s ILE 27 Cb -0.14 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 2bwx s ILE 27 CO -0.09 0.41 0.13 -0.36 0.00 0.00 0.00 174.94 175.03 2bwx s PHE 28 N 1.41 3.47 0.68 3.97 0.40 -1.26 -0.84 117.98 125.80 2bwx s PHE 28 Ca 0.03 0.37 -0.12 0.00 -0.60 0.00 0.00 56.93 56.61 2bwx s PHE 28 Cb -0.14 -1.84 0.01 0.00 0.51 0.00 0.00 43.02 41.56 2bwx s PHE 28 CO -0.11 0.64 1.07 0.00 0.70 0.00 0.00 175.22 177.52 2bwx s ALA 29 N -1.14 2.58 0.44 5.36 0.00 -0.10 -4.64 121.76 124.27 2bwx s ALA 29 Ca 0.20 0.24 -0.24 0.00 0.00 0.00 0.00 51.96 52.17 2bwx s ALA 29 Cb -0.12 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 2bwx s ALA 29 CO 0.11 -1.25 1.24 0.00 0.00 0.00 0.00 175.76 175.86 2bwx s ALA 30 N -2.80 3.07 0.60 0.00 0.00 -1.26 -4.82 121.76 116.55 2bwx s ALA 30 Ca 0.61 1.09 -0.17 0.00 0.00 0.00 0.00 51.96 53.49 2bwx s ALA 30 Cb -0.16 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 2bwx s ALA 30 CO 0.50 -0.79 1.11 -1.25 0.00 0.00 0.00 175.76 175.32 2bwx s PRO 31 N -2.50 3.12 0.71 0.00 0.04 -1.26 -4.46 135.00 130.64 2bwx s PRO 31 Ca 0.61 1.45 -0.15 0.00 0.04 0.00 0.00 61.00 62.96 2bwx s PRO 31 Cb -0.34 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.24 2bwx s PRO 31 CO 0.42 -1.01 1.16 -1.21 0.04 0.00 0.00 177.00 176.40 2bwx s GLU 32 N -3.75 2.38 -0.08 4.56 2.02 -1.26 -4.92 118.70 117.65 2bwx s GLU 32 Ca 0.69 1.58 0.00 0.00 0.02 0.00 0.00 54.97 57.26 2bwx s GLU 32 Cb -0.21 -1.88 0.02 0.00 0.10 0.00 0.00 34.13 32.16 2bwx s GLU 32 CO 0.34 -1.61 -0.06 0.08 0.02 0.00 0.00 175.26 174.03 2bwx s VAL 33 N -2.19 0.80 0.21 2.63 1.01 -1.26 -5.09 120.40 116.52 2bwx s VAL 33 Ca 0.70 -0.21 -0.30 0.00 0.00 0.00 0.00 61.98 62.18 2bwx s VAL 33 Cb -0.25 -0.82 -0.09 0.00 0.00 0.00 0.00 36.38 35.22 2bwx s VAL 33 CO 0.44 0.31 1.35 -0.89 0.00 0.00 0.00 175.10 176.31 2bwx s THR 34 N 1.32 3.03 -0.18 3.92 2.01 -1.26 -1.00 115.64 123.48 2bwx s THR 34 Ca -0.04 0.85 -0.15 0.00 0.31 0.00 0.00 61.69 62.67 2bwx s THR 34 Cb -0.14 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.73 2bwx s THR 34 CO -0.03 0.13 -0.07 -1.14 -0.69 0.00 0.00 174.62 172.82 2bwx n ARG 35 N 2.54 0.51 -3.66 4.92 0.63 0.48 -4.66 116.66 117.42 2bwx n ARG 35 Ca 0.06 0.49 -0.08 0.00 -0.92 0.00 0.00 57.85 57.40 2bwx n ARG 35 Cb 0.42 -1.67 -0.08 0.00 0.45 0.00 0.00 32.46 31.58 2bwx n ARG 35 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2bwx s SER 36 N -6.32 -0.78 1.47 6.15 0.15 -0.98 -5.03 113.70 108.37 2bwx s SER 36 Ca -0.23 1.28 0.00 0.00 0.70 0.00 0.00 55.95 57.70 2bwx s SER 36 Cb 0.05 1.16 0.00 0.00 -1.71 0.00 0.00 66.02 65.52 2bwx s SER 36 CO 0.40 -0.22 0.00 0.00 1.20 0.00 0.00 173.24 174.62 2bwx n ALA 37 N 4.27 0.00 0.96 5.45 0.00 -1.26 -0.50 120.51 129.43 2bwx n ALA 37 Ca -0.21 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.33 2bwx n ALA 37 Cb 0.58 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.34 2bwx n ALA 37 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2bwx n ASP 38 N 7.42 2.16 -4.77 0.00 8.00 -1.26 -4.87 116.55 123.22 2bwx n ASP 38 Ca 0.00 -1.81 -0.36 0.00 0.71 0.00 0.00 54.79 53.33 2bwx n ASP 38 Cb 0.00 -0.15 -0.07 0.00 -0.02 0.00 0.00 41.12 40.87 2bwx n ASP 38 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2bwx s SER 39 N -1.50 6.31 0.15 -2.24 1.04 0.35 -5.04 113.70 112.77 2bwx s SER 39 Ca 0.33 0.35 0.03 0.00 0.48 0.00 0.00 55.95 57.15 2bwx s SER 39 Cb 0.18 -2.10 -0.04 0.00 0.10 0.00 0.00 66.02 64.17 2bwx s SER 39 CO 0.27 0.24 0.23 -1.61 0.98 0.00 0.00 173.24 173.35 2bwx s GLU 40 N -0.05 3.26 0.72 4.02 8.01 -1.26 -0.39 118.70 133.02 2bwx s GLU 40 Ca 0.11 -0.68 -0.14 0.00 0.01 0.00 0.00 54.97 54.27 2bwx s GLU 40 Cb -0.12 -2.86 0.04 0.00 -4.31 0.00 0.00 34.13 26.87 2bwx s GLU 40 CO 0.01 0.51 1.15 0.71 0.01 0.00 0.00 175.26 177.66 2bwx s TYR 41 N -1.73 2.27 0.25 1.61 2.02 -0.17 -4.65 117.35 116.95 2bwx s TYR 41 Ca 0.33 1.60 -0.31 0.00 -0.37 0.00 0.00 57.07 58.32 2bwx s TYR 41 Cb -0.11 -3.31 -0.13 0.00 -0.40 0.00 0.00 41.96 38.02 2bwx s TYR 41 CO 0.27 -2.20 1.51 -2.30 -1.57 0.00 0.00 175.55 171.25 2bwx n PRO 42 N -2.81 2.34 -2.08 -1.71 -0.02 -1.26 -4.75 135.00 124.72 2bwx n PRO 42 Ca 0.12 0.83 -0.42 0.00 -2.02 0.00 0.00 63.50 62.01 2bwx n PRO 42 Cb 0.51 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 2bwx n PRO 42 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2bwx s TYR 43 N 0.08 3.13 -0.20 6.00 5.04 -1.26 -5.01 117.35 125.13 2bwx s TYR 43 Ca 0.68 0.97 0.01 0.00 -2.44 0.00 0.00 57.07 56.29 2bwx s TYR 43 Cb -0.58 -3.76 0.04 0.00 0.35 0.00 0.00 41.96 38.00 2bwx s TYR 43 CO 0.48 -2.58 -0.13 0.50 -1.34 0.00 0.00 175.55 172.47 2bwx s ARG 44 N 0.31 2.36 0.52 4.97 6.06 -1.26 -5.12 118.95 126.79 2bwx s ARG 44 Ca 0.62 -0.93 -0.21 0.00 -2.50 0.00 0.00 55.73 52.71 2bwx s ARG 44 Cb -0.40 -2.54 -0.06 0.00 0.06 0.00 0.00 34.95 32.01 2bwx s ARG 44 CO 0.37 -0.39 1.22 -1.14 -2.50 0.00 0.00 175.30 172.86 2bwx s GLN 45 N 1.31 3.37 0.22 5.12 2.00 -1.26 -4.75 119.66 125.67 2bwx s GLN 45 Ca -0.01 1.87 -0.32 0.00 -2.00 0.00 0.00 55.36 54.90 2bwx s GLN 45 Cb -0.16 -2.21 -0.13 0.00 0.80 0.00 0.00 33.01 31.31 2bwx s GLN 45 CO -0.09 -0.89 1.56 -1.71 -0.50 0.00 0.00 175.29 173.65 2bwx n ASN 46 N -0.98 3.30 -0.30 6.67 2.85 -1.26 -4.87 115.26 120.67 2bwx n ASN 46 Ca 0.10 1.11 -0.05 0.00 -0.11 0.00 0.00 54.58 55.63 2bwx n ASN 46 Cb 0.48 -1.49 0.07 0.00 1.24 0.00 0.00 39.78 40.09 2bwx n ASN 46 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2bwx h SER 47 N 5.35 1.01 -0.37 1.20 0.02 -1.94 0.82 113.55 119.64 2bwx h SER 47 Ca -0.45 -0.09 -0.10 0.00 -0.84 0.00 0.00 61.79 60.31 2bwx h SER 47 Cb 1.25 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 2bwx h SER 47 CO 0.84 0.81 -0.14 0.44 -1.14 0.00 0.00 176.83 177.64 2bwx h ASP 48 N 1.13 0.77 -0.43 3.07 3.32 -1.95 0.47 116.42 122.79 2bwx h ASP 48 Ca 0.29 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2bwx h ASP 48 Cb 0.01 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 2bwx h ASP 48 CO -0.05 0.99 0.26 0.15 -1.72 0.00 0.00 179.24 178.87 2bwx h PHE 49 N 0.55 0.57 -0.24 4.55 3.57 -1.76 -2.65 116.94 121.53 2bwx h PHE 49 Ca 0.09 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2bwx h PHE 49 Cb 0.68 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 2bwx h PHE 49 CO 0.06 0.41 0.02 2.35 -2.23 0.00 0.00 178.31 178.91 2bwx h TRP 50 N 0.57 0.02 -0.99 0.41 2.91 -0.70 -2.50 115.95 115.66 2bwx h TRP 50 Ca 0.15 0.02 0.21 0.00 1.13 0.00 0.00 58.89 60.40 2bwx h TRP 50 Cb 0.01 0.03 -0.10 0.00 -0.51 0.00 0.00 29.16 28.58 2bwx h TRP 50 CO -0.03 -0.02 0.62 -0.92 -1.03 0.00 0.00 178.44 177.06 2bwx h TYR 51 N 0.10 0.91 -0.02 2.65 3.20 -0.56 0.15 116.97 123.40 2bwx h TYR 51 Ca 0.11 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2bwx h TYR 51 Cb 0.14 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.13 2bwx h TYR 51 CO -0.18 0.17 -0.04 1.19 -1.64 0.00 0.00 178.16 177.67 2bwx n PHE 52 N -4.71 0.00 0.00 -3.82 3.72 -1.04 -4.74 117.46 106.87 2bwx n PHE 52 Ca 0.23 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.63 2bwx n PHE 52 Cb 0.66 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 2bwx n PHE 52 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2bwx n THR 53 N 0.54 0.00 -2.26 4.37 -2.24 -0.43 -4.74 114.28 109.52 2bwx n THR 53 Ca 0.16 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.75 2bwx n THR 53 Cb 0.45 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 2bwx n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bwx n GLY 54 N 1.01 -0.10 3.40 3.38 0.00 0.40 -4.97 105.19 108.31 2bwx n GLY 54 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2bwx n GLY 54 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bwx s PHE 55 N -2.90 3.01 -0.55 1.61 5.36 -1.26 -5.02 117.98 118.23 2bwx s PHE 55 Ca 0.00 -0.61 0.01 0.00 -0.96 0.00 0.00 56.93 55.37 2bwx s PHE 55 Cb 0.00 -2.11 0.48 0.00 -0.34 0.00 0.00 43.02 41.05 2bwx s PHE 55 CO 0.00 -0.36 1.83 -1.71 -1.46 0.00 0.00 175.22 173.51 2bwx n ASN 56 N 4.54 6.41 -4.48 6.13 5.15 -1.26 -4.78 115.26 126.97 2bwx n ASN 56 Ca -0.17 -3.76 -0.30 0.00 -0.60 0.00 0.00 54.58 49.75 2bwx n ASN 56 Cb 0.51 -0.82 -0.12 0.00 -0.53 0.00 0.00 39.78 38.83 2bwx n ASN 56 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2bwx s GLU 57 N -3.69 1.90 0.99 1.20 2.02 -1.26 -4.94 118.70 114.91 2bwx s GLU 57 Ca 0.60 -1.11 -0.16 0.00 0.02 0.00 0.00 54.97 54.32 2bwx s GLU 57 Cb 0.48 -2.15 0.21 0.00 0.10 0.00 0.00 34.13 32.77 2bwx s GLU 57 CO 0.01 0.50 1.28 -1.25 0.02 0.00 0.00 175.26 175.83 2bwx s PRO 58 N -1.91 0.42 -1.23 0.39 0.04 -1.26 -4.48 135.00 126.97 2bwx s PRO 58 Ca 0.17 -0.33 -0.08 0.00 0.04 0.00 0.00 61.00 60.80 2bwx s PRO 58 Cb -0.11 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 2bwx s PRO 58 CO 0.09 -2.58 0.72 0.39 0.04 0.00 0.00 177.00 175.66 2bwx n GLU 59 N -3.90 -3.13 -3.85 4.56 1.02 -1.26 -4.64 120.64 109.44 2bwx n GLU 59 Ca 0.15 0.57 -0.12 0.00 -0.02 0.00 0.00 57.16 57.74 2bwx n GLU 59 Cb 0.59 -4.82 -0.12 0.00 -0.02 0.00 0.00 31.44 27.07 2bwx n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bwx s ALA 60 N -3.60 -0.31 -0.05 0.62 0.00 -1.26 -3.28 121.76 113.88 2bwx s ALA 60 Ca 0.22 0.19 -0.02 0.00 0.00 0.00 0.00 51.96 52.35 2bwx s ALA 60 Cb -0.06 -0.11 0.04 0.00 0.00 0.00 0.00 23.12 22.98 2bwx s ALA 60 CO 0.83 -0.11 0.10 0.08 0.00 0.00 0.00 175.76 176.66 2bwx s VAL 61 N -0.41 -0.10 -0.18 0.00 1.01 -0.09 -0.92 120.40 119.71 2bwx s VAL 61 Ca -0.05 0.26 -0.16 0.00 0.00 0.00 0.00 61.98 62.04 2bwx s VAL 61 Cb -0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2bwx s VAL 61 CO 0.00 0.11 0.38 -0.22 0.00 0.00 0.00 175.10 175.37 2bwx s LEU 62 N 1.49 4.20 -0.21 3.92 2.96 -0.02 -0.40 118.68 130.61 2bwx s LEU 62 Ca -0.05 0.56 0.02 0.00 -0.22 0.00 0.00 54.13 54.44 2bwx s LEU 62 Cb -0.12 -2.50 0.04 0.00 0.50 0.00 0.00 46.19 44.10 2bwx s LEU 62 CO -0.05 -0.02 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.12 2bwx s VAL 63 N 0.98 2.09 -0.31 1.68 1.01 0.60 -0.71 120.40 125.74 2bwx s VAL 63 Ca 0.19 -1.23 -0.10 0.00 0.00 0.00 0.00 61.98 60.85 2bwx s VAL 63 Cb -0.14 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 2bwx s VAL 63 CO 0.07 0.29 0.15 -0.76 0.00 0.00 0.00 175.10 174.85 2bwx s LEU 64 N 1.22 4.07 -0.24 3.92 1.43 -0.32 -0.46 118.68 128.30 2bwx s LEU 64 Ca -0.01 -0.48 -0.07 0.00 -1.03 0.00 0.00 54.13 52.55 2bwx s LEU 64 Cb -0.16 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2bwx s LEU 64 CO -0.10 -0.18 0.05 -0.63 0.23 0.00 0.00 176.35 175.73 2bwx s ILE 65 N 1.62 4.19 -0.53 -0.59 1.01 0.38 -0.70 121.20 126.58 2bwx s ILE 65 Ca 0.05 -0.22 -0.07 0.00 0.00 0.00 0.00 60.65 60.41 2bwx s ILE 65 Cb -0.17 -2.94 0.14 0.00 0.01 0.00 0.00 42.46 39.50 2bwx s ILE 65 CO 0.06 0.37 0.39 -0.75 0.00 0.00 0.00 174.94 175.01 2bwx s LYS 66 N 1.45 2.53 0.15 2.79 2.20 0.10 -1.18 119.74 127.79 2bwx s LYS 66 Ca 0.05 -2.03 -0.12 0.00 -0.36 0.00 0.00 55.97 53.52 2bwx s LYS 66 Cb -0.15 -3.87 0.01 0.00 -1.51 0.00 0.00 37.83 32.31 2bwx s LYS 66 CO 0.03 -1.18 1.58 0.77 -0.36 0.00 0.00 175.35 176.19 2bwx h SER 67 N 7.98 0.90 -0.54 1.43 0.02 -1.34 0.94 113.55 122.93 2bwx h SER 67 Ca -0.12 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2bwx h SER 67 Cb 1.04 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2bwx h SER 67 CO 0.79 1.03 0.00 -0.90 -1.14 0.00 0.00 176.83 176.60 2bwx n ASP 68 N -4.27 0.00 0.00 3.07 5.68 -1.03 -2.77 116.55 117.24 2bwx n ASP 68 Ca 0.01 -0.58 0.10 0.00 -0.50 0.00 0.00 54.79 53.82 2bwx n ASP 68 Cb 0.36 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 40.80 2bwx n ASP 68 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2bwx n ASP 69 N -0.54 0.00 -0.04 -1.12 8.00 -1.26 -3.34 116.55 118.25 2bwx n ASP 69 Ca 0.00 0.46 -0.04 0.00 0.71 0.00 0.00 54.79 55.92 2bwx n ASP 69 Cb 0.00 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 40.56 2bwx n ASP 69 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2bwx n THR 70 N -1.48 0.49 -3.83 -3.53 -2.24 -1.26 -5.02 114.28 97.40 2bwx n THR 70 Ca 0.06 -0.28 -0.36 0.00 -2.27 0.00 0.00 64.05 61.20 2bwx n THR 70 Cb 0.24 -0.81 -0.11 0.00 -2.10 0.00 0.00 70.33 67.55 2bwx n THR 70 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bwx s HIS 71 N -2.17 3.19 0.10 4.78 3.76 -1.21 -5.07 115.29 118.67 2bwx s HIS 71 Ca -0.05 -0.08 -0.13 0.00 -0.15 0.00 0.00 55.06 54.64 2bwx s HIS 71 Cb 0.02 -2.20 0.02 0.00 1.11 0.00 0.00 32.58 31.54 2bwx s HIS 71 CO 0.27 -0.08 0.32 0.54 -0.85 0.00 0.00 174.74 174.94 2bwx s ASN 72 N 1.07 -0.11 0.25 1.40 2.20 -1.26 -1.08 114.94 117.41 2bwx s ASN 72 Ca 0.05 -0.40 -0.18 0.00 -0.94 0.00 0.00 52.86 51.39 2bwx s ASN 72 Cb -0.14 0.41 0.02 0.00 -2.00 0.00 0.00 41.25 39.54 2bwx s ASN 72 CO 0.04 -0.78 0.61 -1.38 -2.94 0.00 0.00 177.10 172.65 2bwx s HIS 73 N -3.63 -0.06 0.01 1.54 -3.43 -0.32 -4.99 115.29 104.40 2bwx s HIS 73 Ca 0.02 -0.33 0.07 0.00 -0.80 0.00 0.00 55.06 54.02 2bwx s HIS 73 Cb 0.02 0.50 -0.02 0.00 -1.43 0.00 0.00 32.58 31.66 2bwx s HIS 73 CO -0.10 -1.08 -0.21 -1.54 -2.00 0.00 0.00 174.74 169.80 2bwx s SER 74 N -2.92 2.53 -0.08 7.38 1.04 -1.26 -0.47 113.70 119.91 2bwx s SER 74 Ca 0.13 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 56.14 2bwx s SER 74 Cb -0.03 -0.26 0.01 0.00 0.10 0.00 0.00 66.02 65.84 2bwx s SER 74 CO 0.04 0.23 -0.14 -0.69 0.98 0.00 0.00 173.24 173.66 2bwx s VAL 75 N -0.61 1.29 -0.18 5.02 1.01 0.40 -2.06 120.40 125.27 2bwx s VAL 75 Ca 0.08 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 2bwx s VAL 75 Cb -0.08 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2bwx s VAL 75 CO 0.00 0.39 0.04 -0.22 0.00 0.00 0.00 175.10 175.32 2bwx s LEU 76 N 0.79 3.68 -0.15 3.92 2.96 -0.26 -0.29 118.68 129.33 2bwx s LEU 76 Ca -0.12 0.03 -0.14 0.00 -0.22 0.00 0.00 54.13 53.68 2bwx s LEU 76 Cb -0.16 -1.93 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 2bwx s LEU 76 CO 0.02 0.16 0.29 -0.36 -1.32 0.00 0.00 176.35 175.15 2bwx s PHE 77 N 0.42 3.48 0.20 5.38 0.08 0.46 -0.41 117.98 127.60 2bwx s PHE 77 Ca 0.02 0.62 -0.17 0.00 0.12 0.00 0.00 56.93 57.51 2bwx s PHE 77 Cb -0.13 -2.32 0.03 0.00 -0.57 0.00 0.00 43.02 40.02 2bwx s PHE 77 CO 0.01 0.28 0.53 0.54 -0.10 0.00 0.00 175.22 176.48 2bwx s ASN 78 N 0.32 -0.25 0.33 1.36 4.22 -0.64 -0.91 114.94 119.36 2bwx s ASN 78 Ca 0.17 -0.51 -0.29 0.00 -2.14 0.00 0.00 52.86 50.09 2bwx s ASN 78 Cb -0.13 0.59 -0.11 0.00 1.28 0.00 0.00 41.25 42.88 2bwx s ASN 78 CO 0.04 -1.07 1.51 -0.13 -2.04 