#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvy s THR 22 N 0.00 1.94 -0.89 -0.44 -1.32 -1.26 -5.00 115.64 108.68 1bvy s THR 22 Ca 0.00 -1.75 0.27 0.00 -1.21 0.00 0.00 61.69 58.99 1bvy s THR 22 Cb 0.00 -1.80 0.16 0.00 -1.51 0.00 0.00 72.50 69.34 1bvy s THR 22 CO 0.00 -0.10 1.66 -0.90 -2.21 0.00 0.00 174.62 173.07 1bvy n ASP 23 N 0.73 0.41 -3.29 8.08 5.75 -1.26 -4.33 116.55 122.64 1bvy n ASP 23 Ca -0.17 0.25 -0.26 0.00 -0.01 0.00 0.00 54.79 54.61 1bvy n ASP 23 Cb 0.55 -0.25 -0.07 0.00 -1.03 0.00 0.00 41.12 40.32 1bvy n ASP 23 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1bvy n LYS 24 N -1.75 2.20 -0.14 0.11 5.02 -1.26 -4.42 118.16 117.92 1bvy n LYS 24 Ca 0.06 -4.35 -0.11 0.00 -2.02 0.00 0.00 58.31 51.89 1bvy n LYS 24 Cb 0.37 -2.02 -0.02 0.00 -0.02 0.00 0.00 35.03 33.35 1bvy n LYS 24 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1bvy h PRO 25 N 3.90 0.79 -0.39 1.97 0.11 -1.95 -1.55 132.00 134.89 1bvy h PRO 25 Ca 0.16 -0.30 -0.05 0.00 0.11 0.00 0.00 66.00 65.92 1bvy h PRO 25 Cb 0.70 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1bvy h PRO 25 CO 0.74 0.92 0.06 0.28 -0.21 0.00 0.00 178.00 179.80 1bvy h VAL 26 N 0.60 1.24 -0.20 3.15 2.07 -1.97 0.40 116.25 121.55 1bvy h VAL 26 Ca 0.10 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 1bvy h VAL 26 Cb 0.63 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1bvy h VAL 26 CO 0.04 0.29 0.00 1.56 0.02 0.00 0.00 177.57 179.49 1bvy h GLN 27 N 0.48 0.28 -0.17 1.57 4.20 -1.97 0.01 115.11 119.51 1bvy h GLN 27 Ca 0.12 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.69 1bvy h GLN 27 Cb 0.36 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1bvy h GLN 27 CO 0.01 0.31 -0.26 0.00 -0.67 0.00 0.00 178.83 178.21 1bvy h ALA 28 N 1.73 0.26 0.00 3.87 0.00 -0.58 -2.55 119.26 122.01 1bvy h ALA 28 Ca 0.07 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1bvy h ALA 28 Cb 0.19 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1bvy h ALA 28 CO 0.00 0.25 -0.12 -0.07 0.00 0.00 0.00 179.25 179.32 1bvy h LEU 29 N 0.12 0.00 -0.33 0.00 3.38 0.28 -2.05 115.31 116.71 1bvy h LEU 29 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1bvy h LEU 29 Cb 0.84 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1bvy h LEU 29 CO 0.06 0.12 -0.05 0.24 0.09 0.00 0.00 178.44 178.90 1bvy h MET 30 N 0.00 0.62 -0.96 1.13 2.86 -0.86 0.45 114.93 118.17 1bvy h MET 30 Ca -0.00 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1bvy h MET 30 Cb 0.25 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.82 1bvy h MET 30 CO 0.02 0.77 0.60 0.87 1.06 0.00 0.00 176.91 180.23 1bvy h LYS 31 N 0.41 1.29 -0.46 1.72 1.79 -0.99 -0.04 116.57 120.30 1bvy h LYS 31 Ca 0.09 -0.11 -0.12 0.00 -2.18 0.00 0.00 60.65 58.33 1bvy h LYS 31 Cb 0.53 -0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 1bvy h LYS 31 CO 0.03 0.89 -0.19 0.82 -1.08 0.00 0.00 179.45 179.92 1bvy h ILE 32 N 1.32 1.27 -0.76 1.86 2.04 -1.16 -2.28 117.51 119.79 1bvy h ILE 32 Ca 0.35 -1.33 0.07 0.00 1.00 0.00 0.00 64.86 64.95 1bvy h ILE 32 Cb -0.08 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.05 1bvy h ILE 32 CO -0.07 0.46 0.44 0.00 0.00 0.00 0.00 178.15 178.97 1bvy h ALA 33 N 0.98 1.05 -0.80 1.87 0.00 -0.40 0.47 119.26 122.45 1bvy h ALA 33 Ca 0.11 0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.24 1bvy h ALA 33 Cb 0.73 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1bvy h ALA 33 CO 0.06 0.10 0.55 -0.44 0.00 0.00 0.00 179.25 179.52 1bvy h ASP 34 N 0.77 0.22 0.02 0.00 3.32 -0.44 0.10 116.42 120.42 1bvy h ASP 34 Ca 0.35 0.02 -0.39 0.00 0.02 0.00 0.00 57.03 57.04 1bvy h ASP 34 Cb 0.26 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 39.73 1bvy h ASP 34 CO -0.21 0.10 -2.39 -1.84 -1.72 0.00 0.00 179.24 173.18 1bvy n GLU 35 N -4.42 0.67 0.03 3.56 0.28 -0.35 -4.58 120.64 115.83 1bvy n GLU 35 Ca 0.16 0.18 0.11 0.00 -0.16 0.00 0.00 57.16 57.45 1bvy n GLU 35 Cb 0.71 -1.56 -0.00 0.00 1.43 0.00 0.00 31.44 32.02 1bvy n GLU 35 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1bvy n LEU 36 N -3.33 0.59 0.00 -1.84 4.32 0.15 -5.08 117.00 111.82 1bvy n LEU 36 Ca -0.43 -0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.55 1bvy n LEU 36 Cb 1.00 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.72 1bvy n LEU 36 CO 0.29 0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.09 1bvy n GLY 37 N 1.35 -1.17 0.17 -0.72 0.00 0.34 -4.64 105.19 100.52 1bvy n GLY 37 Ca 0.01 -1.83 0.13 0.00 0.00 0.00 0.00 46.02 44.34 1bvy n GLY 37 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1bvy h GLU 38 N 0.00 0.00 -2.64 1.61 4.11 -1.90 -3.43 114.58 112.33 1bvy h GLU 38 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.32 1bvy h GLU 38 Cb 0.00 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.02 1bvy h GLU 38 CO 0.00 0.00 -0.18 -1.50 0.07 0.00 0.00 179.01 177.40 1bvy s ILE 39 N -3.38 0.00 0.14 -1.06 2.07 -1.25 -1.11 121.20 116.61 1bvy s ILE 39 Ca 0.04 -0.01 -0.16 0.00 -1.41 0.00 0.00 60.65 59.11 1bvy s ILE 39 Cb 0.09 -0.64 0.03 0.00 0.13 0.00 0.00 42.46 42.08 1bvy s ILE 39 CO 0.46 -0.01 0.43 0.72 -1.91 0.00 0.00 174.94 174.63 1bvy s PHE 40 N 0.18 -0.18 0.02 3.50 -0.12 -1.11 -4.96 117.98 115.32 1bvy s PHE 40 Ca -0.00 -0.14 0.06 0.00 -0.05 0.00 0.00 56.93 56.80 1bvy s PHE 40 Cb -0.03 0.29 -0.02 0.00 -0.63 0.00 0.00 43.02 42.62 1bvy s PHE 40 CO 0.01 -0.75 -0.19 0.21 -0.05 0.00 0.00 175.22 174.45 1bvy s LYS 41 N -3.82 1.38 0.04 1.99 2.20 -1.26 -0.80 119.74 119.46 1bvy s LYS 41 Ca 0.04 -0.81 0.07 0.00 -0.36 0.00 0.00 55.97 54.92 1bvy s LYS 41 Cb 0.01 -1.42 -0.03 0.00 -1.51 0.00 0.00 37.83 34.89 1bvy s LYS 41 CO -0.10 0.37 -0.19 -0.06 -0.36 0.00 0.00 175.35 175.01 1bvy s PHE 42 N -0.66 2.54 -0.02 4.03 0.40 -0.38 -5.00 117.98 118.89 1bvy s PHE 42 Ca 0.07 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.16 1bvy s PHE 42 Cb -0.08 -1.46 -0.00 0.00 0.51 0.00 0.00 43.02 41.99 1bvy s PHE 42 CO 0.01 0.24 -0.09 -2.00 0.70 0.00 0.00 175.22 174.07 1bvy s GLU 43 N -1.41 0.89 0.35 0.44 2.12 -1.26 -1.72 118.70 118.12 1bvy s GLU 43 Ca 0.14 -0.33 0.07 0.00 0.36 0.00 0.00 54.97 55.21 1bvy s GLU 43 Cb -0.10 -0.84 -0.07 0.00 0.26 0.00 0.00 34.13 33.37 1bvy s GLU 43 CO 0.05 0.16 -0.01 0.00 -0.54 0.00 0.00 175.26 174.92 1bvy s ALA 44 N -0.01 2.79 -0.13 6.30 0.00 0.20 -5.00 121.76 125.91 1bvy s ALA 44 Ca 0.00 -2.14 -0.33 0.00 0.00 0.00 0.00 51.96 49.50 1bvy s ALA 44 Cb -0.06 0.24 -0.10 0.00 0.00 0.00 0.00 23.12 23.20 1bvy s ALA 44 CO 0.00 -0.11 1.99 -2.30 0.00 0.00 0.00 175.76 175.34 1bvy n PRO 45 N -0.80 2.10 0.00 0.00 -0.02 -1.26 -2.37 135.00 132.65 1bvy n PRO 45 Ca -0.04 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1bvy n PRO 45 Cb 0.66 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1bvy n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bvy n GLY 46 N 4.92 2.12 3.62 -1.23 0.00 -1.26 -4.96 105.19 108.39 1bvy n GLY 46 Ca 0.26 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1bvy n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bvy s ARG 47 N 0.00 4.03 -0.14 1.61 0.52 -1.00 -5.06 118.95 118.92 1bvy s ARG 47 Ca 0.00 -0.06 -0.03 0.00 -0.52 0.00 0.00 55.73 55.11 1bvy s ARG 47 Cb 0.00 -3.62 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 1bvy s ARG 47 CO 0.00 -0.17 -0.02 0.08 0.02 0.00 0.00 175.30 175.21 1bvy s VAL 48 N 1.75 4.08 -0.04 3.52 1.01 -1.26 0.58 120.40 130.03 1bvy s VAL 48 Ca 0.13 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1bvy s VAL 48 Cb -0.15 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.46 1bvy s VAL 48 CO 0.09 0.52 -0.12 -0.89 0.00 0.00 0.00 175.10 174.71 1bvy s THR 49 N 0.00 1.01 -0.03 3.92 2.01 -0.70 -4.04 115.64 117.81 1bvy s THR 49 Ca 0.02 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.57 1bvy s THR 49 Cb -0.13 -0.90 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 1bvy s THR 49 CO 0.02 0.31 -0.05 -0.13 -0.69 0.00 0.00 174.62 174.08 1bvy s ARG 50 N 0.28 2.70 -0.27 4.92 0.52 -1.00 -1.25 118.95 124.86 1bvy s ARG 50 Ca -0.06 -0.61 -0.05 0.00 -0.52 0.00 0.00 55.73 54.49 1bvy s ARG 50 Cb -0.11 -2.58 0.01 0.00 0.52 0.00 0.00 34.95 32.78 1bvy s ARG 50 CO 0.02 0.64 0.01 0.71 0.02 0.00 0.00 175.30 176.70 1bvy s TYR 51 N -0.92 3.09 -0.16 -0.53 1.51 0.02 0.17 117.35 120.53 1bvy s TYR 51 Ca 0.15 -1.12 -0.10 0.00 -1.01 0.00 0.00 57.07 54.99 1bvy s TYR 51 Cb -0.11 -2.17 -0.05 0.00 -0.11 0.00 0.00 41.96 39.53 1bvy s TYR 51 CO 0.05 -0.61 0.17 -0.51 -1.11 0.00 0.00 175.55 173.55 1bvy s LEU 52 N 1.45 4.29 0.00 -1.29 1.02 0.11 -2.73 118.68 121.52 1bvy s LEU 52 Ca 0.03 0.39 0.00 0.00 0.02 0.00 0.00 54.13 54.57 1bvy s LEU 52 Cb -0.16 -2.15 0.00 0.00 0.02 0.00 0.00 46.19 43.89 1bvy s LEU 52 CO -0.01 0.25 0.00 -1.54 0.02 0.00 0.00 176.35 175.08 1bvy n SER 53 N 2.93 0.00 -4.88 2.29 3.41 -0.27 -1.93 113.62 115.17 1bvy n SER 53 Ca -0.17 -1.00 -0.30 0.00 -0.26 0.00 0.00 58.87 57.15 1bvy n SER 53 Cb 0.53 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.43 1bvy n SER 53 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1bvy s SER 54 N 0.00 6.11 0.36 4.04 1.04 -1.26 -3.10 113.70 120.89 1bvy s SER 54 Ca 0.00 0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.62 1bvy s SER 54 Cb 0.00 -1.81 0.69 0.00 0.10 0.00 0.00 66.02 65.00 1bvy s SER 54 CO 0.00 0.14 2.02 -0.61 0.98 0.00 0.00 173.24 175.77 1bvy h GLN 55 N 2.92 0.76 -0.51 4.02 -0.00 -1.87 -0.94 115.11 119.49 1bvy h GLN 55 Ca -0.46 -0.05 0.01 0.00 -0.00 0.00 0.00 58.65 58.15 1bvy h GLN 55 Cb 1.17 -0.17 -0.03 0.00 0.00 0.00 0.00 27.48 28.45 1bvy h GLN 55 CO 0.72 0.51 0.33 -0.09 0.00 0.00 0.00 178.83 180.29 1bvy h ARG 56 N 0.78 0.65 0.10 1.69 2.43 -1.94 -0.62 114.38 117.48 1bvy h ARG 56 Ca 0.21 -0.04 -0.31 0.00 -0.81 0.00 0.00 59.98 59.03 1bvy h ARG 56 Cb -0.09 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.30 1bvy h ARG 56 CO -0.05 0.43 -1.65 -0.07 -1.51 0.00 0.00 179.97 177.13 1bvy h LEU 57 N 0.67 0.32 -1.42 3.80 3.38 -1.90 -3.34 115.31 116.82 1bvy h LEU 57 Ca 0.19 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 1bvy h LEU 57 Cb -0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1bvy h LEU 57 CO -0.05 1.45 -0.17 0.40 0.09 0.00 0.00 178.44 180.16 1bvy h ILE 58 N 0.06 1.18 -0.80 1.22 2.04 -1.15 -0.38 117.51 119.67 1bvy h ILE 58 Ca -0.28 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 64.77 1bvy h ILE 58 Cb 2.02 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 39.35 1bvy h ILE 58 CO 0.13 0.25 0.53 0.50 0.00 0.00 0.00 178.15 179.56 1bvy h LYS 59 N 0.16 1.05 -0.11 2.37 3.64 -1.22 -0.36 116.57 122.10 1bvy h LYS 59 Ca 0.03 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.15 1bvy h LYS 59 Cb 0.40 -0.24 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1bvy h LYS 59 CO 0.03 0.69 -0.72 0.93 -2.27 0.00 0.00 179.45 178.11 1bvy h GLU 60 N 1.08 0.68 0.00 1.90 5.08 -1.33 -3.13 114.58 118.86 1bvy h GLU 60 Ca 0.30 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1bvy h GLU 60 Cb -0.11 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1bvy h GLU 60 CO -0.07 1.20 0.00 0.00 -1.00 0.00 0.00 179.01 179.14 1bvy h ALA 61 N 0.49 1.00 -0.01 3.43 0.00 -0.53 -1.44 119.26 122.20 1bvy h ALA 61 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1bvy h ALA 61 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1bvy h ALA 61 CO 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.38 1bvy s ASP 63 N -2.07 6.09 0.00 0.00 -1.08 -0.55 -4.88 116.67 114.19 1bvy s ASP 63 Ca 0.40 0.30 0.13 0.00 -0.52 0.00 0.00 52.55 52.86 1bvy s ASP 63 Cb 0.21 -2.54 0.64 0.00 -1.46 0.00 0.00 42.92 39.76 1bvy s ASP 63 CO 0.37 -1.74 1.33 -0.62 0.52 0.00 0.00 175.17 175.04 1bvy n GLU 64 N 8.69 0.16 0.04 4.34 1.02 -1.26 -1.08 120.64 132.55 1bvy n GLU 64 Ca 0.13 0.18 0.12 0.00 -0.02 0.00 0.00 57.16 57.57 1bvy n GLU 64 Cb 0.49 -1.50 0.31 0.00 -0.02 0.00 0.00 31.44 30.72 1bvy n GLU 64 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1bvy n SER 65 N -1.31 0.55 -0.06 1.62 3.41 -1.26 -4.23 113.62 112.35 1bvy n SER 65 Ca 0.06 0.17 -0.07 0.00 -0.26 0.00 0.00 58.87 58.77 1bvy n SER 65 Cb 0.11 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 63.89 1bvy n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1bvy n ARG 66 N -1.88 1.64 -4.10 4.33 1.74 -0.24 -4.94 116.66 113.21 1bvy n ARG 66 Ca 0.05 0.02 -0.15 0.00 -0.77 0.00 0.00 57.85 57.00 1bvy n ARG 66 Cb 0.39 -1.27 -0.14 0.00 -1.02 0.00 0.00 32.46 30.42 1bvy n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1bvy s PHE 67 N -2.26 0.39 0.29 -1.55 0.40 -0.41 -1.74 117.98 113.09 1bvy s PHE 67 Ca -0.09 -0.08 0.06 0.00 -0.60 0.00 0.00 56.93 56.21 1bvy s PHE 67 Cb 0.04 -0.25 -0.06 0.00 0.51 0.00 0.00 43.02 43.26 1bvy s PHE 67 CO 0.39 -0.01 -0.02 0.34 0.70 0.00 0.00 175.22 176.62 1bvy s ASP 68 N -0.14 2.67 0.20 1.36 2.15 -1.13 -3.98 116.67 117.81 1bvy s ASP 68 Ca 0.01 -1.24 -0.31 0.00 0.43 0.00 0.00 52.55 51.44 1bvy s ASP 68 Cb -0.02 -0.15 -0.11 0.00 -0.30 0.00 0.00 42.92 42.35 1bvy s ASP 68 CO -0.00 -0.42 1.58 -0.75 -0.17 0.00 0.00 175.17 175.41 1bvy s LYS 69 N -3.77 4.19 0.08 4.34 2.20 -1.26 -1.57 119.74 123.95 1bvy s LYS 69 Ca 0.31 2.42 0.03 0.00 -0.36 0.00 0.00 55.97 58.37 1bvy s LYS 69 Cb 0.05 -3.12 -0.04 0.00 -1.51 0.00 0.00 37.83 33.22 1bvy s LYS 69 CO 0.13 -0.61 0.10 1.21 -0.36 0.00 0.00 175.35 175.82 1bvy s ASN 70 N 0.95 5.64 -0.50 1.43 2.47 0.24 -4.72 114.94 120.45 1bvy s ASN 70 Ca 0.68 0.03 -0.19 0.00 0.42 0.00 0.00 52.86 53.80 1bvy s ASN 70 Cb -0.45 -1.55 0.06 0.00 -1.45 0.00 0.00 41.25 37.86 1bvy s ASN 70 CO 0.35 0.17 0.60 -0.76 -3.72 0.00 0.00 177.10 173.74 1bvy s LEU 71 N -2.42 5.02 1.23 3.21 1.02 -1.26 -4.48 118.68 121.01 1bvy s LEU 71 Ca 0.30 -0.94 -0.17 0.00 0.02 0.00 0.00 54.13 53.34 1bvy s LEU 71 Cb -0.12 -2.42 0.30 0.00 0.02 0.00 0.00 46.19 43.96 1bvy s LEU 71 CO 0.23 -0.86 1.02 -0.94 0.02 0.00 0.00 176.35 175.82 1bvy s SER 72 N 2.64 0.52 0.24 2.29 1.04 -1.26 -4.76 113.70 114.42 1bvy s SER 72 Ca 0.14 1.09 -0.06 0.00 0.48 0.00 0.00 55.95 57.60 1bvy s SER 72 Cb -0.20 -1.64 0.25 0.00 0.10 0.00 0.00 66.02 64.53 1bvy s SER 72 CO 0.12 -4.42 1.86 -0.61 0.98 0.00 0.00 173.24 171.16 1bvy h GLN 73 N -2.78 1.20 -0.37 4.02 5.75 -1.99 -2.15 115.11 118.80 1bvy h GLN 73 Ca -0.53 -0.15 0.07 0.00 -0.15 0.00 0.00 58.65 57.90 1bvy h GLN 73 Cb 1.33 -0.23 -0.07 0.00 1.07 0.00 0.00 27.48 29.58 1bvy h GLN 73 CO 0.42 0.89 -0.10 0.00 -2.65 0.00 0.00 178.83 177.39 1bvy h ALA 74 N 1.29 0.22 0.00 3.38 0.00 -1.93 -0.95 119.26 121.27 1bvy h ALA 74 Ca 0.30 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.29 1bvy h ALA 74 Cb 0.06 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1bvy h ALA 74 CO -0.04 -0.47 -0.30 -0.07 0.00 0.00 0.00 179.25 178.36 1bvy h LEU 75 N -0.02 0.00 -0.53 0.00 3.38 -1.79 0.10 115.31 116.46 1bvy h LEU 75 Ca 0.18 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 1bvy h LEU 75 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1bvy h LEU 75 CO -0.39 0.30 -0.21 0.11 0.09 0.00 0.00 178.44 178.35 1bvy h LYS 76 N 0.00 0.98 -0.29 1.13 1.79 -0.66 0.22 116.57 119.74 1bvy h LYS 76 Ca -0.00 -0.41 -0.18 0.00 -2.18 0.00 0.00 60.65 57.88 1bvy h LYS 76 Cb 0.56 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1bvy h LYS 76 CO 0.04 1.08 -0.51 0.74 -1.08 0.00 0.00 179.45 179.72 1bvy h PHE 77 N 0.85 1.02 -0.23 -1.35 0.04 -0.74 -3.05 116.94 113.48 1bvy h PHE 77 Ca 0.11 -0.35 -0.09 0.00 2.80 0.00 0.00 57.97 60.44 1bvy h PHE 77 Cb 0.78 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.72 