#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bs4 s LYS 2 N 0.00 3.99 -0.03 2.12 3.01 -1.26 -5.08 119.74 122.49 2bs4 s LYS 2 Ca 0.00 -0.32 0.02 0.00 -1.01 0.00 0.00 55.97 54.66 2bs4 s LYS 2 Cb 0.00 -3.44 0.01 0.00 -1.01 0.00 0.00 37.83 33.38 2bs4 s LYS 2 CO 0.00 0.06 -0.06 0.08 0.51 0.00 0.00 175.35 175.94 2bs4 s VAL 3 N 1.01 0.60 -0.06 3.17 1.01 -1.26 -1.53 120.40 123.35 2bs4 s VAL 3 Ca 0.06 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 61.87 2bs4 s VAL 3 Cb -0.14 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 2bs4 s VAL 3 CO 0.04 0.21 -0.24 -1.10 0.00 0.00 0.00 175.10 174.00 2bs4 s GLN 4 N 0.41 2.53 0.03 2.72 -1.52 -0.31 -4.98 119.66 118.54 2bs4 s GLN 4 Ca -0.06 -0.88 0.08 0.00 -1.95 0.00 0.00 55.36 52.56 2bs4 s GLN 4 Cb -0.10 -2.12 -0.03 0.00 -0.22 0.00 0.00 33.01 30.54 2bs4 s GLN 4 CO 0.00 0.35 -0.24 -0.47 -0.25 0.00 0.00 175.29 174.68 2bs4 s TYR 5 N -0.11 2.13 0.11 0.91 6.14 -1.26 -1.20 117.35 124.07 2bs4 s TYR 5 Ca -0.05 -0.40 -0.17 0.00 0.64 0.00 0.00 57.07 57.10 2bs4 s TYR 5 Cb -0.14 -1.29 0.04 0.00 0.42 0.00 0.00 41.96 40.98 2bs4 s TYR 5 CO 0.04 0.08 0.41 0.00 0.64 0.00 0.00 175.55 176.72 2bs4 h ASP 7 N 2.47 0.63 -3.54 0.00 3.32 -1.25 -3.33 116.42 114.72 2bs4 h ASP 7 Ca -0.33 -0.63 -0.63 0.00 0.02 0.00 0.00 57.03 55.46 2bs4 h ASP 7 Cb 1.25 -0.19 -0.37 0.00 0.22 0.00 0.00 39.33 40.24 2bs4 h ASP 7 CO 0.46 1.16 -0.80 -0.44 -1.72 0.00 0.00 179.24 177.90 2bs4 s SER 8 N -6.68 3.67 -0.21 6.45 0.01 -0.76 -1.78 113.70 114.41 2bs4 s SER 8 Ca -0.13 -1.03 -0.13 0.00 1.31 0.00 0.00 55.95 55.97 2bs4 s SER 8 Cb 0.06 -1.29 -0.05 0.00 0.21 0.00 0.00 66.02 64.96 2bs4 s SER 8 CO 0.83 -0.17 0.26 -0.22 0.41 0.00 0.00 173.24 174.36 2bs4 s LEU 9 N 1.34 4.16 -0.20 2.44 2.96 -0.60 -1.99 118.68 126.80 2bs4 s LEU 9 Ca -0.03 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.21 2bs4 s LEU 9 Cb -0.17 -2.30 0.01 0.00 0.50 0.00 0.00 46.19 44.23 2bs4 s LEU 9 CO -0.07 0.03 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.16 2bs4 s VAL 10 N 0.97 2.52 -0.46 1.68 1.01 0.54 -1.01 120.40 125.65 2bs4 s VAL 10 Ca 0.13 -0.82 -0.17 0.00 0.00 0.00 0.00 61.98 61.12 2bs4 s VAL 10 Cb -0.14 -2.12 0.05 0.00 0.00 0.00 0.00 36.38 34.18 2bs4 s VAL 10 CO 0.05 0.47 0.47 -0.63 0.00 0.00 0.00 175.10 175.45 2bs4 s ILE 11 N 1.35 5.09 0.00 2.22 -1.09 0.52 0.30 121.20 129.59 2bs4 s ILE 11 Ca 0.05 -0.67 0.00 0.00 -2.23 0.00 0.00 60.65 57.79 2bs4 s ILE 11 Cb -0.14 -4.14 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2bs4 s ILE 11 CO -0.09 -0.58 0.00 0.61 -1.23 0.00 0.00 174.94 173.64 2bs4 n GLY 12 N 5.17 3.77 1.88 6.18 0.00 0.34 0.04 105.19 122.58 2bs4 n GLY 12 Ca -0.09 -1.11 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 2bs4 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs4 n GLY 13 N 0.00 5.89 0.00 -0.02 0.00 -1.25 -4.19 105.19 105.61 2bs4 n GLY 13 