0.00 0.00 177.10 175.41 2bwx s ARG 79 N -3.88 4.15 0.60 3.55 0.52 -1.21 -1.05 118.95 121.63 2bwx s ARG 79 Ca 0.10 2.51 -0.18 0.00 -0.52 0.00 0.00 55.73 57.64 2bwx s ARG 79 Cb -0.01 -3.01 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 2bwx s ARG 79 CO -0.02 -0.53 1.15 0.54 0.02 0.00 0.00 175.30 176.47 2bwx s VAL 80 N -0.57 2.97 0.24 3.52 0.11 -1.26 -3.50 120.40 121.92 2bwx s VAL 80 Ca 0.57 0.56 -0.31 0.00 -2.93 0.00 0.00 61.98 59.87 2bwx s VAL 80 Cb -0.46 -3.17 -0.13 0.00 -1.53 0.00 0.00 36.38 31.09 2bwx s VAL 80 CO 0.54 -0.18 1.42 0.54 -3.33 0.00 0.00 175.10 174.10 2bwx n ARG 81 N -1.74 2.08 -3.37 1.54 5.12 -1.26 -4.80 116.66 114.22 2bwx n ARG 81 Ca 0.12 0.74 -0.07 0.00 -1.93 0.00 0.00 57.85 56.71 2bwx n ARG 81 Cb 0.51 -2.41 -0.07 0.00 -1.16 0.00 0.00 32.46 29.33 2bwx n ARG 81 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2bwx s ASP 82 N 0.31 -0.12 0.16 0.55 -1.08 -1.26 -5.06 116.67 110.17 2bwx s ASP 82 Ca 0.68 0.47 -0.20 0.00 -0.52 0.00 0.00 52.55 52.98 2bwx s ASP 82 Cb -0.64 1.34 0.06 0.00 -1.46 0.00 0.00 42.92 42.22 2bwx s ASP 82 CO 0.49 -0.28 1.64 0.25 0.52 0.00 0.00 175.17 177.80 2bwx h LEU 83 N 8.15 -0.61 0.10 -1.34 5.85 -1.99 -1.10 115.31 124.37 2bwx h LEU 83 Ca -0.19 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2bwx h LEU 83 Cb 1.15 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.50 2bwx h LEU 83 CO 0.24 -0.22 -0.05 0.74 -0.34 0.00 0.00 178.44 178.82 2bwx h THR 84 N -0.15 1.01 -0.45 1.05 2.02 -1.99 0.48 112.91 114.88 2bwx h THR 84 Ca 0.16 -0.38 0.05 0.00 0.77 0.00 0.00 66.41 67.01 2bwx h THR 84 Cb 0.39 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 2bwx h THR 84 CO -0.40 0.09 0.30 0.00 0.37 0.00 0.00 175.52 175.89 2bwx h ALA 85 N 0.58 1.92 0.12 6.16 0.00 -1.91 -1.82 119.26 124.32 2bwx h ALA 85 Ca -0.01 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 2bwx h ALA 85 Cb 0.25 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.97 2bwx h ALA 85 CO 0.02 0.00 -0.97 0.93 0.00 0.00 0.00 179.25 179.24 2bwx h GLU 86 N 0.39 0.44 -0.91 0.00 5.08 -0.90 0.17 114.58 118.86 2bwx h GLU 86 Ca 0.19 -0.64 0.16 0.00 -1.00 0.00 0.00 59.36 58.07 2bwx h GLU 86 Cb 0.27 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 29.64 2bwx h GLU 86 CO -0.05 1.28 0.51 0.82 -1.00 0.00 0.00 179.01 180.57 2bwx h ILE 87 N -0.07 0.74 0.06 3.13 2.04 -0.61 -1.49 117.51 121.31 2bwx h ILE 87 Ca -0.15 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 2bwx h ILE 87 Cb 1.71 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 2bwx h ILE 87 CO 0.18 0.13 -0.03 -0.50 0.00 0.00 0.00 178.15 177.93 2bwx h TRP 88 N 0.70 -0.08 -0.00 1.37 4.06 -1.30 -3.43 115.95 117.28 2bwx h TRP 88 Ca 0.50 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.45 2bwx h TRP 88 Cb 0.71 0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.90 2bwx h TRP 88 CO -0.06 0.50 -0.05 1.19 -3.56 0.00 0.00 178.44 176.47 2bwx n PHE 89 N -4.78 0.00 0.00 0.49 3.72 0.61 -5.10 117.46 112.39 2bwx n PHE 89 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2bwx n PHE 89 Cb 0.30 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2bwx n PHE 89 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bwx n GLY 90 N 0.71 2.94 3.78 1.37 0.00 -0.56 -5.00 105.19 108.44 2bwx n GLY 90 Ca 0.01 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.66 2bwx n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bwx s ARG 91 N -2.35 3.61 0.06 1.61 0.52 -1.26 -4.09 118.95 117.05 2bwx s ARG 91 Ca 0.00 1.50 0.08 0.00 -0.52 0.00 0.00 55.73 56.79 2bwx s ARG 91 Cb 0.00 -2.09 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 2bwx s ARG 91 CO 0.00 -0.61 -0.23 1.03 0.02 0.00 0.00 175.30 175.51 2bwx s ARG 92 N -3.20 1.50 0.08 3.54 0.52 -1.26 -5.05 118.95 115.08 2bwx s ARG 92 Ca 0.69 -1.05 -0.21 0.00 -0.52 0.00 0.00 55.73 54.64 2bwx s ARG 92 Cb -0.20 -1.68 -0.11 0.00 0.52 0.00 0.00 34.95 33.48 2bwx s ARG 92 CO 0.24 0.43 1.64 1.25 0.02 0.00 0.00 175.30 178.87 2bwx h LEU 93 N 4.69 0.19 0.00 2.53 5.85 -1.94 -3.46 115.31 123.18 2bwx h LEU 93 Ca -0.45 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.16 2bwx h LEU 93 Cb 1.16 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 2bwx h LEU 93 CO 0.43 0.28 -0.05 0.61 -0.34 0.00 0.00 178.44 179.37 2bwx n GLY 94 N -0.75 -2.18 0.11 3.75 0.00 -1.23 -4.36 105.19 100.53 2bwx n GLY 94 Ca -0.05 -1.47 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 2bwx n GLY 94 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2bwx h GLN 95 N 0.00 0.20 -0.34 1.61 7.50 -1.90 -3.27 115.11 118.91 2bwx h GLN 95 Ca 0.00 -0.34 -0.05 0.00 0.50 0.00 0.00 58.65 58.77 2bwx h GLN 95 Cb 0.12 0.13 -0.01 0.00 0.05 0.00 0.00 27.48 27.76 2bwx h GLN 95 CO 0.00 1.02 0.03 -0.44 -1.50 0.00 0.00 178.83 177.94 2bwx h ASP 96 N 0.05 0.57 1.34 1.46 3.32 -1.91 -3.23 116.42 118.01 2bwx h ASP 96 Ca -0.26 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2bwx h ASP 96 Cb 2.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 41.40 2bwx h ASP 96 CO 0.14 0.71 -0.43 0.00 -1.72 0.00 0.00 179.24 177.94 2bwx h ALA 97 N 0.88 0.76 -0.31 3.45 0.00 -1.76 -3.39 119.26 118.88 2bwx h ALA 97 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2bwx h ALA 97 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2bwx h ALA 97 CO 0.01 0.00 0.12 0.00 0.00 0.00 0.00 179.25 179.38 2bwx h ALA 98 N 2.23 0.40 -0.51 0.00 0.00 -1.60 -1.91 119.26 117.88 2bwx h ALA 98 Ca 0.00 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2bwx h ALA 98 Cb 0.88 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 2bwx h ALA 98 CO 0.00 0.01 0.15 -1.35 0.00 0.00 0.00 179.25 178.06 2bwx h PRO 99 N 0.35 0.30 -0.23 0.00 0.11 -1.76 0.45 132.00 131.23 2bwx h PRO 99 Ca 0.10 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.06 2bwx h PRO 99 Cb 0.19 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 2bwx h PRO 99 CO -0.01 0.20 -0.39 1.49 -0.21 0.00 0.00 178.00 179.08 2bwx h GLU 100 N 0.31 0.66 -0.28 1.05 4.22 -1.80 0.12 114.58 118.86 2bwx h GLU 100 Ca 0.25 -0.41 -0.03 0.00 0.08 0.00 0.00 59.36 59.24 2bwx h GLU 100 Cb 0.30 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2bwx h GLU 100 CO -0.28 1.03 0.04 -0.22 -2.18 0.00 0.00 179.01 177.40 2bwx h LYS 101 N 0.37 0.47 0.00 1.92 1.63 -1.09 -3.31 116.57 116.55 2bwx h LYS 101 Ca 0.02 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2bwx h LYS 101 Cb 0.99 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2bwx h LYS 101 CO 0.09 0.58 -1.64 1.28 -3.45 0.00 0.00 179.45 176.31 2bwx n LEU 102 N -4.65 0.32 -0.15 5.20 4.77 0.13 -4.91 117.00 117.70 2bwx n LEU 102 Ca -0.03 -0.08 -0.01 0.00 -0.03 0.00 0.00 56.01 55.86 2bwx n LEU 102 Cb 0.21 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2bwx n LEU 102 CO 0.37 0.04 -0.01 0.61 -1.33 0.00 0.00 177.39 177.08 2bwx n GLY 103 N 1.31 0.40 3.95 -0.72 0.00 0.39 -4.81 105.19 105.71 2bwx n GLY 103 Ca -0.02 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.94 2bwx n GLY 103 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bwx s VAL 104 N -2.15 5.22 0.11 1.61 -7.23 -1.06 -4.95 120.40 111.95 2bwx s VAL 104 Ca 0.00 -0.91 -0.05 0.00 -1.81 0.00 0.00 61.98 59.21 2bwx s VAL 104 Cb -0.00 -3.78 -0.22 0.00 0.56 0.00 0.00 36.38 32.93 2bwx s VAL 104 CO 0.00 -0.25 1.24 0.44 -0.31 0.00 0.00 175.10 176.22 2bwx h ASP 105 N 1.54 0.50 -4.99 4.85 3.32 -1.81 -3.39 116.42 116.43 2bwx h ASP 105 Ca -0.51 -0.45 -0.13 0.00 0.02 0.00 0.00 57.03 55.96 2bwx h ASP 105 Cb 1.22 -0.16 -0.20 0.00 0.22 0.00 0.00 39.33 40.41 2bwx h ASP 105 CO 0.64 1.29 -0.41 -0.13 -1.72 0.00 0.00 179.24 178.91 2bwx s ARG 106 N -3.03 0.57 -0.01 3.56 0.52 -0.88 -4.94 118.95 114.75 2bwx s ARG 106 Ca -0.05 -0.35 0.03 0.00 -0.52 0.00 0.00 55.73 54.83 2bwx s ARG 106 Cb 0.08 0.24 -0.00 0.00 0.52 0.00 0.00 34.95 35.79 2bwx s ARG 106 CO 0.88 -0.15 -0.08 0.00 0.02 0.00 0.00 175.30 175.96 2bwx s ALA 107 N -1.49 0.72 0.14 2.13 0.00 -1.26 -1.10 121.76 120.91 2bwx s ALA 107 Ca -0.13 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.52 2bwx s ALA 107 Cb -0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 2bwx s ALA 107 CO 0.02 0.17 -0.12 -0.51 0.00 0.00 0.00 175.76 175.32 2bwx s LEU 108 N -0.13 2.49 0.21 0.00 1.43 0.45 -4.89 118.68 118.23 2bwx s LEU 108 Ca 0.02 -0.94 -0.30 0.00 -1.03 0.00 0.00 54.13 51.89 2bwx s LEU 108 Cb -0.04 -0.43 -0.09 0.00 0.03 0.00 0.00 46.19 45.66 2bwx s LEU 108 CO -0.00 -0.26 1.27 0.00 0.23 0.00 0.00 176.35 177.59 2bwx s ALA 109 N -2.88 3.49 0.39 4.21 0.00 -1.26 -1.62 121.76 124.09 2bwx s ALA 109 Ca 0.14 1.07 0.08 0.00 0.00 0.00 0.00 51.96 53.24 2bwx s ALA 109 Cb -0.00 -3.46 0.82 0.00 0.00 0.00 0.00 23.12 20.48 2bwx s ALA 109 CO 0.02 -0.49 1.99 0.35 0.00 0.00 0.00 175.76 177.63 2bwx h PHE 110 N 5.16 0.64 0.00 0.00 3.57 -1.38 -1.05 116.94 123.88 2bwx h PHE 110 Ca -0.45 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2bwx h PHE 110 Cb 1.21 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2bwx h PHE 110 CO 0.62 0.35 0.10 0.66 -2.23 0.00 0.00 178.31 177.80 2bwx h SER 111 N 0.64 0.00 -0.35 0.41 4.64 -1.91 -1.43 113.55 115.55 2bwx h SER 111 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2bwx h SER 111 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2bwx h SER 111 CO -0.08 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.26 2bwx n GLU 112 N -2.86 2.47 -0.32 4.77 -0.58 -0.40 -4.67 120.64 119.04 2bwx n GLU 112 Ca -0.02 -2.24 0.01 0.00 -0.42 0.00 0.00 57.16 54.48 2bwx n GLU 112 Cb 0.15 -1.50 0.19 0.00 -0.57 0.00 0.00 31.44 29.71 2bwx n GLU 112 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 2bwx h ILE 113 N 4.42 1.17 0.00 -3.67 2.10 -1.32 -0.55 117.51 119.66 2bwx h ILE 113 Ca 0.00 -0.40 -0.08 0.00 1.08 0.00 0.00 64.86 65.46 2bwx h ILE 113 Cb 0.98 -0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 36.59 2bwx h ILE 113 CO 0.00 0.21 -0.37 0.78 -1.08 0.00 0.00 178.15 177.70 2bwx h ASN 114 N 1.17 0.00 1.80 2.19 2.35 -1.83 0.30 115.58 121.55 2bwx h ASN 114 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 2bwx h ASN 114 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2bwx h ASN 114 CO -0.11 0.37 -0.16 1.56 -1.65 0.00 0.00 177.43 177.44 2bwx h GLN 115 N 0.00 0.00 0.00 0.81 7.50 -1.48 -3.40 115.11 118.53 2bwx h GLN 115 Ca -0.00 0.00 -0.09 0.00 0.50 0.00 0.00 58.65 59.05 2bwx h GLN 115 Cb 0.85 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.36 2bwx h GLN 115 CO 0.05 0.00 -1.36 1.04 -1.50 0.00 0.00 178.83 177.06 2bwx n GLN 116 N -2.96 2.08 -0.11 1.46 1.13 -0.50 -4.71 117.38 113.77 2bwx n GLN 116 Ca 0.04 0.01 -0.08 0.00 -1.94 0.00 0.00 57.00 55.03 2bwx n GLN 116 Cb 0.52 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.74 2bwx n GLN 116 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2bwx h LEU 117 N 0.00 0.35 -1.67 1.08 5.85 -0.63 -1.72 115.31 118.56 2bwx h LEU 117 Ca -0.14 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.62 2bwx h LEU 117 Cb 1.28 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 2bwx h LEU 117 CO -0.00 0.25 0.29 0.10 -0.34 0.00 0.00 178.44 178.74 2bwx h TYR 118 N 0.44 0.41 -0.27 1.25 -0.00 -1.81 -1.02 116.97 115.96 2bwx h TYR 118 Ca 0.14 0.01 -0.09 0.00 -0.00 0.00 0.00 58.73 58.80 2bwx h TYR 118 Cb -0.00 -0.14 -0.01 0.00 -0.00 0.00 0.00 36.73 36.58 2bwx h TYR 118 CO -0.07 0.23 -0.20 1.96 -0.00 0.00 0.00 178.16 180.08 2bwx h GLN 119 N 0.42 0.49 -0.07 0.10 4.20 -1.61 -0.15 115.11 118.49 2bwx h GLN 119 Ca 0.18 -0.16 -0.15 0.00 0.06 0.00 0.00 58.65 58.58 2bwx h GLN 119 Cb 0.21 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2bwx h GLN 119 CO -0.04 0.66 -0.62 -0.07 -0.67 0.00 0.00 178.83 178.09 2bwx h LEU 120 N 0.44 0.29 0.00 1.46 3.38 -0.85 -3.26 115.31 116.78 2bwx h LEU 120 Ca 0.07 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2bwx h LEU 120 Cb 0.59 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2bwx h LEU 120 CO 0.04 0.84 -0.73 -0.07 0.09 0.00 0.00 178.44 178.61 2bwx h LEU 121 N 0.19 0.00 -9.39 1.67 3.38 -1.06 -3.46 115.31 106.64 2bwx h LEU 121 Ca -0.01 -0.06 -0.61 0.00 0.09 0.00 0.00 57.88 57.29 2bwx h LEU 121 Cb 1.13 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.93 2bwx h LEU 121 CO 0.10 0.03 0.84 -3.20 0.09 0.00 0.00 178.44 176.30 2bwx n ASN 122 N -2.57 2.95 0.00 -0.43 5.15 -0.09 -1.74 115.26 118.53 2bwx n ASN 122 Ca 0.02 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.05 2bwx n ASN 122 Cb 0.51 -1.36 0.00 0.00 -0.53 0.00 0.00 39.78 38.40 2bwx n ASN 122 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bwx n GLY 123 N 3.61 2.22 3.80 8.20 0.00 -0.64 -4.95 105.19 117.43 2bwx n GLY 123 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2bwx n GLY 123 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bwx s LEU 124 N 0.00 3.29 -0.07 0.99 1.43 -0.71 -4.97 118.68 118.64 2bwx s LEU 124 Ca 0.00 1.76 0.04 0.00 -1.03 0.00 0.00 54.13 54.90 2bwx s LEU 124 Cb 0.00 -4.52 -0.25 0.00 0.03 0.00 0.00 46.19 41.46 2bwx s LEU 124 CO 0.00 -1.42 0.57 0.44 0.23 0.00 0.00 176.35 176.16 2bwx h ASP 125 N -0.23 0.19 -3.73 2.29 3.32 -1.00 -3.15 116.42 114.11 2bwx h ASP 125 Ca -0.45 -0.40 -0.35 0.00 0.02 0.00 0.00 57.03 55.84 2bwx h ASP 125 Cb 1.22 -0.06 -0.31 0.00 0.22 0.00 0.00 39.33 40.40 2bwx h ASP 125 CO 0.56 1.36 -0.76 -0.69 -1.72 0.00 0.00 179.24 177.99 2bwx s VAL 126 N -2.59 0.41 -0.11 -1.35 1.01 -1.08 -2.97 120.40 113.73 2bwx s VAL 126 Ca -0.12 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2bwx s VAL 126 Cb 0.07 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 36.05 2bwx s VAL 126 CO 0.81 0.15 -0.20 0.54 0.00 0.00 0.00 175.10 176.40 2bwx s VAL 127 N 0.32 2.46 -0.28 2.92 0.11 0.08 -1.98 120.40 124.02 2bwx s VAL 127 Ca -0.03 -0.88 -0.13 0.00 -2.93 0.00 0.00 61.98 58.00 2bwx s VAL 127 Cb -0.07 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.76 2bwx s VAL 127 CO -0.00 0.55 0.29 -0.31 -3.33 0.00 0.00 175.10 172.30 2bwx s TYR 128 N 0.29 3.23 -0.12 1.54 1.51 0.92 -0.79 117.35 123.93 2bwx s TYR 128 Ca -0.14 0.23 -0.07 0.00 -1.01 0.00 0.00 57.07 56.08 2bwx s TYR 128 Cb -0.17 -2.50 0.04 0.00 -0.11 0.00 0.00 41.96 39.23 2bwx s TYR 128 CO 0.07 -0.22 0.28 -1.58 -1.11 0.00 0.00 175.55 172.99 2bwx s HIS 129 N 1.92 -0.37 -1.32 2.71 2.46 -0.31 -0.93 115.29 119.45 2bwx s HIS 129 Ca 0.11 0.86 -0.17 0.00 0.47 0.00 0.00 55.06 56.33 2bwx s HIS 129 Cb -0.16 0.10 0.07 0.00 -0.13 0.00 0.00 32.58 32.46 2bwx s HIS 129 CO 0.11 -0.24 1.80 0.00 -2.47 0.00 0.00 174.74 173.93 2bwx n ALA 130 N 4.00 3.86 -1.82 1.58 0.00 -1.26 -3.83 120.51 123.03 2bwx n ALA 130 Ca -0.23 -3.88 -0.42 0.00 0.00 0.00 0.00 53.44 48.92 2bwx n ALA 130 Cb 0.54 -3.57 -0.02 0.00 0.00 0.00 0.00 19.45 16.40 2bwx n ALA 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2bwx s GLN 131 N 3.93 4.17 0.00 0.00 0.74 -1.26 -2.03 119.66 125.22 2bwx s GLN 131 Ca 0.52 2.47 0.00 0.00 0.05 0.00 0.00 55.36 58.41 2bwx s GLN 131 Cb 0.05 -3.09 0.00 0.00 1.10 0.00 0.00 33.01 31.07 2bwx s GLN 131 CO 0.05 -0.62 0.00 0.41 -0.55 0.00 0.00 175.29 174.58 2bwx n GLY 132 N 3.13 1.17 0.15 2.59 0.00 -1.26 -4.93 105.19 106.04 2bwx n GLY 132 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2bwx n GLY 132 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bwx h GLU 133 N 3.42 -0.27 -4.12 1.61 4.57 -1.84 -3.44 114.58 114.51 2bwx h GLU 133 Ca 0.00 0.02 -0.34 0.00 -1.18 0.00 0.00 59.36 57.85 2bwx h GLU 133 Cb 0.00 0.06 -0.31 0.00 -0.16 0.00 0.00 28.75 28.35 2bwx h GLU 133 CO 0.00 -0.02 -0.76 0.71 -1.18 0.00 0.00 179.01 177.76 2bwx s TYR 134 N -5.25 0.49 0.20 0.92 2.02 -1.26 -5.05 117.35 109.41 2bwx s TYR 134 Ca -0.15 -0.09 -0.11 0.00 -0.37 0.00 0.00 57.07 56.35 2bwx s TYR 134 Cb 0.03 -0.39 0.18 0.00 -0.40 0.00 0.00 41.96 41.38 2bwx s TYR 134 CO 0.61 -0.07 1.84 0.00 -1.57 0.00 0.00 175.55 176.36 2bwx h ALA 135 N 6.51 0.86 -0.37 3.71 0.00 -1.99 -1.59 119.26 126.38 2bwx h ALA 135 Ca -0.33 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 2bwx h ALA 135 Cb 1.