1bvy h PHE 77 CO 0.05 1.16 -0.25 0.28 -0.60 0.00 0.00 178.31 178.95 1bvy h VAL 78 N 0.64 1.26 -0.35 -0.55 2.07 -0.57 -2.89 116.25 115.86 1bvy h VAL 78 Ca 0.02 -1.23 0.10 0.00 0.82 0.00 0.00 66.70 66.41 1bvy h VAL 78 Cb 1.10 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1bvy h VAL 78 CO 0.11 0.39 0.38 -0.09 0.02 0.00 0.00 177.57 178.38 1bvy h ARG 79 N 0.38 0.00 0.00 1.57 2.43 -0.45 0.80 114.38 119.10 1bvy h ARG 79 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1bvy h ARG 79 Cb 0.64 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1bvy h ARG 79 CO 0.05 0.00 0.00 -0.44 -1.51 0.00 0.00 179.97 178.07 1bvy h ASP 80 N 0.00 0.00 0.00 -3.80 3.32 -1.55 0.39 116.42 114.78 1bvy h ASP 80 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1bvy h ASP 80 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1bvy h ASP 80 CO -0.00 0.00 -0.11 2.22 -1.72 0.00 0.00 179.24 179.63 1bvy n PHE 81 N -2.98 0.00 0.75 4.55 -1.74 0.12 -4.70 117.46 113.46 1bvy n PHE 81 Ca -0.02 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 56.97 1bvy n PHE 81 Cb 0.10 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.07 1bvy n PHE 81 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1bvy n ALA 82 N -0.72 3.93 -0.63 1.98 0.00 -0.31 -4.95 120.51 119.80 1bvy n ALA 82 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1bvy n ALA 82 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1bvy n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bvy n GLY 83 N 1.43 2.41 2.32 0.00 0.00 0.14 -2.07 105.19 109.42 1bvy n GLY 83 Ca 0.03 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1bvy n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bvy n ASP 84 N 0.15 7.54 -3.46 1.61 5.75 -1.26 -4.53 116.55 122.35 1bvy n ASP 84 Ca 0.00 -3.77 -0.31 0.00 -0.01 0.00 0.00 54.79 50.70 1bvy n ASP 84 Cb 0.00 -0.98 0.28 0.00 -1.03 0.00 0.00 41.12 39.39 1bvy n ASP 84 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1bvy s GLY 85 N -1.79 1.47 0.24 6.12 0.00 -0.88 -4.68 107.32 107.80 1bvy s GLY 85 Ca 0.64 -0.93 -0.05 0.00 0.00 0.00 0.00 44.72 44.38 1bvy s GLY 85 CO -0.01 0.07 1.78 1.41 0.00 0.00 0.00 173.10 176.35 1bvy h LEU 86 N -3.22 0.97 -0.65 0.66 3.38 -1.90 -3.12 115.31 111.44 1bvy h LEU 86 Ca -0.42 -0.18 -0.14 0.00 0.09 0.00 0.00 57.88 57.23 1bvy h LEU 86 Cb 1.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1bvy h LEU 86 CO 0.27 0.91 -0.51 0.15 0.09 0.00 0.00 178.44 179.36 1bvy h PHE 87 N 0.99 0.53 -0.26 1.13 3.57 -1.94 -3.27 116.94 117.69 1bvy h PHE 87 Ca 0.22 -0.18 -0.12 0.00 3.53 0.00 0.00 57.97 61.42 1bvy h PHE 87 Cb 0.30 -0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.87 1bvy h PHE 87 CO 0.02 0.85 -0.15 0.25 -2.23 0.00 0.00 178.31 177.05 1bvy n THR 88 N -3.96 2.43 -4.05 4.41 -2.24 -1.21 -5.00 114.28 104.65 1bvy n THR 88 Ca -0.02 -2.75 -0.27 0.00 -2.27 0.00 0.00 64.05 58.74 1bvy n THR 88 Cb 0.57 -0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 68.45 1bvy n THR 88 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1bvy s SER 89 N -2.64 5.66 0.42 3.42 0.01 -1.18 -4.77 113.70 114.61 1bvy s SER 89 Ca 0.42 -0.05 -0.22 0.00 1.31 0.00 0.00 55.95 57.41 1bvy s SER 89 Cb 0.39 -1.53 -0.10 0.00 0.21 0.00 0.00 66.02 64.99 1bvy s SER 89 CO -0.01 0.09 0.98 0.26 0.41 0.00 0.00 173.24 174.98 1bvy s TRP 90 N -1.66 3.31 0.39 2.43 0.52 -1.26 -4.96 118.94 117.71 1bvy s TRP 90 Ca 0.31 1.64 0.10 0.00 0.02 0.00 0.00 56.10 58.17 1bvy s TRP 90 Cb -0.11 -2.94 0.88 0.00 -1.15 0.00 0.00 33.47 30.15 1bvy s TRP 90 CO 0.24 -0.26 1.96 1.15 0.02 0.00 0.00 176.95 180.05 1bvy h THR 91 N 2.01 0.94 0.00 2.01 2.02 -1.97 -1.19 112.91 116.73 1bvy h THR 91 Ca -0.49 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.49 1bvy h THR 91 Cb 1.19 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1bvy h THR 91 CO 0.61 0.11 0.00 0.00 0.37 0.00 0.00 175.52 176.61 1bvy n HIS 92 N -4.48 0.61 -2.31 3.16 1.44 -1.26 -4.53 115.22 107.85 1bvy n HIS 92 Ca 0.11 0.21 -0.39 0.00 -2.01 0.00 0.00 57.72 55.64 1bvy n HIS 92 Cb 0.32 -0.84 -0.02 0.00 0.12 0.00 0.00 29.99 29.56 1bvy n HIS 92 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1bvy s GLU 93 N -3.16 4.18 0.17 -1.40 2.02 -0.45 -4.91 118.70 115.14 1bvy s GLU 93 Ca 0.08 1.87 -0.16 0.00 0.02 0.00 0.00 54.97 56.77 1bvy s GLU 93 Cb 0.11 -2.79 0.11 0.00 0.10 0.00 0.00 34.13 31.67 1bvy s GLU 93 CO 0.45 -0.22 1.68 -0.22 0.02 0.00 0.00 175.26 176.97 1bvy h LYS 94 N 2.89 0.06 0.00 1.61 3.64 -1.89 -1.92 116.57 120.96 1bvy h LYS 94 Ca -0.48 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1bvy h LYS 94 Cb 1.23 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1bvy h LYS 94 CO 0.63 0.04 0.00 -0.91 -2.27 0.00 0.00 179.45 176.94 1bvy h ASN 95 N 0.06 0.00 0.52 4.20 2.35 -1.91 -3.09 115.58 117.71 1bvy h ASN 95 Ca 0.20 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.93 1bvy h ASN 95 Cb 0.30 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.68 1bvy h ASN 95 CO -0.38 0.00 -0.25 -0.25 -1.65 0.00 0.00 177.43 174.90 1bvy h TRP 96 N 0.00 -0.64 -0.54 1.19 7.01 -1.61 -2.30 115.95 119.05 1bvy h TRP 96 Ca 0.00 -0.02 -0.05 0.00 2.11 0.00 0.00 58.89 60.93 1bvy h TRP 96 Cb 0.31 0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.56 1bvy h TRP 96 CO 0.00 -0.40 0.12 -0.22 -2.79 0.00 0.00 178.44 175.15 1bvy h LYS 97 N -1.05 0.84 0.17 2.65 3.64 -1.60 0.24 116.57 121.46 1bvy h LYS 97 Ca -0.07 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1bvy h LYS 97 Cb 0.53 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1bvy h LYS 97 CO 0.12 0.77 -0.11 -0.22 -2.27 0.00 0.00 179.45 177.73 1bvy h LYS 98 N 0.81 -0.27 -0.61 1.90 3.64 -1.66 -0.82 116.57 119.56 1bvy h LYS 98 Ca 0.18 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.50 1bvy h LYS 98 Cb 0.31 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1bvy h LYS 98 CO 0.00 -0.18 0.08 0.00 -2.27 0.00 0.00 179.45 177.08 1bvy h ALA 99 N 0.54 0.99 -0.55 5.00 0.00 -1.09 -2.09 119.26 122.06 1bvy h ALA 99 Ca -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1bvy h ALA 99 Cb 0.24 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1bvy h ALA 99 CO 0.01 0.63 0.34 1.25 0.00 0.00 0.00 179.25 181.48 1bvy h HIS 100 N 0.94 0.63 0.00 0.00 -0.00 -0.63 -0.16 115.15 115.92 1bvy h HIS 100 Ca 0.19 0.02 -0.17 0.00 -0.00 0.00 0.00 60.37 60.40 1bvy h HIS 100 Cb 0.44 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.62 1bvy h HIS 100 CO 0.03 0.36 -0.83 -0.91 -0.00 0.00 0.00 177.93 176.58 1bvy h ASN 101 N 0.67 0.00 0.25 3.26 2.35 -1.07 -2.02 115.58 119.02 1bvy h ASN 101 Ca 0.22 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.79 1bvy h ASN 101 Cb 0.01 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1bvy h ASN 101 CO -0.09 0.83 -0.69 0.40 -1.65 0.00 0.00 177.43 176.23 1bvy h ILE 102 N 0.00 1.37 0.00 2.81 2.04 -1.10 -3.34 117.51 119.29 1bvy h ILE 102 Ca -0.01 -2.08 0.00 0.00 1.00 0.00 0.00 64.86 63.77 1bvy h ILE 102 Cb 1.51 2.06 0.00 0.00 -0.74 0.00 0.00 36.82 39.65 1bvy h ILE 102 CO 0.11 0.63 -1.41 0.18 0.00 0.00 0.00 178.15 177.65 1bvy n LEU 103 N -3.86 0.55 -0.12 1.44 4.77 -0.10 -4.41 117.00 115.27 1bvy n LEU 103 Ca -0.04 -0.24 -0.04 0.00 -0.03 0.00 0.00 56.01 55.66 1bvy n LEU 103 Cb 0.68 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.79 1bvy n LEU 103 CO 0.47 0.12 0.82 0.25 -1.33 0.00 0.00 177.39 177.73 1bvy h LEU 104 N 0.00 -0.28 -1.69 2.23 5.85 -1.48 -1.13 115.31 118.81 1bvy h LEU 104 Ca 0.00 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1bvy h LEU 104 Cb 0.73 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1bvy h LEU 104 CO 0.00 -0.09 0.24 -0.65 -0.34 0.00 0.00 178.44 177.60 1bvy h PRO 105 N 0.05 0.40 0.00 5.25 0.11 -1.79 -1.94 132.00 134.08 1bvy h PRO 105 Ca 0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1bvy h PRO 105 Cb 0.30 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1bvy h PRO 105 CO -0.38 0.27 0.00 0.43 -0.21 0.00 0.00 178.00 178.11 1bvy n SER 106 N -4.48 0.00 0.00 -2.05 7.64 -0.43 -2.96 113.62 111.33 1bvy n SER 106 Ca 0.03 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.17 1bvy n SER 106 Cb 0.13 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1bvy n SER 106 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1bvy n PHE 107 N -1.36 0.00 -1.30 1.43 3.72 -0.73 -4.85 117.46 114.37 1bvy n PHE 107 Ca 0.05 -0.24 -0.29 0.00 -0.05 0.00 0.00 57.45 56.91 1bvy n PHE 107 Cb 0.11 -0.02 0.14 0.00 -0.94 0.00 0.00 39.48 38.77 1bvy n PHE 107 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1bvy s SER 108 N -0.48 3.35 0.26 4.37 1.04 -1.16 -4.54 113.70 116.55 1bvy s SER 108 Ca 0.00 1.28 -0.03 0.00 0.48 0.00 0.00 55.95 57.68 1bvy s SER 108 Cb 0.00 -1.95 0.38 0.00 0.10 0.00 0.00 66.02 64.55 1bvy s SER 108 CO 0.00 -2.69 1.90 -0.61 0.98 0.00 0.00 173.24 172.82 1bvy h GLN 109 N -1.59 1.19 -0.62 4.02 5.75 -1.95 -1.84 115.11 120.06 1bvy h GLN 109 Ca -0.51 -0.07 0.08 0.00 -0.15 0.00 0.00 58.65 58.00 1bvy h GLN 109 Cb 1.30 -0.27 -0.06 0.00 1.07 0.00 0.00 27.48 29.52 1bvy h GLN 109 CO 0.57 0.79 0.30 1.96 -2.65 0.00 0.00 178.83 179.80 1bvy h GLN 110 N 1.22 0.52 0.00 1.69 7.50 -1.93 -0.93 115.11 123.18 1bvy h GLN 110 Ca 0.41 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.53 1bvy h GLN 110 Cb 0.08 -0.12 0.00 0.00 0.05 0.00 0.00 27.48 27.49 1bvy h GLN 110 CO -0.15 0.34 0.00 0.00 -1.50 0.00 0.00 178.83 177.53 1bvy n ALA 111 N -2.40 1.36 0.20 3.87 0.00 -0.70 -2.50 120.51 120.34 1bvy n ALA 111 Ca 0.08 0.13 0.04 0.00 0.00 0.00 0.00 53.44 53.70 1bvy n ALA 111 Cb 0.22 -1.34 0.42 0.00 0.00 0.00 0.00 19.45 18.75 1bvy n ALA 111 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1bvy h MET 112 N 0.00 0.00 -0.99 0.00 2.86 -1.05 -2.65 114.93 113.10 1bvy h MET 112 Ca 0.00 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.71 1bvy h MET 112 Cb 0.19 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.78 1bvy h MET 112 CO 0.00 0.32 0.64 0.87 1.06 0.00 0.00 176.91 179.80 1bvy h LYS 113 N 0.00 1.11 0.00 1.72 6.56 -1.63 -1.72 116.57 122.61 1bvy h LYS 113 Ca -0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1bvy h LYS 113 Cb 0.61 -0.25 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 1bvy h LYS 113 CO 0.04 0.73 0.00 0.41 -2.06 0.00 0.00 179.45 178.57 1bvy n GLY 114 N -1.36 -1.40 0.02 3.86 0.00 -1.00 -3.26 105.19 102.04 1bvy n GLY 114 Ca 0.16 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1bvy n GLY 114 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1bvy n TYR 115 N -1.69 0.00 -0.27 1.61 4.01 -0.79 -4.67 117.16 115.37 1bvy n TYR 115 Ca 0.06 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.87 1bvy n TYR 115 Cb 0.31 -0.52 0.21 0.00 -0.31 0.00 0.00 39.34 39.03 1bvy n TYR 115 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1bvy h HIS 116 N 0.00 0.46 -0.44 -0.72 2.76 -1.32 -0.95 115.15 114.94 1bvy h HIS 116 Ca -0.05 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.12 1bvy h HIS 116 Cb 1.07 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.93 1bvy h HIS 116 CO 0.00 -0.01 0.12 0.00 -1.30 0.00 0.00 177.93 176.74 1bvy h ALA 117 N 1.61 0.57 0.00 5.26 0.00 -1.83 0.11 119.26 124.98 1bvy h ALA 117 Ca 0.45 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1bvy h ALA 117 Cb 0.75 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1bvy h ALA 117 CO -0.47 0.24 -0.02 0.52 0.00 0.00 0.00 179.25 179.52 1bvy h MET 118 N 0.57 0.00 -0.28 0.00 2.07 -1.75 -1.01 114.93 114.52 1bvy h MET 118 Ca 0.14 0.00 -0.12 0.00 -2.07 0.00 0.00 59.70 57.65 1bvy h MET 118 Cb 0.29 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.02 1bvy h MET 118 CO -0.00 0.02 -0.28 0.52 1.07 0.00 0.00 176.91 178.23 1bvy h MET 119 N 0.00 0.69 -0.17 1.72 2.86 -0.14 -2.58 114.93 117.31 1bvy h MET 119 Ca -0.00 -0.36 -0.05 0.00 -2.06 0.00 0.00 59.70 57.22 1bvy h MET 119 Cb 0.74 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1bvy h MET 119 CO 0.00 0.98 -0.13 0.28 1.06 0.00 0.00 176.91 179.10 1bvy h VAL 120 N 0.43 1.18 -0.61 -2.22 2.07 -0.43 -1.11 116.25 115.56 1bvy h VAL 120 Ca 0.04 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 1bvy h VAL 120 Cb 0.85 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 1bvy h VAL 120 CO 0.07 0.25 0.38 -0.78 0.02 0.00 0.00 177.57 177.51 1bvy h ASP 121 N 0.25 0.73 0.77 0.57 1.82 -0.81 -0.15 116.42 119.59 1bvy h ASP 121 Ca 0.05 -0.05 -0.24 0.00 -0.39 0.00 0.00 57.03 56.40 1bvy h ASP 121 Cb 0.38 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.20 1bvy h ASP 121 CO 0.02 0.56 -1.12 0.40 -1.61 0.00 0.00 179.24 177.49 1bvy h ILE 122 N 0.83 1.58 -0.35 2.25 1.08 -1.21 -3.18 117.51 118.52 1bvy h ILE 122 Ca 0.22 -3.16 -0.01 0.00 -0.39 0.00 0.00 64.86 61.52 1bvy h ILE 122 Cb -0.04 2.87 -0.02 0.00 -3.07 0.00 0.00 36.82 36.56 1bvy h ILE 122 CO -0.04 0.92 0.16 0.00 -0.69 0.00 0.00 178.15 178.50 1bvy h ALA 123 N 0.77 1.64 -0.53 1.87 0.00 -0.82 -1.25 119.26 120.94 1bvy h ALA 123 Ca -0.08 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1bvy h ALA 123 Cb 1.86 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.48 1bvy h ALA 123 CO 0.17 0.29 -0.05 0.28 0.00 0.00 0.00 179.25 179.94 1bvy h VAL 124 N 0.48 1.26 -0.51 0.00 2.07 -1.07 -1.92 116.25 116.55 1bvy h VAL 124 Ca 0.12 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.42 1bvy h VAL 124 Cb 0.06 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1bvy h VAL 124 CO -0.02 0.41 0.06 1.56 0.02 0.00 0.00 177.57 179.60 1bvy h GLN 125 N 0.85 0.82 0.73 1.57 4.20 -1.23 0.13 115.11 122.18 1bvy h GLN 125 Ca 0.15 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1bvy h GLN 125 Cb 0.57 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.25 1bvy h GLN 125 CO 0.03 0.79 -0.35 1.25 -0.67 0.00 0.00 178.83 179.88 1bvy h LEU 126 N 0.78 -0.83 -0.88 1.46 7.12 -1.18 -0.82 115.31 120.96 1bvy h LEU 126 Ca 0.16 0.01 0.05 0.00 0.13 0.00 0.00 57.88 58.23 1bvy h LEU 126 Cb 0.38 0.22 -0.06 0.00 -0.53 0.00 0.00 40.66 40.67 1bvy h LEU 126 CO 0.01 -0.55 0.55 0.58 -0.13 0.00 0.00 178.44 178.90 1bvy h VAL 127 N -1.05 1.09 -0.11 1.05 2.07 -1.16 -1.63 116.25 116.50 1bvy h VAL 127 Ca -0.10 -0.