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.81 2bs4 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs4 n GLY 14 N -0.87 1.25 0.18 -0.02 0.00 -1.26 -4.57 105.19 99.89 2bs4 n GLY 14 Ca 0.46 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.46 2bs4 n GLY 14 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bs4 h LEU 15 N 0.00 0.35 -0.32 0.99 3.38 -1.93 -1.02 115.31 116.76 2bs4 h LEU 15 Ca 0.00 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 2bs4 h LEU 15 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2bs4 h LEU 15 CO 0.00 0.25 -0.05 0.00 0.09 0.00 0.00 178.44 178.73 2bs4 h ALA 16 N 1.21 0.43 0.11 1.53 0.00 -1.91 -2.20 119.26 118.43 2bs4 h ALA 16 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2bs4 h ALA 16 Cb 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2bs4 h ALA 16 CO -0.10 0.24 -0.05 0.78 0.00 0.00 0.00 179.25 180.12 2bs4 h GLY 17 N 0.38 -0.15 1.01 0.00 0.00 -1.71 -2.16 103.07 100.44 2bs4 h GLY 17 Ca 0.08 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 2bs4 h GLY 17 CO 0.03 -0.05 0.38 1.41 0.00 0.00 0.00 176.54 178.30 2bs4 h LEU 18 N -0.42 0.90 -0.89 3.11 3.38 -1.26 0.05 115.31 120.18 2bs4 h LEU 18 Ca -0.01 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 2bs4 h LEU 18 Cb 0.34 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2bs4 h LEU 18 CO 0.02 0.75 0.03 -0.09 0.09 0.00 0.00 178.44 179.24 2bs4 h ARG 19 N 0.98 0.84 -0.29 1.13 9.65 -1.42 -1.29 114.38 123.99 2bs4 h ARG 19 Ca 0.25 -0.22 -0.11 0.00 -1.10 0.00 0.00 59.98 58.80 2bs4 h ARG 19 Cb 0.05 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.52 2bs4 h ARG 19 CO -0.04 0.83 -0.26 0.00 2.80 0.00 0.00 179.97 183.30 2bs4 h ALA 20 N 1.24 1.00 -0.29 2.80 0.00 -1.01 -2.26 119.26 120.73 2bs4 h ALA 20 Ca 0.16 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2bs4 h ALA 20 Cb 0.44 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2bs4 h ALA 20 CO 0.02 0.59 -0.06 0.00 0.00 0.00 0.00 179.25 179.80 2bs4 h ALA 21 N 1.21 1.36 -0.44 0.00 0.00 -0.20 -2.33 119.26 118.86 2bs4 h ALA 21 Ca 0.07 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 2bs4 h ALA 21 Cb 0.72 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2bs4 h ALA 21 CO 0.06 0.44 -0.06 0.28 0.00 0.00 0.00 179.25 179.96 2bs4 h VAL 22 N 0.44 1.27 -0.16 0.00 2.07 -0.75 -1.49 116.25 117.62 2bs4 h VAL 22 Ca 0.09 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 2bs4 h VAL 22 Cb 0.39 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2bs4 h VAL 22 CO 0.02 0.39 -0.01 0.00 0.02 0.00 0.00 177.57 177.99 2bs4 h ALA 23 N 0.88 1.69 0.01 1.67 0.00 -0.91 -1.22 119.26 121.39 2bs4 h ALA 23 Ca 0.12 -0.11 -0.29 0.00 0.00 0.00 0.00 54.91 54.63 2bs4 h ALA 23 Cb 0.58 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2bs4 h ALA 23 CO 0.03 0.23 -1.69 1.79 0.00 0.00 0.00 179.25 179.62 2bs4 h THR 24 N 0.22 0.87 -0.04 0.00 1.35 -1.30 -3.36 112.91 110.65 2bs4 h THR 24 Ca 0.05 -2.71 -0.08 0.00 -0.55 0.00 0.00 66.41 63.12 2bs4 h THR 24 Cb 0.17 2.