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2bwx h ALA 135 CO 0.49 0.16 0.02 0.10 0.00 0.00 0.00 179.25 180.02 2bwx h TYR 136 N 0.79 0.59 -0.11 0.00 -0.00 -2.00 -1.12 116.97 115.13 2bwx h TYR 136 Ca 0.27 -0.06 -0.04 0.00 -0.00 0.00 0.00 58.73 58.90 2bwx h TYR 136 Cb 0.03 -0.17 -0.00 0.00 -0.00 0.00 0.00 36.73 36.59 2bwx h TYR 136 CO -0.05 0.56 -0.10 0.00 -0.00 0.00 0.00 178.16 178.57 2bwx h ALA 137 N 1.48 0.16 -0.82 0.10 0.00 -1.87 -2.55 119.26 115.76 2bwx h ALA 137 Ca 0.12 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 54.80 2bwx h ALA 137 Cb 0.33 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2bwx h ALA 137 CO 0.01 -0.00 0.49 -0.44 0.00 0.00 0.00 179.25 179.30 2bwx h ASP 138 N -0.14 0.74 -0.41 0.00 3.32 -1.03 -0.48 116.42 118.43 2bwx h ASP 138 Ca 0.02 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.12 2bwx h ASP 138 Cb 0.62 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.02 2bwx h ASP 138 CO 0.03 0.45 0.24 0.58 -1.72 0.00 0.00 179.24 178.82 2bwx h VAL 139 N 0.86 1.03 -0.34 -1.35 2.07 -1.14 0.47 116.25 117.86 2bwx h VAL 139 Ca 0.37 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 2bwx h VAL 139 Cb 0.25 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2bwx h VAL 139 CO -0.20 0.09 0.12 0.40 0.02 0.00 0.00 177.57 178.00 2bwx h ILE 140 N 0.48 1.19 -0.19 4.57 2.04 -0.96 -1.49 117.51 123.15 2bwx h ILE 140 Ca 0.17 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 2bwx h ILE 140 Cb 0.02 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2bwx h ILE 140 CO -0.08 0.21 -0.03 0.58 0.00 0.00 0.00 178.15 178.83 2bwx h VAL 141 N 0.40 1.28 -0.61 1.67 2.07 -0.97 -2.16 116.25 117.92 2bwx h VAL 141 Ca 0.11 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 2bwx h VAL 141 Cb 0.21 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 2bwx h VAL 141 CO -0.01 0.29 0.24 0.78 0.02 0.00 0.00 177.57 178.89 2bwx h ASN 142 N 0.08 0.81 -0.47 0.57 2.35 -0.86 -1.39 115.58 116.67 2bwx h ASN 142 Ca 0.05 -0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 2bwx h ASN 142 Cb 0.46 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 2bwx h ASN 142 CO 0.02 0.73 0.09 -1.28 -1.65 0.00 0.00 177.43 175.34 2bwx h SER 143 N 0.87 0.73 -0.32 5.81 0.87 -1.17 -0.35 113.55 119.98 2bwx h SER 143 Ca 0.21 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 2bwx h SER 143 Cb 0.18 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 2bwx h SER 143 CO -0.02 0.79 0.14 0.00 -0.53 0.00 0.00 176.83 177.21 2bwx h ALA 144 N 0.96 0.42 -0.61 6.23 0.00 -0.97 -1.34 119.26 123.95 2bwx h ALA 144 Ca 0.14 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2bwx h ALA 144 Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2bwx h ALA 144 CO 0.01 0.00 0.06 -0.07 0.00 0.00 0.00 179.25 179.25 2bwx h LEU 145 N 0.38 0.99 -0.63 0.00 3.38 -1.16 -2.12 115.31 116.16 2bwx h LEU 145 Ca 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2bwx h LEU 145 Cb 0.16 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2bwx h LEU 145 CO -0.01 1.01 0.31 -0.33 0.09 0.00 0.00 178.44 179.51 2bwx h GLU 146 N 0.96 0.89 -0.75 1.13 4.39 -0.92 0.87 114.58 121.15 2bwx h GLU 146 Ca 0.18 -0.13 0.07 0.00 0.34 0.00 0.00 59.36 59.82 2bwx h GLU 146 Cb 0.47 -0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 28.90 2bwx h GLU 146 CO 0.02 0.71 0.44 0.87 -1.16 0.00 0.00 179.01 179.89 2bwx h LYS 147 N 0.86 0.77 -0.09 2.33 1.57 -0.94 -1.03 116.57 120.03 2bwx h LYS 147 Ca 0.22 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2bwx h LYS 147 Cb 0.10 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 2bwx h LYS 147 CO -0.03 0.51 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.23 2bwx h LEU 148 N 0.79 0.22 -0.69 2.94 3.38 -1.01 -1.74 115.31 119.20 2bwx h LEU 148 Ca 0.34 -0.44 0.07 0.00 0.09 0.00 0.00 57.88 57.93 2bwx h LEU 148 Cb 0.21 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 2bwx h LEU 148 CO -0.19 0.61 0.37 0.03 0.09 0.00 0.00 178.44 179.35 2bwx h ARG 149 N -0.18 0.64 -0.02 1.13 3.08 -0.68 -2.08 114.38 116.27 2bwx h ARG 149 Ca 0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2bwx h ARG 149 Cb 0.54 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2bwx h ARG 149 CO 0.02 0.43 0.00 1.63 -1.07 0.00 0.00 179.97 180.97 2bwx n LYS 150 N -4.81 1.26 -0.90 0.04 5.02 -0.41 -4.34 118.16 114.03 2bwx n LYS 150 Ca 0.09 -0.38 -0.06 0.00 -2.02 0.00 0.00 58.31 55.95 2bwx n LYS 150 Cb 0.21 -1.46 0.26 0.00 -0.02 0.00 0.00 35.03 34.02 2bwx n LYS 150 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bwx n GLY 151 N 1.04 4.13 0.32 0.72 0.00 -0.66 -4.66 105.19 106.07 2bwx n GLY 151 Ca 0.20 -1.07 0.06 0.00 0.00 0.00 0.00 46.02 45.21 2bwx n GLY 151 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bwx h SER 152 N 1.90 0.42 0.79 1.61 4.64 -1.74 0.33 113.55 121.51 2bwx h SER 152 Ca 0.26 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 2bwx h SER 152 Cb 2.11 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 64.10 2bwx h SER 152 CO 0.63 0.30 -0.07 0.03 -0.87 0.00 0.00 176.83 176.84 2bwx h ARG 153 N 0.49 0.00 -0.65 4.77 3.08 -1.89 -0.30 114.38 119.89 2bwx h ARG 153 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2bwx h ARG 153 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2bwx h ARG 153 CO -0.04 0.07 0.00 1.04 -1.07 0.00 0.00 179.97 179.97 2bwx n GLN 154 N -3.24 3.64 -2.99 0.04 3.00 -0.04 -4.95 117.38 112.84 2bwx n GLN 154 Ca -0.00 -2.65 -0.22 0.00 -0.01 0.00 0.00 57.00 54.12 2bwx n GLN 154 Cb 0.30 -1.89 0.03 0.00 0.00 0.00 0.00 30.24 28.67 2bwx n GLN 154 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2bwx n ASN 155 N 0.97 -5.87 -4.90 1.08 3.02 -0.12 -5.01 115.26 104.43 2bwx n ASN 155 Ca 0.24 -0.26 -0.32 0.00 -0.03 0.00 0.00 54.58 54.20 2bwx n ASN 155 Cb 0.86 -4.77 -0.05 0.00 -0.61 0.00 0.00 39.78 35.22 2bwx n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2bwx s LEU 156 N -6.60 4.30 -0.03 3.41 1.43 -0.36 -4.98 118.68 115.84 2bwx s LEU 156 Ca 0.28 0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 53.92 2bwx s LEU 156 Cb -0.13 -3.16 0.01 0.00 0.03 0.00 0.00 46.19 42.94 2bwx s LEU 156 CO 0.35 0.10 0.09 0.42 0.23 0.00 0.00 176.35 177.53 2bwx s THR 157 N -1.57 -0.01 0.09 5.49 -4.23 -1.26 -3.82 115.64 110.33 2bwx s THR 157 Ca 0.38 0.04 -0.13 0.00 -1.18 0.00 0.00 61.69 60.80 2bwx s THR 157 Cb -0.13 -0.13 -0.06 0.00 1.34 0.00 0.00 72.50 73.52 2bwx s THR 157 CO 0.23 0.02 0.47 0.00 -0.54 0.00 0.00 174.62 174.80 2bwx s ALA 158 N 0.29 3.65 0.14 3.99 0.00 -1.26 -1.61 121.76 126.96 2bwx s ALA 158 Ca -0.02 -0.23 -0.31 0.00 0.00 0.00 0.00 51.96 51.40 2bwx s ALA 158 Cb -0.03 -2.41 -0.09 0.00 0.00 0.00 0.00 23.12 20.58 2bwx s ALA 158 CO -0.01 0.50 1.56 -1.25 0.00 0.00 0.00 175.76 176.56 2bwx s PRO 159 N -1.72 4.23 0.32 0.00 0.04 -1.19 -4.89 135.00 131.77 2bwx s PRO 159 Ca 0.33 2.32 0.25 0.00 0.04 0.00 0.00 61.00 63.93 2bwx s PRO 159 Cb -0.15 -3.25 0.56 0.00 0.04 0.00 0.00 34.50 31.70 2bwx s PRO 159 CO 0.18 -0.61 1.67 0.00 0.04 0.00 0.00 177.00 178.28 2bwx h ALA 160 N 7.08 0.98 -3.22 8.56 0.00 -1.79 -3.45 119.26 127.42 2bwx h ALA 160 Ca -0.42 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.85 2bwx h ALA 160 Cb 1.20 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.77 2bwx h ALA 160 CO 0.91 0.00 -0.66 0.99 0.00 0.00 0.00 179.25 180.49 2bwx s THR 161 N -3.16 3.94 -0.15 0.00 2.01 -1.16 -5.06 115.64 112.06 2bwx s THR 161 Ca 0.09 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.77 2bwx s THR 161 Cb 0.09 -2.75 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2bwx s THR 161 CO 0.64 0.46 -0.20 -0.32 -0.69 0.00 0.00 174.62 174.51 2bwx s MET 162 N 0.64 3.05 -0.11 4.92 1.75 -1.26 -0.75 119.30 127.55 2bwx s MET 162 Ca -0.01 -0.83 0.02 0.00 -1.25 0.00 0.00 55.69 53.62 2bwx s MET 162 Cb -0.14 -2.51 -0.01 0.00 2.84 0.00 0.00 34.83 35.02 2bwx s MET 162 CO 0.02 -0.06 -0.20 0.42 -0.65 0.00 0.00 175.02 174.56 2bwx s ILE 163 N 0.93 2.46 -0.22 10.11 1.01 0.03 -4.97 121.20 130.55 2bwx s ILE 163 Ca -0.04 -0.88 -0.29 0.00 0.00 0.00 0.00 60.65 59.45 2bwx s ILE 163 Cb -0.15 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 2bwx s ILE 163 CO -0.04 0.55 1.61 -0.62 0.00 0.00 0.00 174.94 176.43 2bwx s ASP 164 N 0.33 6.38 0.00 3.58 -1.08 -1.25 -1.17 116.67 123.46 2bwx s ASP 164 Ca -0.15 1.60 0.27 0.00 -0.52 0.00 0.00 52.55 53.75 2bwx s ASP 164 Cb -0.17 -2.53 1.21 0.00 -1.46 0.00 0.00 42.92 39.97 2bwx s ASP 164 CO 0.08 -1.26 1.88 -2.67 0.52 0.00 0.00 175.17 173.71 2bwx n TRP 165 N 8.44 0.00 -0.08 -5.34 4.27 -1.26 -4.19 117.44 119.28 2bwx n TRP 165 Ca 0.19 0.00 -0.07 0.00 -3.89 0.00 0.00 57.50 53.72 2bwx n TRP 165 Cb 0.45 -0.44 -0.00 0.00 -1.36 0.00 0.00 31.31 29.96 2bwx n TRP 165 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2bwx h ARG 166 N 0.00 0.21 -0.59 -2.67 3.08 -1.91 -0.39 114.38 112.11 2bwx h ARG 166 Ca 0.00 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.13 2bwx h ARG 166 Cb 0.40 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.33 2bwx h ARG 166 CO 0.00 0.14 0.21 -1.35 -1.07 0.00 0.00 179.97 177.91 2bwx h PRO 167 N 0.22 0.38 -0.34 0.04 0.11 -2.00 0.23 132.00 130.65 2bwx h PRO 167 Ca 0.13 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 2bwx h PRO 167 Cb 0.11 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 2bwx h PRO 167 CO -0.14 0.25 0.04 -0.24 -0.21 0.00 0.00 178.00 177.70 2bwx h VAL 168 N 0.39 1.24 -0.37 3.15 3.04 -1.71 -2.03 116.25 119.97 2bwx h VAL 168 Ca 0.30 -0.86 -0.14 0.00 -1.01 0.00 0.00 66.70 64.98 2bwx h VAL 168 Cb 0.36 1.15 -0.01 0.00 -2.01 0.00 0.00 31.29 30.78 2bwx h VAL 168 CO -0.30 0.29 -0.34 0.58 -1.01 0.00 0.00 177.57 176.79 2bwx h VAL 169 N 0.40 1.28 -0.21 1.51 2.07 -0.83 -1.87 116.25 118.61 2bwx h VAL 169 Ca 0.10 -1.50 -0.10 0.00 0.82 0.00 0.00 66.70 66.03 2bwx h VAL 169 Cb 0.38 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 2bwx h VAL 169 CO 0.01 0.50 -0.30 0.45 0.02 0.00 0.00 177.57 178.25 2bwx h HIS 170 N 0.70 0.47 -0.59 1.57 3.86 -0.49 0.21 115.15 120.88 2bwx h HIS 170 Ca 0.07 -0.11 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 2bwx h HIS 170 Cb 0.89 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.23 2bwx h HIS 170 CO 0.05 0.67 0.07 1.49 0.86 0.00 0.00 177.93 181.08 2bwx h GLU 171 N 0.36 0.96 0.09 2.45 4.57 -1.18 -1.42 114.58 120.41 2bwx h GLU 171 Ca 0.05 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 57.98 2bwx h GLU 171 Cb 0.71 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2bwx h GLU 171 CO 0.05 0.90 -0.05 0.52 -1.18 0.00 0.00 179.01 179.25 2bwx h MET 172 N 0.90 -0.13 0.00 1.92 2.86 -0.67 -3.01 114.93 116.79 2bwx h MET 172 Ca 0.18 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2bwx h MET 172 Cb 0.42 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 2bwx h MET 172 CO 0.01 -0.09 -0.05 0.00 1.06 0.00 0.00 176.91 177.84 2bwx h ARG 173 N -0.14 0.00 0.00 1.72 3.08 -0.80 -2.70 114.38 115.54 2bwx h ARG 173 Ca -0.01 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2bwx h ARG 173 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2bwx h ARG 173 CO 0.01 0.05 -0.21 1.25 -1.07 0.00 0.00 179.97 180.00 2bwx h LEU 174 N 0.00 0.00 -8.27 3.04 5.85 -1.12 -3.39 115.31 111.42 2bwx h LEU 174 Ca -0.00 0.00 -0.69 0.00 0.84 0.00 0.00 57.88 58.03 2bwx h LEU 174 Cb 0.12 0.00 -0.28 0.00 0.37 0.00 0.00 40.66 40.87 2bwx h LEU 174 CO 0.01 0.21 -0.60 -0.36 -0.34 0.00 0.00 178.44 177.35 2bwx s PHE 175 N -4.36 3.22 0.16 1.25 0.40 -1.02 -4.09 117.98 113.54 2bwx s PHE 175 Ca -0.03 -1.24 -0.24 0.00 -0.60 0.00 0.00 56.93 54.81 2bwx s PHE 175 Cb 0.14 -2.28 -0.08 0.00 0.51 0.00 0.00 43.02 41.31 2bwx s PHE 175 CO 0.67 -0.67 0.75 0.15 0.70 0.00 0.00 175.22 176.82 2bwx s LYS 176 N 1.45 4.51 0.79 0.44 3.01 -0.30 -4.96 119.74 124.68 2bwx s LYS 176 Ca 0.00 1.10 -0.11 0.00 -1.01 0.00 0.00 55.97 55.95 2bwx s LYS 176 Cb -0.19 -3.22 0.07 0.00 -1.01 0.00 0.00 37.83 33.47 2bwx s LYS 176 CO 0.03 0.56 1.09 -1.54 0.51 0.00 0.00 175.35 176.00 2bwx s SER 177 N -1.19 4.45 0.33 2.83 1.04 -1.26 -4.79 113.70 115.11 2bwx s SER 177 Ca 0.36 1.59 0.06 0.00 0.48 0.00 0.00 55.95 58.43 2bwx s SER 177 Cb -0.22 -2.33 0.71 0.00 0.10 0.00 0.00 66.02 64.27 2bwx s SER 177 CO 0.25 -2.03 1.86 -0.65 0.98 0.00 0.00 173.24 173.65 2bwx h PRO 178 N -1.13 0.80 -0.46 4.02 0.11 -1.99 -0.87 132.00 132.47 2bwx h PRO 178 Ca -0.46 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2bwx h PRO 178 Cb 1.25 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2bwx h PRO 178 CO 0.55 0.53 0.16 0.93 -0.21 0.00 0.00 178.00 179.96 2bwx h GLU 179 N 0.82 0.71 -0.60 1.05 3.07 -1.94 -0.32 114.58 117.37 2bwx h GLU 179 Ca 0.46 -0.14 0.03 0.00 -0.50 0.00 0.00 59.36 59.21 2bwx h GLU 179 Cb 0.60 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 2bwx h GLU 179 CO -0.22 0.66 0.36 0.93 -1.40 0.00 0.00 179.01 179.34 2bwx h GLU 180 N 0.61 0.69 -0.86 2.33 5.08 -1.71 -1.98 114.58 118.74 2bwx h GLU 180 Ca 0.15 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2bwx h GLU 180 Cb 0.24 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2bwx h GLU 180 CO -0.01 0.46 0.49 0.82 -1.00 0.00 0.00 179.01 179.76 2bwx h ILE 181 N 0.71 1.25 -0.81 3.13 2.04 -0.85 0.18 117.51 123.15 2bwx h ILE 181 Ca 0.25 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 2bwx h ILE 181 Cb 0.04 0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 2bwx h ILE 181 CO -0.11 0.27 0.35 0.00 0.00 0.00 0.00 178.15 178.66 2bwx h ALA 182 N 1.34 1.04 -0.21 1.87 0.00 -0.66 0.26 119.26 122.90 2bwx h ALA 182 Ca 0.30 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2bwx h ALA 182 Cb 0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2bwx h ALA 182 CO -0.05 0.65 -0.02 0.28 0.00 0.00 0.00 179.25 180.10 2bwx h VAL 183 N 1.16 1.27 -0.79 0.00 2.07 -0.75 -2.10 116.25 117.10 2bwx h VAL 183 Ca 0.27 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.86 2bwx h VAL 183 Cb 0.18 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 2bwx h VAL 183 CO -0.03 0.29 0.52 -0.07 0.02 0.00 0.00 177.57 178.31 2bwx h LEU 184 N 0.14 0.87 -0.58 2.57 3.38 -0.63 -0.21 115.31 120.85 2bwx h LEU 184 Ca 0.06 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2bwx h LEU 184 Cb 0.45 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2bwx h LEU 184 CO 0.02 0.62 0.37 -0.09 0.09 0.00 0.00 178.44 179.44 2bwx h ARG 185 N 1.02 0.77 -0.46 1.13 2.43 -0.27 0.53 114.38 119.53 2bwx h ARG 185 Ca 0.31 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.33 2bwx h ARG 185 Cb -0.03 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 2bwx h ARG 185 CO -0.08 0.53 -0.07 -0.09 -1.51 0.00 0.00 179.97 178.75 2bwx h ARG 186 N 0.79 0.87 -0.82 0.20 9.65 -0.68 -0.92 114.38 123.47 2bwx h ARG 186 Ca 0.21 -0.31 0.07 0.00 -1.10 0.00 0.00 59.98 58.85 2bwx h ARG 186 Cb -0.06 -0.06 -0.06 0.00 -1.39 0.00 0.00 29.97 28.40 2bwx h ARG 186 CO -0.04 0.95 0.49 0.00 2.80 0.00 0.00 179.97 184.17 2bwx h ALA 187 N 0.89 1.13 -0.58 2.80 0.00 -0.75 -0.40 119.26 122.35 2bwx h ALA 187 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2bwx h ALA 187 Cb 0.60 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2bwx h ALA 187 CO 0.04 0.20 0.25 0.78 0.00 0.00 0.00 179.25 180.52 2bwx h GLY 188 N 0.89 0.92 0.88 0.00 0.00 -0.52 -0.01 103.07 105.22 2bwx h GLY 188 Ca 0.37 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 2bwx h GLY 188 CO -0.19 0.46 0.06 0.83 0.00 0.00 0.00 176.54 177.70 2bwx h GLU 189 N 0.80 0.42 -0.32 4.80 5.08 -0.69 0.67 114.58 125.33 2bwx h GLU 189 Ca 0.20 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2bwx h GLU 189 Cb 0.17 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2bwx h GLU 189 CO -0.02 0.51 0.19 0.82 -1.00 0.00 0.00 179.01 179.51 2bwx h ILE 190 N 0.25 1.12 -0.52 3.13 2.04 -0.96 -0.62 117.51 121.95 2bwx h ILE 190 Ca 0.08 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 2bwx h ILE 190 Cb 0.28 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2bwx h ILE 190 CO 0.00 0.12 0.19 0.74 0.00 0.00 0.00 178.15 179.20 2bwx h THR 191 N 0.42 1.22 -0.62 -0.27 2.02 -0.88 -2.08 112.91 112.72 2bwx h THR 191 Ca 0.12 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.62 2bwx h THR 191 Cb 0.02 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2bwx h THR 191 CO -0.02 0.27 0.37 0.00 0.37 0.00 0.00 175.52 176.50 2bwx h ALA 192 N 1.04 0.80 -0.80 6.16 0.00 -0.67 -1.62 119.26 124.18 2bwx h ALA 192 Ca 0.17 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2bwx h ALA 192 Cb 0.23 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2bwx h ALA 192 CO -0.01 0.09 0.49 0.52 0.00 0.00 0.00 179.25 180.34 2bwx h MET 193 N 0.72 1.07 -0.48 0.00 2.07 -0.77 -0.86 114.93 116.68 2bwx h MET 193 Ca 0.25 -0.09 -0.05 0.00 -2.07 0.00 0.00 59.70 57.74 2bwx h MET 193 Cb 0.05 -0.23 -0.02 0.00 -1.87 0.00 0.00 31.60 29.54 2bwx h MET 193 CO -0.12 0.74 0.08 0.00 1.07 0.00 0.00 176.91 178.69 2bwx h ALA 194 N 1.45 0.63 -0.53 6.32 0.00 -0.87 -0.88 119.26 125.38 2bwx h ALA 194 Ca 0.29 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2bwx h ALA 194 Cb -0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2bwx h ALA 194 CO -0.06 0.35 -0.08 0.45 0.00 0.00 0.00 179.25 179.91 2bwx h HIS 195 N 0.66 1.10 -0.39 0.00 3.86 -0.86 -0.75 115.15 118.76 2bwx h HIS 195 Ca 0.15 -0.22 0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2bwx h HIS 195 Cb 0.38 -0.27 -0.04 0.00 1.06 0.00 0.00 27.41 28.53 2bwx h HIS 195 CO 0.03 1.02 0.14 1.15 0.86 0.00 0.00 177.93 181.13 2bwx h THR 196 N 0.86 0.89 -0.66 2.45 2.02 -1.08 -1.74 112.91 115.65 2bwx h THR 196 Ca 0.14 -0.10 0.03 0.00 0.77 0.00 0.00 66.41 67.25 2bwx h THR 196 Cb 0.64 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2bwx h THR 196 CO 0.04 0.06 0.40 -0.09 0.37 0.00 0.00 175.52 176.30 2bwx h ARG 197 N 0.30 0.76 -0.60 6.66 2.43 -0.85 -0.96 114.38 122.12 2bwx h ARG 197 Ca 0.18 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2bwx h ARG 197 Cb 0.15 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2bwx h ARG 197 CO -0.17 0.50 0.34 0.00 -1.51 0.00 0.00 179.97 179.13 2bwx h ALA 198 N 1.29 0.77 -0.89 2.80 0.00 -0.68 -0.59 119.26 121.96 2bwx h ALA 198 Ca 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2bwx h ALA 198 Cb 0.05 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2bwx h ALA 198 CO -0.12 0.27 0.51 0.52 0.00 0.00 0.00 179.25 180.43 2bwx h MET 199 N 0.81 1.23 0.00 0.00 2.86 -1.00 -0.82 114.93 118.01 2bwx h MET 199 Ca 0.21 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.67 2bwx h MET 199 Cb 0.02 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.43 2bwx h MET 199 CO -0.04 0.89 -0.22 0.93 1.06 0.00 0.00 176.91 179.53 2bwx h GLU 200 N 1.24 0.00 0.00 1.72 5.08 -0.65 -3.28 114.58 118.68 2bwx h GLU 200 Ca 0.32 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.52 2bwx h GLU 200 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2bwx h GLU 200 CO -0.05 0.22 -1.82 1.63 -1.00 0.00 0.00 179.01 177.99 2bwx n LYS 201 N -3.34 0.65 -1.70 2.33 4.76 -0.28 -4.75 118.16 115.83 2bwx n LYS 201 Ca 0.00 0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 2bwx n LYS 201 Cb 0.45 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 31.96 2bwx n LYS 201 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bwx s ARG 203 N 2.13 0.44 0.26 0.00 1.81 -1.26 -4.93 118.95 117.40 2bwx s ARG 203 Ca 0.79 -0.71 -0.30 0.00 -1.72 0.00 0.00 55.73 53.79 2bwx s ARG 203 Cb -0.49 -0.09 -0.14 0.00 -0.45 0.00 0.00 34.95 33.77 2bwx s ARG 203 CO 0.35 -0.00 1.23 -2.30 -0.68 0.00 0.00 175.30 173.90 2bwx n PRO 204 N 1.46 1.69 0.00 3.54 -0.02 -1.26 -2.20 135.00 138.21 2bwx n PRO 204 Ca -0.23 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2bwx n PRO 204 Cb 0.55 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 2bwx n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bwx n GLY 205 N 1.62 3.37 3.76 -1.23 0.00 -0.08 -4.97 105.19 107.65 2bwx n GLY 205 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 2bwx n GLY 205 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bwx s MET 206 N -0.76 3.10 0.42 1.61 -1.94 -0.94 -4.67 119.30 116.13 2bwx s MET 206 Ca 0.00 1.70 -0.17 0.00 -1.71 0.00 0.00 55.69 55.51 2bwx s MET 206 Cb 0.00 -1.96 -0.09 0.00 2.01 0.00 0.00 34.83 34.79 2bwx s MET 206 CO 0.00 -1.07 0.88 -0.06 -0.01 0.00 0.00 175.02 174.76 2bwx s PHE 207 N -1.74 3.38 0.27 -0.03 0.40 -1.26 -0.50 117.98 118.49 2bwx s PHE 207 Ca 0.74 1.40 -0.01 0.00 -0.60 0.00 0.00 56.93 58.47 2bwx s PHE 207 Cb -0.27 -2.70 0.54 0.00 0.51 0.00 0.00 43.02 41.10 2bwx s PHE 207 CO 0.31 -0.12 1.78 0.93 0.70 0.00 0.00 175.22 178.82 2bwx h GLU 208 N 1.67 0.67 0.00 0.44 5.08 -1.23 0.02 114.58 121.23 2bwx h GLU 208 Ca -0.48 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 2bwx h GLU 208 Cb 1.18 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 2bwx h GLU 208 CO 0.63 0.44 -0.07 0.10 -1.00 0.00 0.00 179.01 179.11 2bwx h TYR 209 N 0.69 0.00 -0.88 4.33 -0.00 -1.46 -1.99 116.97 117.67 2bwx h TYR 209 Ca 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.19 2bwx h TYR 209 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.31 2bwx h TYR 209 CO -0.07 0.07 0.52 0.45 -0.00 0.00 0.00 178.16 179.12 2bwx h HIS 210 N 0.00 1.17 -0.46 0.10 3.86 -1.29 -0.65 115.15 117.88 2bwx h HIS 210 Ca -0.00 -0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.07 2bwx h HIS 210 Cb 0.25 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 2bwx h HIS 210 CO 0.00 0.78 -0.25 -0.07 0.86 0.00 0.00 177.93 179.26 2bwx h LEU 211 N 1.21 0.99 -0.55 2.43 3.38 -1.43 -1.77 115.31 119.59 2bwx h LEU 211 Ca 0.31 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 58.00 2bwx h LEU 211 Cb -0.03 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.36 2bwx h LEU 211 CO -0.06 1.18 0.06 -0.08 0.09 0.00 0.00 178.44 179.64 2bwx h GLU 212 N 0.82 0.18 -0.36 1.13 4.81 -1.36 -1.20 114.58 118.60 2bwx h GLU 212 Ca 0.10 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2bwx h GLU 212 Cb 0.82 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.11 2bwx h GLU 212 CO 0.07 0.12 0.08 0.78 -0.73 0.00 0.00 179.01 179.33 2bwx h GLY 213 N 0.19 0.43 0.99 1.92 0.00 -0.65 -0.14 103.07 105.80 2bwx h GLY 213 Ca 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 2bwx h GLY 213 CO -0.41 -0.02 0.29 0.83 0.00 0.00 0.00 176.54 177.23 2bwx h GLU 214 N 0.20 0.64 0.22 4.80 4.39 -0.96 -1.76 114.58 122.11 2bwx h GLU 214 Ca 0.17 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 2bwx h GLU 214 Cb 0.20 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2bwx h GLU 214 CO -0.22 0.46 -0.11 0.82 -1.16 0.00 0.00 179.01 178.81 2bwx h ILE 215 N 0.63 0.79 -0.44 3.13 2.04 -0.91 -1.59 117.51 121.16 2bwx h ILE 215 Ca 0.17 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 2bwx h ILE 215 Cb -0.02 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2bwx h ILE 215 CO -0.03 0.01 0.10 0.45 0.00 0.00 0.00 178.15 178.68 2bwx h HIS 216 N -0.31 0.66 -0.49 1.37 3.86 -0.96 -0.28 115.15 118.99 2bwx h HIS 216 Ca -0.03 -0.05 -0.06 0.00 -1.16 0.00 0.00 60.37 59.07 2bwx h HIS 216 Cb 0.24 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2bwx h HIS 216 CO -0.06 0.57 0.07 1.25 0.86 0.00 0.00 177.93 180.63 2bwx h HIS 217 N 0.63 0.88 -0.40 2.45 -0.00 -1.16 -1.52 115.15 116.03 2bwx h HIS 217 Ca 0.14 -0.13 -0.04 0.00 -0.00 0.00 0.00 60.37 60.35 2bwx h HIS 217 Cb 0.24 -0.24 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 2bwx h HIS 217 CO 0.01 0.81 0.10 1.49 -0.00 0.00 0.00 177.93 180.34 2bwx h GLU 218 N 0.70 0.64 -0.24 5.26 4.57 -0.63 -0.84 114.58 124.04 2bwx h GLU 218 Ca 0.15 -0.15 0.06 0.00 -1.18 0.00 0.00 59.36 58.24 2bwx h GLU 218 Cb 0.41 -0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 28.84 2bwx h GLU 218 CO 0.01 0.65 -0.29 0.74 -1.18 0.00 0.00 179.01 178.94 2bwx h PHE 219 N 0.50 -0.80 -0.74 0.92 0.04 -0.96 -2.84 116.94 113.07 2bwx h PHE 219 Ca 0.13 0.04 0.06 0.00 2.80 0.00 0.00 57.97 61.00 2bwx h PHE 219 Cb 0.30 0.39 -0.06 0.00 2.20 0.00 0.00 35.95 38.78 2bwx h PHE 219 CO 0.02 -0.37 0.43 -0.97 -0.60 0.00 0.00 178.31 176.82 2bwx h ASN 220 N -0.31 0.65 0.43 2.17 -0.73 -0.95 -1.20 115.58 115.64 2bwx h ASN 220 Ca 0.13 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.30 2bwx h ASN 220 Cb 0.51 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 39.00 2bwx h ASN 220 CO -0.41 0.42 -0.12 0.08 -0.37 0.00 0.00 177.43 177.02 2bwx h ARG 221 N 0.78 0.00 -0.30 6.67 0.11 -0.91 -0.70 114.38 120.03 2bwx h ARG 221 Ca 0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.41 2bwx h ARG 221 Cb 0.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.27 2bwx h ARG 221 CO -0.18 0.12 0.00 0.72 0.10 0.00 0.00 179.97 180.73 2bwx n HIS 222 N -3.59 0.39 -0.58 4.08 8.25 -1.02 -4.93 115.22 117.81 2bwx n HIS 222 Ca -0.02 -0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 2bwx n HIS 222 Cb 0.25 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2bwx n HIS 222 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bwx n GLY 223 N 1.26 0.68 3.31 -1.41 0.00 -0.27 -5.02 105.19 103.74 2bwx n GLY 223 Ca 0.17 -0.27 -0.46 0.00 0.00 0.00 0.00 46.02 45.47 2bwx n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bwx s ALA 224 N -2.00 4.17 0.25 4.61 0.00 -0.48 -4.77 121.76 123.54 2bwx s ALA 224 Ca 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 51.96 48.50 2bwx s ALA 224 Cb 0.00 -3.44 0.30 0.00 0.00 0.00 0.00 23.12 19.98 2bwx s ALA 224 CO 0.00 -2.25 1.80 0.00 0.00 0.00 0.00 175.76 175.30 2bwx h ARG 225 N 7.48 0.96 -6.55 0.00 3.08 -1.78 -2.77 114.38 114.79 2bwx h ARG 225 Ca 0.11 -0.20 -0.69 0.00 0.07 0.00 0.00 59.98 59.27 2bwx h ARG 225 Cb 1.00 -0.14 -0.25 0.00 0.08 0.00 0.00 29.97 30.66 2bwx h ARG 225 CO 0.79 0.84 -0.83 0.71 -1.07 0.00 0.00 179.97 180.42 2bwx s TYR 226 N -5.29 2.51 0.65 3.04 2.02 -1.26 -4.70 117.35 114.32 2bwx s TYR 226 Ca -0.11 -0.29 -0.16 0.00 -0.37 0.00 0.00 57.07 56.14 2bwx s TYR 226 Cb 0.15 -1.50 -0.00 0.00 -0.40 0.00 0.00 41.96 40.21 2bwx s TYR 226 CO 0.82 0.16 1.15 -2.14 -1.57 0.00 0.00 175.55 173.97 2bwx s PRO 227 N -1.09 2.73 0.14 -1.71 0.02 -1.26 -0.95 135.00 132.89 2bwx s PRO 227 Ca 0.13 1.57 0.26 0.00 0.02 0.00 0.00 61.00 62.98 2bwx s PRO 227 Cb -0.10 -1.93 0.94 0.00 0.02 0.00 0.00 34.50 33.43 2bwx s PRO 227 CO 0.02 -1.34 1.80 -1.13 -0.33 0.00 0.00 177.00 176.03 2bwx n SER 228 N -2.23 0.53 -3.69 2.53 3.41 0.11 -4.54 113.62 109.75 2bwx n SER 228 Ca 0.12 0.56 -0.06 0.00 -0.26 0.00 0.00 58.87 59.22 2bwx n SER 228 Cb 0.51 -0.70 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 2bwx n SER 228 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2bwx s TYR 229 N -3.09 -0.23 -0.06 7.33 1.13 -1.26 -4.75 117.35 116.42 2bwx s TYR 229 Ca 0.11 -0.06 -0.30 0.00 -1.41 0.00 0.00 57.07 55.41 2bwx s TYR 229 Cb 0.14 0.62 -0.05 0.00 -1.10 0.00 0.00 41.96 41.57 2bwx s TYR 229 CO 0.55 -0.85 1.55 -0.80 -2.51 0.00 0.00 175.55 173.48 2bwx s ASN 230 N -2.82 6.74 0.27 -0.18 0.01 -1.26 -4.75 114.94 112.95 2bwx s ASN 230 Ca 0.09 2.14 -0.30 0.00 -0.71 0.00 0.00 52.86 54.08 2bwx s ASN 230 Cb -0.02 -2.54 -0.12 0.00 0.41 0.00 0.00 41.25 38.97 2bwx s ASN 230 CO -0.01 -0.86 1.50 0.41 -1.51 0.00 0.00 177.10 176.63 2bwx n THR 231 N 5.29 1.05 -3.93 1.60 -1.04 -1.26 -4.95 114.28 111.03 2bwx n THR 231 Ca 0.16 -0.26 -0.35 0.00 -2.04 0.00 0.00 64.05 61.55 