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 1bvy h VAL 127 Cb 0.77 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1bvy h VAL 127 CO 0.17 0.19 -0.29 1.56 0.02 0.00 0.00 177.57 179.22 1bvy h GLN 128 N 1.04 0.20 -0.54 1.57 4.20 -0.67 -0.55 115.11 120.36 1bvy h GLN 128 Ca 0.37 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.99 1bvy h GLN 128 Cb 0.10 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1bvy h GLN 128 CO -0.15 0.48 0.28 -0.22 -0.67 0.00 0.00 178.83 178.55 1bvy h LYS 129 N 0.18 0.77 -0.30 1.46 3.64 -0.18 -2.55 116.57 119.58 1bvy h LYS 129 Ca 0.03 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.16 1bvy h LYS 129 Cb 0.61 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1bvy h LYS 129 CO 0.04 0.62 -0.41 -1.49 -2.27 0.00 0.00 179.45 175.94 1bvy h TRP 130 N 0.73 0.88 -0.52 1.91 4.06 -1.13 -2.46 115.95 119.42 1bvy h TRP 130 Ca 0.19 -0.26 0.11 0.00 2.06 0.00 0.00 58.89 60.98 1bvy h TRP 130 Cb 0.09 -0.18 -0.03 0.00 -1.00 0.00 0.00 29.16 28.04 1bvy h TRP 130 CO -0.01 1.02 0.36 0.93 -3.56 0.00 0.00 178.44 177.18 1bvy h GLU 131 N 0.60 0.24 -0.67 0.49 4.39 -1.00 -2.73 114.58 115.91 1bvy h GLU 131 Ca 0.05 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1bvy h GLU 131 Cb 0.96 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 1bvy h GLU 131 CO 0.09 0.16 0.00 0.54 -1.16 0.00 0.00 179.01 178.64 1bvy n ARG 132 N -4.45 2.78 -2.75 2.33 1.74 -0.94 -4.93 116.66 110.42 1bvy n ARG 132 Ca 0.09 -2.47 -0.35 0.00 -0.77 0.00 0.00 57.85 54.35 1bvy n ARG 132 Cb 0.42 -1.60 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 1bvy n ARG 132 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1bvy s LEU 133 N -1.17 4.14 0.59 0.55 1.43 -1.03 -5.04 118.68 118.14 1bvy s LEU 133 Ca 0.45 1.81 -0.16 0.00 -1.03 0.00 0.00 54.13 55.20 1bvy s LEU 133 Cb 0.25 -4.27 -0.04 0.00 0.03 0.00 0.00 46.19 42.17 1bvy s LEU 133 CO 0.29 -0.27 1.06 0.20 0.23 0.00 0.00 176.35 177.86 1bvy s ASN 134 N -1.85 5.78 0.61 2.29 0.01 -1.26 -4.93 114.94 115.59 1bvy s ASN 134 Ca 0.57 1.85 0.35 0.00 -0.71 0.00 0.00 52.86 54.91 1bvy s ASN 134 Cb -0.15 -2.54 1.97 0.00 0.41 0.00 0.00 41.25 40.94 1bvy s ASN 134 CO 0.20 -1.17 2.26 0.00 -1.51 0.00 0.00 177.10 176.88 1bvy h ALA 135 N 0.51 1.28 -0.00 0.60 0.00 -1.98 -1.38 119.26 118.28 1bvy h ALA 135 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1bvy h ALA 135 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1bvy h ALA 135 CO 0.57 0.02 -0.03 -0.40 0.00 0.00 0.00 179.25 179.41 1bvy n ASP 136 N -3.52 0.34 -4.87 0.00 5.75 -1.26 -4.91 116.55 108.07 1bvy n ASP 136 Ca -0.03 -0.79 -0.21 0.00 -0.01 0.00 0.00 54.79 53.75 1bvy n ASP 136 Cb 0.11 -0.07 0.09 0.00 -1.03 0.00 0.00 41.12 40.21 1bvy n ASP 136 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1bvy s GLU 137 N -2.24 1.99 0.21 0.11 2.02 -0.52 -5.13 118.70 115.13 1bvy s GLU 137 Ca 0.38 -1.45 -0.05 0.00 0.02 0.00 0.00 54.97 53.87 1bvy s GLU 137 Cb 0.21 -2.51 -0.03 0.00 0.10 0.00 0.00 34.13 31.90 1bvy s GLU 137 CO 0.41 -1.15 0.23 -3.38 0.02 0.00 0.00 175.26 171.38 1bvy s HIS 138 N -2.89 0.90 -0.17 1.61 -3.43 -1.26 -4.88 115.29 105.17 1bvy s HIS 138 Ca 0.64 -1.17 -0.05 0.00 -0.80 0.00 0.00 55.06 53.69 1bvy s HIS 138 Cb -0.05 -0.33 -0.03 0.00 -1.43 0.00 0.00 32.58 30.73 1bvy s HIS 138 CO 0.42 -0.73 -0.01 0.42 -2.00 0.00 0.00 174.74 172.84 1bvy s ILE 139 N -4.11 4.16 -0.64 -5.38 1.01 0.14 -4.98 121.20 111.40 1bvy s ILE 139 Ca 0.33 -0.26 -0.22 0.00 0.00 0.00 0.00 60.65 60.50 1bvy s ILE 139 Cb 0.05 -2.84 0.07 0.00 0.01 0.00 0.00 42.46 39.75 1bvy s ILE 139 CO 0.10 0.48 0.93 -1.61 0.00 0.00 0.00 174.94 174.84 1bvy s GLU 140 N 0.42 3.11 -0.01 2.79 2.02 -1.26 -1.72 118.70 124.05 1bvy s GLU 140 Ca -0.02 -0.86 -0.21 0.00 0.02 0.00 0.00 54.97 53.91 1bvy s GLU 140 Cb -0.14 -4.22 -0.12 0.00 0.10 0.00 0.00 34.13 29.75 1bvy s GLU 140 CO 0.02 -1.76 0.88 0.28 0.02 0.00 0.00 175.26 174.70 1bvy h VAL 141 N 5.97 0.06 0.00 2.63 2.07 -1.78 -0.94 116.25 124.26 1bvy h VAL 141 Ca -0.29 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 1bvy h VAL 141 Cb 1.07 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1bvy h VAL 141 CO 1.17 0.01 -0.07 -0.65 0.02 0.00 0.00 177.57 178.04 1bvy h PRO 142 N -1.17 0.00 0.23 1.57 0.11 -1.88 -0.62 132.00 130.24 1bvy h PRO 142 Ca -0.07 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1bvy h PRO 142 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1bvy h PRO 142 CO 0.12 0.07 -0.11 0.93 -0.21 0.00 0.00 178.00 178.81 1bvy h GLU 143 N 0.00 -0.29 -0.65 1.05 3.07 -1.89 -1.07 114.58 114.80 1bvy h GLU 143 Ca -0.00 0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.84 1bvy h GLU 143 Cb 0.15 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 1bvy h GLU 143 CO 0.01 0.02 0.24 -0.44 -1.40 0.00 0.00 179.01 177.43 1bvy h ASP 144 N -0.61 0.92 0.25 1.42 3.32 -0.80 -2.47 116.42 118.44 1bvy h ASP 144 Ca -0.03 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.79 1bvy h ASP 144 Cb 0.44 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1bvy h ASP 144 CO 0.05 0.86 -0.18 0.24 -1.72 0.00 0.00 179.24 178.48 1bvy h MET 145 N 0.92 0.00 0.01 3.56 2.86 -1.05 -1.64 114.93 119.60 1bvy h MET 145 Ca 0.21 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.61 1bvy h MET 145 Cb 0.24 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.91 1bvy h MET 145 CO -0.01 0.18 -0.99 1.15 1.06 0.00 0.00 176.91 178.30 1bvy h THR 146 N 0.00 1.38 -0.38 2.22 2.02 -0.84 -1.29 112.91 116.01 1bvy h THR 146 Ca -0.00 -2.44 0.07 0.00 0.77 0.00 0.00 66.41 64.80 1bvy h THR 146 Cb 0.36 2.45 -0.06 0.00 -1.74 0.00 0.00 68.15 69.15 1bvy h THR 146 CO 0.02 0.73 0.01 0.03 0.37 0.00 0.00 175.52 176.69 1bvy h ARG 147 N 0.25 0.11 -0.22 6.66 3.08 -1.00 -0.72 114.38 122.55 1bvy h ARG 147 Ca -0.10 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1bvy h ARG 147 Cb 1.63 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.65 1bvy h ARG 147 CO 0.18 0.07 0.02 1.25 -1.07 0.00 0.00 179.97 180.42 1bvy h LEU 148 N 0.11 0.36 -0.47 3.04 6.46 -1.26 -2.25 115.31 121.30 1bvy h LEU 148 Ca 0.18 -0.29 -0.17 0.00 -0.12 0.00 0.00 57.88 57.49 1bvy h LEU 148 Cb 0.25 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 1bvy h LEU 148 CO -0.30 0.56 -0.64 0.71 -0.62 0.00 0.00 178.44 178.14 1bvy h THR 149 N 0.15 1.35 -0.17 1.05 1.35 -1.14 -1.24 112.91 114.26 1bvy h THR 149 Ca 0.06 -1.97 -0.01 0.00 -0.55 0.00 0.00 66.41 63.95 1bvy h THR 149 Cb 0.36 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.72 1bvy h THR 149 CO 0.01 0.60 0.08 -0.07 -0.25 0.00 0.00 175.52 175.88 1bvy h LEU 150 N 0.34 0.23 -1.05 3.87 3.38 -1.13 -1.73 115.31 119.22 1bvy h LEU 150 Ca -0.01 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 1bvy h LEU 150 Cb 1.20 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1bvy h LEU 150 CO 0.11 0.31 -0.36 0.44 0.09 0.00 0.00 178.44 179.03 1bvy h ASP 151 N 0.14 0.22 -0.57 -0.43 5.19 -1.36 -2.12 116.42 117.48 1bvy h ASP 151 Ca 0.06 -0.08 -0.07 0.00 -0.62 0.00 0.00 57.03 56.32 1bvy h ASP 151 Cb 0.14 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.57 1bvy h ASP 151 CO -0.01 0.57 0.09 0.74 -3.12 0.00 0.00 179.24 177.51 1bvy h THR 152 N 0.18 1.26 -0.20 0.35 2.02 -1.08 -1.29 112.91 114.15 1bvy h THR 152 Ca 0.02 -0.99 -0.18 0.00 0.77 0.00 0.00 66.41 66.03 1bvy h THR 152 Cb 0.73 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1bvy h THR 152 CO 0.05 0.36 -0.61 0.40 0.37 0.00 0.00 175.52 176.10 1bvy h ILE 153 N 0.85 1.30 -0.18 3.11 2.04 -1.01 -1.27 117.51 122.36 1bvy h ILE 153 Ca 0.17 -1.84 0.02 0.00 1.00 0.00 0.00 64.86 64.21 1bvy h ILE 153 Cb 0.43 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 1bvy h ILE 153 CO 0.01 0.58 0.06 1.23 0.00 0.00 0.00 178.15 180.03 1bvy h GLY 154 N 0.88 0.21 0.36 5.37 0.00 -1.32 0.54 103.07 109.12 1bvy h GLY 154 Ca -0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1bvy h GLY 154 CO 0.12 0.03 -0.03 -2.00 0.00 0.00 0.00 176.54 174.66 1bvy h LEU 155 N 0.15 -0.08 -1.25 3.11 5.85 -0.93 -1.74 115.31 120.42 1bvy h LEU 155 Ca 0.08 -0.52 -0.06 0.00 0.84 0.00 0.00 57.88 58.22 1bvy h LEU 155 Cb 0.05 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1bvy h LEU 155 CO -0.08 0.53 -0.09 0.00 -0.34 0.00 0.00 178.44 178.46 1bvy h GLY 157 N 0.84 -0.24 -3.32 0.00 0.00 0.05 -3.36 103.07 97.03 1bvy h GLY 157 Ca 0.08 0.09 -0.19 0.00 0.00 0.00 0.00 47.33 47.31 1bvy h GLY 157 CO 0.02 -0.09 -1.01 1.97 0.00 0.00 0.00 176.54 177.43 1bvy n PHE 158 N -4.92 0.16 -3.94 5.60 -1.74 -0.85 -1.56 117.46 110.22 1bvy n PHE 158 Ca -0.06 -0.74 -0.29 0.00 -0.56 0.00 0.00 57.45 55.79 1bvy n PHE 158 Cb 0.21 -0.12 0.01 0.00 1.52 0.00 0.00 39.48 41.10 1bvy n PHE 158 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1bvy n ASN 159 N 0.31 -3.40 -4.23 5.98 4.05 -0.62 -4.95 115.26 112.39 1bvy n ASN 159 Ca 0.05 -0.86 -0.31 0.00 0.45 0.00 0.00 54.58 53.91 1bvy n ASN 159 Cb 1.08 -3.60 -0.17 0.00 1.23 0.00 0.00 39.78 38.32 1bvy n ASN 159 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1bvy s TYR 160 N -3.44 2.45 -0.43 1.20 5.04 -0.71 -4.93 117.35 116.53 1bvy s TYR 160 Ca 0.49 -0.87 -0.14 0.00 -2.44 0.00 0.00 57.07 54.12 1bvy s TYR 160 Cb -0.25 -1.62 0.05 0.00 0.35 0.00 0.00 41.96 40.48 1bvy s TYR 160 CO 0.85 -0.32 0.31 1.03 -1.34 0.00 0.00 175.55 176.09 1bvy s ARG 161 N 0.11 2.90 0.39 4.97 0.52 -1.26 -2.52 118.95 124.05 1bvy s ARG 161 Ca -0.11 -1.20 0.19 0.00 -0.52 0.00 0.00 55.73 54.08 1bvy s ARG 161 Cb -0.16 -3.96 0.76 0.00 0.52 0.00 0.00 34.95 32.11 1bvy s ARG 161 CO 0.06 -0.86 1.78 0.74 0.02 0.00 0.00 175.30 177.04 1bvy h PHE 162 N 8.61 0.00 -6.33 -0.53 0.04 -1.94 -3.47 116.94 113.32 1bvy h PHE 162 Ca -0.27 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.03 1bvy h PHE 162 Cb 1.11 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.22 1bvy h PHE 162 CO 0.59 0.36 -0.80 0.09 -0.60 0.00 0.00 178.31 177.95 1bvy n ASN 163 N -3.63 -3.28 0.03 2.17 3.02 -1.26 -4.64 115.26 107.68 1bvy n ASN 163 Ca -0.01 -0.84 0.19 0.00 -0.03 0.00 0.00 54.58 53.89 1bvy n ASN 163 Cb 0.47 -3.69 0.70 0.00 -0.61 0.00 0.00 39.78 36.64 1bvy n ASN 163 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1bvy h SER 164 N -1.94 0.00 -0.05 6.41 0.02 -1.91 -1.65 113.55 114.42 1bvy h SER 164 Ca -0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1bvy h SER 164 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 1bvy h SER 164 CO 0.66 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.84 1bvy n PHE 165 N -4.32 0.07 -0.29 3.45 3.72 -1.26 -2.82 117.46 116.00 1bvy n PHE 165 Ca 0.08 -0.03 0.11 0.00 -0.05 0.00 0.00 57.45 57.56 1bvy n PHE 165 Cb 0.56 0.00 0.30 0.00 -0.94 0.00 0.00 39.48 39.40 1bvy n PHE 165 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1bvy n TYR 166 N -0.28 0.89 -4.00 1.38 4.01 -0.62 -5.01 117.16 113.53 1bvy n TYR 166 Ca 0.18 -0.47 -0.09 0.00 -0.16 0.00 0.00 57.90 57.35 1bvy n TYR 166 Cb 0.22 -0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.14 1bvy n TYR 166 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1bvy s ARG 167 N -1.05 0.37 -0.13 -0.72 0.52 -1.13 -5.02 118.95 111.79 1bvy s ARG 167 Ca 0.46 -0.70 -0.12 0.00 -0.52 0.00 0.00 55.73 54.85 1bvy s ARG 167 Cb 0.24 0.09 -0.10 0.00 0.52 0.00 0.00 34.95 35.70 1bvy s ARG 167 CO 0.32 -0.05 0.18 -0.44 0.02 0.00 0.00 175.30 175.33 1bvy h ASP 168 N 4.46 0.00 -3.45 0.23 3.32 -1.95 -3.46 116.42 115.57 1bvy h ASP 168 Ca -0.33 -0.32 -0.60 0.00 0.02 0.00 0.00 57.03 55.81 1bvy h ASP 168 Cb 1.20 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.64 1bvy h ASP 168 CO 0.44 0.82 -0.16 -1.10 -1.72 0.00 0.00 179.24 177.53 1bvy s GLN 169 N -1.98 4.20 1.01 3.56 1.11 -1.26 -5.05 119.66 121.24 1bvy s GLN 169 Ca -0.12 0.28 -0.11 0.00 0.01 0.00 0.00 55.36 55.42 1bvy s GLN 169 Cb 0.01 -3.53 0.19 0.00 -1.01 0.00 0.00 33.01 28.67 1bvy s GLN 169 CO 0.30 -0.03 1.06 -2.30 0.01 0.00 0.00 175.29 174.33 1bvy n PRO 170 N 4.43 -1.12 -1.60 2.91 -0.02 -1.26 -4.89 135.00 133.44 1bvy n PRO 170 Ca -0.07 -0.27 -0.46 0.00 -2.02 0.00 0.00 63.50 60.67 1bvy n PRO 170 Cb 0.51 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1bvy n PRO 170 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1bvy n HIS 171 N -4.48 1.47 -0.33 6.00 -0.00 -1.26 -4.63 115.22 111.99 1bvy n HIS 171 Ca 0.09 0.64 0.26 0.00 -0.00 0.00 0.00 57.72 58.72 1bvy n HIS 171 Cb 0.53 -2.30 0.51 0.00 -0.00 0.00 0.00 29.99 28.72 1bvy n HIS 171 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1bvy h PRO 172 N 2.90 0.15 -0.18 1.57 0.11 -1.98 0.45 132.00 135.02 1bvy h PRO 172 Ca -0.42 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.72 1bvy h PRO 172 Cb 1.33 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.36 1bvy h PRO 172 CO 0.67 0.10 -0.08 0.35 -0.21 0.00 0.00 178.00 178.82 1bvy h PHE 173 N 0.15 -0.19 -0.53 0.65 3.04 -1.92 -2.11 116.94 116.03 1bvy h PHE 173 Ca 0.77 0.02 -0.12 0.00 3.98 0.00 0.00 57.97 62.62 1bvy h PHE 173 Cb 1.88 0.12 -0.02 0.00 2.56 0.00 0.00 35.95 40.49 1bvy h PHE 173 CO -0.05 -0.13 -0.12 0.82 -2.02 0.00 0.00 178.31 176.81 1bvy h ILE 174 N -0.06 1.27 -0.34 1.41 2.04 -0.48 0.14 117.51 121.49 1bvy h ILE 174 Ca 0.10 -1.28 0.05 0.00 1.00 0.00 0.00 64.86 64.73 1bvy h ILE 174 Cb 0.21 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 1bvy h ILE 174 CO -0.22 0.45 0.04 0.74 0.00 0.00 0.00 178.15 179.16 1bvy h THR 175 N 0.88 0.80 -0.22 -0.27 2.02 -1.11 0.01 112.91 115.03 1bvy h THR 175 Ca 0.13 -0.05 -0.06 0.00 0.77 0.00 0.00 66.41 67.20 1bvy h THR 175 Cb 0.69 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1bvy h THR 175 CO 0.05 0.03 -0.09 0.28 0.37 0.00 0.00 175.52 176.16 1bvy h SER 176 N 0.15 0.46 -0.16 4.18 0.02 -0.91 0.07 113.55 117.36 1bvy h SER 176 Ca 0.16 -0.40 0.04 0.00 -0.84 0.00 0.00 61.79 60.76 1bvy h SER 176 Cb 0.20 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 1bvy h SER 176 CO -0.23 0.75 -0.12 -0.03 -1.14 0.00 0.00 176.83 176.06 1bvy h MET 177 N 0.16 -0.12 -0.40 3.45 -1.53 -0.53 0.77 114.93 116.72 1bvy h MET 177 Ca 0.05 0.01 -0.02 0.00 -3.44 0.00 0.00 59.70 56.30 1bvy h MET 177 Cb 0.57 0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.63 1bvy h MET 177 CO 0.03 -0.08 0.18 0.28 0.14 0.00 0.00 176.91 177.46 1bvy h VAL 178 N -0.12 1.18 -0.57 -5.77 2.07 -0.90 -0.48 116.25 111.66 1bvy h VAL 178 Ca 0.10 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 1bvy h VAL 178 Cb 0.27 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1bvy h VAL 178 CO -0.24 0.20 0.25 -0.09 0.02 0.00 0.00 177.57 177.71 1bvy h ARG 179 N 0.51 0.84 -0.50 1.57 2.43 -0.62 -0.18 114.38 118.43 1bvy h ARG 179 Ca 0.14 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1bvy h ARG 179 Cb 0.15 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1bvy h ARG 179 CO -0.01 0.71 0.03 0.00 -1.51 0.00 0.00 179.97 179.18 1bvy h ALA 180 N 1.09 1.12 -0.48 2.80 0.00 0.97 -1.52 119.26 123.24 1bvy h ALA 180 Ca 0.19 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1bvy h ALA 180 Cb 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1bvy h ALA 180 CO -0.02 0.57 -0.20 1.25 0.00 0.00 0.00 179.25 180.85 1bvy h LEU 181 N 0.77 0.98 -0.77 0.00 5.85 -0.71 -1.41 115.31 120.02 1bvy h LEU 181 Ca 0.15 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.53 1bvy h LEU 181 Cb 0.42 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1bvy h LEU 181 CO 0.01 1.15 0.50 -0.78 -0.34 0.00 0.00 178.44 178.98 1bvy h ASP 182 N 0.84 0.85 -0.48 1.25 3.58 -0.57 -0.68 116.42 121.21 1bvy h ASP 182 Ca 0.11 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.51 1bvy h ASP 182 Cb 0.76 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 1bvy h ASP 182 CO 0.06 0.60 0.13 -0.08 -2.88 0.00 0.00 179.24 177.08 1bvy h GLU 183 N 1.00 0.75 -0.72 0.28 4.57 -1.08 0.24 114.58 119.62 1bvy h GLU 183 Ca 0.29 -0.17 0.12 0.00 -1.18 0.00 0.00 59.36 58.42 1bvy h GLU 183 Cb -0.06 -0.10 -0.08 0.00 -0.16 0.00 0.00 28.75 28.34 1bvy h GLU 183 CO -0.08 0.72 0.32 0.00 -1.18 0.00 0.00 179.01 178.79 1bvy h ALA 184 N 0.99 1.01 -0.05 2.92 0.00 -0.76 0.23 119.26 123.60 1bvy h ALA 184 Ca 0.15 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1bvy h ALA 184 Cb 0.30 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1bvy h ALA 184 CO -0.00 -0.13 -0.45 0.52 0.00 0.00 0.00 179.25 179.18 1bvy h MET 185 N 0.51 0.40 -0.77 0.00 2.86 -0.54 -3.18 114.93 114.21 1bvy h MET 185 Ca 0.38 -0.36 0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1bvy h MET 185 Cb 0.49 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 1bvy h MET 185 CO -0.33 1.01 0.51 -0.91 1.06 0.00 0.00 176.91 178.24 1bvy h ASN 186 N -0.09 0.80 -0.21 1.22 2.35 -0.30 -1.90 115.58 117.45 1bvy h ASN 186 Ca -0.04 -0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.76 1bvy h ASN 186 Cb 1.13 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 1bvy