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 2bs4 h THR 24 CO 0.00 0.53 -0.30 -0.61 -0.25 0.00 0.00 175.52 174.90 2bs4 h GLN 25 N 0.00 0.28 -0.01 4.72 5.75 -1.15 -1.87 115.11 122.84 2bs4 h GLN 25 Ca -0.28 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 57.98 2bs4 h GLN 25 Cb 2.00 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 30.61 2bs4 h GLN 25 CO 0.08 0.91 0.24 -0.56 -2.65 0.00 0.00 178.83 176.85 2bs4 h GLN 26 N -0.26 0.00 -0.78 1.69 3.07 -1.40 -0.32 115.11 117.11 2bs4 h GLN 26 Ca -0.02 0.00 -0.52 0.00 0.09 0.00 0.00 58.65 58.20 2bs4 h GLN 26 Cb 0.97 0.00 -0.30 0.00 0.08 0.00 0.00 27.48 28.23 2bs4 h GLN 26 CO 0.06 0.00 0.08 0.36 0.09 0.00 0.00 178.83 179.42 2bs4 n LYS 27 N -2.97 2.79 -0.93 0.06 2.85 -1.20 -4.94 118.16 113.82 2bs4 n LYS 27 Ca -0.02 -3.55 0.00 0.00 -1.05 0.00 0.00 58.31 53.69 2bs4 n LYS 27 Cb 0.30 -2.18 0.00 0.00 -0.65 0.00 0.00 35.03 32.50 2bs4 n LYS 27 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2bs4 n GLY 28 N -0.91 0.51 3.67 2.58 0.00 -0.13 -5.01 105.19 105.90 2bs4 n GLY 28 Ca 0.50 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.12 2bs4 n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bs4 s LEU 29 N 0.00 4.18 0.04 0.99 1.43 -0.71 -5.00 118.68 119.61 2bs4 s LEU 29 Ca 0.00 1.02 -0.30 0.00 -1.03 0.00 0.00 54.13 53.82 2bs4 s LEU 29 Cb 0.00 -3.06 -0.07 0.00 0.03 0.00 0.00 46.19 43.10 2bs4 s LEU 29 CO 0.00 -0.30 1.48 -0.94 0.23 0.00 0.00 176.35 176.82 2bs4 s SER 30 N 1.12 6.76 -0.01 2.29 1.04 -1.26 -3.92 113.70 119.72 2bs4 s SER 30 Ca 0.34 2.27 0.04 0.00 0.48 0.00 0.00 55.95 59.07 2bs4 s SER 30 Cb -0.16 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.38 2bs4 s SER 30 CO 0.12 -0.77 -0.13 0.42 0.98 0.00 0.00 173.24 173.86 2bs4 s THR 31 N 2.31 1.07 -0.06 2.02 -4.23 -1.26 -0.77 115.64 114.72 2bs4 s THR 31 Ca 0.67 -0.57 0.02 0.00 -1.18 0.00 0.00 61.69 60.63 2bs4 s THR 31 Cb -0.35 -0.89 -0.03 0.00 1.34 0.00 0.00 72.50 72.57 2bs4 s THR 31 CO 0.29 0.30 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.95 2bs4 s ILE 32 N -0.25 3.52 -0.20 2.99 -1.09 -0.84 -2.02 121.20 123.31 2bs4 s ILE 32 Ca 0.04 -0.55 -0.00 0.00 -2.23 0.00 0.00 60.65 57.91 2bs4 s ILE 32 Cb -0.06 -2.42 0.02 0.00 -1.58 0.00 0.00 42.46 38.41 2bs4 s ILE 32 CO -0.00 0.60 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.47 2bs4 s VAL 33 N -0.78 2.47 -0.08 2.92 1.01 0.96 -0.34 120.40 126.56 2bs4 s VAL 33 Ca 0.12 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 2bs4 s VAL 33 Cb -0.11 -2.11 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 2bs4 s VAL 33 CO 0.01 0.45 0.22 -0.76 0.00 0.00 0.00 175.10 175.02 2bs4 s LEU 34 N 1.33 4.42 -0.03 3.92 1.43 0.15 -0.59 118.68 129.30 2bs4 s