2bwx n THR 231 Cb 0.43 -1.75 -0.13 0.00 -1.82 0.00 0.00 70.33 67.06 2bwx n THR 231 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2bwx s ILE 232 N -0.09 3.87 -0.47 12.58 1.01 0.01 -4.64 121.20 133.47 2bwx s ILE 232 Ca 0.65 -0.33 0.03 0.00 0.00 0.00 0.00 60.65 61.00 2bwx s ILE 232 Cb -0.56 -2.77 0.14 0.00 0.01 0.00 0.00 42.46 39.28 2bwx s ILE 232 CO 0.50 0.40 0.28 -0.69 0.00 0.00 0.00 174.94 175.43 2bwx s VAL 233 N 1.32 1.53 -0.49 2.92 1.01 -1.25 -1.08 120.40 124.36 2bwx s VAL 233 Ca 0.04 -2.80 -0.09 0.00 0.00 0.00 0.00 61.98 59.13 2bwx s VAL 233 Cb -0.15 -2.06 0.13 0.00 0.00 0.00 0.00 36.38 34.30 2bwx s VAL 233 CO 0.01 -0.94 0.37 -0.83 0.00 0.00 0.00 175.10 173.71 2bwx s GLY 234 N 0.08 2.09 0.16 4.51 0.00 0.27 -4.52 107.32 109.90 2bwx s GLY 234 Ca 0.20 -2.60 -0.05 0.00 0.00 0.00 0.00 44.72 42.27 2bwx s GLY 234 CO -0.04 1.12 0.40 -1.35 0.00 0.00 0.00 173.10 173.23 2bwx s SER 235 N 2.59 6.50 1.17 1.64 1.04 -1.26 -1.20 113.70 124.18 2bwx s SER 235 Ca 0.07 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.11 2bwx s SER 235 Cb -0.25 -2.10 0.00 0.00 0.10 0.00 0.00 66.02 63.76 2bwx s SER 235 CO -0.01 0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2bwx n GLY 236 N -0.03 3.12 0.31 7.32 0.00 0.77 -1.57 105.19 115.11 2bwx n GLY 236 Ca -0.02 -0.08 0.19 0.00 0.00 0.00 0.00 46.02 46.10 2bwx n GLY 236 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bwx h GLU 237 N 0.00 0.00 0.00 1.61 5.08 -1.91 -1.27 114.58 118.08 2bwx h GLU 237 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2bwx h GLU 237 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2bwx h GLU 237 CO 0.00 0.01 -0.18 -0.91 -1.00 0.00 0.00 179.01 176.93 2bwx h ASN 238 N 0.00 0.00 0.43 1.42 2.35 -1.58 -2.24 115.58 115.96 2bwx h ASN 238 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2bwx h ASN 238 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 2bwx h ASN 238 CO 0.00 0.18 0.00 1.23 -1.65 0.00 0.00 177.43 177.19 2bwx h GLY 239 N 1.23 0.00 0.44 2.83 0.00 -1.16 -1.79 103.07 104.62 2bwx h GLY 239 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bwx h GLY 239 CO 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.56 2bwx s ILE 241 N -2.03 4.52 0.13 0.00 1.01 -0.68 -5.02 121.20 119.13 2bwx s ILE 241 Ca 0.43 -0.24 -0.18 0.00 0.00 0.00 0.00 60.65 60.66 2bwx s ILE 241 Cb 0.22 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 2bwx s ILE 241 CO 0.36 0.22 1.75 -0.07 0.00 0.00 0.00 174.94 177.20 2bwx h LEU 242 N 8.29 0.36 -4.50 2.97 3.38 -1.85 -2.93 115.31 121.04 2bwx h LEU 242 Ca -0.35 -0.06 -0.65 0.00 0.09 0.00 0.00 57.88 56.90 2bwx h LEU 242 Cb 1.16 -0.09 -0.36 0.00 0.09 0.00 0.00 40.66 41.46 2bwx h LEU 242 CO 0.59 0.32 -0.04 1.41 0.09 0.00 0.00 178.44 180.80 2bwx n HIS 243 N -4.83 3.17 -1.92 1.13 8.25 -1.26 -5.02 115.22 114.74 2bwx n HIS 243 Ca -0.02 -2.74 -0.43 0.00 -0.26 0.00 0.00 57.72 54.27 2bwx n HIS 243 Cb 0.06 -0.59 -0.03 0.00 1.12 0.00 0.00 29.99 30.56 2bwx n HIS 243 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2bwx s TYR 244 N -3.74 1.70 0.00 4.41 5.04 -1.11 -4.82 117.35 118.84 2bwx s TYR 244 Ca 0.51 0.52 0.00 0.00 -2.44 0.00 0.00 57.07 55.66 2bwx s TYR 244 Cb 0.42 -4.06 0.00 0.00 0.35 0.00 0.00 41.96 38.67 2bwx s TYR 244 CO -0.21 -3.37 0.43 0.25 -1.34 0.00 0.00 175.55 171.32 2bwx n THR 245 N 7.15 0.04 -0.23 4.34 -2.24 -1.26 -3.76 114.28 118.32 2bwx n THR 245 Ca 0.23 -0.43 -0.01 0.00 -2.27 0.00 0.00 64.05 61.57 2bwx n THR 245 Cb 0.46 1.15 0.10 0.00 -2.10 0.00 0.00 70.33 69.94 2bwx n THR 245 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2bwx h GLU 246 N 0.00 0.67 -6.57 -0.78 3.07 -1.89 -3.47 114.58 105.61 2bwx h GLU 246 Ca 0.00 -0.04 -0.52 0.00 -0.50 0.00 0.00 59.36 58.30 2bwx h GLU 246 Cb 0.12 -0.15 -0.14 0.00 -0.84 0.00 0.00 28.75 27.74 2bwx h GLU 246 CO 0.00 0.44 -0.81 0.09 -1.40 0.00 0.00 179.01 177.33 2bwx n ASN 247 N -4.78 -3.58 -0.22 1.42 3.02 -1.26 -4.85 115.26 105.01 2bwx n ASN 247 Ca 0.09 -0.93 0.07 0.00 -0.03 0.00 0.00 54.58 53.78 2bwx n ASN 247 Cb 0.18 -3.18 -0.03 0.00 -0.61 0.00 0.00 39.78 36.14 2bwx n ASN 247 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2bwx n GLU 248 N -4.49 1.88 -3.80 3.52 0.28 -1.26 -1.26 120.64 115.51 2bwx n GLU 248 Ca 0.03 -0.50 -0.29 0.00 -0.16 0.00 0.00 57.16 56.24 2bwx n GLU 248 Cb 0.52 -1.23 -0.04 0.00 1.43 0.00 0.00 31.44 32.12 2bwx n GLU 248 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2bwx s GLU 250 N -3.02 4.39 -0.10 0.00 2.12 -1.26 -1.03 118.70 119.79 2bwx s GLU 250 Ca 0.37 1.79 -0.30 0.00 0.36 0.00 0.00 54.97 57.20 2bwx s GLU 250 Cb -0.12 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.84 2bwx s GLU 250 CO 0.28 -0.35 1.00 -1.64 -0.54 0.00 0.00 175.26 174.01 2bwx s MET 251 N 1.50 4.43 -0.07 4.30 -1.94 0.35 -4.93 119.30 122.93 2bwx s MET 251 Ca 0.59 1.39 -0.13 0.00 -1.71 0.00 0.00 55.69 55.83 2bwx s MET 251 Cb -0.29 -3.54 -0.05 0.00 2.01 0.00 0.00 34.83 32.96 2bwx s MET 251 CO 0.27 -0.31 0.34 1.03 -0.01 0.00 0.00 175.02 176.34 2bwx s ARG 252 N 1.98 3.96 -0.22 2.03 1.81 -1.26 -0.90 118.95 126.34 2bwx s ARG 252 Ca 0.48 0.23 -0.38 0.00 -1.72 0.00 0.00 55.73 54.35 2bwx s ARG 252 Cb -0.18 -3.29 -0.14 0.00 -0.45 0.00 0.00 34.95 30.89 2bwx s ARG 252 CO 0.18 0.54 1.81 -3.47 -0.68 0.00 0.00 175.30 173.68 2bwx n ASP 253 N 2.47 2.77 0.00 0.23 -0.08 -1.26 -1.61 116.55 119.07 2bwx n ASP 253 Ca -0.14 1.03 0.00 0.00 -1.51 0.00 0.00 54.79 54.17 2bwx n ASP 253 Cb 0.53 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.76 2bwx n ASP 253 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2bwx n GLY 254 N 4.32 0.98 3.94 0.27 0.00 -1.26 -5.02 105.19 108.42 2bwx n GLY 254 Ca 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.02 2bwx n GLY 254 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bwx s ASP 255 N -1.84 6.35 0.50 1.61 1.01 -0.64 -4.94 116.67 118.71 2bwx s ASP 255 Ca 0.00 0.36 -0.09 0.00 0.71 0.00 0.00 52.55 53.52 2bwx s ASP 255 Cb 0.00 -1.99 -0.05 0.00 1.01 0.00 0.00 42.92 41.89 2bwx s ASP 255 CO 0.00 -0.12 0.86 -0.76 0.21 0.00 0.00 175.17 175.36 2bwx s LEU 256 N -3.73 3.59 -0.07 1.23 1.43 -1.26 -1.08 118.68 118.79 2bwx s LEU 256 Ca 0.38 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.68 2bwx s LEU 256 Cb -0.10 -4.12 0.01 0.00 0.03 0.00 0.00 46.19 42.00 2bwx s LEU 256 CO 0.31 -0.60 -0.14 0.54 0.23 0.00 0.00 176.35 176.69 2bwx s VAL 257 N -2.73 1.28 -0.24 -1.59 0.11 0.17 -0.16 120.40 117.24 2bwx s VAL 257 Ca 0.51 -0.57 -0.07 0.00 -2.93 0.00 0.00 61.98 58.92 2bwx s VAL 257 Cb -0.10 -1.15 -0.03 0.00 -1.53 0.00 0.00 36.38 33.57 2bwx s VAL 257 CO 0.42 0.39 0.07 -0.22 -3.33 0.00 0.00 175.10 172.43 2bwx s LEU 258 N 0.58 3.52 -0.19 2.54 0.20 -0.34 -1.10 118.68 123.88 2bwx s LEU 258 Ca -0.15 -0.15 0.01 0.00 0.69 0.00 0.00 54.13 54.53 2bwx s LEU 258 Cb -0.16 -1.93 0.02 0.00 -0.43 0.00 0.00 46.19 43.69 2bwx s LEU 258 CO 0.04 0.00 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.30 2bwx s ILE 259 N 1.40 2.22 -0.30 6.68 1.01 0.31 -0.57 121.20 131.95 2bwx s ILE 259 Ca 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.74 2bwx s ILE 259 Cb -0.15 -1.98 0.07 0.00 0.01 0.00 0.00 42.46 40.40 2bwx s ILE 259 CO 0.04 0.46 -0.01 -0.62 0.00 0.00 0.00 174.94 174.81 2bwx s ASP 260 N 1.29 4.77 -0.07 3.58 -1.08 -0.24 -1.25 116.67 123.66 2bwx s ASP 260 Ca 0.04 -1.51 -0.16 0.00 -0.52 0.00 0.00 52.55 50.40 2bwx s ASP 260 Cb -0.14 -1.66 0.03 0.00 -1.46 0.00 0.00 42.92 39.69 2bwx s ASP 260 CO -0.11 -0.28 0.38 0.00 0.52 0.00 0.00 175.17 175.68 2bwx s ALA 261 N 1.15 -0.96 -0.11 3.66 0.00 -0.29 -0.81 121.76 124.39 2bwx s ALA 261 Ca -0.03 0.75 -0.17 0.00 0.00 0.00 0.00 51.96 52.51 2bwx s ALA 261 Cb -0.20 -0.24 0.04 0.00 0.00 0.00 0.00 23.12 22.72 2bwx s ALA 261 CO -0.04 -0.24 0.44 0.20 0.00 0.00 0.00 175.76 176.13 2bwx s GLY 262 N -0.67 -0.32 0.52 0.00 0.00 -1.26 -2.28 107.32 103.31 2bwx s GLY 262 Ca -0.08 1.02 -0.02 0.00 0.00 0.00 0.00 44.72 45.64 2bwx s GLY 262 CO 0.03 0.81 0.77 0.00 0.00 0.00 0.00 173.10 174.71 2bwx s GLU 264 N -4.75 2.66 -0.21 0.00 2.12 -0.12 -1.04 118.70 117.36 2bwx s GLU 264 Ca 0.51 -1.10 0.02 0.00 0.36 0.00 0.00 54.97 54.76 2bwx s GLU 264 Cb -0.10 -3.10 0.04 0.00 0.26 0.00 0.00 34.13 31.23 2bwx s GLU 264 CO 0.41 -0.50 -0.15 -0.47 -0.54 0.00 0.00 175.26 174.01 2bwx s TYR 265 N 1.30 2.91 -1.61 5.30 5.04 0.79 -4.31 117.35 126.77 2bwx s TYR 265 Ca -0.02 -1.90 -0.14 0.00 -2.44 0.00 0.00 57.07 52.57 2bwx s TYR 265 Cb -0.18 -1.88 0.11 0.00 0.35 0.00 0.00 41.96 40.36 2bwx s TYR 265 CO -0.02 -0.83 0.80 1.63 -1.34 0.00 0.00 175.55 175.78 2bwx n LYS 266 N 4.56 -3.91 0.00 4.97 4.76 -1.26 -1.53 118.16 125.75 2bwx n LYS 266 Ca -0.17 0.45 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 2bwx n LYS 266 Cb 0.46 -5.14 0.00 0.00 -1.84 0.00 0.00 35.03 28.52 2bwx n LYS 266 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2bwx n GLY 267 N -1.57 3.00 3.81 0.72 0.00 -1.26 -4.87 105.19 105.03 2bwx n GLY 267 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2bwx n GLY 267 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bwx s TYR 268 N -2.19 3.38 -0.07 1.61 1.51 -0.58 -4.38 117.35 116.63 2bwx s TYR 268 Ca 0.00 0.30 -0.13 0.00 -1.01 0.00 0.00 57.07 56.24 2bwx s TYR 268 Cb 0.00 -1.81 -0.05 0.00 -0.11 0.00 0.00 41.96 39.99 2bwx s TYR 268 CO 0.00 0.60 0.32 0.00 -1.11 0.00 0.00 175.55 175.36 2bwx s ALA 269 N -1.13 3.72 0.44 3.71 0.00 -0.40 -0.15 121.76 127.95 2bwx s ALA 269 Ca 0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 51.96 51.78 2bwx s ALA 269 Cb -0.12 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 20.70 2bwx s ALA 269 CO 0.11 0.43 0.68 0.20 0.00 0.00 0.00 175.76 177.18 2bwx s GLY 270 N -0.72 1.49 -0.37 0.00 0.00 -0.20 -4.72 107.32 102.81 2bwx s GLY 270 Ca 0.20 -0.87 0.06 0.00 0.00 0.00 0.00 44.72 44.11 2bwx s GLY 270 CO 0.09 -0.72 0.65 -0.35 0.00 0.00 0.00 173.10 172.77 2bwx s ASP 271 N -4.15 -1.48 -0.01 1.64 -1.08 -1.26 -3.99 116.67 106.34 2bwx s ASP 271 Ca 0.46 -0.43 0.08 0.00 -0.52 0.00 0.00 52.55 52.14 2bwx s ASP 271 Cb -0.10 1.89 -0.02 0.00 -1.46 0.00 0.00 42.92 43.23 2bwx s ASP 271 CO 0.40 -0.20 -0.24 -0.63 0.52 0.00 0.00 175.17 175.01 2bwx s ILE 272 N 2.18 1.92 -0.08 4.11 1.01 -0.97 -4.44 121.20 124.93 2bwx s ILE 272 Ca 0.14 -1.05 0.04 0.00 0.00 0.00 0.00 60.65 59.78 2bwx s ILE 272 Cb -0.05 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.82 2bwx s ILE 272 CO -0.14 0.53 -0.22 -0.89 0.00 0.00 0.00 174.94 174.22 2bwx s THR 273 N -0.58 1.87 0.02 2.92 2.01 -1.13 -1.14 115.64 119.60 2bwx s THR 273 Ca 0.09 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.21 2bwx s THR 273 Cb -0.09 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 2bwx s THR 273 CO -0.01 0.52 -0.13 -0.13 -0.69 0.00 0.00 174.62 174.18 2bwx s ARG 274 N 0.20 0.96 -0.05 4.92 1.81 -0.38 -1.33 118.95 125.09 2bwx s ARG 274 Ca -0.12 -0.60 0.06 0.00 -1.72 0.00 0.00 55.73 53.34 2bwx s ARG 274 Cb -0.16 -0.95 -0.01 0.00 -0.45 0.00 0.00 34.95 33.38 2bwx s ARG 274 CO 0.06 0.25 -0.23 0.99 -0.68 0.00 0.00 175.30 175.68 2bwx s THR 275 N -0.59 1.90 0.11 0.02 2.01 -1.22 -0.53 115.64 117.35 2bwx s THR 275 Ca 0.03 -0.99 -0.18 0.00 0.31 0.00 0.00 61.69 60.86 2bwx s THR 275 Cb -0.06 -1.61 0.04 0.00 0.01 0.00 0.00 72.50 70.88 2bwx s THR 275 CO 0.00 0.53 0.44 0.72 -0.69 0.00 0.00 174.62 175.63 2bwx s PHE 276 N -0.18 -0.28 0.14 4.92 -0.71 -0.26 -4.98 117.98 116.63 2bwx s PHE 276 Ca -0.02 0.05 -0.31 0.00 -1.04 0.00 0.00 56.93 55.62 2bwx s PHE 276 Cb -0.13 0.30 -0.08 0.00 -1.21 0.00 0.00 43.02 41.90 2bwx s PHE 276 CO 0.03 -0.70 1.37 -1.25 -1.34 0.00 0.00 175.22 173.33 2bwx s PRO 277 N -3.46 4.33 0.28 1.99 0.04 -1.26 -0.65 135.00 136.27 2bwx s PRO 277 Ca 0.01 2.08 0.01 0.00 0.04 0.00 0.00 61.00 63.14 2bwx s PRO 277 Cb 0.01 -3.23 0.54 0.00 0.04 0.00 0.00 34.50 31.86 2bwx s PRO 277 CO -0.10 -0.39 1.85 0.28 0.04 0.00 0.00 177.00 178.68 2bwx h VAL 278 N 4.10 0.94 -0.34 -0.36 2.07 -1.40 -1.83 116.25 119.43 2bwx h VAL 278 Ca -0.43 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2bwx h VAL 278 Cb 1.21 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2bwx h VAL 278 CO 0.84 0.18 0.00 -0.46 0.02 0.00 0.00 177.57 178.15 2bwx n ASN 279 N -4.60 2.02 0.00 0.57 0.23 -1.26 -4.10 115.26 108.13 2bwx n ASN 279 Ca 0.18 -1.94 0.00 0.00 -0.53 0.00 0.00 54.58 52.30 2bwx n ASN 279 Cb 0.33 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 2bwx n ASN 279 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bwx n GLY 280 N 1.13 1.17 2.73 4.83 0.00 -0.69 -5.01 105.19 109.35 2bwx n GLY 280 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2bwx n GLY 280 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bwx s LYS 281 N -0.24 0.47 0.29 1.61 2.47 -1.26 -4.51 119.74 118.58 2bwx s LYS 281 Ca 0.00 -0.03 -0.30 0.00 -1.56 0.00 0.00 55.97 54.08 2bwx s LYS 281 Cb 0.00 -1.35 -0.11 0.00 -1.46 0.00 0.00 37.83 34.91 2bwx s LYS 281 CO 0.00 -0.45 1.56 -0.06 0.16 0.00 0.00 175.35 176.56 2bwx s PHE 282 N 1.98 2.79 0.91 4.03 0.08 -1.26 -4.84 117.98 121.67 2bwx s PHE 282 Ca 0.03 0.85 -0.12 0.00 0.12 0.00 0.00 56.93 57.81 2bwx s PHE 282 Cb -0.14 -4.02 0.13 0.00 -0.57 0.00 0.00 43.02 38.42 2bwx s PHE 282 CO -0.06 -3.38 1.11 0.95 -0.10 0.00 0.00 175.22 173.74 2bwx s THR 283 N -0.08 2.42 0.13 0.64 -4.23 -1.26 -4.82 115.64 108.44 2bwx s THR 283 Ca 0.62 0.14 -0.19 0.00 -1.18 0.00 0.00 61.69 61.07 2bwx s THR 283 Cb -0.47 -2.75 -0.05 0.00 1.34 0.00 0.00 72.50 70.57 2bwx s THR 283 CO 0.48 -0.18 1.76 -0.61 -0.54 0.00 0.00 174.62 175.53 2bwx h GLN 284 N -1.52 0.22 -0.51 3.99 4.15 -1.99 0.55 115.11 120.00 2bwx h GLN 284 Ca -0.51 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 58.93 2bwx h GLN 284 Cb 1.31 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.91 2bwx h GLN 284 CO 0.58 0.14 0.30 0.00 -1.93 0.00 0.00 178.83 177.93 2bwx h ALA 285 N 1.12 0.65 -0.39 3.38 0.00 -1.94 -0.39 119.26 121.68 2bwx h ALA 285 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2bwx h ALA 285 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2bwx h ALA 285 CO -0.07 -0.00 0.22 1.96 0.00 0.00 0.00 179.25 181.36 2bwx h GLN 286 N 0.59 0.55 -0.91 0.00 4.20 -1.82 -2.67 115.11 115.06 2bwx h GLN 286 Ca 0.20 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 2bwx h GLN 286 Cb 0.03 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 2bwx h GLN 286 CO -0.10 0.44 0.55 -0.09 -0.67 0.00 0.00 178.83 178.97 2bwx h ARG 287 N 0.51 1.24 -0.68 1.46 9.65 -0.55 0.35 114.38 126.35 2bwx h ARG 287 Ca 0.14 -0.11 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 2bwx h ARG 287 Cb 0.05 -0.26 -0.03 0.00 -1.39 0.00 0.00 29.97 28.34 2bwx h ARG 287 CO -0.02 0.86 0.32 0.93 2.80 0.00 0.00 179.97 184.86 2bwx h GLU 288 N 1.26 0.99 -0.17 0.20 5.08 -0.82 0.29 114.58 121.41 2bwx h GLU 288 Ca 0.33 -0.15 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 2bwx h GLU 288 Cb -0.06 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.02 2bwx h GLU 288 CO -0.06 0.79 -0.30 0.82 -1.00 0.00 0.00 179.01 179.25 2bwx h ILE 289 N 0.95 1.35 -0.61 3.13 1.08 -1.26 -3.28 117.51 118.87 2bwx h ILE 289 Ca 0.23 -1.53 0.07 0.00 -0.39 0.00 0.00 64.86 63.24 2bwx h ILE 289 Cb 0.13 1.92 -0.06 0.00 -3.07 0.00 0.00 36.82 35.73 2bwx h ILE 289 CO -0.03 0.46 0.29 0.22 -0.69 0.00 0.00 178.15 178.41 2bwx h TYR 290 N 0.15 0.53 -0.82 1.37 3.20 -0.63 -2.12 116.97 118.65 2bwx h TYR 290 Ca 0.01 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.96 2bwx h TYR 290 Cb 0.89 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.96 2bwx h TYR 290 CO 0.09 0.22 0.54 -0.44 -1.64 0.00 0.00 178.16 176.93 2bwx h ASP 291 N 0.54 0.83 -0.20 -2.11 3.32 -1.01 0.18 116.42 117.96 2bwx h ASP 291 Ca 0.29 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.29 2bwx h ASP 291 Cb 0.26 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2bwx h ASP 291 CO -0.23 0.55 -0.05 0.40 -1.72 0.00 0.00 179.24 178.19 2bwx h ILE 292 N 0.95 1.29 -0.47 0.35 2.04 -1.45 -0.37 117.51 119.85 2bwx h ILE 292 Ca 0.34 -1.