h ASN 186 CO 0.09 0.55 0.29 0.11 -1.65 0.00 0.00 177.43 176.82 1bvy h LYS 187 N 0.93 0.00 0.00 0.81 1.57 -0.52 -1.31 116.57 118.05 1bvy h LYS 187 Ca 0.31 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.98 1bvy h LYS 187 Cb 0.08 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1bvy h LYS 187 CO -0.09 0.00 -0.55 -0.07 -0.57 0.00 0.00 179.45 178.17 1bvy h LEU 188 N 0.00 0.00 -2.46 2.94 3.38 -1.43 -3.17 115.31 114.57 1bvy h LEU 188 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1bvy h LEU 188 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1bvy h LEU 188 CO -0.00 0.55 0.00 0.00 0.09 0.00 0.00 178.44 179.08 1bvy n GLN 189 N -3.77 2.46 -2.80 1.13 6.02 -0.50 -4.93 117.38 114.99 1bvy n GLN 189 Ca -0.01 -2.25 -0.43 0.00 -0.01 0.00 0.00 57.00 54.30 1bvy n GLN 189 Cb 0.58 -1.46 -0.04 0.00 1.02 0.00 0.00 30.24 30.34 1bvy n GLN 189 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1bvy s ARG 190 N -1.23 3.68 0.19 -1.09 6.06 -1.19 -4.93 118.95 120.45 1bvy s ARG 190 Ca 0.36 0.37 -0.05 0.00 -2.50 0.00 0.00 55.73 53.90 1bvy s ARG 190 Cb 0.20 -3.87 0.12 0.00 0.06 0.00 0.00 34.95 31.47 1bvy s ARG 190 CO 0.28 -1.11 1.57 0.00 -2.50 0.00 0.00 175.30 173.53 1bvy h ALA 191 N 8.83 0.77 -2.79 6.12 0.00 -1.91 -3.38 119.26 126.91 1bvy h ALA 191 Ca -0.24 -0.42 -0.61 0.00 0.00 0.00 0.00 54.91 53.65 1bvy h ALA 191 Cb 1.08 -0.13 -0.40 0.00 0.00 0.00 0.00 17.79 18.34 1bvy h ALA 191 CO 1.01 0.65 -0.76 0.54 0.00 0.00 0.00 179.25 180.70 1bvy s ASN 192 N -6.81 3.31 0.37 0.00 4.22 -1.26 -4.97 114.94 109.79 1bvy s ASN 192 Ca -0.09 -3.35 0.08 0.00 -2.14 0.00 0.00 52.86 47.35 1bvy s ASN 192 Cb 0.12 -1.07 0.73 0.00 1.28 0.00 0.00 41.25 42.31 1bvy s ASN 192 CO 0.85 -0.15 1.90 -0.65 -2.04 0.00 0.00 177.10 177.01 1bvy h PRO 193 N 5.70 0.30 -0.63 3.55 0.11 -1.97 -2.38 132.00 136.69 1bvy h PRO 193 Ca 0.17 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1bvy h PRO 193 Cb 0.84 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1bvy h PRO 193 CO 0.54 0.43 0.00 -0.25 -0.21 0.00 0.00 178.00 178.51 1bvy n ASP 194 N -4.26 3.76 -4.73 -2.05 8.00 -1.26 -4.70 116.55 111.31 1bvy n ASP 194 Ca -0.00 -2.22 -0.41 0.00 0.71 0.00 0.00 54.79 52.87 1bvy n ASP 194 Cb 0.27 -0.48 0.01 0.00 -0.02 0.00 0.00 41.12 40.90 1bvy n ASP 194 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1bvy n ASP 195 N 1.08 2.99 0.31 -2.24 -0.08 -0.90 -4.84 116.55 112.87 1bvy n ASP 195 Ca 0.21 1.15 0.19 0.00 -1.51 0.00 0.00 54.79 54.84 1bvy n ASP 195 Cb 0.67 -1.54 1.04 0.00 2.34 0.00 0.00 41.12 43.62 1bvy n ASP 195 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1bvy h PRO 196 N 2.39 0.00 0.00 -0.67 0.11 -1.91 0.26 132.00 132.18 1bvy h PRO 196 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1bvy h PRO 196 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1bvy h PRO 196 CO 0.61 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.40 1bvy h ALA 197 N 1.85 1.00 -0.42 -0.75 0.00 -1.95 -2.49 119.26 116.51 1bvy h ALA 197 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bvy h ALA 197 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1bvy h ALA 197 CO -0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 1bvy n TYR 198 N -3.01 0.54 -0.23 0.00 4.01 0.90 -4.34 117.16 115.04 1bvy n TYR 198 Ca -0.02 -0.27 -0.07 0.00 -0.16 0.00 0.00 57.90 57.37 1bvy n TYR 198 Cb 0.12 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.19 1bvy n TYR 198 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1bvy h ASP 199 N 3.83 0.92 -0.09 7.72 3.32 -1.57 -2.01 116.42 128.54 1bvy h ASP 199 Ca 0.00 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.75 1bvy h ASP 199 Cb 0.85 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1bvy h ASP 199 CO 0.00 0.87 -0.25 -0.08 -1.72 0.00 0.00 179.24 178.07 1bvy h GLU 200 N 0.91 0.53 -0.54 3.56 4.57 -1.80 -2.27 114.58 119.54 1bvy h GLU 200 Ca 0.21 -0.20 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1bvy h GLU 200 Cb 0.27 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.79 1bvy h GLU 200 CO -0.01 0.73 0.28 -0.91 -1.18 0.00 0.00 179.01 177.93 1bvy h ASN 201 N 0.47 0.42 -0.30 1.04 4.21 -1.70 0.14 115.58 119.86 1bvy h ASN 201 Ca 0.07 0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.60 1bvy h ASN 201 Cb 0.68 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.81 1bvy h ASN 201 CO 0.05 0.29 0.16 0.11 -1.29 0.00 0.00 177.43 176.75 1bvy h LYS 202 N 0.55 0.42 -0.41 0.81 1.57 -1.16 0.48 116.57 118.83 1bvy h LYS 202 Ca 0.23 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 1bvy h LYS 202 Cb 0.13 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1bvy h LYS 202 CO -0.15 0.37 0.08 0.00 -0.57 0.00 0.00 179.45 179.17 1bvy h ARG 203 N 0.37 0.67 -0.85 3.15 3.08 -1.08 -1.55 114.38 118.16 1bvy h ARG 203 Ca 0.11 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1bvy h ARG 203 Cb 0.07 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1bvy h ARG 203 CO -0.02 0.71 0.49 0.37 -1.07 0.00 0.00 179.97 180.45 1bvy h GLN 204 N 0.53 1.18 -0.24 0.04 5.75 -0.53 0.97 115.11 122.81 1bvy h GLN 204 Ca 0.13 -0.13 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1bvy h GLN 204 Cb 0.36 -0.24 -0.05 0.00 1.07 0.00 0.00 27.48 28.61 1bvy h GLN 204 CO 0.01 0.85 -0.10 0.35 -2.65 0.00 0.00 178.83 177.28 1bvy h PHE 205 N 1.18 -0.25 -0.04 3.99 3.57 0.31 0.69 116.94 126.41 1bvy h PHE 205 Ca 0.30 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 1bvy h PHE 205 Cb 0.00 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1bvy h PHE 205 CO 0.00 -0.16 -0.26 1.96 -2.23 0.00 0.00 178.31 177.62 1bvy h GLN 206 N -0.07 0.06 -0.39 1.11 1.08 -0.48 -2.45 115.11 113.97 1bvy h GLN 206 Ca 0.13 -0.02 -0.11 0.00 -1.45 0.00 0.00 58.65 57.20 1bvy h GLN 206 Cb 0.26 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1bvy h GLN 206 CO -0.29 0.32 -0.20 0.93 -0.95 0.00 0.00 178.83 178.64 1bvy h GLU 207 N 0.06 0.76 -0.49 1.46 4.39 0.55 -2.64 114.58 118.66 1bvy h GLU 207 Ca 0.01 -0.29 -0.13 0.00 0.34 0.00 0.00 59.36 59.28 1bvy h GLU 207 Cb 0.50 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1bvy h GLU 207 CO 0.04 0.90 -0.20 -0.44 -1.16 0.00 0.00 179.01 178.14 1bvy h ASP 208 N 0.67 1.03 -0.57 1.42 3.32 -0.50 -1.83 116.42 119.96 1bvy h ASP 208 Ca 0.10 -0.39 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 1bvy h ASP 208 Cb 0.70 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1bvy h ASP 208 CO 0.05 1.19 0.30 0.40 -1.72 0.00 0.00 179.24 179.47 1bvy h ILE 209 N 0.87 1.19 -0.87 0.35 2.04 -1.38 -1.00 117.51 118.72 1bvy h ILE 209 Ca 0.11 -0.51 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 1bvy h ILE 209 Cb 0.79 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 1bvy h ILE 209 CO 0.07 0.21 0.44 0.50 0.00 0.00 0.00 178.15 179.36 1bvy h LYS 210 N 0.77 1.24 0.20 2.37 3.64 -1.34 0.19 116.57 123.63 1bvy h LYS 210 Ca 0.20 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1bvy h LYS 210 Cb 0.07 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1bvy h LYS 210 CO -0.03 0.94 -0.10 0.28 -2.27 0.00 0.00 179.45 178.27 1bvy h VAL 211 N 1.23 0.81 0.02 2.00 2.07 -0.83 0.81 116.25 122.36 1bvy h VAL 211 Ca 0.30 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1bvy h VAL 211 Cb 0.09 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1bvy h VAL 211 CO -0.04 0.01 -0.03 0.24 0.02 0.00 0.00 177.57 177.77 1bvy h MET 212 N -0.28 -0.06 -0.46 1.57 2.86 -0.86 -1.55 114.93 116.15 1bvy h MET 212 Ca -0.03 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1bvy h MET 212 Cb 0.22 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1bvy h MET 212 CO 0.04 -0.04 0.16 -0.91 1.06 0.00 0.00 176.91 177.23 1bvy h ASN 213 N -0.06 0.65 -0.70 1.22 4.21 -0.56 -1.42 115.58 118.93 1bvy h ASN 213 Ca 0.01 -0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.30 1bvy h ASN 213 Cb 0.07 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.06 1bvy h ASN 213 CO -0.02 0.67 0.35 0.44 -1.29 0.00 0.00 177.43 177.57 1bvy h ASP 214 N 0.60 0.92 -0.09 5.81 3.32 -0.69 0.44 116.42 126.73 1bvy h ASP 214 Ca 0.15 -0.10 -0.21 0.00 0.02 0.00 0.00 57.03 56.89 1bvy h ASP 214 Cb 0.23 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.56 1bvy h ASP 214 CO -0.01 0.78 -0.76 0.25 -1.72 0.00 0.00 179.24 177.78 1bvy h LEU 215 N 1.01 0.83 -0.22 1.55 7.12 -1.07 -2.97 115.31 121.56 1bvy h LEU 215 Ca 0.25 -0.67 -0.22 0.00 0.13 0.00 0.00 57.88 57.37 1bvy h LEU 215 Cb 0.10 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 39.99 1bvy h LEU 215 CO -0.03 1.37 -0.86 0.58 -0.13 0.00 0.00 178.44 179.37 1bvy h VAL 216 N 0.35 1.36 -0.28 1.05 2.07 -0.85 -2.08 116.25 117.86 1bvy h VAL 216 Ca -0.07 -2.25 -0.02 0.00 0.82 0.00 0.00 66.70 65.19 1bvy h VAL 216 Cb 1.41 2.24 -0.02 0.00 -1.52 0.00 0.00 31.29 33.41 1bvy h VAL 216 CO 0.15 0.68 0.11 0.44 0.02 0.00 0.00 177.57 178.97 1bvy h ASP 217 N 0.32 0.35 0.01 0.57 3.32 -0.22 -1.77 116.42 119.01 1bvy h ASP 217 Ca -0.07 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 1bvy h ASP 217 Cb 1.48 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.94 1bvy h ASP 217 CO 0.16 0.33 -0.01 0.50 -1.72 0.00 0.00 179.24 178.50 1bvy h LYS 218 N 0.40 -0.02 -0.97 3.56 1.63 -1.41 -2.76 116.57 116.99 1bvy h LYS 218 Ca 0.10 0.00 0.14 0.00 -0.85 0.00 0.00 60.65 60.04 1bvy h LYS 218 Cb 0.09 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 31.64 1bvy h LYS 218 CO -0.01 0.71 0.59 0.82 -3.45 0.00 0.00 179.45 178.12 1bvy h ILE 219 N -0.78 0.84 -0.02 2.00 2.04 -1.23 -1.38 117.51 118.98 1bvy h ILE 219 Ca -0.00 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 1bvy h ILE 219 Cb 0.74 -0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1bvy h ILE 219 CO 0.00 0.16 0.01 0.40 0.00 0.00 0.00 178.15 178.72 1bvy h ILE 220 N 0.88 1.18 -0.49 -0.67 2.04 -1.36 -2.47 117.51 116.62 1bvy h ILE 220 Ca 0.51 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1bvy h ILE 220 Cb 0.60 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1bvy h ILE 220 CO -0.30 0.14 0.29 0.00 0.00 0.00 0.00 178.15 178.28 1bvy h ALA 221 N 0.79 0.62 -0.86 1.87 0.00 -1.19 -0.30 119.26 120.19 1bvy h ALA 221 Ca 0.01 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 54.96 1bvy h ALA 221 Cb 0.22 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 1bvy h ALA 221 CO -0.00 0.11 0.50 -0.44 0.00 0.00 0.00 179.25 179.42 1bvy h ASP 222 N 0.65 0.71 -0.15 0.00 3.32 -1.23 -0.91 116.42 118.81 1bvy h ASP 222 Ca 0.18 0.05 -0.16 0.00 0.02 0.00 0.00 57.03 57.11 1bvy h ASP 222 Cb -0.01 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1bvy h ASP 222 CO -0.03 0.39 -0.49 -0.09 -1.72 0.00 0.00 179.24 177.30 1bvy h ARG 223 N 0.82 0.72 -0.94 3.56 9.65 -0.94 -0.89 114.38 126.37 1bvy h ARG 223 Ca 0.42 -0.42 0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1bvy h ARG 223 Cb 0.41 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.98 1bvy h ARG 223 CO -0.26 1.05 0.61 0.87 2.80 0.00 0.00 179.97 185.04 1bvy h LYS 224 N 0.57 1.25 0.00 0.20 1.57 -0.11 -0.59 116.57 119.46 1bvy h LYS 224 Ca 0.03 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1bvy h LYS 224 Cb 1.05 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1bvy h LYS 224 CO 0.10 0.83 0.00 0.00 -0.57 0.00 0.00 179.45 179.82 1bvy n ALA 225 N -2.37 2.17 -2.00 3.86 0.00 -0.44 -4.85 120.51 116.89 1bvy n ALA 225 Ca 0.11 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 1bvy n ALA 225 Cb 0.02 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 1bvy n ALA 225 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bvy s SER 226 N -4.29 6.66 -0.68 0.00 0.15 -0.23 -4.95 113.70 110.36 1bvy s SER 226 Ca 0.10 2.51 0.01 0.00 0.70 0.00 0.00 55.95 59.27 1bvy s SER 226 Cb 0.12 -2.59 0.37 0.00 -1.71 0.00 0.00 66.02 62.22 1bvy s SER 226 CO 0.55 -0.79 1.57 0.61 1.20 0.00 0.00 173.24 176.38 1bvy n GLY 227 N 3.72 5.78 0.48 9.45 0.00 -1.26 -4.37 105.19 118.98 1bvy n GLY 227 Ca 0.13 -2.63 -0.00 0.00 0.00 0.00 0.00 46.02 43.52 1bvy n GLY 227 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bvy n GLU 228 N -0.45 0.00 -0.88 1.61 0.28 -1.26 -5.17 120.64 114.77 1bvy n GLU 228 Ca 0.46 -0.06 -0.33 0.00 -0.16 0.00 0.00 57.16 57.07 1bvy n GLU 228 Cb 0.41 0.45 0.03 0.00 1.43 0.00 0.00 31.44 33.76 1bvy n GLU 228 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1bvy n GLN 229 N 0.00 0.00 0.00 3.44 6.02 -1.26 -5.05 117.38 120.53 1bvy n GLN 229 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1bvy n GLN 229 Cb 0.26 -0.89 0.00 0.00 1.02 0.00 0.00 30.24 30.63 1bvy n GLN 229 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1bvy n SER 230 N 3.09 0.00 -3.00 1.08 2.88 -1.26 -5.09 113.62 111.32 1bvy n SER 230 Ca -0.02 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.38 1bvy n SER 230 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1bvy n SER 230 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1bvy n ASP 231 N 0.00 0.38 -1.60 -3.46 2.03 -1.26 -4.88 116.55 107.75 1bvy n ASP 231 Ca 0.00 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.28 1bvy n ASP 231 Cb 0.00 -0.17 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 1bvy n ASP 231 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1bvy n ASP 232 N 0.19 1.48 -0.03 1.67 5.68 -1.26 -4.95 116.55 119.33 1bvy n ASP 232 Ca 0.18 -0.80 -0.05 0.00 -0.50 0.00 0.00 54.79 53.62 1bvy n ASP 232 Cb 0.70 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.85 1bvy n ASP 232 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1bvy h LEU 233 N 0.00 0.61 -0.78 -2.12 3.38 -1.44 -1.26 115.31 113.69 1bvy h LEU 233 Ca 0.00 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 1bvy h LEU 233 Cb 0.00 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1bvy h LEU 233 CO 0.00 0.82 0.39 0.25 0.09 0.00 0.00 178.44 179.99 1bvy h LEU 234 N 0.53 1.02 -0.11 1.67 5.85 -1.84 0.27 115.31 122.70 1bvy h LEU 234 Ca 0.08 -0.13 -0.24 0.00 0.84 0.00 0.00 57.88 58.43 1bvy h LEU 234 Cb 0.67 -0.26 0.01 0.00 0.37 0.00 0.00 40.66 41.45 1bvy h LEU 234 CO 0.05 0.86 -0.97 0.71 -0.34 0.00 0.00 178.44 178.75 1bvy h THR 235 N 1.10 1.35 -0.82 1.05 1.35 -1.78 -0.16 112.91 115.00 1bvy h THR 235 Ca 0.27 -2.34 0.01 0.00 -0.55 0.00 0.00 66.41 63.81 1bvy h THR 235 Cb 0.11 2.37 -0.04 0.00 -1.73 0.00 0.00 68.15 68.86 1bvy h THR 235 CO -0.04 0.71 0.54 0.45 -0.25 0.00 0.00 175.52 176.94 1bvy h HIS 236 N 0.31 1.02 -0.32 4.73 3.86 -1.01 -0.98 115.15 122.76 1bvy h HIS 236 Ca -0.10 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 58.99 1bvy h HIS 236 Cb 1.61 -0.34 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 1bvy h HIS 236 CO 0.08 0.63 -0.36 0.52 0.86 0.00 0.00 177.93 179.66 1bvy h MET 237 N 1.09 0.81 0.00 2.45 2.07 -0.89 -0.09 114.93 120.38 1bvy h MET 237 Ca 0.30 -0.45 -0.04 0.00 -2.07 0.00 0.00 59.70 57.45 1bvy h MET 237 Cb -0.10 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 29.65 1bvy h MET 237 CO -0.07 1.08 -0.18 -0.07 1.07 0.00 0.00 176.91 178.74 1bvy h LEU 238 N 0.58 0.00 0.00 1.22 3.38 -0.34 -3.15 115.31 117.00 1bvy h LEU 238 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1bvy h LEU 238 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1bvy h LEU 238 CO 0.09 0.18 -0.86 0.59 0.09 0.00 0.00 178.44 178.53 1bvy n ASN 239 N -3.76 0.81 -4.77 -0.43 3.02 -0.43 -4.96 115.26 104.73 1bvy n ASN 239 Ca -0.02 -0.78 -0.38 0.00 -0.03 0.00 0.00 54.58 53.38 1bvy n ASN 239 Cb 0.29 1.08 -0.01 0.00 -0.61 0.00 0.00 39.78 40.53 1bvy n ASN 239 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1bvy