LEU 34 Ca 0.04 0.62 -0.15 0.00 -1.03 0.00 0.00 54.13 53.61 2bs4 s LEU 34 Cb -0.14 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.88 2bs4 s LEU 34 CO -0.09 0.38 0.33 -0.55 0.23 0.00 0.00 176.35 176.65 2bs4 s SER 35 N -1.04 -0.24 0.27 2.29 0.15 -0.61 -0.50 113.70 114.02 2bs4 s SER 35 Ca 0.18 0.21 0.03 0.00 0.70 0.00 0.00 55.95 57.07 2bs4 s SER 35 Cb -0.13 0.39 0.37 0.00 -1.71 0.00 0.00 66.02 64.94 2bs4 s SER 35 CO 0.07 -0.40 1.67 -0.07 1.20 0.00 0.00 173.24 175.71 2bs4 h LEU 36 N 4.10 0.39 -8.90 3.45 3.38 -1.87 0.17 115.31 116.03 2bs4 h LEU 36 Ca -0.29 -0.16 -0.39 0.00 0.09 0.00 0.00 57.88 57.13 2bs4 h LEU 36 Cb 1.18 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 41.68 2bs4 h LEU 36 CO 0.38 0.74 -0.56 0.27 0.09 0.00 0.00 178.44 179.36 2bs4 s ILE 37 N -4.23 0.23 0.24 1.22 -4.36 -1.26 -2.59 121.20 110.44 2bs4 s ILE 37 Ca -0.06 -2.00 -0.31 0.00 -0.26 0.00 0.00 60.65 58.02 2bs4 s ILE 37 Cb 0.13 -2.51 -0.13 0.00 1.25 0.00 0.00 42.46 41.20 2bs4 s ILE 37 CO 0.79 0.00 1.42 -2.65 0.24 0.00 0.00 174.94 174.74 2bs4 n PRO 38 N -0.53 2.06 -0.24 0.37 -0.02 -1.26 -4.54 135.00 130.84 2bs4 n PRO 38 Ca 0.02 0.73 0.14 0.00 -2.02 0.00 0.00 63.50 62.38 2bs4 n PRO 38 Cb 0.65 -2.40 0.43 0.00 -0.02 0.00 0.00 33.50 32.16 2bs4 n PRO 38 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2bs4 h VAL 39 N 3.09 0.79 0.00 -1.45 -1.51 -1.96 -1.73 116.25 113.48 2bs4 h VAL 39 Ca -0.45 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2bs4 h VAL 39 Cb 1.27 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.60 2bs4 h VAL 39 CO 0.76 0.10 0.00 2.29 -1.23 0.00 0.00 177.57 179.50 2bs4 n LYS 40 N -4.54 0.99 -0.03 5.19 2.85 -1.26 -2.48 118.16 118.88 2bs4 n LYS 40 Ca 0.17 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.46 2bs4 n LYS 40 Cb 0.54 -1.41 0.04 0.00 -0.65 0.00 0.00 35.03 33.54 2bs4 n LYS 40 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2bs4 n ARG 41 N -0.07 0.67 -0.76 -1.58 1.74 -0.65 -4.87 116.66 111.13 2bs4 n ARG 41 Ca 0.00 -1.10 -0.32 0.00 -0.77 0.00 0.00 57.85 55.65 2bs4 n ARG 41 Cb 0.21 -1.12 0.13 0.00 -1.02 0.00 0.00 32.46 30.66 2bs4 n ARG 41 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2bs4 n SER 42 N 0.24 -1.52 0.28 0.55 7.64 -1.03 -4.83 113.62 114.95 2bs4 n SER 42 Ca 0.04 0.34 0.18 0.00 1.01 0.00 0.00 58.87 60.44 2bs4 n SER 42 Cb 0.20 -1.27 0.95 0.00 -1.01 0.00 0.00 64.21 63.08 2bs4 n SER 42 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 2bs4 h HIS 43 N -1.66 0.00 -0.84 1.43 2.76 -1.96 -1.82 115.15 113.06 2bs4 h HIS 43 Ca -0.44 0.00 0.16 0.00 -2.20 0.00 0.00 60.37 57.90 2bs4 h HIS 43 Cb 1.28 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 30.18 2bs4 h HIS 43 CO 0.41 0.00 0.55 0.77 -1.30 0.00 0.00 177.93 178.36 2bs4 h SER 44 N 0.00 0.47 -0.00 3.26 0.02 -1.94 0.30 113.55 115.66 2bs4 h SER 44 Ca 0.03 