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 2bwx h ILE 292 Cb 0.15 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2bwx h ILE 292 CO -0.11 0.32 0.19 0.58 0.00 0.00 0.00 178.15 179.12 2bwx h VAL 293 N 0.12 1.20 -0.47 1.67 2.07 -1.10 -1.24 116.25 118.50 2bwx h VAL 293 Ca 0.05 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 2bwx h VAL 293 Cb 0.51 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2bwx h VAL 293 CO 0.02 0.23 0.20 0.25 0.02 0.00 0.00 177.57 178.29 2bwx h LEU 294 N 0.61 0.64 -0.78 2.57 5.85 -0.92 -0.88 115.31 122.41 2bwx h LEU 294 Ca 0.16 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.74 2bwx h LEU 294 Cb 0.18 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2bwx h LEU 294 CO -0.01 0.62 0.51 -0.08 -0.34 0.00 0.00 178.44 179.14 2bwx h GLU 295 N 0.62 0.98 -0.41 1.25 4.81 -0.91 0.12 114.58 121.04 2bwx h GLU 295 Ca 0.16 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.39 2bwx h GLU 295 Cb 0.17 -0.22 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 2bwx h GLU 295 CO -0.02 0.65 0.10 0.77 -0.73 0.00 0.00 179.01 179.78 2bwx h SER 296 N 1.01 0.04 -0.12 1.04 0.02 -0.79 -0.38 113.55 114.37 2bwx h SER 296 Ca 0.30 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.29 2bwx h SER 296 Cb -0.06 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 2bwx h SER 296 CO -0.09 0.06 -0.03 0.25 -1.14 0.00 0.00 176.83 175.88 2bwx h LEU 297 N 0.23 0.23 -0.77 5.07 5.85 -0.60 -2.09 115.31 123.23 2bwx h LEU 297 Ca 0.20 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2bwx h LEU 297 Cb 0.23 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2bwx h LEU 297 CO -0.25 0.56 0.45 -0.33 -0.34 0.00 0.00 178.44 178.53 2bwx h GLU 298 N -0.09 1.06 -0.33 1.25 5.08 -0.68 0.18 114.58 121.05 2bwx h GLU 298 Ca 0.03 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2bwx h GLU 298 Cb 0.46 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2bwx h GLU 298 CO 0.01 0.77 0.13 1.15 -1.00 0.00 0.00 179.01 180.07 2bwx h THR 299 N 1.06 1.19 -0.78 1.13 2.02 -1.09 -1.86 112.91 114.58 2bwx h THR 299 Ca 0.28 -0.57 0.08 0.00 0.77 0.00 0.00 66.41 66.96 2bwx h THR 299 Cb -0.01 0.94 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 2bwx h THR 299 CO -0.05 0.20 0.45 0.28 0.37 0.00 0.00 175.52 176.77 2bwx h SER 300 N 0.39 0.66 0.08 4.18 0.02 -0.96 -1.03 113.55 116.88 2bwx h SER 300 Ca 0.11 0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 2bwx h SER 300 Cb 0.19 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2bwx h SER 300 CO -0.01 0.40 -0.31 -0.07 -1.14 0.00 0.00 176.83 175.70 2bwx h LEU 301 N 0.78 0.36 -0.78 5.07 3.38 -0.73 -0.11 115.31 123.29 2bwx h LEU 301 Ca 0.36 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 2bwx h LEU 301 Cb 0.27 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2bwx h LEU 301 CO -0.21 0.66 -0.11 0.03 0.09 0.00 0.00 178.44 178.90 2bwx h ARG 302 N 0.31 0.81 0.18 1.13 3.08 -0.65 -3.36 114.38 115.86 2bwx h ARG 302 Ca 0.04 -0.27 -0.35 0.00 0.07 0.00 0.00 59.98 59.47 2bwx h ARG 302 Cb 0.71 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.70 2bwx h ARG 302 CO 0.05 0.88 -1.76 -0.07 -1.07 0.00 0.00 179.97 178.01 2bwx h LEU 303 N 0.73 0.58 -9.50 3.04 3.38 -0.72 -3.47 115.31 109.34 2bwx h LEU 303 Ca 0.12 -0.90 -0.56 0.00 0.09 0.00 0.00 57.88 56.64 2bwx h LEU 303 Cb 0.60 -0.19 0.05 0.00 0.09 0.00 0.00 40.66 41.21 2bwx h LEU 303 CO 0.04 1.76 0.98 -1.22 0.09 0.00 0.00 178.44 180.09 2bwx n TYR 304 N -3.57 2.49 -3.62 1.13 4.01 -0.10 -4.92 117.16 112.59 2bwx n TYR 304 Ca -0.25 0.05 -0.04 0.00 -0.16 0.00 0.00 57.90 57.50 2bwx n TYR 304 Cb 1.07 -2.65 -0.01 0.00 -0.31 0.00 0.00 39.34 37.44 2bwx n TYR 304 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2bwx s ARG 305 N 2.00 0.69 0.33 -0.72 1.70 -1.26 -3.45 118.95 118.24 2bwx s ARG 305 Ca 0.81 -0.32 -0.29 0.00 -0.47 0.00 0.00 55.73 55.46 2bwx s ARG 305 Cb -0.58 0.27 -0.11 0.00 -0.57 0.00 0.00 34.95 33.95 2bwx s ARG 305 CO 0.38 -0.31 1.56 -2.14 -1.08 0.00 0.00 175.30 173.72 2bwx s PRO 306 N -2.82 4.10 0.00 3.89 0.02 -1.26 -3.00 135.00 135.93 2bwx s PRO 306 Ca 0.10 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.72 2bwx s PRO 306 Cb 0.00 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.53 2bwx s PRO 306 CO -0.04 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.43 2bwx n GLY 307 N 1.40 2.15 0.00 0.52 0.00 -0.15 -4.96 105.19 104.14 2bwx n GLY 307 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2bwx n GLY 307 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2bwx n THR 308 N -2.00 0.00 -3.86 2.61 5.66 -1.16 -4.76 114.28 110.77 2bwx n THR 308 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2bwx n THR 308 Cb 0.00 -1.25 -0.07 0.00 -1.55 0.00 0.00 70.33 67.46 2bwx n THR 308 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2bwx s SER 309 N -1.00 0.05 0.22 1.09 1.04 -1.26 -0.57 113.70 113.27 2bwx s SER 309 Ca 0.00 -0.67 -0.07 0.00 0.48 0.00 0.00 55.95 55.68 2bwx s SER 309 Cb 0.00 0.39 0.28 0.00 0.10 0.00 0.00 66.02 66.79 2bwx s SER 309 CO 0.00 -0.80 1.83 0.40 0.98 0.00 0.00 173.24 175.65 2bwx h ILE 310 N 2.63 1.01 -0.17 -1.02 2.04 -1.76 -1.57 117.51 118.67 2bwx h ILE 310 Ca -0.33 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.26 2bwx h ILE 310 Cb 1.22 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2bwx h ILE 310 CO 0.52 0.15 0.05 0.25 0.00 0.00 0.00 178.15 179.13 2bwx h LEU 311 N 0.83 0.06 -0.15 1.44 5.85 -1.37 0.84 115.31 122.80 2bwx h LEU 311 Ca 0.34 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.08 2bwx h LEU 311 Cb 0.17 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2bwx h LEU 311 CO -0.17 0.06 0.06 -0.08 -0.34 0.00 0.00 178.44 177.97 2bwx h GLU 312 N 0.13 0.14 -0.56 1.25 4.81 -1.76 -2.17 114.58 116.42 2bwx h GLU 312 Ca 0.07 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 2bwx h GLU 312 Cb 0.05 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 2bwx h GLU 312 CO -0.08 0.09 0.01 0.28 -0.73 0.00 0.00 179.01 178.59 2bwx h VAL 313 N 0.14 1.26 -0.88 0.32 2.07 -1.16 -2.55 116.25 115.45 2bwx h VAL 313 Ca 0.06 -1.09 0.11 0.00 0.82 0.00 0.00 66.70 66.61 2bwx h VAL 313 Cb 0.02 0.81 -0.08 0.00 -1.52 0.00 0.00 31.29 30.52 2bwx h VAL 313 CO -0.05 0.39 0.52 0.74 0.02 0.00 0.00 177.57 179.18 2bwx h THR 314 N 0.89 0.89 -0.79 2.57 2.02 -0.57 -1.62 112.91 116.30 2bwx h THR 314 Ca 0.17 -0.28 0.10 0.00 0.77 0.00 0.00 66.41 67.16 2bwx h THR 314 Cb 0.50 -0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.82 2bwx h THR 314 CO 0.02 0.15 0.43 1.23 0.37 0.00 0.00 175.52 177.72 2bwx h GLY 315 N 0.83 1.23 0.94 2.16 0.00 -0.96 0.14 103.07 107.41 2bwx h GLY 315 Ca 0.44 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 2bwx h GLY 315 CO -0.27 0.08 0.09 0.83 0.00 0.00 0.00 176.54 177.27 2bwx h GLU 316 N 0.70 0.65 -0.42 4.80 4.39 -1.25 -2.40 114.58 121.05 2bwx h GLU 316 Ca 0.39 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.94 2bwx h GLU 316 Cb 0.42 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 2bwx h GLU 316 CO -0.28 0.67 0.26 0.28 -1.16 0.00 0.00 179.01 178.79 2bwx h VAL 317 N 0.51 1.13 -0.78 3.13 2.07 -0.77 -1.99 116.25 119.56 2bwx h VAL 317 Ca 0.13 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.43 2bwx h VAL 317 Cb 0.32 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 2bwx h VAL 317 CO 0.00 0.13 0.47 0.58 0.02 0.00 0.00 177.57 178.77 2bwx h VAL 318 N 0.56 1.02 -0.45 2.57 2.07 -0.61 0.03 116.25 121.44 2bwx h VAL 318 Ca 0.15 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 2bwx h VAL 318 Cb -0.02 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 2bwx h VAL 318 CO -0.03 0.16 0.15 -0.09 0.02 0.00 0.00 177.57 177.78 2bwx h ARG 319 N 0.86 0.70 -0.69 1.57 2.43 -1.19 -0.10 114.38 117.96 2bwx h ARG 319 Ca 0.34 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.41 2bwx h ARG 319 Cb 0.16 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 2bwx h ARG 319 CO -0.17 0.66 0.40 0.82 -1.51 0.00 0.00 179.97 180.18 2bwx h ILE 320 N 0.59 1.02 0.07 1.20 2.04 -0.89 -0.73 117.51 120.82 2bwx h ILE 320 Ca 0.15 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2bwx h ILE 320 Cb 0.24 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2bwx h ILE 320 CO -0.01 0.14 -0.04 0.24 0.00 0.00 0.00 178.15 178.49 2bwx h MET 321 N 0.76 -0.10 -0.38 2.37 2.86 -0.69 -1.66 114.93 118.09 2bwx h MET 321 Ca 0.30 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.96 2bwx h MET 321 Cb 0.13 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 2bwx h MET 321 CO -0.15 0.30 0.21 0.28 1.06 0.00 0.00 176.91 178.61 2bwx h VAL 322 N -0.52 1.02 -0.43 -2.22 2.07 -0.98 -0.03 116.25 115.16 2bwx h VAL 322 Ca -0.01 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.41 2bwx h VAL 322 Cb 0.44 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 2bwx h VAL 322 CO 0.02 0.08 0.17 0.28 0.02 0.00 0.00 177.57 178.14 2bwx h SER 323 N 0.43 0.21 -0.48 0.57 0.02 -1.13 -0.86 113.55 112.31 2bwx h SER 323 Ca 0.15 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2bwx h SER 323 Cb 0.03 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2bwx h SER 323 CO -0.08 0.15 0.01 1.23 -1.14 0.00 0.00 176.83 177.00 2bwx h GLY 324 N 0.35 0.90 1.53 -3.77 0.00 -0.92 -2.03 103.07 99.14 2bwx h GLY 324 Ca 0.20 -0.65 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 2bwx h GLY 324 CO -0.18 0.60 -0.19 1.41 0.00 0.00 0.00 176.54 178.18 2bwx h LEU 325 N 0.69 0.54 -0.29 3.11 3.38 -0.77 -2.24 115.31 119.73 2bwx h LEU 325 Ca 0.14 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2bwx h LEU 325 Cb 0.49 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2bwx h LEU 325 CO 0.02 0.74 0.05 0.58 0.09 0.00 0.00 178.44 179.93 2bwx h VAL 326 N 0.49 1.23 -0.69 1.22 2.07 -1.09 -0.03 116.25 119.45 2bwx h VAL 326 Ca 0.08 -0.77 0.09 0.00 0.82 0.00 0.00 66.70 66.92 2bwx h VAL 326 Cb 0.61 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 2bwx h VAL 326 CO 0.04 0.25 0.46 0.50 0.02 0.00 0.00 177.57 178.84 2bwx h LYS 327 N 0.30 0.58 -0.01 1.57 3.64 -1.08 -1.65 116.57 119.92 2bwx h LYS 327 Ca 0.09 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2bwx h LYS 327 Cb 0.32 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2bwx h LYS 327 CO 0.00 0.38 -0.13 1.28 -2.27 0.00 0.00 179.45 178.72 2bwx n LEU 328 N -4.49 1.11 -0.05 5.20 4.77 -0.87 -4.94 117.00 117.74 2bwx n LEU 328 Ca 0.11 -0.32 -0.01 0.00 -0.03 0.00 0.00 56.01 55.77 2bwx n LEU 328 Cb 0.33 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2bwx n LEU 328 CO 0.33 0.20 -0.01 0.61 -1.33 0.00 0.00 177.39 177.19 2bwx n GLY 329 N 1.25 0.47 0.19 -0.72 0.00 -0.62 -4.90 105.19 100.86 2bwx n GLY 329 Ca 0.16 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 2bwx n GLY 329 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bwx h ILE 330 N 0.00 1.29 -2.99 -0.61 2.04 -1.25 -3.42 117.51 112.56 2bwx h ILE 330 Ca -0.01 -2.25 -0.61 0.00 1.00 0.00 0.00 64.86 62.99 2bwx h ILE 330 Cb 0.15 2.41 -0.11 0.00 -0.74 0.00 0.00 36.82 38.53 2bwx h ILE 330 CO 0.02 0.69 -0.65 -0.76 0.00 0.00 0.00 178.15 177.45 2bwx s LEU 331 N -8.12 3.39 -0.05 1.44 1.43 -0.91 -4.89 118.68 110.97 2bwx s LEU 331 Ca -0.10 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 2bwx s LEU 331 Cb 0.07 -2.06 0.02 0.00 0.03 0.00 0.00 46.19 44.24 2bwx s LEU 331 CO 0.92 0.11 -0.08 -0.54 0.23 0.00 0.00 176.35 176.99 2bwx s LYS 332 N -2.79 1.20 0.00 1.70 1.02 -1.26 -4.13 119.74 115.48 2bwx s LYS 332 Ca 0.27 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 56.02 2bwx s LYS 332 Cb -0.10 -1.08 0.00 0.00 -0.52 0.00 0.00 37.83 36.13 2bwx s LYS 332 CO 0.19 -0.03 0.00 0.41 -0.92 0.00 0.00 175.35 174.99 2bwx n GLY 333 N 3.95 0.79 3.71 -3.33 0.00 -1.26 -5.02 105.19 104.02 2bwx n GLY 333 Ca -0.24 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.32 2bwx n GLY 333 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bwx s ASP 334 N -4.00 7.38 0.15 1.61 2.15 -1.26 -4.97 116.67 117.73 2bwx s ASP 334 Ca 0.00 1.67 -0.17 0.00 0.43 0.00 0.00 52.55 54.48 2bwx s ASP 334 Cb 0.00 -2.57 0.04 0.00 -0.30 0.00 0.00 42.92 40.09 2bwx s ASP 334 CO 0.00 -0.23 1.75 0.58 -0.17 0.00 0.00 175.17 177.10 2bwx h VAL 335 N 4.71 0.91 -0.60 1.11 2.07 -1.96 0.10 116.25 122.59 2bwx h VAL 335 Ca -0.41 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 2bwx h VAL 335 Cb 1.22 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 2bwx h VAL 335 CO 0.75 0.05 0.10 0.44 0.02 0.00 0.00 177.57 178.93 2bwx h ASP 336 N 0.27 0.95 -0.53 0.57 3.32 -1.98 0.30 116.42 119.32 2bwx h ASP 336 Ca 0.15 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2bwx h ASP 336 Cb 0.12 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2bwx h ASP 336 CO -0.15 0.97 0.21 -0.33 -1.72 0.00 0.00 179.24 178.22 2bwx h GLU 337 N 0.90 0.80 -0.70 3.56 5.08 -1.89 -0.15 114.58 122.18 2bwx