s GLY 240 N -2.65 2.82 0.02 7.41 0.00 -0.05 -4.98 107.32 109.89 1bvy s GLY 240 Ca 0.05 0.97 0.07 0.00 0.00 0.00 0.00 44.72 45.80 1bvy s GLY 240 CO 0.65 1.46 -0.19 0.54 0.00 0.00 0.00 173.10 175.56 1bvy s LYS 241 N -2.51 1.38 -0.39 2.90 -0.14 -1.26 -3.66 119.74 116.07 1bvy s LYS 241 Ca 0.61 -0.84 -0.29 0.00 -1.36 0.00 0.00 55.97 54.09 1bvy s LYS 241 Cb -0.30 -1.43 0.01 0.00 -1.68 0.00 0.00 37.83 34.42 1bvy s LYS 241 CO 0.37 0.37 1.37 0.34 -0.76 0.00 0.00 175.35 177.04 1bvy s ASP 242 N -0.94 6.44 0.14 2.83 2.15 0.38 -4.85 116.67 122.82 1bvy s ASP 242 Ca 0.07 0.91 -0.23 0.00 0.43 0.00 0.00 52.55 53.72 1bvy s ASP 242 Cb -0.08 -2.54 -0.01 0.00 -0.30 0.00 0.00 42.92 39.99 1bvy s ASP 242 CO 0.01 -1.33 1.24 -2.65 -0.17 0.00 0.00 175.17 172.27 1bvy n PRO 243 N 7.87 -0.32 0.05 4.34 -0.02 -1.26 0.19 135.00 145.84 1bvy n PRO 243 Ca 0.16 1.22 -0.02 0.00 -2.02 0.00 0.00 63.50 62.84 1bvy n PRO 243 Cb 0.48 -1.79 -0.01 0.00 -0.02 0.00 0.00 33.50 32.15 1bvy n PRO 243 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bvy h GLU 244 N 0.00 -0.11 0.00 -0.52 5.08 -1.97 -3.28 114.58 113.77 1bvy h GLU 244 Ca 0.16 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1bvy h GLU 244 Cb 0.36 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1bvy h GLU 244 CO -0.76 -0.08 -0.11 1.79 -1.00 0.00 0.00 179.01 178.85 1bvy h THR 245 N -0.13 0.54 -1.27 1.13 1.35 -1.88 -3.46 112.91 109.19 1bvy h THR 245 Ca -0.01 -0.49 -0.22 0.00 -0.55 0.00 0.00 66.41 65.14 1bvy h THR 245 Cb 0.09 1.32 -0.03 0.00 -1.73 0.00 0.00 68.15 67.80 1bvy h THR 245 CO 0.02 0.10 -0.26 0.61 -0.25 0.00 0.00 175.52 175.75 1bvy n GLY 246 N -0.72 0.28 3.26 5.82 0.00 0.51 -4.99 105.19 109.35 1bvy n GLY 246 Ca -0.02 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.40 1bvy n GLY 246 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bvy s GLU 247 N -4.10 1.10 0.73 1.61 -1.05 -1.21 -4.79 118.70 110.99 1bvy s GLU 247 Ca 0.00 -1.49 -0.01 0.00 -0.15 0.00 0.00 54.97 53.32 1bvy s GLU 247 Cb 0.00 -0.54 0.15 0.00 -0.44 0.00 0.00 34.13 33.29 1bvy s GLU 247 CO 0.00 0.01 1.00 -0.35 0.95 0.00 0.00 175.26 176.87 1bvy n PRO 248 N -0.23 -0.15 -2.19 -4.83 -0.04 -1.24 0.14 135.00 126.47 1bvy n PRO 248 Ca -0.09 -2.65 -0.39 0.00 -0.04 0.00 0.00 63.50 60.33 1bvy n PRO 248 Cb 0.62 -0.68 -0.01 0.00 -0.04 0.00 0.00 33.50 33.38 1bvy n PRO 248 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bvy s LEU 249 N 0.00 4.18 0.74 1.53 1.43 -1.26 -4.87 118.68 120.43 1bvy s LEU 249 Ca 0.66 2.47 -0.11 0.00 -1.03 0.00 0.00 54.13 56.11 1bvy s LEU 249 Cb -0.04 -4.00 0.03 0.00 0.03 0.00 0.00 46.19 42.22 1bvy s LEU 249 CO 0.44 -0.78 1.07 1.51 0.23 0.00 0.00 176.35 178.82 1bvy s ASP 250 N -1.00 4.99 0.64 2.29 1.47 -1.26 -4.82 116.67 118.98 1bvy s ASP 250 Ca 0.58 1.53 0.39 0.00 1.18 0.00 0.00 52.55 56.23 1bvy s ASP 250 Cb -0.33 -2.34 2.19 0.00 -0.34 0.00 0.00 42.92 42.09 1bvy s ASP 250 CO 0.42 -1.68 2.32 0.44 0.68 0.00 0.00 175.17 177.35 1bvy h ASP 251 N -0.89 0.00 -0.14 2.11 3.32 -1.99 -2.27 116.42 116.57 1bvy h ASP 251 Ca -0.45 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.47 1bvy h ASP 251 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1bvy h ASP 251 CO 0.57 0.00 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.61 1bvy h GLU 252 N 0.00 0.52 -0.59 3.56 4.81 -1.99 -2.25 114.58 118.64 1bvy h GLU 252 Ca -0.00 -0.37 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 1bvy h GLU 252 Cb 0.02 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1bvy h GLU 252 CO 0.00 0.99 0.23 -0.97 -0.73 0.00 0.00 179.01 178.53 1bvy h ASN 253 N 0.13 0.82 -0.59 1.04 -0.73 -1.79 0.15 115.58 114.61 1bvy h ASN 253 Ca -0.01 -0.18 0.07 0.00 1.87 0.00 0.00 56.30 58.06 1bvy h ASN 253 Cb 1.03 -0.21 -0.06 0.00 0.27 0.00 0.00 38.32 39.35 1bvy h ASN 253 CO 0.09 0.77 0.26 0.40 -0.37 0.00 0.00 177.43 178.58 1bvy h ILE 254 N 0.81 0.86 -0.66 2.57 2.04 -1.51 0.31 117.51 121.94 1bvy h ILE 254 Ca 0.19 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 1bvy h ILE 254 Cb 0.21 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 1bvy h ILE 254 CO -0.01 0.09 0.41 -0.09 0.00 0.00 0.00 178.15 178.54 1bvy h ARG 255 N 0.49 0.90 -0.94 2.37 2.43 -0.81 -0.82 114.38 117.99 1bvy h ARG 255 Ca 0.28 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1bvy h ARG 255 Cb 0.28 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 1bvy h ARG 255 CO -0.24 0.63 0.57 1.88 -1.51 0.00 0.00 179.97 181.30 1bvy h TYR 256 N 0.90 1.23 -0.42 2.20 0.05 0.76 -2.05 116.97 119.64 1bvy h TYR 256 Ca 0.24 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.95 1bvy h TYR 256 Cb -0.04 -0.40 -0.02 0.00 1.01 0.00 0.00 36.73 37.27 1bvy h TYR 256 CO -0.02 0.81 -0.03 1.96 -1.05 0.00 0.00 178.16 179.83 1bvy h GLN 257 N 1.29 0.69 -0.05 4.88 1.08 0.05 0.23 115.11 123.29 1bvy h GLN 257 Ca 0.34 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1bvy h GLN 257 Cb -0.07 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1bvy h GLN 257 CO -0.06 0.73 -0.00 0.82 -0.95 0.00 0.00 178.83 179.36 1bvy h ILE 258 N 0.65 1.27 -0.72 2.54 2.04 -0.75 0.11 117.51 122.64 1bvy h ILE 258 Ca 0.13 -0.82 0.07 0.00 1.00 0.00 0.00 64.86 65.24 1bvy h ILE 258 Cb 0.45 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 1bvy h ILE 258 CO 0.02 0.22 0.47 0.40 0.00 0.00 0.00 178.15 179.27 1bvy h ILE 259 N -0.24 0.99 -0.34 -0.67 2.04 -1.30 -2.37 117.51 115.63 1bvy h ILE 259 Ca 0.01 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.57 1bvy h ILE 259 Cb 0.36 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1bvy h ILE 259 CO 0.00 0.13 -0.03 0.74 0.00 0.00 0.00 178.15 178.99 1bvy h THR 260 N 0.71 1.27 -0.56 -0.27 2.02 -0.35 -1.76 112.91 113.96 1bvy h THR 260 Ca 0.32 -1.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.41 1bvy h THR 260 Cb 0.33 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 1bvy h THR 260 CO -0.11 0.34 0.15 -0.26 0.37 0.00 0.00 175.52 176.01 1bvy h PHE 261 N 0.41 0.89 -0.08 3.16 0.04 -0.28 0.78 116.94 121.86 1bvy h PHE 261 Ca 0.09 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1bvy h PHE 261 Cb 0.51 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 1bvy h PHE 261 CO 0.04 0.73 0.01 -0.07 -0.60 0.00 0.00 178.31 178.42 1bvy h LEU 262 N 0.83 0.13 -0.08 1.54 3.38 -1.34 -1.83 115.31 117.94 1bvy h LEU 262 Ca 0.18 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.89 1bvy h LEU 262 Cb 0.28 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1bvy h LEU 262 CO -0.00 0.38 -0.05 0.40 0.09 0.00 0.00 178.44 179.25 1bvy h ILE 263 N -0.13 0.85 0.00 1.22 1.08 -1.07 -1.46 117.51 118.00 1bvy h ILE 263 Ca 0.02 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.38 1bvy h ILE 263 Cb 0.31 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 1bvy h ILE 263 CO 0.00 0.00 -0.52 0.00 -0.69 0.00 0.00 178.15 176.94 1bvy h ALA 264 N 1.03 0.70 0.00 1.87 0.00 -0.81 -3.33 119.26 118.71 1bvy h ALA 264 Ca 0.05 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1bvy h ALA 264 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1bvy h ALA 264 CO -0.11 0.65 -1.01 0.41 0.00 0.00 0.00 179.25 179.19 1bvy n GLY 265 N 1.09 -0.50 0.09 0.00 0.00 -0.69 -4.35 105.19 100.83 1bvy n GLY 265 Ca 0.02 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 1bvy n GLY 265 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1bvy h HIS 266 N 0.00 0.21 0.00 1.61 2.07 -1.38 -2.60 115.15 115.06 1bvy h HIS 266 Ca 0.00 -0.06 -0.15 0.00 -2.85 0.00 0.00 60.37 57.31 1bvy h HIS 266 Cb 0.46 -0.04 -0.03 0.00 2.57 0.00 0.00 27.41 30.37 1bvy h HIS 266 CO 0.00 0.59 -1.69 0.39 -3.07 0.00 0.00 177.93 174.15 1bvy n GLU 267 N -4.73 0.64 -0.01 5.12 1.02 -1.26 -2.78 120.64 118.64 1bvy n GLU 267 Ca -0.07 0.07 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1bvy n GLU 267 Cb 0.29 -1.69 -0.06 0.00 -0.02 0.00 0.00 31.44 29.96 1bvy n GLU 267 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1bvy h THR 268 N 0.00 1.08 -0.27 2.62 1.35 -1.76 -1.16 112.91 114.77 1bvy h THR 268 Ca -0.18 -0.23 -0.16 0.00 -0.55 0.00 0.00 66.41 65.28 1bvy h THR 268 Cb 1.52 1.04 -0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1bvy h THR 268 CO 0.03 0.07 -0.49 0.74 -0.25 0.00 0.00 175.52 175.62 1bvy h THR 269 N 0.08 1.29 -0.08 6.82 2.02 -1.59 -2.81 112.91 118.64 1bvy h THR 269 Ca 0.04 -1.69 -0.10 0.00 0.77 0.00 0.00 66.41 65.42 1bvy h THR 269 Cb 0.07 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1bvy h THR 269 CO -0.01 0.54 -0.42 0.77 0.37 0.00 0.00 175.52 176.78 1bvy h SER 270 N 0.59 0.18 -0.61 4.18 4.64 -1.47 -2.25 113.55 118.81 1bvy h SER 270 Ca 0.03 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1bvy h SER 270 Cb 1.06 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 63.08 1bvy h SER 270 CO 0.10 0.59 0.10 1.23 -0.87 0.00 0.00 176.83 177.98 1bvy h GLY 271 N 1.25 1.12 0.91 -0.77 0.00 -1.13 0.02 103.07 104.47 1bvy h GLY 271 Ca 0.01 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.61 1bvy h GLY 271 CO 0.06 0.68 -0.04 -2.00 0.00 0.00 0.00 176.54 175.24 1bvy h LEU 272 N 0.97 -0.10 -0.59 3.11 5.85 -1.19 0.40 115.31 123.75 1bvy h LEU 272 Ca 0.19 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1bvy h LEU 272 Cb 0.43 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1bvy h LEU 272 CO 0.01 0.01 0.39 -0.07 -0.34 0.00 0.00 178.44 178.44 1bvy h LEU 273 N -0.21 0.68 -0.21 2.25 3.38 -1.34 0.98 115.31 120.84 1bvy h LEU 273 Ca -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1bvy h LEU 273 Cb 0.17 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1bvy h LEU 273 CO 0.02 0.49 0.06 0.28 0.09 0.00 0.00 178.44 179.38 1bvy h SER 274 N 0.80 0.31 -0.34 -0.43 0.02 -0.66 -1.15 113.55 112.09 1bvy h SER 274 Ca 0.22 -0.21 -0.09 0.00 -0.84 0.00 0.00 61.79 60.87 1bvy h SER 274 Cb -0.09 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 1bvy h SER 274 CO -0.05 0.43 -0.11 -0.26 -1.14 0.00 0.00 176.83 175.71 1bvy h PHE 275 N 0.17 0.85 -0.43 3.45 0.04 -0.04 -0.68 116.94 120.30 1bvy h PHE 275 Ca 0.07 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 1bvy h PHE 275 Cb 0.24 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 1bvy h PHE 275 CO 0.00 0.85 0.23 0.00 -0.60 0.00 0.00 178.31 178.78 1bvy h ALA 276 N 1.17 0.56 -0.17 2.45 0.00 -0.65 0.09 119.26 122.71 1bvy h ALA 276 Ca 0.12 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1bvy h ALA 276 Cb 0.59 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1bvy h ALA 276 CO 0.04 0.10 -0.27 1.25 0.00 0.00 0.00 179.25 180.37 1bvy h LEU 277 N 0.56 0.32 0.31 0.00 5.85 -1.00 -1.85 115.31 119.51 1bvy h LEU 277 Ca 0.15 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1bvy h LEU 277 Cb 0.08 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1bvy h LEU 277 CO -0.02 0.59 -0.21 0.22 -0.34 0.00 0.00 178.44 178.68 1bvy h TYR 278 N 0.29 -0.55 0.00 1.25 3.20 -0.19 -1.58 116.97 119.39 1bvy h TYR 278 Ca 0.04 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 1bvy h TYR 278 Cb 0.63 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 1bvy h TYR 278 CO 0.01 -0.32 -0.18 0.74 -1.64 0.00 0.00 178.16 176.77 1bvy h PHE 279 N -0.51 0.00 -0.03 -3.82 0.04 -0.85 -1.99 116.94 109.77 1bvy h PHE 279 Ca -0.03 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.65 1bvy h PHE 279 Cb 0.44 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.59 1bvy h PHE 279 CO -0.10 0.18 -0.35 -0.07 -0.60 0.00 0.00 178.31 177.37 1bvy h LEU 280 N 0.00 0.37 -1.37 1.54 3.38 -1.01 -1.74 115.31 116.48 1bvy h LEU 280 Ca -0.00 -0.71 -0.02 0.00 0.09 0.00 0.00 57.88 57.25 1bvy h LEU 280 Cb 0.52 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1bvy h LEU 280 CO 0.02 1.02 -0.07 -0.37 0.09 0.00 0.00 178.44 179.13 1bvy h VAL 281 N -0.25 0.20 0.00 1.22 -1.51 -1.09 -1.82 116.25 113.00 1bvy h VAL 281 Ca -0.03 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 1bvy h VAL 281 Cb 1.04 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 1bvy h VAL 281 CO 0.07 0.07 -0.38 0.11 -1.23 0.00 0.00 177.57 176.21 1bvy h LYS 282 N 0.00 0.00 -2.47 5.19 1.79 -1.34 -3.37 116.57 116.37 1bvy h LYS 282 Ca -0.00 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 1bvy h LYS 282 Cb 0.58 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.82 1bvy h LYS 282 CO 0.01 0.00 -0.73 0.09 -1.08 0.00 0.00 179.45 177.74 1bvy n ASN 283 N -2.40 2.32 0.03 0.86 3.02 -0.66 -4.98 115.26 113.44 1bvy n ASN 283 Ca 0.04 -3.09 0.04 0.00 -0.03 0.00 0.00 54.58 51.54 1bvy n ASN 283 Cb 0.47 -0.68 0.44 0.00 -0.61 0.00 0.00 39.78 39.40 1bvy n ASN 283 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1bvy h PRO 284 N 4.75 0.48 0.00 3.52 0.11 -1.70 0.90 132.00 140.06 1bvy h PRO 284 Ca 0.17 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.20 1bvy h PRO 284 Cb 0.76 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 1bvy h PRO 284 CO 0.67 0.32 -0.23 0.45 -0.21 0.00 0.00 178.00 179.01 1bvy h HIS 285 N 0.50 0.00 0.02 0.65 3.86 -1.94 -1.16 115.15 117.08 1bvy h HIS 285 Ca 0.13 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 59.11 1bvy h HIS 285 Cb -0.05 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.43 1bvy h HIS 285 CO 0.00 0.23 -0.99 0.28 0.86 0.00 0.00 177.93 178.31 1bvy h VAL 286 N 0.00 1.39 -0.20 2.45 2.07 -1.20 -2.80 116.25 117.97 1bvy h VAL 286 Ca -0.00 -2.47 0.05 0.00 0.82 0.00 0.00 66.70 65.10 1bvy h VAL 286 Cb 0.90 2.46 -0.05 0.00 -1.52 0.00 0.00 31.29 33.08 1bvy h VAL 286 CO 0.03 0.74 -0.15 0.25 0.02 0.00 0.00 177.57 178.46 1bvy h LEU 287 N 0.24 -0.48 -0.20 2.57 7.12 -0.80 -0.94 115.31 122.81 1bvy h LEU 287 Ca -0.09 0.10 0.04 0.00 0.13 0.00 0.00 57.88 58.06 1bvy h LEU 287 Cb 1.64 0.24 -0.04 0.00 -0.53 0.00 0.00 40.66 41.97 1bvy h LEU 287 CO 0.17 -0.19 -0.07 -0.61 -0.13 0.00 0.00 178.44 177.62 1bvy h GLN 288 N -0.15 -0.02 -0.85 1.25 4.15 -1.21 0.42 115.11 118.70 1bvy h GLN 288 Ca 0.12 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.62 1bvy h GLN 288 Cb 0.33 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.96 1bvy h GLN 288 CO -0.29 -0.02 0.51 -0.22 -1.93 0.00 0.00 178.83 176.88 1bvy h LYS 289 N -0.02 0.86 -0.28 1.69 3.64 -1.33 0.77 116.57 121.89 1bvy h LYS 289 Ca 0.10 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.36 1bvy h LYS 289 Cb 0.18 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1bvy h LYS 289 CO -0.23 0.57 -0.10 0.00 -2.27 0.00 0.00 179.45 177.42 1bvy h ALA 290 N 1.43 0.40 -0.25 5.00 0.00 0.17 -2.62 119.26 123.39 1bvy h ALA 290 Ca 0.39 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1bvy h ALA 290 Cb 0.28 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1bvy h ALA 290 CO -0.21 0.25 -0.08 0.00 0.00 0.00 0.00 179.25 179.20 1bvy h ALA 291 N 0.76 1.41 -0.11 0.00 0.00 0.44 -1.30 119.26 120.45 1bvy h ALA 291 Ca 0.07 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1bvy h ALA 291 Cb 0.60 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1bvy h ALA 291 CO 0.03 0.41 -0.34 0.93 0.00 0.00 0.00 179.25 180.29 1bvy h GLU 292 N 0.37 0.23 -0.21 0.00 5.08 0.65 -1.85 114.58 118.84 1bvy h GLU 292 Ca 0.08 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 1bvy h GLU 292 Cb 0.38 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1bvy h GLU 292 CO 0.02 0.54 -0.50 1.49 -1.00 0.00 0.00 179.01 179.56 1bvy h GLU 293 N 0.20 0.71 -0.75 2.33 4.81 -0.97 -2.55 114.58 118.35 1bvy h GLU 293 Ca 0.02 -0.48 0.02 0.00 -0.13 0.00 0.00 59.36 58.79 1bvy h GLU 293 Cb 0.70 