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2bs4 h SER 44 Cb 0.21 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 2bs4 h SER 44 CO -0.00 0.23 0.04 0.00 -1.14 0.00 0.00 176.83 175.96 2bs4 h ALA 45 N 1.62 1.07 0.00 3.77 0.00 -1.52 -2.62 119.26 121.59 2bs4 h ALA 45 Ca 0.42 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 2bs4 h ALA 45 Cb 0.91 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2bs4 h ALA 45 CO -0.16 -0.04 -0.04 0.00 0.00 0.00 0.00 179.25 179.01 2bs4 h ALA 46 N 1.92 0.98 -1.99 0.00 0.00 -1.12 -2.91 119.26 116.14 2bs4 h ALA 46 Ca 0.00 -0.04 -0.63 0.00 0.00 0.00 0.00 54.91 54.24 2bs4 h ALA 46 Cb 0.08 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 17.91 2bs4 h ALA 46 CO -0.00 0.05 0.81 0.00 0.00 0.00 0.00 179.25 180.10 2bs4 n ALA 47 N -2.11 0.52 -0.25 0.00 0.00 -0.99 -4.87 120.51 112.81 2bs4 n ALA 47 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2bs4 n ALA 47 Cb 0.47 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.61 2bs4 n ALA 47 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bs4 n GLN 48 N 4.24 1.55 0.02 0.00 6.02 -1.26 -1.28 117.38 126.67 2bs4 n GLN 48 Ca 0.20 -0.11 -0.09 0.00 -0.01 0.00 0.00 57.00 56.99 2bs4 n GLN 48 Cb 0.25 -0.47 -0.07 0.00 1.02 0.00 0.00 30.24 30.97 2bs4 n GLN 48 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2bs4 h GLY 49 N 0.00 -0.17 0.00 1.08 0.00 -1.91 -3.45 103.07 98.62 2bs4 h GLY 49 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2bs4 h GLY 49 CO 0.00 -0.06 0.00 0.61 0.00 0.00 0.00 176.54 177.09 2bs4 n GLY 50 N 1.00 1.01 3.28 4.60 0.00 -1.26 -4.86 105.19 108.96 2bs4 n GLY 50 Ca -0.06 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 2bs4 n GLY 50 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2bs4 s MET 51 N -1.12 3.27 -0.12 1.61 1.75 0.11 -4.42 119.30 120.37 2bs4 s MET 51 Ca 0.00 -0.71 -0.30 0.00 -1.25 0.00 0.00 55.69 53.43 2bs4 s MET 51 Cb 0.00 -2.71 -0.01 0.00 2.84 0.00 0.00 34.83 34.94 2bs4 s MET 51 CO 0.00 -0.01 1.09 -1.14 -0.65 0.00 0.00 175.02 174.31 2bs4 s GLN 52 N 0.92 4.36 -0.28 4.11 0.74 0.85 0.06 119.66 130.40 2bs4 s GLN 52 Ca -0.03 1.49 -0.15 0.00 0.05 0.00 0.00 55.36 56.72 2bs4 s GLN 52 Cb -0.15 -3.59 0.10 0.00 1.10 0.00 0.00 33.01 30.48 2bs4 s GLN 52 CO -0.01 -0.45 0.74 0.00 -0.55 0.00 0.00 175.29 175.03 2bs4 s ALA 53 N 2.43 -2.00 -1.00 1.58 0.00 -0.68 -4.86 121.76 117.22 2bs4 s ALA 53 Ca 0.50 2.37 -0.18 0.00 0.00 0.00 0.00 51.96 54.65 2bs4 s ALA 53 Cb -0.20 -1.54 -0.09 0.00 0.00 0.00 0.00 23.12 21.29 2bs4 s ALA 53 CO 0.16 -0.46 2.05 -1.13 0.00 0.00 0.00 175.76 176.39 2bs4 n SER 54 N 4.38 3.24 0.10 0.00 3.41 -1.26 -4.67 113.62 118.82 2bs4 n SER 54 Ca -0.18 -2.70 -0.22 0.00 -0.26 0.00 0.00 58.87 55.51 2bs4 n SER 54 Cb 0.57 -1.28 -0.13 0.00 -0.26 0.00 0.00 64.21 63.11 2bs4 n SER 54 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2bs4 h LEU 55 N 12.13 