h GLU 337 Ca 0.18 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2bwx h GLU 337 Cb 0.42 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2bwx h GLU 337 CO 0.01 0.70 0.25 -0.07 -1.00 0.00 0.00 179.01 178.90 2bwx h LEU 338 N 0.72 0.99 -0.32 1.33 3.38 -0.45 -0.26 115.31 120.70 2bwx h LEU 338 Ca 0.18 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bwx h LEU 338 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2bwx h LEU 338 CO -0.01 0.91 0.21 0.40 0.09 0.00 0.00 178.44 180.03 2bwx h ILE 339 N 1.01 1.08 -0.05 1.22 2.04 -0.24 -1.18 117.51 121.39 2bwx h ILE 339 Ca 0.23 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.94 2bwx h ILE 339 Cb 0.25 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2bwx h ILE 339 CO -0.01 0.08 0.03 0.00 0.00 0.00 0.00 178.15 178.25 2bwx h ALA 340 N 1.11 1.96 -0.09 1.87 0.00 -0.59 -0.90 119.26 122.63 2bwx h ALA 340 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2bwx h ALA 340 Cb -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2bwx h ALA 340 CO -0.02 0.03 0.00 1.04 0.00 0.00 0.00 179.25 180.30 2bwx n GLN 341 N -4.53 1.50 -4.06 0.00 6.02 -0.15 -4.93 117.38 111.23 2bwx n GLN 341 Ca -0.02 -0.74 -0.31 0.00 -0.01 0.00 0.00 57.00 55.92 2bwx n GLN 341 Cb 0.09 -1.39 -0.01 0.00 1.02 0.00 0.00 30.24 29.94 2bwx n GLN 341 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2bwx n ASN 342 N -0.06 -2.36 0.13 1.08 3.02 -0.34 -4.85 115.26 111.88 2bwx n ASN 342 Ca 0.17 -0.97 0.12 0.00 -0.03 0.00 0.00 54.58 53.87 2bwx n ASN 342 Cb 0.26 -3.09 0.49 0.00 -0.61 0.00 0.00 39.78 36.83 2bwx n ASN 342 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bwx n ALA 343 N -4.44 1.59 0.28 5.41 0.00 -0.49 -1.96 120.51 120.90 2bwx n ALA 343 Ca -0.09 0.09 0.17 0.00 0.00 0.00 0.00 53.44 53.61 2bwx n ALA 343 Cb 0.58 -1.37 0.62 0.00 0.00 0.00 0.00 19.45 19.28 2bwx n ALA 343 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2bwx h HIS 344 N 0.00 0.00 -0.29 0.00 2.07 -1.89 -3.38 115.15 111.67 2bwx h HIS 344 Ca 0.00 0.00 0.01 0.00 -2.85 0.00 0.00 60.37 57.53 2bwx h HIS 344 Cb 0.32 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.28 2bwx h HIS 344 CO 0.00 0.00 0.19 0.00 -3.07 0.00 0.00 177.93 175.05 2bwx h ARG 345 N 0.00 0.34 0.00 5.12 2.47 -1.56 0.82 114.38 121.57 2bwx h ARG 345 Ca 0.00 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 2bwx h ARG 345 Cb 0.56 -0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.80 2bwx h ARG 345 CO 0.00 0.22 -0.03 -1.35 0.56 0.00 0.00 179.97 179.37 2bwx h PRO 346 N 0.35 0.00 0.00 0.04 0.11 -1.83 -3.26 132.00 127.41 2bwx h PRO 346 Ca 0.11 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.08 2bwx h PRO 346 Cb 0.02 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.10 2bwx h PRO 346 CO -0.02 0.03 -1.64 1.19 -0.21 0.00 0.00 178.00 177.35 2bwx n PHE 347 N -3.44 0.00 -3.77 0.65 3.72 0.04 -4.83 117.46 109.84 2bwx n PHE 347 Ca -0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.08 2bwx n PHE 347 Cb 0.14 -0.43 -0.14 0.00 -0.94 0.00 0.00 39.48 38.10 2bwx n PHE 347 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 2bwx s PHE 348 N -2.36 2.11 -1.60 1.38 5.36 0.06 -0.82 117.98 122.11 2bwx s PHE 348 Ca -0.05 -2.20 0.14 0.00 -0.96 0.00 0.00 56.93 53.86 2bwx s PHE 348 Cb 0.04 -1.96 0.19 0.00 -0.34 0.00 0.00 43.02 40.94 2bwx s PHE 348 CO 0.41 -0.85 1.05 0.00 -1.46 0.00 0.00 175.22 174.38 2bwx n MET 349 N 4.22 1.47 -4.68 10.12 0.00 -1.23 -4.18 117.12 122.84 2bwx n MET 349 Ca 0.03 -1.57 -0.31 0.00 0.00 0.00 0.00 57.70 55.85 2bwx n MET 349 Cb 0.39 -1.29 -0.08 0.00 0.00 0.00 0.00 33.22 32.24 2bwx n MET 349 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 175.97 172.59 2bwx s HIS 350 N -1.12 1.92 0.61 3.17 -3.43 -1.26 -5.11 115.29 110.07 2bwx s HIS 350 Ca 0.20 -0.99 -0.14 0.00 -0.80 0.00 0.00 55.06 53.32 2bwx s HIS 350 Cb 0.13 -1.52 -0.03 0.00 -1.43 0.00 0.00 32.58 29.72 2bwx s HIS 350 CO 0.18 0.14 1.04 0.20 -2.00 0.00 0.00 174.74 174.30 2bwx s GLY 351 N -3.79 1.95 0.16 -1.38 0.00 -1.26 -4.99 107.32 98.01 2bwx s GLY 351 Ca 0.14 0.24 0.03 0.00 0.00 0.00 0.00 44.72 45.13 2bwx s GLY 351 CO 0.07 0.54 1.36 -2.00 0.00 0.00 0.00 173.10 173.07 2bwx h LEU 352 N 0.13 0.20 -7.44 0.66 5.85 -1.94 -3.45 115.31 109.32 2bwx h LEU 352 Ca -0.46 -0.17 -0.16 0.00 0.84 0.00 0.00 57.88 57.94 2bwx h LEU 352 Cb 1.21 -0.06 -0.25 0.00 0.37 0.00 0.00 40.66 41.92 2bwx h LEU 352 CO 0.58 1.00 -0.39 -0.44 -0.34 0.00 0.00 178.44 178.85 2bwx s SER 353 N -6.90 -0.29 0.06 1.25 0.01 -1.26 -0.02 113.70 106.55 2bwx s SER 353 Ca -0.02 0.56 0.05 0.00 1.31 0.00 0.00 55.95 57.85 2bwx s SER 353 Cb 0.10 0.56 -0.03 0.00 0.21 0.00 0.00 66.02 66.87 2bwx s SER 353 CO 0.83 -0.10 -0.14 0.00 0.41 0.00 0.00 173.24 174.23 2bwx s ALA 354 N 0.21 1.18 0.71 1.44 0.00 -1.25 -4.92 121.76 119.14 2bwx s ALA 354 Ca -0.00 -0.93 -0.16 0.00 0.00 0.00 0.00 51.96 50.86 2bwx s ALA 354 Cb -0.02 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.99 2bwx s ALA 354 CO -0.00 0.19 1.23 -1.58 0.00 0.00 0.00 175.76 175.60 2bwx s TRP 355 N -1.10 2.03 -0.01 0.00 0.23 -1.26 -0.38 118.94 118.45 2bwx s TRP 355 Ca -0.00 1.58 0.01 0.00 -2.03 0.00 0.00 56.10 55.66 2bwx s TRP 355 Cb -0.09 -3.54 -0.00 0.00 0.03 0.00 0.00 33.47 29.87 2bwx s TRP 355 CO 0.02 -2.72 -0.05 -1.17 0.96 0.00 0.00 176.95 173.99 2bwx s LEU 356 N -4.97 1.97 0.00 2.99 2.96 -0.42 -0.40 118.68 120.80 2bwx s LEU 356 Ca 0.77 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 2bwx s LEU 356 Cb -0.31 -0.26 0.00 0.00 0.50 0.00 0.00 46.19 46.12 2bwx s LEU 356 CO 0.44 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 176.13 2bwx n GLY 357 N 3.02 0.36 0.29 7.98 0.00 -1.26 -4.58 105.19 111.00 2bwx n GLY 357 Ca -0.14 0.48 0.17 0.00 0.00 0.00 0.00 46.02 46.53 2bwx n GLY 357 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bwx h LEU 358 N 0.00 0.00 -8.52 0.99 3.38 -1.94 -1.04 115.31 108.17 2bwx h LEU 358 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2bwx h LEU 358 Cb 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 40.53 2bwx h LEU 358 CO 0.00 0.05 -0.80 -1.81 0.09 0.00 0.00 178.44 175.97 2bwx s ASP 359 N -5.71 2.04 0.55 -0.43 1.01 -1.26 -4.64 116.67 108.23 2bwx s ASP 359 Ca -0.02 -0.64 -0.18 0.00 0.71 0.00 0.00 52.55 52.42 2bwx s ASP 359 Cb 0.11 -0.09 -0.05 0.00 1.01 0.00 0.00 42.92 43.90 2bwx s ASP 359 CO 0.53 -0.02 1.08 0.68 0.21 0.00 0.00 175.17 177.65 2bwx s VAL 360 N -1.22 3.52 -1.18 -1.27 -7.23 -1.26 -3.10 120.40 108.66 2bwx s VAL 360 Ca 0.02 0.86 -0.18 0.00 -1.81 0.00 0.00 61.98 60.86 2bwx s VAL 360 Cb -0.10 -3.34 -0.01 0.00 0.56 0.00 0.00 36.38 33.50 2bwx s VAL 360 CO 0.03 -0.29 0.75 1.41 -0.31 0.00 0.00 175.10 176.69 2bwx n HIS 361 N -1.51 -1.86 -0.90 2.82 8.25 -1.13 -4.90 115.22 115.99 2bwx n HIS 361 Ca 0.10 0.48 -0.30 0.00 -0.26 0.00 0.00 57.72 57.74 2bwx n HIS 361 Cb 0.52 -3.48 0.17 0.00 1.12 0.00 0.00 29.99 28.32 2bwx n HIS 361 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2bwx s ASP 362 N -3.60 2.90 0.89 0.41 2.15 0.46 -4.93 116.67 114.96 2bwx s ASP 362 Ca 0.41 1.78 -0.11 0.00 0.43 0.00 0.00 52.55 55.06 2bwx s ASP 362 Cb -0.15 -2.38 0.13 0.00 -0.30 0.00 0.00 42.92 40.22 2bwx s ASP 362 CO 0.87 -3.05 1.10 0.68 -0.17 0.00 0.00 175.17 174.60 2bwx s VAL 363 N -2.73 2.64 0.00 1.11 -7.23 -1.26 -4.59 120.40 108.34 2bwx s VAL 363 Ca 0.65 0.21 0.00 0.00 -1.81 0.00 0.00 61.98 61.03 2bwx s VAL 363 Cb -0.21 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.21 2bwx s VAL 363 CO 0.59 -0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2bwx n GLY 364 N -0.60 3.73 3.68 2.32 0.00 -1.26 -4.59 105.19 108.48 2bwx n GLY 364 Ca 0.08 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2bwx n GLY 364 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bwx s VAL 365 N -1.54 4.30 -0.29 1.61 1.01 -1.26 -4.94 120.40 119.29 2bwx s VAL 365 Ca 0.00 1.62 0.21 0.00 0.00 0.00 0.00 61.98 63.80 2bwx s VAL 365 Cb 0.00 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.46 2bwx s VAL 365 CO 0.00 -0.01 1.30 1.88 0.00 0.00 0.00 175.10 178.26 2bwx h TYR 366 N 7.49 0.00 -0.21 5.22 0.05 -1.98 -3.47 116.97 124.08 2bwx h TYR 366 Ca -0.33 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.47 2bwx h TYR 366 Cb 1.15 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.88 2bwx h TYR 366 CO 0.74 0.14 -0.07 0.41 -1.05 0.00 0.00 178.16 178.33 2bwx n GLY 367 N 1.18 -2.37 3.69 3.88 0.00 -1.26 -1.17 105.19 109.14 2bwx n GLY 367 Ca 0.01 -1.45 -0.44 0.00 0.00 0.00 0.00 46.02 44.14 2bwx n GLY 367 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2bwx n GLN 368 N -2.34 2.56 -2.40 1.61 7.27 -1.26 -1.71 117.38 121.11 2bwx n GLN 368 Ca -0.00 0.93 -0.16 0.00 0.07 0.00 0.00 57.00 57.83 2bwx n GLN 368 Cb 0.04 -2.77 -0.01 0.00 2.41 0.00 0.00 30.24 29.91 2bwx n GLN 368 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2bwx n ASP 369 N 4.61 -4.86 -3.49 1.69 8.00 -1.26 -1.91 116.55 119.34 2bwx n ASP 369 Ca 0.18 0.10 -0.21 0.00 0.71 0.00 0.00 54.79 55.56 2bwx n ASP 369 Cb 0.34 -4.09 0.08 0.00 -0.02 0.00 0.00 41.12 37.43 2bwx n ASP 369 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2bwx n ARG 370 N -2.89 -7.41 0.00 -1.24 1.74 -0.69 -4.25 116.66 101.92 2bwx n ARG 370 Ca -0.19 0.82 0.13 0.00 -0.77 0.00 0.00 57.85 57.84 2bwx n ARG 370 Cb 0.65 -5.82 0.40 0.00 -1.02 0.00 0.00 32.46 26.67 2bwx n ARG 370 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2bwx n SER 371 N -2.98 1.52 -4.70 0.55 3.41 -0.80 -1.30 113.62 109.32 2bwx n SER 371 Ca -0.09 -1.35 -0.44 0.00 -0.26 0.00 0.00 58.87 56.74 2bwx n SER 371 Cb 0.59 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.59 2bwx n SER 371 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2bwx n ARG 372 N 0.00 2.29 -2.14 4.33 0.63 -0.32 -4.84 116.66 116.62 2bwx n ARG 372 Ca 0.16 0.82 -0.42 0.00 -0.92 0.00 0.00 57.85 57.48 2bwx n ARG 372 Cb 0.38 -2.52 -0.03 0.00 0.45 0.00 0.00 32.46 30.74 2bwx n ARG 372 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2bwx s ILE 373 N -0.01 3.34 0.34 5.15 -1.09 -1.26 -4.45 121.20 123.22 2bwx s ILE 373 Ca 0.67 0.89 -0.27 0.00 -2.23 0.00 0.00 60.65 59.71 2bwx s ILE 373 Cb -0.59 -3.57 -0.09 0.00 -1.58 0.00 0.00 42.46 36.63 2bwx s ILE 373 CO 0.49 0.04 1.09 -0.76 -1.23 0.00 0.00 174.94 174.57 2bwx s LEU 374 N 1.69 4.35 0.10 2.97 1.43 0.26 -4.85 118.68 124.62 2bwx s LEU 374 Ca 0.66 2.20 0.03 0.00 -1.03 0.00 0.00 54.13 55.99 2bwx s LEU 374 Cb -0.36 -3.89 -0.04 0.00 0.03 0.00 0.00 46.19 41.93 2bwx s LEU 374 CO 0.29 -0.35 -0.08 -1.61 0.23 0.00 0.00 176.35 174.83 2bwx s GLU 375 N -1.96 0.85 0.34 1.70 2.02 -1.26 -0.98 118.70 119.41 2bwx s GLU 375 Ca 0.51 -1.26 -0.28 0.00 0.02 0.00 0.00 54.97 53.97 2bwx s GLU 375 Cb -0.28 -0.37 -0.12 0.00 0.10 0.00 0.00 34.13 33.45 2bwx s GLU 375 CO 0.36 0.03 1.29 -2.30 0.02 0.00 0.00 175.26 174.66 2bwx n PRO 376 N 0.23 2.12 0.00 0.39 -0.02 -1.26 -2.67 135.00 133.79 2bwx n PRO 376 Ca -0.14 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2bwx n PRO 376 Cb 0.59 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2bwx n PRO 376 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bwx n GLY 377 N 0.77 1.12 3.77 -1.23 0.00 -0.29 -4.90 105.19 104.44 2bwx n GLY 377 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2bwx n GLY 377 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bwx s MET 378 N -0.96 4.59 -0.07 1.61 -1.94 -1.09 -1.15 119.30 120.29 2bwx s MET 378 Ca 0.00 1.54 0.03 0.00 -1.71 0.00 0.00 55.69 55.55 2bwx s MET 378 Cb 0.00 -2.98 0.00 0.00 2.01 0.00 0.00 34.83 33.86 2bwx s MET 378 CO 0.00 0.24 -0.18 0.08 -0.01 0.00 0.00 175.02 175.16 2bwx s VAL 379 N -1.38 1.56 0.07 -6.03 1.01 -1.26 -0.49 120.40 113.87 2bwx s VAL 379 Ca 0.48 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.57 2bwx s VAL 379 Cb -0.25 -1.37 0.02 0.00 0.00 0.00 0.00 36.38 34.79 2bwx s VAL 379 CO 0.31 0.45 0.33 -1.48 0.00 0.00 0.00 175.10 174.71 2bwx s LEU 380 N 0.40 0.77 0.51 3.92 2.34 -0.02 -1.30 118.68 125.29 2bwx s LEU 380 Ca -0.14 -0.26 -0.06 0.00 0.06 0.00 0.00 54.13 53.74 2bwx s LEU 380 Cb -0.16 1.48 -0.03 0.00 -0.56 0.00 0.00 46.19 46.93 2bwx s LEU 380 CO 0.05 -0.70 0.82 0.42 -1.06 0.00 0.00 176.35 175.88 2bwx s THR 381 N -3.03 4.72 -0.19 5.48 -4.23 0.49 -0.45 115.64 118.42 2bwx s THR 381 Ca -0.02 0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 60.67 2bwx s THR 381 Cb 0.01 -3.81 0.06 0.00 1.34 0.00 0.00 72.50 70.10 2bwx s THR 381 CO -0.06 -0.82 0.05 -0.69 -0.54 0.00 0.00 174.62 172.56 2bwx s VAL 382 N -2.81 0.35 -0.37 2.29 1.01 0.28 -3.77 120.40 117.39 2bwx s VAL 382 Ca 0.49 -0.45 0.12 0.00 0.00 0.00 0.00 61.98 62.14 2bwx s VAL 382 Cb -0.10 -0.90 0.36 0.00 0.00 0.00 0.00 36.38 35.73 2bwx s VAL 382 CO 0.46 -0.23 0.74 -1.84 0.00 0.00 0.00 175.10 174.22 2bwx n GLU 383 N 5.11 0.98 -1.76 2.72 0.28 0.97 -1.78 120.64 127.17 2bwx n GLU 383 Ca -0.08 -3.37 -0.35 0.00 -0.16 0.00 0.00 57.16 53.19 2bwx n GLU 383 Cb 0.48 -1.69 0.06 0.00 1.43 0.00 0.00 31.44 31.72 2bwx n GLU 383 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2bwx s PRO 384 N -2.47 2.62 0.14 3.44 0.04 -1.24 -4.78 135.00 132.75 2bwx s PRO 384 Ca 0.39 1.79 -0.17 0.00 0.04 0.00 0.00 61.00 63.05 2bwx s PRO 384 Cb 0.36 -1.89 0.04 0.00 0.04 0.00 0.00 34.50 33.05 2bwx s PRO 384 CO -0.07 -1.47 0.45 0.20 0.04 0.00 0.00 177.00 176.14 2bwx s GLY 385 N -1.82 -0.33 -0.04 0.56 0.00 -1.26 -2.49 107.32 101.95 2bwx s GLY 385 Ca 0.76 0.05 0.01 0.00 0.00 0.00 0.00 44.72 45.54 2bwx s GLY 385 CO 0.39 -0.21 -0.04 1.08 0.00 0.00 0.00 173.10 174.31 2bwx s LEU 386 N -2.80 1.40 -0.19 0.66 1.43 0.11 -4.44 118.68 114.84 2bwx s LEU 386 Ca 0.03 -0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2bwx s LEU 386 Cb 0.01 -0.42 0.05 0.00 0.03 0.00 0.00 46.19 45.86 2bwx s LEU 386 CO -0.12 -0.04 -0.02 -0.31 0.23 0.00 0.00 176.35 176.09 2bwx s TYR 387 N 0.79 1.67 -0.41 0.29 1.51 -0.00 -0.92 117.35 120.29 2bwx s TYR 387 Ca -0.10 -1.20 -0.08 0.00 -1.01 0.00 0.00 57.07 54.67 2bwx s TYR 387 Cb -0.13 -1.29 0.07 0.00 -0.11 0.00 0.00 41.96 40.50 2bwx s TYR 387 CO 0.00 -0.66 0.23 0.42 -1.11 0.00 0.00 175.55 174.44 2bwx s ILE 388 N 1.64 4.11 0.64 2.71 -1.09 0.85 -4.42 121.20 125.64 2bwx s ILE 388 Ca -0.02 -1.39 -0.18 0.00 -2.23 0.00 0.00 60.65 56.83 2bwx s ILE 388 Cb -0.17 -3.50 -0.01 0.00 -1.58 0.00 0.00 42.46 37.19 2bwx s ILE 388 CO -0.07 -0.47 1.30 0.00 -1.23 0.00 0.00 174.94 174.48 2bwx s ALA 389 N 1.41 2.40 0.58 9.38 0.00 -1.26 0.36 121.76 