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.10 1bvy h GLU 293 CO 0.05 1.10 0.49 0.00 -0.73 0.00 0.00 179.01 179.92 1bvy h ALA 294 N 0.60 0.98 -0.70 2.92 0.00 -1.13 -0.15 119.26 121.77 1bvy h ALA 294 Ca -0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1bvy h ALA 294 Cb 1.11 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1bvy h ALA 294 CO 0.11 0.31 0.26 0.00 0.00 0.00 0.00 179.25 179.93 1bvy h ALA 295 N 1.30 0.92 -0.38 0.00 0.00 -1.34 0.45 119.26 120.21 1bvy h ALA 295 Ca 0.29 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1bvy h ALA 295 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1bvy h ALA 295 CO -0.09 0.56 -0.30 -0.09 0.00 0.00 0.00 179.25 179.33 1bvy h ARG 296 N 1.01 0.87 0.09 0.00 2.43 -1.15 -3.34 114.38 114.30 1bvy h ARG 296 Ca 0.23 -0.43 -0.35 0.00 -0.81 0.00 0.00 59.98 58.63 1bvy h ARG 296 Cb 0.25 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 1bvy h ARG 296 CO -0.01 1.07 -1.92 0.28 -1.51 0.00 0.00 179.97 177.88 1bvy n VAL 297 N -4.16 1.74 -2.51 0.20 0.31 -0.10 -4.48 118.33 109.33 1bvy n VAL 297 Ca -0.02 -0.69 -0.43 0.00 -0.01 0.00 0.00 64.34 63.18 1bvy n VAL 297 Cb 0.49 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 1bvy n VAL 297 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1bvy n LEU 298 N -3.37 5.90 -0.94 7.52 4.77 0.16 -4.68 117.00 126.36 1bvy n LEU 298 Ca -0.28 -4.40 0.10 0.00 -0.03 0.00 0.00 56.01 51.40 1bvy n LEU 298 Cb 1.05 -1.60 0.26 0.00 -2.33 0.00 0.00 43.42 40.81 1bvy n LEU 298 CO 0.44 0.92 0.72 1.33 -1.33 0.00 0.00 177.39 179.47 1bvy n VAL 299 N 4.49 0.54 -4.34 4.08 0.24 -1.26 -4.86 118.33 117.23 1bvy n VAL 299 Ca 0.42 -0.64 -0.25 0.00 -2.04 0.00 0.00 64.34 61.83 1bvy n VAL 299 Cb 0.40 0.53 -0.09 0.00 -1.47 0.00 0.00 33.84 33.21 1bvy n VAL 299 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1bvy s ASP 300 N -1.26 4.10 0.49 -1.34 1.11 -1.26 -5.02 116.67 113.49 1bvy s ASP 300 Ca 0.36 -0.72 0.18 0.00 0.18 0.00 0.00 52.55 52.54 1bvy s ASP 300 Cb 0.20 -0.62 1.21 0.00 1.07 0.00 0.00 42.92 44.78 1bvy s ASP 300 CO 0.27 0.06 2.04 -0.65 1.18 0.00 0.00 175.17 178.07 1bvy h PRO 301 N 2.52 0.16 -5.68 8.23 0.11 -1.89 -3.39 132.00 132.06 1bvy h PRO 301 Ca -0.45 -0.01 -0.57 0.00 0.11 0.00 0.00 66.00 65.08 1bvy h PRO 301 Cb 1.23 -0.04 -0.30 0.00 0.11 0.00 0.00 31.00 32.00 1bvy h PRO 301 CO 0.56 0.11 -0.84 0.08 -0.21 0.00 0.00 178.00 177.70 1bvy s VAL 302 N -5.18 1.48 0.40 3.15 1.01 -1.26 -3.43 120.40 116.58 1bvy s VAL 302 Ca -0.06 -0.79 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 1bvy s VAL 302 Cb 0.19 -1.25 -0.09 0.00 0.00 0.00 0.00 36.38 35.24 1bvy s VAL 302 CO 0.72 0.42 1.29 -2.84 0.00 0.00 0.00 175.10 174.69 1bvy s PRO 303 N -0.31 3.99 0.35 2.72 0.02 -1.26 -4.99 135.00 135.52 1bvy s PRO 303 Ca 0.04 2.12 0.04 0.00 0.02 0.00 0.00 61.00 63.21 1bvy s PRO 303 Cb -0.09 -2.75 -0.01 0.00 0.02 0.00 0.00 34.50 31.67 1bvy s PRO 303 CO 0.00 -0.46 0.52 -1.54 -0.33 0.00 0.00 177.00 175.19 1bvy s SER 304 N -0.78 6.04 0.17 2.53 1.04 -1.26 -5.00 113.70 116.44 1bvy s SER 304 Ca 0.57 0.09 -0.14 0.00 0.48 0.00 0.00 55.95 56.95 1bvy s SER 304 Cb -0.37 -1.55 0.06 0.00 0.10 0.00 0.00 66.02 64.26 1bvy s SER 304 CO 0.48 -0.43 1.82 0.22 0.98 0.00 0.00 173.24 176.31 1bvy h TYR 305 N 0.77 0.67 -0.57 5.02 3.20 -1.96 -1.32 116.97 122.78 1bvy h TYR 305 Ca -0.48 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.45 1bvy h TYR 305 Cb 1.25 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 39.25 1bvy h TYR 305 CO 0.45 0.44 0.31 0.87 -1.64 0.00 0.00 178.16 178.59 1bvy h LYS 306 N 0.70 0.58 -0.61 1.82 6.56 -1.99 -1.74 116.57 121.90 1bvy h LYS 306 Ca 0.19 -0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 59.74 1bvy h LYS 306 Cb -0.05 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.45 1bvy h LYS 306 CO -0.04 0.39 0.37 1.96 -2.06 0.00 0.00 179.45 180.07 1bvy h GLN 307 N 0.60 0.83 -0.97 3.15 4.20 -1.81 0.35 115.11 121.46 1bvy h GLN 307 Ca 0.25 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.93 1bvy h GLN 307 Cb 0.12 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 27.67 1bvy h GLN 307 CO -0.15 0.59 0.64 0.28 -0.67 0.00 0.00 178.83 179.52 1bvy h VAL 308 N 0.83 1.14 0.00 -0.54 2.07 -0.79 0.68 116.25 119.64 1bvy h VAL 308 Ca 0.22 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1bvy h VAL 308 Cb -0.02 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 29.58 1bvy h VAL 308 CO -0.04 0.22 0.00 0.11 0.02 0.00 0.00 177.57 177.88 1bvy h LYS 309 N 1.20 0.00 -0.01 1.57 1.79 -0.08 -1.67 116.57 119.37 1bvy h LYS 309 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 1bvy h LYS 309 Cb 0.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1bvy h LYS 309 CO -0.13 0.00 -0.18 1.04 -1.08 0.00 0.00 179.45 179.10 1bvy n GLN 310 N -2.80 0.91 -2.12 3.15 6.02 0.22 -4.55 117.38 118.21 1bvy n GLN 310 Ca -0.01 -0.47 -0.42 0.00 -0.01 0.00 0.00 57.00 56.08 1bvy n GLN 310 Cb 0.17 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.94 1bvy n GLN 310 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1bvy n LEU 311 N -0.63 6.29 -0.03 1.08 4.77 -0.63 -4.73 117.00 123.11 1bvy n LEU 311 Ca 0.14 -4.21 -0.16 0.00 -0.03 0.00 0.00 56.01 51.74 1bvy n LEU 311 Cb 0.32 -1.64 -0.08 0.00 -2.33 0.00 0.00 43.42 39.70 1bvy n LEU 311 CO 0.24 0.92 0.33 0.11 -1.33 0.00 0.00 177.39 177.66 1bvy h LYS 312 N 6.38 0.67 -0.03 3.23 1.79 -1.86 -1.33 116.57 125.42 1bvy h LYS 312 Ca 0.49 -0.53 -0.15 0.00 -2.18 0.00 0.00 60.65 58.28 1bvy h LYS 312 Cb 0.70 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.45 1bvy h LYS 312 CO 1.70 1.15 -0.67 -0.92 -1.08 0.00 0.00 179.45 179.63 1bvy h TYR 313 N 0.34 0.18 -0.33 -1.35 3.20 -1.97 -0.82 116.97 116.23 1bvy h TYR 313 Ca -0.04 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 61.65 1bvy h TYR 313 Cb 1.25 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1bvy h TYR 313 CO 0.10 0.76 -0.21 0.28 -1.64 0.00 0.00 178.16 177.45 1bvy h VAL 314 N 0.10 1.26 -0.66 1.81 2.07 -1.90 -0.22 116.25 118.72 1bvy h VAL 314 Ca -0.01 -1.25 0.02 0.00 0.82 0.00 0.00 66.70 66.27 1bvy h VAL 314 Cb 1.19 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 1bvy h VAL 314 CO 0.10 0.41 0.43 1.23 0.02 0.00 0.00 177.57 179.76 1bvy h GLY 315 N 0.99 0.91 1.72 2.17 0.00 -0.77 -2.55 103.07 105.55 1bvy h GLY 315 Ca 0.08 -0.33 -0.23 0.00 0.00 0.00 0.00 47.33 46.85 1bvy h GLY 315 CO 0.05 0.32 -1.06 -0.33 0.00 0.00 0.00 176.54 175.52 1bvy h MET 316 N 0.86 0.22 -0.31 4.80 2.07 -0.52 -2.73 114.93 119.32 1bvy h MET 316 Ca 0.25 -0.31 0.01 0.00 -2.07 0.00 0.00 59.70 57.57 1bvy h MET 316 Cb -0.05 0.11 -0.02 0.00 -1.87 0.00 0.00 31.60 29.77 1bvy h MET 316 CO -0.06 1.09 0.20 0.28 1.07 0.00 0.00 176.91 179.49 1bvy h VAL 317 N 0.09 1.07 -0.62 -2.22 2.07 -0.91 -0.85 116.25 114.88 1bvy h VAL 317 Ca -0.08 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 1bvy h VAL 317 Cb 1.75 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 1bvy h VAL 317 CO 0.17 0.07 0.22 -0.07 0.02 0.00 0.00 177.57 177.98 1bvy h LEU 318 N 0.41 0.87 -1.34 2.57 3.38 -1.51 -1.72 115.31 117.98 1bvy h LEU 318 Ca 0.12 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1bvy h LEU 318 Cb -0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1bvy h LEU 318 CO -0.03 0.82 -0.24 0.78 0.09 0.00 0.00 178.44 179.86 1bvy h ASN 319 N 0.87 0.13 0.61 -0.43 2.35 -1.23 -1.44 115.58 116.44 1bvy h ASN 319 Ca 0.20 -0.03 -0.23 0.00 -0.55 0.00 0.00 56.30 55.69 1bvy h ASN 319 Cb 0.24 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1bvy h ASN 319 CO -0.01 0.38 -1.01 -0.08 -1.65 0.00 0.00 177.43 175.06 1bvy h GLU 320 N 0.13 0.23 -0.62 0.81 4.57 -0.80 -1.22 114.58 117.68 1bvy h GLU 320 Ca 0.02 -0.30 -0.09 0.00 -1.18 0.00 0.00 59.36 57.81 1bvy h GLU 320 Cb 0.50 0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1bvy h GLU 320 CO 0.04 1.06 0.03 0.00 -1.18 0.00 0.00 179.01 178.95 1bvy h ALA 321 N 0.82 0.88 0.00 2.92 0.00 -0.99 -2.16 119.26 120.73 1bvy h ALA 321 Ca -0.07 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1bvy h ALA 321 Cb 1.69 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1bvy h ALA 321 CO 0.16 0.67 -0.17 -0.07 0.00 0.00 0.00 179.25 179.83 1bvy h LEU 322 N 0.98 0.00 -0.07 0.00 4.07 -1.21 0.16 115.31 119.24 1bvy h LEU 322 Ca 0.18 0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.97 1bvy h LEU 322 Cb 0.53 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.28 1bvy h LEU 322 CO 0.03 0.17 -0.62 -0.09 -1.08 0.00 0.00 178.44 176.84 1bvy h ARG 323 N 0.00 0.54 0.14 1.13 2.43 -0.76 -2.29 114.38 115.57 1bvy h ARG 323 Ca -0.00 -0.49 -0.20 0.00 -0.81 0.00 0.00 59.98 58.48 1bvy h ARG 323 Cb 0.30 0.12 0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1bvy h ARG 323 CO 0.02 1.12 -0.88 -0.07 -1.51 0.00 0.00 179.97 178.66 1bvy h LEU 324 N 0.14 0.46 -6.35 3.80 3.38 -1.26 -3.42 115.31 112.07 1bvy h LEU 324 Ca -0.06 -0.94 -0.59 0.00 0.09 0.00 0.00 57.88 56.38 1bvy h LEU 324 Cb 1.28 -0.15 -0.39 0.00 0.09 0.00 0.00 40.66 41.49 1bvy h LEU 324 CO 0.13 1.42 -0.94 0.79 0.09 0.00 0.00 178.44 179.93 1bvy n TRP 325 N -4.11 0.06 -1.75 1.13 7.02 0.56 -4.87 117.44 115.48 1bvy n TRP 325 Ca -0.15 -3.56 -0.42 0.00 -1.02 0.00 0.00 57.50 52.35 1bvy n TRP 325 Cb 0.83 -0.07 -0.03 0.00 -2.42 0.00 0.00 31.31 29.62 1bvy n TRP 325 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 1bvy s PRO 326 N -0.64 4.15 0.00 -0.99 0.04 -0.86 -4.53 135.00 132.16 1bvy s PRO 326 Ca 0.33 2.55 0.23 0.00 0.04 0.00 0.00 61.00 64.15 1bvy s PRO 326 Cb 0.07 -3.63 1.10 0.00 0.04 0.00 0.00 34.50 32.08 1bvy s PRO 326 CO -0.16 -0.83 1.76 0.25 0.04 0.00 0.00 177.00 178.06 1bvy n THR 327 N 4.78 0.33 -3.73 1.26 -2.24 -1.26 -3.03 114.28 110.39 1bvy n THR 327 Ca 0.18 0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.73 1bvy n THR 327 Cb 0.39 -0.69 -0.09 0.00 -2.10 0.00 0.00 70.33 67.83 1bvy n THR 327 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bvy n ALA 328 N -1.37 3.69 0.34 6.98 0.00 -1.26 -1.21 120.51 127.68 1bvy n ALA 328 Ca 0.09 -4.60 0.08 0.00 0.00 0.00 0.00 53.44 49.02 1bvy n ALA 328 Cb 0.22 -1.29 0.37 0.00 0.00 0.00 0.00 19.45 18.75 1bvy n ALA 328 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1bvy n PRO 329 N 1.92 0.09 -3.76 0.00 -0.04 -1.17 -4.73 135.00 127.31 1bvy n PRO 329 Ca 0.22 0.40 -0.13 0.00 -0.04 0.00 0.00 63.50 63.96 1bvy n PRO 329 Cb 0.36 -1.70 -0.08 0.00 -0.04 0.00 0.00 33.50 32.04 1bvy n PRO 329 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bvy s ALA 330 N -3.19 -0.74 0.03 0.55 0.00 -1.26 -1.84 121.76 115.30 1bvy s ALA 330 Ca 0.04 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1bvy s ALA 330 Cb 0.08 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 1bvy s ALA 330 CO 0.26 -0.31 -0.05 -0.59 0.00 0.00 0.00 175.76 175.08 1bvy s PHE 331 N -1.75 0.41 -0.05 0.00 -0.71 -1.18 -5.00 117.98 109.70 1bvy s PHE 331 Ca -0.11 -0.56 0.02 0.00 -1.04 0.00 0.00 56.93 55.25 1bvy s PHE 331 Cb -0.04 -0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.47 1bvy s PHE 331 CO 0.02 -0.17 -0.10 0.45 -1.34 0.00 0.00 175.22 174.08 1bvy s SER 332 N -1.61 4.41 0.17 1.98 0.15 -1.26 -1.34 113.70 116.20 1bvy s SER 332 Ca -0.12 -0.10 0.05 0.00 0.70 0.00 0.00 55.95 56.47 1bvy s SER 332 Cb -0.09 -1.04 -0.05 0.00 -1.71 0.00 0.00 66.02 63.14 1bvy s SER 332 CO -0.01 0.35 -0.09 -0.76 1.20 0.00 0.00 173.24 173.93 1bvy s LEU 333 N -0.85 2.47 0.01 3.45 1.43 -0.30 0.82 118.68 125.71 1bvy s LEU 333 Ca 0.13 -1.06 0.03 0.00 -1.03 0.00 0.00 54.13 52.20 1bvy s LEU 333 Cb -0.11 -0.37 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 1bvy s LEU 333 CO 0.02 -0.35 -0.10 -0.72 0.23 0.00 0.00 176.35 175.42 1bvy s TYR 334 N -3.30 0.93 -0.05 0.29 -0.85 -0.61 0.81 117.35 114.56 1bvy s TYR 334 Ca 0.20 -0.26 -0.30 0.00 -0.52 0.00 0.00 57.07 56.19 1bvy s TYR 334 Cb 0.03 -0.57 -0.05 0.00 0.38 0.00 0.00 41.96 41.75 1bvy s TYR 334 CO 0.03 -0.01 1.45 0.00 -1.52 0.00 0.00 175.55 175.50 1bvy s ALA 335 N -0.57 3.61 -0.92 9.51 0.00 0.12 -2.82 121.76 130.69 1bvy s ALA 335 Ca 0.01 0.80 0.21 0.00 0.00 0.00 0.00 51.96 52.98 1bvy s ALA 335 Cb -0.06 -3.65 0.87 0.00 0.00 0.00 0.00 23.12 20.29 1bvy s ALA 335 CO 0.00 -1.12 1.66 1.63 0.00 0.00 0.00 175.76 177.93 1bvy n LYS 336 N 6.20 0.04 -3.71 0.00 5.02 -0.71 0.38 118.16 125.38 1bvy n LYS 336 Ca 0.15 0.19 -0.06 0.00 -2.02 0.00 0.00 58.31 56.57 1bvy n LYS 336 Cb 0.44 -1.57 -0.02 0.00 -0.02 0.00 0.00 35.03 33.86 1bvy n LYS 336 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1bvy s GLU 337 N -3.05 1.30 0.36 1.97 2.02 -1.26 -4.82 118.70 115.21 1bvy s GLU 337 Ca 0.09 -0.67 -0.28 0.00 0.02 0.00 0.00 54.97 54.12 1bvy s GLU 337 Cb 0.13 0.47 -0.11 0.00 0.10 0.00 0.00 34.13 34.72 1bvy s GLU 337 CO 0.39 -0.59 1.50 -0.25 0.02 0.00 0.00 175.26 176.32 1bvy n ASP 338 N -0.43 3.73 -3.67 -0.19 8.00 -1.26 -3.90 116.55 118.83 1bvy n ASP 338 Ca -0.07 1.21 -0.05 0.00 0.71 0.00 0.00 54.79 56.59 1bvy n ASP 338 Cb 0.61 -1.60 -0.02 0.00 -0.02 0.00 0.00 41.12 40.09 1bvy n ASP 338 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1bvy s THR 339 N -0.88 0.00 -0.09 -3.53 2.01 -0.74 -4.92 115.64 107.49 1bvy s THR 339 Ca 0.56 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 62.14 1bvy s THR 339 Cb -0.49 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.34 1bvy s THR 339 CO 0.61 0.00 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.72 1bvy s VAL 340 N -3.22 3.12 -0.14 3.82 1.01 -1.26 0.55 120.40 124.28 1bvy s VAL 340 Ca 0.10 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1bvy s VAL 340 Cb -0.01 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1bvy s VAL 340 CO -0.02 0.55 0.15 -0.22 0.00 0.00 0.00 175.10 175.57 1bvy s LEU 341 N -0.16 4.33 -1.78 3.92 2.96 0.14 -4.35 118.68 123.73 1bvy s LEU 341 Ca -0.00 0.41 0.00 0.00 -0.22 0.00 0.00 54.13 54.32 1bvy s LEU 341 Cb -0.13 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.45 1bvy s LEU 341 CO 0.03 0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.99 1bvy n GLY 342 N 2.52 1.23 2.61 7.98 0.00 -1.26 -0.93 105.19 117.34 1bvy n GLY 342 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 1bvy n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvy n GLY 343 N -0.45 0.85 0.00 -0.02 0.00 -1.26 -4.75 105.19 99.57 1bvy n GLY 343 Ca -0.18 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1bvy n GLY 343 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bvy n GLU 344 N -1.23 0.00 -3.99 1.61 0.28 -0.11 -5.04 120.64 112.17 1bvy n GLU 344 Ca -0.08 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.61 1bvy n GLU 344 Cb 0.45 -0.14 -0.15 0.00 1.43 0.00 0.00 31.44 33.03 1bvy n GLU 344 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1bvy s TYR 345 N 0.00 3.53 0.28 -1.84 2.02 -0.28 -4.95 117.35 116.10 1bvy s TYR 345 Ca 0.00 -2.88 -0.29 0.00 -0.37 0.00 0.00 57.07 53.53 1bvy s TYR 345 Cb 0.00 -2.79 -0.10 0.00 -0.40 0.00 0.00 41.96 38.67 1bvy s TYR 345 CO 0.00 -0.94 1.20 -2.14 -1.57 0.00 0.00 175.55 172.10 1bvy s PRO 346 N 0.94 4.50 -0.03 -1.71 0.02 -1.26 -0.69 135.00 136.77 1bvy s PRO 346 Ca 0.11 1.98 0.07 0.00 0.02 0.00 0.00 61.00 63.18 1bvy s PRO 346 Cb -0.19 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 1bvy s PRO 346 CO -0.10 0.00 -0.26 -0.51 -0.33 0.00 0.00 177.00 175.81 1bvy s LEU 347 N -1.32 2.06 0.23 -5.54 1.43 0.19 -4.92 118.68 110.81 1bvy s LEU 347 Ca 0.48 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.98 1bvy s LEU 347 Cb -0.35 -1.35 -0.08 0.00 0.03 0.00 0.00 46.19 44.44 1bvy