0.81 0.97 1.04 3.38 -1.89 -3.42 115.31 128.33 2bs4 h LEU 55 Ca 0.48 -0.77 -0.17 0.00 0.09 0.00 0.00 57.88 57.51 2bs4 h LEU 55 Cb 0.61 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2bs4 h LEU 55 CO 1.90 1.58 -0.20 0.61 0.09 0.00 0.00 178.44 182.42 2bs4 n GLY 56 N 1.42 0.33 0.10 0.83 0.00 -1.26 -4.55 105.19 102.06 2bs4 n GLY 56 Ca -0.13 -0.57 -0.06 0.00 0.00 0.00 0.00 46.02 45.26 2bs4 n GLY 56 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2bs4 h ASN 57 N 0.00 -0.10 -3.85 1.61 -0.26 -1.84 -3.36 115.58 107.78 2bs4 h ASN 57 Ca -0.19 -0.25 -0.45 0.00 -0.56 0.00 0.00 56.30 54.84 2bs4 h ASN 57 Cb 0.97 0.03 0.16 0.00 -1.06 0.00 0.00 38.32 38.42 2bs4 h ASN 57 CO 0.25 0.49 0.18 -0.94 -1.06 0.00 0.00 177.43 176.35 2bs4 s SER 58 N -5.57 2.53 0.11 5.81 1.04 -1.26 -4.74 113.70 111.63 2bs4 s SER 58 Ca -0.07 1.21 -0.23 0.00 0.48 0.00 0.00 55.95 57.34 2bs4 s SER 58 Cb -0.00 -1.88 -0.07 0.00 0.10 0.00 0.00 66.02 64.16 2bs4 s SER 58 CO 0.26 -3.19 1.69 0.50 0.98 0.00 0.00 173.24 173.48 2bs4 h LYS 59 N -1.93 -0.16 0.00 4.02 1.63 -1.92 0.88 116.57 119.09 2bs4 h LYS 59 Ca -0.55 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 2bs4 h LYS 59 Cb 1.33 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 2bs4 h LYS 59 CO 0.57 -0.10 0.00 -1.33 -3.45 0.00 0.00 179.45 175.14 2bs4 n MET 60 N -5.24 0.34 -0.01 1.90 2.81 -1.26 -2.16 117.12 113.50 2bs4 n MET 60 Ca -0.05 0.09 0.10 0.00 -1.81 0.00 0.00 57.70 56.03 2bs4 n MET 60 Cb 0.16 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.01 2bs4 n MET 60 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2bs4 n SER 61 N -1.23 0.29 -4.60 7.83 7.64 -0.34 -2.03 113.62 121.18 2bs4 n SER 61 Ca 0.10 -0.08 -0.50 0.00 1.01 0.00 0.00 58.87 59.41 2bs4 n SER 61 Cb 0.14 1.88 -0.05 0.00 -1.01 0.00 0.00 64.21 65.17 2bs4 n SER 61 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2bs4 n ASP 62 N -2.17 1.68 0.00 6.43 -0.08 0.16 -0.91 116.55 121.66 2bs4 n ASP 62 Ca -0.03 1.13 0.00 0.00 -1.51 0.00 0.00 54.79 54.38 2bs4 n ASP 62 Cb 0.53 -1.23 0.00 0.00 2.34 0.00 0.00 41.12 42.75 2bs4 n ASP 62 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2bs4 n GLY 63 N 2.33 3.04 3.75 0.27 0.00 -1.26 -5.04 105.19 108.28 2bs4 n GLY 63 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2bs4 n GLY 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bs4 s ASP 64 N -1.21 5.15 0.25 1.61 2.15 -0.09 -5.00 116.67 119.54 2bs4 s ASP 64 Ca 0.00 2.57 -0.20 0.00 0.43 0.00 0.00 52.55 55.34 2bs4 s ASP 64 Cb 0.00 -2.62 0.06 0.00 -0.30 0.00 0.00 42.92 40.07 2bs4 s ASP 64 CO 0.00 -1.63 0.93 0.54 -0.17 0.00 0.00 175.17 174.84 2bs4 s ASN 65 N -1.31 -0.04 0.27 -0.34 2.20 -1.26 -4.58 114.94 109.88 2bs4 s ASN 65 Ca 0.76 -0.79 -0.01 0.00 -0.94 0.00 0.00 52.86 51.88 2bs4 s ASN 65 Cb -0.35 0.63 0.59 0.00 -2.00 0.00 0.00 41.25 40.11 2bs4 s ASN 65 CO 0.40 -1.23 1.69 -0.33 -2.94 0.00 0.00 177.10 174.68 2bs4 h GLU 66 N 2.00 0.31 -0.18 3.55 3.07 -1.86 -2.23 114.58 119.23 2bs4 h GLU 66 Ca -0.28 -0.02 0.02 0.00 -0.50 0.00 0.00 59.36 58.58 2bs4 h GLU 66 Cb 1.23 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 29.06 2bs4 h GLU 66 CO 0.35 0.20 0.07 -0.44 -1.40 0.00 0.00 179.01 177.79 2bs4 h ASP 67 N 0.32 0.08 -0.20 1.42 3.32 -1.96 0.21 116.42 119.61 2bs4 h ASP 67 Ca 0.49 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.54 2bs4 h ASP 67 Cb 0.88 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.43 2bs4 h ASP 67 CO -0.54 0.08 0.10 -0.07 -1.72 0.00 0.00 179.24 177.09 2bs4 h LEU 68 N 0.16 0.26 -0.27 1.55 3.38 -1.81 -0.95 115.31 117.63 2bs4 h LEU 68 Ca 0.08 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2bs4 h LEU 68 Cb 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2bs4 h LEU 68 CO -0.07 0.30 0.17 -0.74 0.09 0.00 0.00 178.44 178.19 2bs4 h HIS 69 N 0.20 0.33 -0.56 1.13 2.76 -1.32 -1.85 115.15 115.84 2bs4 h HIS 69 Ca 0.07 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.33 2bs4 h HIS 69 Cb 0.11 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 28.89 2bs4 h HIS 69 CO -0.03 0.21 0.19 0.35 -1.30 0.00 0.00 177.93 177.35 2bs4 h PHE 70 N 0.36 0.34 -0.45 5.26 3.57 -0.37 -1.99 116.94 123.65 2bs4 h PHE 70 Ca 0.10 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 2bs4 h PHE 70 Cb -0.04 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 2bs4 h PHE 70 CO -0.06 0.09 0.06 1.98 -2.23 0.00 0.00 178.31 178.15 2bs4 h MET 71 N 0.37 0.76 -0.77 1.11 4.05 -0.76 -1.27 114.93 118.42 2bs4 h MET 71 Ca 0.28 -0.21 0.05 0.00 -0.28 0.00 0.00 59.70 59.54 2bs4 h MET 71 Cb 0.33 -0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 30.99 2bs4 h MET 71 CO -0.29 0.79 0.47 -0.44 0.23 0.00 0.00 176.91 177.67 2bs4 h ASP 72 N 0.62 0.73 -0.36 1.39 3.32 -0.99 -0.75 116.42 120.38 2bs4 h ASP 72 Ca 0.14 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2bs4 h ASP 72 Cb 0.41 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2bs4 h ASP 72 CO 0.01 0.48 0.18 0.74 -1.72 0.00 0.00 179.24 178.93 2bs4 h THR 73 N 0.87 1.16 -0.12 0.35 2.02 -1.05 0.26 112.91 116.40 2bs4 h THR 73 Ca 0.33 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 2bs4 h THR 73 Cb 0.14 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.33 2bs4 h THR 73 CO -0.16 0.17 -0.17 0.58 0.37 0.00 0.00 175.52 176.30 2bs4 h VAL 74 N 0.45 1.37 0.00 3.16 2.07 -0.81 -0.69 116.25 121.81 2bs4 h VAL 74 Ca 0.13 -1.38 -0.08 0.00 0.82 0.00 0.00 66.70 66.18 2bs4 h VAL 74 Cb 0.10 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2bs4 h VAL 74 CO -0.02 0.40 -0.39 0.11 0.02 0.00 0.00 177.57 177.70 2bs4 h LYS 75 N -0.08 0.00 -0.31 1.57 1.57 -1.17 -2.38 116.57 115.77 2bs4 h LYS 75 Ca 0.01 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.67 2bs4 h LYS 75 