134.63 2bwx s ALA 389 Ca 0.03 1.23 0.29 0.00 0.00 0.00 0.00 51.96 53.51 2bwx s ALA 389 Cb -0.22 -3.56 1.49 0.00 0.00 0.00 0.00 23.12 20.83 2bwx s ALA 389 CO 0.02 -1.60 1.92 -1.35 0.00 0.00 0.00 175.76 174.75 2bwx h PRO 390 N 0.59 0.00 -0.26 0.00 0.11 -1.91 -1.19 132.00 129.34 2bwx h PRO 390 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2bwx h PRO 390 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2bwx h PRO 390 CO 0.53 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 2bwx n ASP 391 N -3.80 3.30 -4.76 -2.05 5.75 -1.26 -4.65 116.55 109.08 2bwx n ASP 391 Ca 0.08 -2.59 -0.39 0.00 -0.01 0.00 0.00 54.79 51.89 2bwx n ASP 391 Cb 0.65 -0.39 0.02 0.00 -1.03 0.00 0.00 41.12 40.37 2bwx n ASP 391 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bwx s ALA 392 N -2.05 3.08 -1.35 2.12 0.00 -0.46 -4.89 121.76 118.22 2bwx s ALA 392 Ca 0.32 1.31 -0.14 0.00 0.00 0.00 0.00 51.96 53.45 2bwx s ALA 392 Cb 0.23 -3.54 0.09 0.00 0.00 0.00 0.00 23.12 19.91 2bwx s ALA 392 CO 0.10 -1.10 1.93 0.39 0.00 0.00 0.00 175.76 177.08 2bwx n GLU 393 N -0.41 3.18 -4.07 0.00 -0.58 -1.26 -4.87 120.64 112.63 2bwx n GLU 393 Ca 0.07 -3.14 -0.10 0.00 -0.42 0.00 0.00 57.16 53.57 2bwx n GLU 393 Cb 0.44 -3.22 -0.09 0.00 -0.57 0.00 0.00 31.44 28.00 2bwx n GLU 393 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2bwx s VAL 394 N 2.55 0.07 0.10 2.62 -7.23 -1.26 -5.04 120.40 112.21 2bwx s VAL 394 Ca 0.46 -1.69 -0.36 0.00 -1.81 0.00 0.00 61.98 58.58 2bwx s VAL 394 Cb 0.08 -2.03 -0.16 0.00 0.56 0.00 0.00 36.38 34.83 2bwx s VAL 394 CO -0.02 -0.32 1.34 -2.65 -0.31 0.00 0.00 175.10 173.14 2bwx n PRO 395 N -0.18 1.22 -0.04 4.82 -0.02 -1.26 -4.80 135.00 134.74 2bwx n PRO 395 Ca -0.05 0.44 0.19 0.00 -2.02 0.00 0.00 63.50 62.06 2bwx n PRO 395 Cb 0.64 -2.08 0.64 0.00 -0.02 0.00 0.00 33.50 32.68 2bwx n PRO 395 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2bwx h GLU 396 N 4.53 0.10 0.00 -0.52 -0.00 -1.99 -2.02 114.58 114.68 2bwx h GLU 396 Ca -0.47 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 58.88 2bwx h GLU 396 Cb 1.33 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 30.06 2bwx h GLU 396 CO 0.78 0.07 0.00 -0.56 -0.00 0.00 0.00 179.01 179.29 2bwx h GLN 397 N 0.10 0.00 0.00 1.06 -0.00 -2.02 -2.63 115.11 111.63 2bwx h GLN 397 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.93 2bwx h GLN 397 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.46 2bwx h GLN 397 CO -0.03 0.00 -0.97 0.66 -0.00 0.00 0.00 178.83 178.49 2bwx n TYR 398 N -2.59 0.20 -1.94 0.06 4.01 -0.76 -4.82 117.16 111.33 2bwx n TYR 398 Ca -0.00 0.06 -0.41 0.00 -0.16 0.00 0.00 57.90 57.38 2bwx n TYR 398 Cb 0.17 -0.36 -0.02 0.00 -0.31 0.00 0.00 39.34 38.81 2bwx n TYR 398 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2bwx s ARG 399 N -3.15 4.22 0.00 -0.72 0.52 -0.99 -2.90 118.95 115.93 2bwx s ARG 399 Ca 0.05 2.39 0.00 0.00 -0.52 0.00 0.00 55.73 57.65 2bwx s ARG 399 Cb 0.15 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.54 2bwx s ARG 399 CO 0.80 -0.47 0.00 0.41 0.02 0.00 0.00 175.30 176.06 2bwx n GLY 400 N 1.99 0.48 3.59 -3.53 0.00 0.16 -4.79 105.19 103.09 2bwx n GLY 400 Ca 0.06 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 2bwx n GLY 400 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bwx s ILE 401 N -2.00 5.24 -0.20 -0.61 1.01 -1.00 -3.84 121.20 119.81 2bwx s ILE 401 Ca 0.00 0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.98 2bwx s ILE 401 Cb 0.00 -3.62 0.04 0.00 0.01 0.00 0.00 42.46 38.88 2bwx s ILE 401 CO 0.00 0.18 -0.15 -0.83 0.00 0.00 0.00 174.94 174.15 2bwx s GLY 402 N 1.71 1.38 -0.07 6.18 0.00 -1.26 -0.10 107.32 115.15 2bwx s GLY 402 Ca 0.11 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.54 2bwx s GLY 402 CO 0.11 0.50 -0.09 -0.42 0.00 0.00 0.00 173.10 173.20 2bwx s ILE 403 N 1.30 0.96 0.01 0.90 1.01 -0.10 -4.70 121.20 120.59 2bwx s ILE 403 Ca 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.33 2bwx s ILE 403 Cb -0.15 -0.92 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 2bwx s ILE 403 CO -0.10 0.33 -0.06 -0.60 0.00 0.00 0.00 174.94 174.51 2bwx s ARG 404 N 0.98 0.43 -0.05 2.79 3.52 -1.26 -0.72 118.95 124.63 2bwx s ARG 404 Ca -0.09 -0.39 -0.00 0.00 -0.13 0.00 0.00 55.73 55.12 2bwx s ARG 404 Cb -0.15 -0.32 0.03 0.00 -1.56 0.00 0.00 34.95 32.95 2bwx s ARG 404 CO 0.00 0.08 -0.01 0.42 -0.81 0.00 0.00 175.30 174.98 2bwx s ILE 405 N -0.60 0.38 -0.03 4.11 1.01 -1.04 -3.45 121.20 121.58 2bwx s ILE 405 Ca -0.03 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2bwx s ILE 405 Cb -0.05 -0.48 0.03 0.00 0.01 0.00 0.00 42.46 41.96 2bwx s ILE 405 CO -0.00 0.22 0.00 -0.70 0.00 0.00 0.00 174.94 174.47 2bwx s GLU 406 N 1.45 0.33 0.31 2.79 2.12 -0.44 -3.59 118.70 121.66 2bwx s GLU 406 Ca -0.03 0.08 0.11 0.00 0.36 0.00 0.00 54.97 55.49 2bwx s GLU 406 Cb -0.13 -0.53 -0.06 0.00 0.26 0.00 0.00 34.13 33.68 2bwx s GLU 406 CO -0.03 -0.15 -0.15 -0.51 -0.54 0.00 0.00 175.26 173.88 2bwx s ASP 407 N 1.11 3.66 -0.13 -1.70 1.01 -0.73 -2.84 116.67 117.05 2bwx s ASP 407 Ca -0.08 -1.10 -0.01 0.00 0.71 0.00 0.00 52.55 52.07 2bwx s ASP 407 Cb -0.13 -0.33 -0.02 0.00 1.01 0.00 0.00 42.92 43.45 2bwx s ASP 407 CO -0.02 -0.06 -0.09 -1.81 0.21 0.00 0.00 175.17 173.40 2bwx s ASP 408 N -3.55 4.36 0.15 0.27 1.01 -1.26 -0.55 116.67 117.08 2bwx s ASP 408 Ca 0.31 -0.21 0.06 0.00 0.71 0.00 0.00 52.55 53.42 2bwx s ASP 408 Cb -0.02 -1.56 -0.04 0.00 1.01 0.00 0.00 42.92 42.31 2bwx s ASP 408 CO 0.16 0.20 -0.13 0.27 0.21 0.00 0.00 175.17 175.88 2bwx s ILE 409 N 0.14 1.37 -0.14 0.77 -4.36 0.40 -0.19 121.20 119.19 2bwx s ILE 409 Ca -0.04 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.42 2bwx s ILE 409 Cb -0.14 -1.74 -0.01 0.00 1.25 0.00 0.00 42.46 41.82 2bwx s ILE 409 CO 0.04 -0.55 -0.14 -0.69 0.24 0.00 0.00 174.94 173.83 2bwx s VAL 410 N -2.68 2.84 0.11 8.37 1.01 -0.32 -0.84 120.40 128.89 2bwx s VAL 410 Ca 0.14 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 2bwx s VAL 410 Cb -0.02 -2.19 -0.07 0.00 0.00 0.00 0.00 36.38 34.10 2bwx s VAL 410 CO 0.03 0.52 1.22 -0.63 0.00 0.00 0.00 175.10 176.24 2bwx s ILE 411 N 0.59 3.77 0.52 2.22 -1.09 0.35 -0.60 121.20 126.96 2bwx s ILE 411 Ca -0.09 1.34 0.01 0.00 -2.23 0.00 0.00 60.65 59.69 2bwx s ILE 411 Cb -0.16 -3.86 -0.00 0.00 -1.58 0.00 0.00 42.46 36.86 2bwx s ILE 411 CO 0.03 0.14 0.04 0.42 -1.23 0.00 0.00 174.94 174.34 2bwx s THR 412 N 0.68 1.15 0.45 2.92 -4.23 -0.36 -1.14 115.64 115.12 2bwx s THR 412 Ca 0.57 -1.96 0.14 0.00 -1.18 0.00 0.00 61.69 59.27 2bwx s THR 412 Cb -0.32 -2.11 0.20 0.00 1.34 0.00 0.00 72.50 71.62 2bwx s THR 412 CO 0.32 0.00 2.02 -0.33 -0.54 0.00 0.00 174.62 176.09 2bwx h GLU 413 N 1.27 0.05 -0.06 3.99 4.39 -1.97 -3.13 114.58 119.12 2bwx h GLU 413 Ca -0.43 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2bwx h GLU 413 Cb 1.32 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2bwx h GLU 413 CO 0.72 0.17 0.00 0.25 -1.16 0.00 0.00 179.01 179.00 2bwx n THR 414 N -4.37 0.20 0.00 1.13 -2.24 -1.26 -4.79 114.28 102.95 2bwx n THR 414 Ca -0.02 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 2bwx n THR 414 Cb 0.21 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 2bwx n THR 414 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bwx n GLY 415 N 0.42 -0.50 3.19 3.38 0.00 -1.18 -4.97 105.19 105.51 2bwx n GLY 415 Ca 0.05 0.10 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 2bwx n GLY 415 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bwx s ASN 416 N -4.00 0.18 -0.15 1.61 2.20 -1.22 -1.22 114.94 112.33 2bwx s ASN 416 Ca 0.00 -0.70 -0.02 0.00 -0.94 0.00 0.00 52.86 51.20 2bwx s ASN 416 Cb 0.00 0.32 -0.02 0.00 -2.00 0.00 0.00 41.25 39.55 2bwx s ASN 416 CO 0.00 -0.70 -0.09 -0.70 -2.94 0.00 0.00 177.10 172.66 2bwx s GLU 417 N -3.85 3.45 -0.32 3.55 2.12 0.23 -4.89 118.70 119.00 2bwx s GLU 417 Ca 0.05 -0.63 -0.22 0.00 0.36 0.00 0.00 54.97 54.52 2bwx s GLU 417 Cb 0.05 -2.77 -0.00 0.00 0.26 0.00 0.00 34.13 31.68 2bwx s GLU 417 CO -0.11 0.15 0.73 1.21 -0.54 0.00 0.00 175.26 176.70 2bwx s ASN 418 N 0.55 6.58 0.05 -1.70 3.84 -1.26 -1.18 114.94 121.82 2bwx s ASN 418 Ca -0.06 0.51 0.27 0.00 0.21 0.00 0.00 52.86 53.79 2bwx s ASN 418 Cb -0.15 -2.38 0.96 0.00 -0.55 0.00 0.00 41.25 39.13 2bwx s ASN 418 CO 0.03 -0.59 1.76 0.18 -2.79 0.00 0.00 177.10 175.70 2bwx n LEU 419 N 6.13 0.31 -0.23 3.21 4.77 0.74 -4.19 117.00 127.73 2bwx n LEU 419 Ca 0.02 0.41 0.05 0.00 -0.03 0.00 0.00 56.01 56.46 2bwx n LEU 419 Cb 0.48 -0.40 0.07 0.00 -2.33 0.00 0.00 43.42 41.25 2bwx n LEU 419 CO 0.49 -0.02 0.42 0.35 -1.33 0.00 0.00 177.39 177.31 2bwx n THR 420 N -1.71 1.00 1.08 -5.08 -2.24 -1.25 -3.99 114.28 102.10 2bwx n THR 420 Ca 0.06 -1.18 0.11 0.00 -2.27 0.00 0.00 64.05 60.77 2bwx n THR 420 Cb 0.37 0.16 0.57 0.00 -2.10 0.00 0.00 70.33 69.33 2bwx n THR 420 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bwx n ALA 421 N -0.74 2.17 1.93 6.98 0.00 -1.26 -3.11 120.51 126.48 2bwx n ALA 421 Ca 0.08 -0.11 0.16 0.00 0.00 0.00 0.00 53.44 53.57 2bwx n ALA 421 Cb 0.63 -1.37 0.92 0.00 0.00 0.00 0.00 19.45 19.64 2bwx n ALA 421 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bwx n SER 422 N -1.28 0.00 -4.45 0.00 3.41 -1.26 -4.50 113.62 105.54 2bwx n SER 422 Ca 0.11 -0.94 -0.34 0.00 -0.26 0.00 0.00 58.87 57.44 2bwx n SER 422 Cb 0.18 -0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 63.99 2bwx n SER 422 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bwx s VAL 423 N -2.02 3.71 0.70 -3.33 0.11 -1.18 -4.88 120.40 113.51 2bwx s VAL 423 Ca 0.46 -0.41 -0.15 0.00 -2.93 0.00 0.00 61.98 58.94 2bwx s VAL 423 Cb 0.21 -2.63 0.02 0.00 -1.53 0.00 0.00 36.38 32.46 2bwx s VAL 423 CO 0.36 0.48 1.18 0.68 -3.33 0.00 0.00 175.10 174.48 2bwx s VAL 424 N 0.56 2.59 0.00 2.04 -7.23 -1.26 -4.97 120.40 112.12 2bwx s VAL 424 Ca -0.04 0.29 0.00 0.00 -1.81 0.00 0.00 61.98 60.42 2bwx s VAL 424 Cb -0.15 -2.86 0.00 0.00 0.56 0.00 0.00 36.38 33.94 2bwx s VAL 424 CO 0.03 -0.15 0.00 2.29 -0.31 0.00 0.00 175.10 176.95 2bwx n LYS 425 N -2.55 5.74 -1.84 4.82 2.85 -1.26 -4.88 118.16 121.04 2bwx n LYS 425 Ca 0.13 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.97 2bwx n LYS 425 Cb 0.51 -0.48 -0.02 0.00 -0.65 0.00 0.00 35.03 34.38 2bwx n LYS 425 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2bwx s LYS 426 N -0.01 4.17 0.28 -1.58 1.02 -1.26 -4.85 119.74 117.50 2bwx s LYS 426 Ca 0.00 2.49 -0.02 0.00 0.02 0.00 0.00 55.97 58.46 2bwx s LYS 426 Cb 0.00 -3.07 0.43 0.00 -0.52 0.00 0.00 37.83 34.67 2bwx s LYS 426 CO 0.00 -0.60 1.91 -1.00 -0.92 0.00 0.00 175.35 174.74 2bwx h PRO 427 N 5.53 1.12 -0.09 -1.68 0.13 -1.98 0.35 132.00 135.38 2bwx h PRO 427 Ca -0.45 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 64.55 2bwx h PRO 427 Cb 1.21 -0.25 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 2bwx h PRO 427 CO 0.84 0.74 -0.23 1.05 -0.23 0.00 0.00 178.00 180.17 2bwx h GLU 428 N 1.16 0.16 0.00 0.86 9.09 -1.99 -0.78 114.58 123.08 2bwx h GLU 428 Ca 0.39 -0.05 -0.26 0.00 0.05 0.00 0.00 59.36 59.50 2bwx h GLU 428 Cb 0.09 -0.02 0.02 0.00 -1.65 0.00 0.00 28.75 27.19 2bwx h GLU 428 CO -0.14 0.38 -1.03 0.93 0.05 0.00 0.00 179.01 179.21 2bwx h GLU 429 N 0.15 0.66 -0.02 1.06 5.08 -1.37 -1.46 114.58 118.66 2bwx h GLU 429 Ca 0.03 -0.71 0.02 0.00 -1.00 0.00 0.00 59.36 57.70 2bwx h GLU 429 Cb 0.49 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 2bwx h GLU 429 CO 0.03 1.29 -0.11 0.82 -1.00 0.00 0.00 179.01 180.05 2bwx h ILE 430 N 0.37 0.72 -0.38 3.13 2.04 -0.90 -0.90 117.51 121.59 2bwx h ILE 430 Ca -0.12 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.75 2bwx h ILE 430 Cb 1.68 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2bwx h ILE 430 CO 0.20 0.00 0.23 -0.33 0.00 0.00 0.00 178.15 178.25 2bwx h GLU 431 N -0.17 0.45 -0.72 2.37 5.08 -1.14 -1.36 114.58 119.09 2bwx h GLU 431 Ca 0.05 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2bwx h GLU 431 Cb 0.24 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2bwx h GLU 431 CO -0.13 0.30 0.46 0.00 -1.00 0.00 0.00 179.01 178.64 2bwx h ALA 432 N 1.17 0.91 -0.38 3.43 0.00 -1.16 0.18 119.26 123.41 2bwx h ALA 432 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bwx h ALA 432 Cb -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2bwx h ALA 432 CO -0.07 0.35 0.25 1.25 0.00 0.00 0.00 179.25 181.03 2bwx h LEU 433 N 0.98 0.44 -0.23 0.00 5.85 -0.78 -1.46 115.31 120.10 2bwx h LEU 433 Ca 0.26 -0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.77 2bwx h LEU 433 Cb -0.09 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2bwx h LEU 433 CO -0.05 0.33 -0.60 0.24 -0.34 0.00 0.00 178.44 178.02 2bwx h MET 434 N 0.51 0.82 -0.42 1.25 2.86 -0.92 -1.72 114.93 117.30 2bwx h MET 434 Ca 0.14 -0.57 0.07 0.00 -2.06 0.00 0.00 59.70 57.28 2bwx h MET 434 Cb -0.04 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.64 2bwx h MET 434 CO -0.03 1.19 0.08 0.28 1.06 0.00 0.00 176.91 179.49 2bwx h VAL 435 N 0.57 0.77 -0.53 -2.22 2.07 -0.55 0.16 116.25 116.52 2bwx h VAL 435 Ca -0.01 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2bwx h VAL 435 Cb 1.22 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2bwx h VAL 435 CO 0.13 0.04 0.28 0.00 0.02 0.00 0.00 177.57 178.04 2bwx h ALA 436 N 1.33 0.68 -0.62 1.67 0.00 -1.16 -2.56 119.26 118.60 2bwx h ALA 436 Ca 0.21 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2bwx h ALA 436 Cb 0.26 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2bwx h ALA 436 CO -0.27 0.21 0.04 0.00 0.00 0.00 0.00 179.25 179.23 2bwx h ALA 437 N 1.12 0.89 0.00 0.00 0.00 -0.98 -3.06 119.26 117.23 2bwx h ALA 437 Ca 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2bwx h ALA 437 Cb 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2bwx h ALA 437 CO -0.03 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.89 2bwx h ARG 438 N 0.98 0.00 -0.00 0.00 3.08 -0.41 -2.21 114.38 115.83 2bwx h ARG 438 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2bwx h ARG 438 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2bwx h ARG 438 CO 0.02 0.00 -0.08 1.63 -1.07 0.00 0.00 179.97 180.47 2bwx n LYS 439 N -2.53 0.07 0.00 0.04 5.02 -0.99 -5.08 118.16 114.69 2bwx n LYS 439 Ca 0.02 -0.01 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2bwx n LYS 439 Cb 0.26 -1.50 0.25 0.00 -0.02 0.00 0.00 35.03 34.02 2bwx n LYS 439 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92