s LEU 347 CO 0.44 0.29 0.59 -1.61 0.23 0.00 0.00 176.35 176.30 1bvy s GLU 348 N -0.44 3.89 -0.14 1.70 2.02 -1.26 -1.79 118.70 122.67 1bvy s GLU 348 Ca 0.05 0.41 -0.40 0.00 0.02 0.00 0.00 54.97 55.05 1bvy s GLU 348 Cb -0.11 -2.66 -0.17 0.00 0.10 0.00 0.00 34.13 31.29 1bvy s GLU 348 CO 0.01 0.32 1.52 1.17 0.02 0.00 0.00 175.26 178.29 1bvy n LYS 349 N 0.01 0.92 0.00 1.61 4.81 -1.25 -1.06 118.16 123.20 1bvy n LYS 349 Ca -0.00 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.78 1bvy n LYS 349 Cb 0.52 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.60 1bvy n LYS 349 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bvy n GLY 350 N 3.31 2.23 3.71 3.14 0.00 0.16 -4.95 105.19 112.80 1bvy n GLY 350 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1bvy n GLY 350 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bvy n ASP 351 N 0.00 4.03 -4.74 1.61 9.92 -0.22 -4.51 116.55 122.65 1bvy n ASP 351 Ca 0.00 1.04 -0.41 0.00 -0.53 0.00 0.00 54.79 54.89 1bvy n ASP 351 Cb 0.00 -1.57 -0.05 0.00 -0.64 0.00 0.00 41.12 38.86 1bvy n ASP 351 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1bvy s GLU 352 N 1.61 4.71 -0.08 -1.24 2.12 -1.26 -0.70 118.70 123.86 1bvy s GLU 352 Ca 0.77 1.39 0.01 0.00 0.36 0.00 0.00 54.97 57.51 1bvy s GLU 352 Cb -0.49 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.53 1bvy s GLU 352 CO 0.33 0.33 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.77 1bvy s LEU 353 N -0.42 2.89 -0.17 2.70 1.43 0.24 -2.36 118.68 122.99 1bvy s LEU 353 Ca 0.43 -0.18 -0.02 0.00 -1.03 0.00 0.00 54.13 53.34 1bvy s LEU 353 Cb -0.24 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 1bvy s LEU 353 CO 0.29 0.29 -0.10 -0.32 0.23 0.00 0.00 176.35 176.74 1bvy s MET 354 N -0.38 3.33 -0.37 1.70 1.75 0.13 -1.15 119.30 124.30 1bvy s MET 354 Ca 0.05 -0.68 -0.19 0.00 -1.25 0.00 0.00 55.69 53.62 1bvy s MET 354 Cb -0.12 -2.78 0.00 0.00 2.84 0.00 0.00 34.83 34.77 1bvy s MET 354 CO 0.02 -0.01 0.55 0.08 -0.65 0.00 0.00 175.02 175.01 1bvy s VAL 355 N 0.93 4.97 -0.88 10.11 1.01 -0.45 -0.71 120.40 135.37 1bvy s VAL 355 Ca -0.02 0.30 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 1bvy s VAL 355 Cb -0.15 -4.02 0.11 0.00 0.00 0.00 0.00 36.38 32.32 1bvy s VAL 355 CO -0.00 -0.30 1.12 -0.76 0.00 0.00 0.00 175.10 175.15 1bvy s LEU 356 N 2.49 4.79 0.21 3.92 1.43 -0.81 -3.12 118.68 127.59 1bvy s LEU 356 Ca 0.20 -1.79 -0.09 0.00 -1.03 0.00 0.00 54.13 51.42 1bvy s LEU 356 Cb -0.15 -2.42 0.24 0.00 0.03 0.00 0.00 46.19 43.89 1bvy s LEU 356 CO 0.14 -1.17 1.82 0.40 0.23 0.00 0.00 176.35 177.77 1bvy h ILE 357 N 5.95 1.01 -0.21 -0.59 2.04 -1.68 -1.77 117.51 122.26 1bvy h ILE 357 Ca 0.07 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1bvy h ILE 357 Cb 1.03 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1bvy h ILE 357 CO 1.15 0.14 0.00 -0.65 0.00 0.00 0.00 178.15 178.79 1bvy h PRO 358 N 0.77 0.30 -0.25 2.37 0.11 -1.88 -1.64 132.00 131.77 1bvy h PRO 358 Ca 0.30 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.27 1bvy h PRO 358 Cb 0.14 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 1bvy h PRO 358 CO -0.16 0.32 -0.22 0.37 -0.21 0.00 0.00 178.00 178.11 1bvy h GLN 359 N 0.29 0.59 -0.49 1.05 5.75 -1.69 -3.04 115.11 117.57 1bvy h GLN 359 Ca 0.07 -0.30 0.08 0.00 -0.15 0.00 0.00 58.65 58.36 1bvy h GLN 359 Cb 0.20 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.68 1bvy h GLN 359 CO 0.00 0.89 0.08 1.25 -2.65 0.00 0.00 178.83 178.40 1bvy h LEU 360 N 0.30 -0.03 0.00 -2.39 5.85 -0.83 0.59 115.31 118.80 1bvy h LEU 360 Ca 0.04 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1bvy h LEU 360 Cb 0.76 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1bvy h LEU 360 CO 0.06 0.01 0.00 1.41 -0.34 0.00 0.00 178.44 179.58 1bvy n HIS 361 N -5.13 0.00 -0.76 1.25 8.25 -0.67 -0.95 115.22 117.21 1bvy n HIS 361 Ca 0.05 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.59 1bvy n HIS 361 Cb 0.24 -0.21 0.13 0.00 1.12 0.00 0.00 29.99 31.27 1bvy n HIS 361 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1bvy n ARG 362 N -1.21 2.00 -1.86 -0.41 1.74 0.18 -4.88 116.66 112.22 1bvy n ARG 362 Ca 0.05 -2.34 -0.41 0.00 -0.77 0.00 0.00 57.85 54.37 1bvy n ARG 362 Cb 0.06 -1.42 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 1bvy n ARG 362 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1bvy s ASP 363 N -2.21 5.51 0.42 0.55 -1.08 -0.12 -4.84 116.67 114.90 1bvy s ASP 363 Ca 0.26 1.27 0.08 0.00 -0.52 0.00 0.00 52.55 53.63 1bvy s ASP 363 Cb 0.22 -2.52 0.89 0.00 -1.46 0.00 0.00 42.92 40.04 1bvy s ASP 363 CO 0.04 -2.02 2.06 0.11 0.52 0.00 0.00 175.17 175.89 1bvy h LYS 364 N 14.55 0.49 0.00 4.34 1.57 -1.90 -0.73 116.57 134.89 1bvy h LYS 364 Ca -0.33 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1bvy h LYS 364 Cb 1.20 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1bvy h LYS 364 CO 1.06 0.33 0.00 0.25 -0.57 0.00 0.00 179.45 180.52 1bvy n THR 365 N -4.48 0.07 -0.03 -0.16 -2.24 -1.26 -1.46 114.28 104.72 1bvy n THR 365 Ca 0.03 0.02 -0.08 0.00 -2.27 0.00 0.00 64.05 61.75 1bvy n THR 365 Cb 0.06 -0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 67.56 1bvy n THR 365 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1bvy n ILE 366 N -1.05 1.17 1.15 2.28 2.08 -0.41 -4.79 119.36 119.79 1bvy n ILE 366 Ca 0.14 0.12 0.12 0.00 0.56 0.00 0.00 62.75 63.70 1bvy n ILE 366 Cb 0.08 -1.87 0.29 0.00 -0.75 0.00 0.00 39.64 37.39 1bvy n ILE 366 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 1bvy n TRP 367 N -3.85 0.00 -1.61 1.39 7.02 -0.46 -5.06 117.44 114.86 1bvy n TRP 367 Ca -0.13 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.35 1bvy n TRP 367 Cb 0.40 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 29.15 1bvy n TRP 367 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bvy n GLY 368 N 1.40 -1.79 0.33 6.99 0.00 -0.53 -4.61 105.19 106.97 1bvy n GLY 368 Ca 0.10 -1.76 0.12 0.00 0.00 0.00 0.00 46.02 44.48 1bvy n GLY 368 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bvy n ASP 369 N 0.18 1.36 -3.00 1.61 8.00 -1.26 -4.34 116.55 119.10 1bvy n ASP 369 Ca 0.00 -1.11 -0.32 0.00 0.71 0.00 0.00 54.79 54.07 1bvy n ASP 369 Cb 0.00 0.24 -0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1bvy n ASP 369 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1bvy n ASP 370 N -0.42 5.70 0.11 -2.24 5.75 -1.26 -4.82 116.55 119.36 1bvy n ASP 370 Ca 0.11 -3.72 0.13 0.00 -0.01 0.00 0.00 54.79 51.30 1bvy n ASP 370 Cb 0.39 -0.76 0.44 0.00 -1.03 0.00 0.00 41.12 40.16 1bvy n ASP 370 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1bvy n VAL 371 N -0.30 0.67 1.15 2.12 0.24 -1.26 -2.17 118.33 118.78 1bvy n VAL 371 Ca 0.40 -0.07 0.12 0.00 -2.04 0.00 0.00 64.34 62.75 1bvy n VAL 371 Cb 0.40 -0.81 0.24 0.00 -1.47 0.00 0.00 33.84 32.20 1bvy n VAL 371 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1bvy n GLU 372 N -2.21 0.87 -2.59 7.34 -0.58 -1.26 -4.90 120.64 117.30 1bvy n GLU 372 Ca 0.04 -0.59 -0.39 0.00 -0.42 0.00 0.00 57.16 55.80 1bvy n GLU 372 Cb 0.35 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.68 1bvy n GLU 372 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1bvy s GLU 373 N -2.54 4.62 -0.79 3.49 2.02 -0.92 -5.00 118.70 119.58 1bvy s GLU 373 Ca 0.21 1.62 -0.19 0.00 0.02 0.00 0.00 54.97 56.64 1bvy s GLU 373 Cb 0.19 -3.08 0.13 0.00 0.10 0.00 0.00 34.13 31.47 1bvy s GLU 373 CO 0.56 0.25 0.96 0.12 0.02 0.00 0.00 175.26 177.17 1bvy s PHE 374 N -1.29 3.10 -0.52 1.61 5.36 -1.26 -4.96 117.98 120.02 1bvy s PHE 374 Ca 0.46 -1.23 0.03 0.00 -0.96 0.00 0.00 56.93 55.24 1bvy s PHE 374 Cb -0.27 -4.16 0.15 0.00 -0.34 0.00 0.00 43.02 38.39 1bvy s PHE 374 CO 0.35 -1.41 0.34 0.50 -1.46 0.00 0.00 175.22 173.53 1bvy s ARG 375 N 2.59 1.63 0.57 10.12 3.52 -1.26 -4.98 118.95 131.15 1bvy s ARG 375 Ca 0.24 -2.48 0.27 0.00 -0.13 0.00 0.00 55.73 53.63 1bvy s ARG 375 Cb -0.12 -2.58 1.56 0.00 -1.56 0.00 0.00 34.95 32.25 1bvy s ARG 375 CO -0.02 -1.24 2.05 -1.35 -0.81 0.00 0.00 175.30 173.93 1bvy h PRO 376 N 6.11 0.00 -0.50 5.12 0.11 -1.93 -0.83 132.00 140.07 1bvy h PRO 376 Ca 0.08 0.00 0.15 0.00 0.11 0.00 0.00 66.00 66.34 1bvy h PRO 376 Cb 0.87 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 1bvy h PRO 376 CO 0.55 0.00 0.52 0.93 -0.21 0.00 0.00 178.00 179.79 1bvy h GLU 377 N 0.00 0.00 -0.94 1.05 3.07 -1.93 -1.37 114.58 114.46 1bvy h GLU 377 Ca 0.13 0.00 0.27 0.00 -0.50 0.00 0.00 59.36 59.26 1bvy h GLU 377 Cb 0.66 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.53 1bvy h GLU 377 CO -0.00 0.00 0.67 0.00 -1.40 0.00 0.00 179.01 178.28 1bvy h ARG 378 N 0.00 0.03 -0.67 2.33 3.08 -1.54 -0.31 114.38 117.29 1bvy h ARG 378 Ca 0.24 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1bvy h ARG 378 Cb 1.28 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.33 1bvy h ARG 378 CO -0.00 0.02 0.00 1.19 -1.07 0.00 0.00 179.97 180.11 1bvy n PHE 379 N -4.27 0.90 -0.27 3.04 3.72 -0.52 -4.43 117.46 115.63 1bvy n PHE 379 Ca 0.20 -0.45 0.06 0.00 -0.05 0.00 0.00 57.45 57.20 1bvy n PHE 379 Cb 0.99 -0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.72 1bvy n PHE 379 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1bvy h GLU 380 N 3.90 0.54 -3.01 -1.08 5.08 -1.20 -3.31 114.58 115.50 1bvy h GLU 380 Ca 0.00 -0.03 -0.62 0.00 -1.00 0.00 0.00 59.36 57.71 1bvy h GLU 380 Cb 0.90 -0.12 -0.41 0.00 0.50 0.00 0.00 28.75 29.62 1bvy h GLU 380 CO 0.00 0.36 -0.68 1.21 -1.00 0.00 0.00 179.01 178.90 1bvy s ASN 381 N -5.41 3.93 0.40 1.42 2.47 -1.26 -5.01 114.94 111.48 1bvy s ASN 381 Ca -0.12 -3.27 0.11 0.00 0.42 0.00 0.00 52.86 49.99 1bvy s ASN 381 Cb 0.21 -1.31 0.90 0.00 -1.45 0.00 0.00 41.25 39.60 1bvy s ASN 381 CO 0.77 -0.17 1.95 -0.65 -3.72 0.00 0.00 177.10 175.28 1bvy h PRO 382 N 5.98 0.55 -0.23 0.43 0.11 -1.88 0.30 132.00 137.25 1bvy h PRO 382 Ca 0.08 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 66.23 1bvy h PRO 382 Cb 0.85 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 1bvy h PRO 382 CO 0.60 0.37 0.28 0.77 -0.21 0.00 0.00 178.00 179.80 1bvy h SER 383 N 0.57 0.00 -0.97 -2.05 0.02 -1.94 0.88 113.55 110.06 1bvy h SER 383 Ca 0.32 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.31 1bvy h SER 383 Cb 0.49 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.97 1bvy h SER 383 CO -0.11 0.00 0.63 0.00 -1.14 0.00 0.00 176.83 176.22 1bvy h ALA 384 N 1.67 1.39 -2.19 3.77 0.00 -0.81 -3.43 119.26 119.65 1bvy h ALA 384 Ca 0.11 -0.04 -0.56 0.00 0.00 0.00 0.00 54.91 54.42 1bvy h ALA 384 Cb 0.66 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1bvy h ALA 384 CO -0.00 0.50 0.88 0.42 0.00 0.00 0.00 179.25 181.06 1bvy s ILE 385 N -6.02 4.20 0.52 0.00 1.01 0.30 -4.99 121.20 116.21 1bvy s ILE 385 Ca -0.12 1.47 -0.22 0.00 0.00 0.00 0.00 60.65 61.78 1bvy s ILE 385 Cb 0.19 -3.95 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 1bvy s ILE 385 CO 0.81 -0.10 1.25 -2.84 0.00 0.00 0.00 174.94 174.06 1bvy s PRO 386 N 3.30 3.37 0.14 2.79 0.02 -1.26 -4.94 135.00 138.43 1bvy s PRO 386 Ca 0.57 1.97 -0.34 0.00 0.02 0.00 0.00 61.00 63.22 1bvy s PRO 386 Cb -0.23 -2.26 -0.17 0.00 0.02 0.00 0.00 34.50 31.86 1bvy s PRO 386 CO 0.17 -0.92 1.08 0.94 -0.33 0.00 0.00 177.00 177.94 1bvy n GLN 387 N -0.90 0.82 -1.36 5.54 7.27 -1.26 -1.91 117.38 125.58 1bvy n GLN 387 Ca 0.10 0.29 -0.12 0.00 0.07 0.00 0.00 57.00 57.33 1bvy n GLN 387 Cb 0.47 -1.74 -0.05 0.00 2.41 0.00 0.00 30.24 31.33 1bvy n GLN 387 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1bvy n HIS 388 N 1.36 0.00 -0.01 3.69 8.25 -1.26 -4.87 115.22 122.39 1bvy n HIS 388 Ca 0.16 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.58 1bvy n HIS 388 Cb 0.22 -2.38 -0.12 0.00 1.12 0.00 0.00 29.99 28.83 1bvy n HIS 388 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bvy n ALA 389 N 1.23 1.71 -3.86 -1.41 0.00 -0.80 -4.71 120.51 112.67 1bvy n ALA 389 Ca -0.12 -0.72 -0.29 0.00 0.00 0.00 0.00 53.44 52.30 1bvy n ALA 389 Cb 0.45 -0.84 -0.16 0.00 0.00 0.00 0.00 19.45 18.91 1bvy n ALA 389 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1bvy s PHE 390 N -2.75 1.97 -0.36 0.00 5.36 -1.26 -4.49 117.98 116.46 1bvy s PHE 390 Ca -0.04 -1.55 0.14 0.00 -0.96 0.00 0.00 56.93 54.52 1bvy s PHE 390 Cb 0.08 -1.49 0.44 0.00 -0.34 0.00 0.00 43.02 41.71 1bvy s PHE 390 CO 0.82 -0.75 0.96 1.63 -1.46 0.00 0.00 175.22 176.43 1bvy n LYS 391 N 4.79 1.66 0.05 10.12 5.02 -1.26 -4.89 118.16 133.64 1bvy n LYS 391 Ca -0.09 -3.57 0.08 0.00 -2.02 0.00 0.00 58.31 52.71 1bvy n LYS 391 Cb 0.45 -1.52 0.37 0.00 -0.02 0.00 0.00 35.03 34.30 1bvy n LYS 391 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1bvy n PRO 392 N -0.12 0.08 -0.23 1.97 -0.04 -1.26 -2.49 135.00 132.91 1bvy n PRO 392 Ca 0.17 0.35 0.08 0.00 -0.04 0.00 0.00 63.50 64.06 1bvy n PRO 392 Cb 0.76 -1.65 0.18 0.00 -0.04 0.00 0.00 33.50 32.75 1bvy n PRO 392 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1bvy n PHE 393 N -1.80 0.43 -2.23 0.54 3.72 -1.26 -4.76 117.46 112.10 1bvy n PHE 393 Ca 0.03 -0.86 0.00 0.00 -0.05 0.00 0.00 57.45 56.57 1bvy n PHE 393 Cb 0.17 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 1bvy n PHE 393 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bvy n GLY 394 N -0.80 -1.05 2.85 1.37 0.00 -1.04 0.12 105.19 106.64 1bvy n GLY 394 Ca 0.16 -1.54 -0.14 0.00 0.00 0.00 0.00 46.02 44.51 1bvy n GLY 394 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bvy s ASN 395 N -4.00 0.15 0.77 1.61 3.84 -1.26 -4.84 114.94 111.20 1bvy s ASN 395 Ca 0.00 -0.01 0.00 0.00 0.21 0.00 0.00 52.86 53.06 1bvy s ASN 395 Cb 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 41.25 40.65 1bvy s ASN 395 CO 0.00 -0.04 0.00 0.61 -2.79 0.00 0.00 177.10 174.88 1bvy n GLY 396 N 3.47 2.54 0.23 1.21 0.00 -1.26 -1.66 105.19 109.72 1bvy n GLY 396 Ca -0.18 -0.29 0.16 0.00 0.00 0.00 0.00 46.02 45.71 1bvy n GLY 396 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1bvy h GLN 397 N 0.00 0.00 -0.69 1.61 3.07 -2.00 -0.76 115.11 116.34 1bvy h GLN 397 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.67 1bvy h GLN 397 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.52 1bvy h GLN 397 CO 0.00 0.00 0.09 0.54 0.09 0.00 0.00 178.83 179.55 1bvy n ARG 398 N -2.75 4.08 -1.07 0.06 5.12 -0.82 -4.96 116.66 116.32 1bvy n ARG 398 Ca 0.01 -2.74 -0.29 0.00 -1.93 0.00 0.00 57.85 52.89 1bvy n ARG 398 Cb 0.24 -2.16 0.22 0.00 -1.16 0.00 0.00 32.46 29.61 1bvy n ARG 398 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bvy s ALA 399 N -2.60 0.62 -0.19 7.54 0.00 -0.29 -4.48 121.76 122.36 1bvy s ALA 399 Ca 0.48 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 51.42 1bvy s ALA 399 Cb 0.37 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 1bvy s ALA 399 CO 0.13 -3.40 1.77 0.00 0.00 0.00 0.00 175.76 174.26 1bvy h ILE 401 N 6.27 0.00 -0.60 0.00 2.10 -1.90 -3.02 117.51 120.36 1bvy h ILE 401 Ca -0.37 -0.29 -0.08 0.00 1.08 0.00 0.00 64.86 65.20 1bvy h ILE 401 Cb 1.18 1.24 -0.05 0.00 -1.09 0.00 0.00 36.82 38.10 1bvy h ILE 401 CO 0.99 0.00 0.10 0.61 -1.08 0.00 0.00 178.15 178.77 1bvy n GLY 402 N -0.39 3.12 0.05 8.18 0.00 -1.26 -4.59 105.19 110.30 1bvy n GLY 402 Ca -0.01 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 1bvy n GLY 402 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1bvy h GLN 403 N 3.31 0.03 -0.34 1.61 4.15 -1.87 -1.31 115.11 120.68 1bvy h GLN 403 Ca 0.09 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1bvy h GLN 403 Cb 2.03 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 29.70 1bvy h GLN 403 CO 0.56 0.06 0.22 1.96 -1.93 0.00 0.00 178.83 179.69 1bvy h GLN 404 N -0.01 0.46 -0.15 1.69 7.50 -1.81 -0.95 115.11 121.84 1bvy h GLN 404 Ca 0.01 -0.04 0.04 0.00 0.50 0.00 0.00 58.65 59.17 1bvy h GLN 404 Cb 0.04 -0.10 -0.05 0.00 0.05 0.00 0.00 27.48 27.42 1bvy h GLN 404 CO -0.00 0.33 -0.15 0.35 -1.50 0.00 0.00 178.83 177.86 1bvy h PHE 405 N 0.46 -0.37 -0.32 2.96 3.04 -1.77 0.20 116.94 121.14 1bvy h PHE 405 Ca 0.12 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.12 1bvy h PHE 405 Cb -0.02 0.19 -0.03 0.00 2.56 0.00 0.00 35.95 38.65 1bvy h PHE 405 CO -0.04 -0.21 0.15 0.00 -2.02 0.00 0.00 178.31 176.18 1bvy h ALA 406 N 0.91 0.39 -0.04 2.41 0.00 -1.10 0.13 119.26 121.95 1bvy h ALA 406 Ca 0.10 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1bvy h ALA 406 Cb 0.32 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bvy h ALA 406 CO -0.25 -0.24 -0.69 -0.07 0.00 0.00 0.00 179.25 178.00 1bvy h LEU 407 N 0.31 0.25 -0.33 0.00 3.38 -0.91 -0.21 115.31 117.81 1bvy h LEU 407 Ca 0.14 -0.16 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1bvy h LEU 407 Cb 0.07 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1bvy h LEU 407 CO -0.11 0.87 -0.29 -0.74 0.09 0.00 0.00 178.44 178.25 1bvy h HIS 408 N 0.15 0.94 -0.37 1.13 2.76 -0.26 -1.78 115.15 117.71 1bvy h HIS 408 Ca -0.02 -0.27 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 1bvy h HIS 408 Cb 1.23 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.98 1bvy h HIS 408 CO 0.02 1.04 0.24 1.49 -1.30 0.00 0.00 177.93 179.43 1bvy h GLU 409 N 0.56 0.48 -0.33 5.26 4.81 -0.56 -2.41 114.58 122.40 1bvy h GLU 409 Ca 0.06 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 1bvy h GLU 409 Cb 0.87 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1bvy h GLU 409 CO 0.07 0.33 -0.41 0.00 -0.73 0.00 0.00 179.01 178.27 1bvy h ALA 410 N 1.13 0.64 0.09 2.92 0.00 -0.95 -0.82 119.26 122.27 1bvy h ALA 410 Ca 0.13 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1bvy h ALA 410 Cb -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1bvy h ALA 410 CO -0.03 0.67 -0.04 1.15 0.00 0.00 0.00 179.25 181.00 1bvy h THR 411 N 0.67 1.04 -0.24 0.00 2.02 -1.33 0.66 112.91 115.74 1bvy h THR 411 Ca 0.05 -0.49 0.06 0.00 0.77 0.00 0.00 66.41 66.80 1bvy h THR 411 Cb 0.98 1.36 -0.06 0.00 -1.74 0.00 0.00 68.15 68.68 1bvy h THR 411 CO 0.09 0.12 -0.18 0.25 0.37 0.00 0.00 175.52 176.17 1bvy h LEU 412 N -0.34 -0.58 -0.18 2.58 5.85 -1.42 -0.79 115.31 120.44 1bvy h LEU 412 Ca -0.01 0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1bvy h LEU 412 Cb 0.29 0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1bvy h LEU 412 CO 0.02 -0.22 -0.23 0.58 -0.34 0.00 0.00 178.44 178.25 1bvy h VAL 413 N -0.17 1.34 -0.77 1.05 2.07 -1.06 -1.33 116.25 117.38 1bvy h VAL 413 Ca 0.13 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 1bvy h VAL 413 Cb 0.38 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 1bvy h VAL 413 CO -0.34 0.43 0.39 0.25 0.02 0.00 0.00 177.57 178.33 1bvy h LEU 414 N 0.12 0.99 0.14 2.57 5.85 -0.87 0.19 115.31 124.30 1bvy h LEU 414 Ca 0.02 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1bvy h LEU 414 Cb 0.80 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1bvy h LEU 414 CO 0.06 0.82 -0.13 1.23 -0.34 0.00 0.00 178.44 180.08 1bvy h GLY 415 N 1.07 -0.28 1.53 3.75 0.00 -1.08 -0.04 103.07 108.03 1bvy h GLY 415 Ca 0.27 0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.74 1bvy h GLY 415 CO -0.04 -0.13 0.27 -0.33 0.00 0.00 0.00 176.54 176.31 1bvy h MET 416 N -0.29 0.62 -0.23 4.80 2.86 -0.93 -1.02 114.93 120.73 1bvy h MET 416 Ca 0.00 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1bvy h MET 416 Cb 0.28 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1bvy h MET 416 CO -0.03 0.44 0.12 0.52 1.06 0.00 0.00 176.91 179.02 1bvy h MET 417 N 0.63 0.33 0.00 1.72 2.07 0.08 -1.88 114.93 117.88 1bvy h MET 417 Ca 0.17 -0.05 -0.09 0.00 -2.07 0.00 0.00 59.70 57.66 1bvy h MET 417 Cb -0.02 -0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 29.64 1bvy h MET 417 CO -0.03 0.33 -0.41 -0.07 1.07 0.00 0.00 176.91 177.79 1bvy h LEU 418 N 0.25 0.00 -0.00 1.22 3.38 -0.56 -2.39 115.31 117.21 1bvy h LEU 418 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1bvy h LEU 418 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1bvy h LEU 418 CO -0.01 0.41 -0.00 0.50 0.09 0.00 0.00 178.44 179.43 1bvy h LYS 419 N 0.00 0.01 0.00 1.13 3.64 -1.06 -3.37 116.57 116.92 1bvy h LYS 419 Ca -0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1bvy h LYS 419 Cb 0.83 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1bvy h LYS 419 CO 0.05 0.39 -0.61 0.72 -2.27 0.00 0.00 179.45 177.73 1bvy n HIS 420 N -4.90 0.44 -3.83 1.91 8.25 -0.72 -4.81 115.22 111.56 1bvy n HIS 420 Ca -0.08 0.13 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 1bvy n HIS 420 Cb 0.20 -0.58 -0.09 0.00 1.12 0.00 0.00 29.99 30.64 1bvy n HIS 420 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1bvy s PHE 421 N -3.14 -0.01 0.07 4.41 0.08 -0.91 -0.76 117.98 117.72 1bvy s PHE 421 Ca 0.07 -0.10 -0.13 0.00 0.12 0.00 0.00 56.93 56.89 1bvy s PHE 421 Cb 0.14 -0.00 -0.06 0.00 -0.57 0.00 0.00 43.02 42.53 1bvy s PHE 421 CO 0.72 -0.38 0.45 -0.51 -0.10 0.00 0.00 175.22 175.39 1bvy s ASP 422 N -1.70 6.75 -0.05 1.36 1.01 -0.05 -4.62 116.67 119.37 1bvy s ASP 422 Ca -0.10 0.93 0.04 0.00 0.71 0.00 0.00 52.55 54.13 1bvy s ASP 422 Cb -0.04 -2.23 -0.02 0.00 1.01 0.00 0.00 42.92 41.64 1bvy s ASP 422 CO -0.00 0.20 -0.17 -0.36 0.21 0.00 0.00 175.17 175.04 1bvy s PHE 423 N -1.32 2.62 -0.10 4.23 0.08 -1.26 -0.57 117.98 121.66 1bvy s PHE 423 Ca 0.32 -0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.11 1bvy s PHE 423 Cb -0.15 -1.62 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1bvy s PHE 423 CO 0.17 0.08 -0.24 -2.00 -0.10 0.00 0.00 175.22 173.13 1bvy s GLU 424 N -0.57 3.04 -1.42 0.44 2.12 0.12 -4.97 118.70 117.46 1bvy s GLU 424 Ca 0.08 -0.87 -0.12 0.00 0.36 0.00 0.00 54.97 54.42 1bvy s GLU 424 Cb -0.11 -2.30 0.06 0.00 0.26 0.00 0.00 34.13 32.04 1bvy s GLU 424 CO 0.01 0.16 2.23 -3.47 -0.54 0.00 0.00 175.26 173.65 1bvy n ASP 425 N 3.57 5.03 0.27 -1.70 2.03 -1.26 -1.50 116.55 122.99 1bvy n ASP 425 Ca -0.19 -2.90 0.12 0.00 0.52 0.00 0.00 54.79 52.34 1bvy n ASP 425 Cb 0.53 -1.58 0.76 0.00 -0.72 0.00 0.00 41.12 40.11 1bvy n ASP 425 CO 0.00 0.00 0.00 1.12 -1.92 0.00 0.00 177.20 176.40 1bvy h HIS 426 N 5.73 0.00 -0.01 -0.67 2.07 -1.93 -0.76 115.15 119.57 1bvy h HIS 426 Ca 0.57 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.09 1bvy h HIS 426 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 1bvy h HIS 426 CO 1.46 0.07 -0.43 0.25 -3.07 0.00 0.00 177.93 176.21 1bvy n THR 427 N -3.95 0.00 -3.45 6.12 -2.24 -1.26 -4.96 114.28 104.54 1bvy n THR 427 Ca -0.03 -0.21 -0.22 0.00 -2.27 0.00 0.00 64.05 61.33 1bvy n THR 427 Cb 0.16 0.97 0.05 0.00 -2.10 0.00 0.00 70.33 69.41 1bvy n THR 427 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bvy n ASN 428 N -0.28 -6.09 -4.70 3.42 4.05 -0.29 -4.82 115.26 106.55 1bvy n ASN 428 Ca 0.10 -0.83 -0.44 0.00 0.45 0.00 0.00 54.58 53.86 1bvy n ASN 428 Cb 0.43 -4.34 -0.03 0.00 1.23 0.00 0.00 39.78 37.07 1bvy n ASN 428 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1bvy n TYR 429 N -3.60 2.47 -3.14 1.20 9.36 -1.26 -4.98 117.16 117.21 1bvy n TYR 429 Ca -0.08 0.25 -0.41 0.00 3.32 0.00 0.00 57.90 60.98 1bvy n TYR 429 Cb 0.60 -2.57 -0.07 0.00 -0.63 0.00 0.00 39.34 36.68 1bvy n TYR 429 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1bvy s GLU 430 N 0.42 4.03 0.14 2.98 2.12 -1.26 -5.02 118.70 122.10 1bvy s GLU 430 Ca 0.73 0.41 -0.33 0.00 0.36 0.00 0.00 54.97 56.14 1bvy s GLU 430 Cb -0.60 -3.68 -0.13 0.00 0.26 0.00 0.00 34.13 29.99 1bvy s GLU 430 CO 0.41 -0.45 1.67 -0.11 -0.54 0.00 0.00 175.26 176.24 1bvy n LEU 431 N 5.72 3.45 -3.64 2.70 7.94 -1.26 -4.96 117.00 126.95 1bvy n LEU 431 Ca -0.02 1.06 -0.28 0.00 -1.11 0.00 0.00 56.01 55.66 1bvy n LEU 431 Cb 0.49 -1.47 -0.16 0.00 0.53 0.00 0.00 43.42 42.81 1bvy n LEU 431 CO 0.43 -0.10 -0.34 -0.62 -1.11 0.00 0.00 177.39 175.65 1bvy s ASP 432 N 1.49 3.17 -0.43 1.96 2.15 -1.26 -5.07 116.67 118.69 1bvy s ASP 432 Ca 0.80 -1.07 -0.19 0.00 0.43 0.00 0.00 52.55 52.52 1bvy s ASP 432 Cb -0.62 -0.47 0.02 0.00 -0.30 0.00 0.00 42.92 41.55 1bvy s ASP 432 CO 0.38 -0.38 0.54 -0.63 -0.17 0.00 0.00 175.17 174.91 1bvy s ILE 433 N 1.97 4.96 0.02 4.11 1.01 -1.26 -0.42 121.20 131.58 1bvy s ILE 433 Ca 0.05 -0.12 -0.27 0.00 0.00 0.00 0.00 60.65 60.30 1bvy s ILE 433 Cb -0.16 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 1bvy s ILE 433 CO -0.21 -0.51 0.87 -0.75 0.00 0.00 0.00 174.94 174.33 1bvy s LYS 434 N 2.48 4.55 -0.21 2.79 2.20 0.52 -4.88 119.74 127.18 1bvy s LYS 434 Ca 0.17 1.23 -0.05 0.00 -0.36 0.00 0.00 55.97 56.96 1bvy s LYS 434 Cb -0.16 -3.42 -0.02 0.00 -1.51 0.00 0.00 37.83 32.73 1bvy s LYS 434 CO 0.16 0.11 -0.01 -1.21 -0.36 0.00 0.00 175.35 174.04 1bvy s GLU 435 N 0.50 3.51 0.00 4.03 2.02 -1.26 -2.25 118.70 125.26 1bvy s GLU 435 Ca 0.45 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.87 1bvy s GLU 435 Cb -0.21 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 30.96 1bvy s GLU 435 CO 0.25 -0.09 0.00 0.25 0.02 0.00 0.00 175.26 175.69 1bvy n THR 436 N 4.52 0.00 0.27 3.63 -2.24 -1.26 -4.90 114.28 114.30 1bvy n THR 436 Ca -0.17 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.77 1bvy n THR 436 Cb 0.51 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.35 1bvy n THR 436 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1bvy h LEU 437 N 0.00 0.00 -9.52 3.22 5.85 -1.96 -3.46 115.31 109.44 1bvy h LEU 437 Ca 0.00 0.00 -0.57 0.00 0.84 0.00 0.00 57.88 58.15 1bvy h LEU 437 Cb 0.00 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.90 1bvy h LEU 437 CO 0.00 0.02 -0.54 0.42 -0.34 0.00 0.00 178.44 178.00 1bvy s THR 438 N -3.62 0.91 -0.01 1.05 -4.23 -1.26 -4.59 115.64 103.89 1bvy s THR 438 Ca 0.02 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.54 1bvy s THR 438 Cb 0.09 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 71.45 1bvy s THR 438 CO 0.57 0.00 0.00 -0.76 -0.54 0.00 0.00 174.62 173.89 1bvy s LEU 439 N -3.64 3.52 -0.05 4.79 1.43 -0.35 -4.28 118.68 120.10 1bvy s LEU 439 Ca 0.24 0.00 -0.23 0.00 -1.03 0.00 0.00 54.13 53.10 1bvy s LEU 439 Cb 0.04 -2.00 0.05 0.00 0.03 0.00 0.00 46.19 44.31 1bvy s LEU 439 CO 0.13 0.29 0.52 -1.59 0.23 0.00 0.00 176.35 175.92 1bvy s LYS 440 N -1.51 0.87 -1.18 1.70 -2.85 -0.95 -4.63 119.74 111.18 1bvy s LYS 440 Ca 0.19 0.13 -0.20 0.00 -1.00 0.00 0.00 55.97 55.08 1bvy s LYS 440 Cb -0.11 0.40 0.05 0.00 -2.06 0.00 0.00 37.83 36.11 1bvy s LYS 440 CO 0.10 -0.25 1.66 -1.25 0.10 0.00 0.00 175.35 175.70 1bvy s PRO 441 N -1.11 3.70 0.09 1.78 0.04 -1.26 -0.36 135.00 137.88 1bvy s PRO 441 Ca -0.11 -1.56 -0.33 0.00 0.04 0.00 0.00 61.00 59.04 1bvy s PRO 441 Cb -0.02 -5.44 -0.12 0.00 0.04 0.00 0.00 34.50 28.96 1bvy s PRO 441 CO 0.07 -2.39 1.74 -1.91 0.04 0.00 0.00 177.00 174.55 1bvy n GLU 442 N 8.59 2.41 -1.14 4.56 4.07 0.43 -1.78 120.64 137.78 1bvy n GLU 442 Ca 0.43 0.87 -0.05 0.00 -0.06 0.00 0.00 57.16 58.35 1bvy n GLU 442 Cb 0.48 -2.71 -0.02 0.00 -0.06 0.00 0.00 31.44 29.13 1bvy n GLU 442 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1bvy n GLY 443 N 3.95 0.72 3.68 8.31 0.00 -1.26 -4.54 105.19 116.05 1bvy n GLY 443 Ca 0.19 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 1bvy n GLY 443 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bvy s PHE 444 N -2.03 2.54 0.16 1.61 5.36 -0.73 -4.98 117.98 119.90 1bvy s PHE 444 Ca 0.00 0.59 0.08 0.00 -0.96 0.00 0.00 56.93 56.63 1bvy s PHE 444 Cb 0.00 -3.76 -0.04 0.00 -0.34 0.00 0.00 43.02 38.87 1bvy s PHE 444 CO 0.00 -2.98 -0.16 0.14 -1.46 0.00 0.00 175.22 170.75 1bvy s VAL 445 N 3.00 1.65 0.30 3.12 -7.23 -1.26 -1.98 120.40 118.00 1bvy s VAL 445 Ca 0.67 -1.91 -0.04 0.00 -1.81 0.00 0.00 61.98 58.89 1bvy s VAL 445 Cb -0.32 -1.79 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 1bvy s VAL 445 CO 0.27 -0.40 0.41 0.68 -0.31 0.00 0.00 175.10 175.75 1bvy s VAL 446 N -2.26 0.00 -0.06 1.32 -7.23 -0.70 -4.71 120.40 106.76 1bvy s VAL 446 Ca 0.15 -1.64 0.05 0.00 -1.81 0.00 0.00 61.98 58.74 1bvy s VAL 446 Cb -0.04 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 1bvy s VAL 446 CO 0.05 0.00 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.07 1bvy s LYS 447 N -3.46 2.41 -0.11 4.82 1.02 -0.56 0.29 119.74 124.15 1bvy s LYS 447 Ca 0.31 -0.83 -0.03 0.00 0.02 0.00 0.00 55.97 55.43 1bvy s LYS 447 Cb 0.01 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.26 1bvy s LYS 447 CO 0.17 0.33 0.02 0.00 -0.92 0.00 0.00 175.35 174.95 1bvy s ALA 448 N -0.06 3.34 -0.27 5.17 0.00 -1.26 0.13 121.76 128.82 1bvy s ALA 448 Ca -0.05 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1bvy s ALA 448 Cb -0.14 -1.61 0.06 0.00 0.00 0.00 0.00 23.12 21.44 1bvy s ALA 448 CO 0.04 0.49 -0.10 0.15 0.00 0.00 0.00 175.76 176.35 1bvy s LYS 449 N -0.59 2.17 0.29 0.00 1.02 0.26 -4.96 119.74 117.94 1bvy s LYS 449 Ca 0.10 -1.38 -0.29 0.00 0.02 0.00 0.00 55.97 54.42 1bvy s LYS 449 Cb -0.12 -2.91 -0.13 0.00 -0.52 0.00 0.00 37.83 34.15 1bvy s LYS 449 CO 0.02 -0.60 1.23 0.45 -0.92 0.00 0.00 175.35 175.54 1bvy n SER 450 N 4.42 2.28 -0.41 2.83 2.88 -1.26 -0.87 113.62 123.49 1bvy n SER 450 Ca -0.13 1.18 0.14 0.00 -1.33 0.00 0.00 58.87 58.74 1bvy n SER 450 Cb 0.42 -1.40 0.56 0.00 -0.75 0.00 0.00 64.21 63.03 1bvy n SER 450 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1bvy n LYS 451 N 1.01 1.52 -3.52 -1.46 5.02 0.06 -4.82 118.16 115.97 1bvy n LYS 451 Ca 0.08 -0.83 -0.20 0.00 -2.02 0.00 0.00 58.31 55.34 1bvy n LYS 451 Cb 0.33 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.94 1bvy n LYS 451 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1bvy n LYS 452 N -0.02 -7.01 -3.76 1.97 4.76 -1.26 -5.00 118.16 107.84 1bvy n LYS 452 Ca 0.19 0.82 -0.37 0.00 -2.87 0.00 0.00 58.31 56.08 1bvy n LYS 452 Cb 0.33 -5.83 -0.13 0.00 -1.84 0.00 0.00 35.03 27.56 1bvy n LYS 452 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1bvy s ILE 453 N -3.36 4.08 0.88 -0.18 1.01 -1.26 -5.11 121.20 117.27 1bvy s ILE 453 Ca 0.24 -0.54 -0.12 0.00 0.00 0.00 0.00 60.65 60.23 1bvy s ILE 453 Cb -0.11 -3.04 0.12 0.00 0.01 0.00 0.00 42.46 39.44 1bvy s ILE 453 CO 0.74 0.15 1.10 -2.84 0.00 0.00 0.00 174.94 174.09 1bvy s PRO 454 N 1.54 1.36 0.00 2.79 0.02 -1.26 -4.97 135.00 134.48 1bvy s PRO 454 Ca 0.04 0.71 0.00 0.00 0.02 0.00 0.00 61.00 61.77 1bvy s PRO 454 Cb -0.17 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.53 1bvy s PRO 454 CO 0.03 -2.14 0.00 1.47 -0.33 0.00 0.00 177.00 176.03 1bvy n LEU 455 N -3.80 0.00 -4.71 -5.54 -0.00 -1.22 -4.78 117.00 96.95 1bvy n LEU 455 Ca 0.07 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 55.68 1bvy n LEU 455 Cb 0.56 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.93 1bvy n LEU 455 CO 0.56 0.00 0.35 -0.83 -0.00 0.00 0.00 177.39 177.47 1bvy s GLY 456 N 0.00 2.45 0.00 1.47 0.00 -1.22 -4.11 107.32 105.91 1bvy s GLY 456 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.71 1bvy s GLY 456 CO 0.00 1.12 0.00 0.61 0.00 0.00 0.00 173.10 174.83 1bvy n GLY 457 N 3.27 0.53 0.00 0.20 0.00 -1.26 -4.91 105.19 103.02 1bvy n GLY 457 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1bvy n GLY 457 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71