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2bs4 h LYS 75 CO 0.04 0.39 -0.33 0.78 -0.57 0.00 0.00 179.45 179.76 2bs4 h GLY 76 N 1.40 0.74 1.84 3.86 0.00 -0.32 -2.58 103.07 108.02 2bs4 h GLY 76 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2bs4 h GLY 76 CO 0.05 0.63 0.00 -1.14 0.00 0.00 0.00 176.54 176.08 2bs4 n SER 77 N -4.07 0.00 -1.92 0.19 3.41 -0.28 -4.24 113.62 106.71 2bs4 n SER 77 Ca -0.01 0.33 -0.17 0.00 -0.26 0.00 0.00 58.87 58.76 2bs4 n SER 77 Cb 0.49 -0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 2bs4 n SER 77 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2bs4 n ASP 78 N -1.42 -4.97 -1.62 4.04 2.03 -0.97 -2.14 116.55 111.51 2bs4 n ASP 78 Ca 0.06 -0.02 -0.15 0.00 0.52 0.00 0.00 54.79 55.20 2bs4 n ASP 78 Cb 0.18 -4.07 -0.01 0.00 -0.72 0.00 0.00 41.12 36.50 2bs4 n ASP 78 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 2bs4 n TRP 79 N -4.02 -0.62 0.59 -0.67 8.01 -1.12 -4.87 117.44 114.74 2bs4 n TRP 79 Ca -0.20 0.00 0.10 0.00 -1.31 0.00 0.00 57.50 56.09 2bs4 n TRP 79 Cb 0.65 -3.04 0.12 0.00 -2.01 0.00 0.00 31.31 27.03 2bs4 n TRP 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bs4 n GLY 80 N -1.03 0.98 3.97 6.99 0.00 -1.05 -4.96 105.19 110.10 2bs4 n GLY 80 Ca -0.17 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 2bs4 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs4 s ASP 82 N -4.21 6.28 0.53 0.00 1.01 -0.77 -4.91 116.67 114.61 2bs4 s ASP 82 Ca 0.47 -0.62 0.24 0.00 0.71 0.00 0.00 52.55 53.34 2bs4 s ASP 82 Cb -0.10 -2.40 1.39 0.00 1.01 0.00 0.00 42.92 42.83 2bs4 s ASP 82 CO 0.34 -1.19 2.04 1.56 0.21 0.00 0.00 175.17 178.13 2bs4 h GLN 83 N 9.28 0.00 -0.42 8.23 4.20 -1.91 -1.03 115.11 133.46 2bs4 h GLN 83 Ca -0.27 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.36 2bs4 h GLN 83 Cb 1.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 2bs4 h GLN 83 CO 1.08 0.00 -0.04 0.87 -0.67 0.00 0.00 178.83 180.07 2bs4 h LYS 84 N 0.00 0.77 -0.37 1.46 1.57 -1.91 -1.16 116.57 116.94 2bs4 h LYS 84 Ca 0.18 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2bs4 h LYS 84 Cb 0.75 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 2bs4 h LYS 84 CO -0.00 0.87 0.18 0.28 -0.57 0.00 0.00 179.45 180.21 2bs4 h VAL 85 N 0.60 1.17 -0.71 0.50 2.07 -1.52 -1.27 116.25 117.09 2bs4 h VAL 85 Ca 0.11 -0.47 0.10 0.00 0.82 0.00 0.00 66.70 67.26 2bs4 h VAL 85 Cb 0.55 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 2bs4 h VAL 85 CO 0.03 0.18 0.47 0.00 0.02 0.00 0.00 177.57 178.27 2bs4 h ALA 86 N 1.03 1.91 -0.21 1.67 0.00 -1.01 0.70 119.26 123.36 2bs4 h ALA 86 Ca 0.13 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2bs4 h ALA 86 Cb 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2bs4 h ALA 86 CO -0.02 -0.06 -0.15 0.00 0.00 0.00 0.00 179.25 179.02 2bs4 h ARG 87 N 0.56 0.46 -1.01 0.00 2.47 -0.46 -1.52 114.38 114.88 2bs4 h ARG 87 Ca 0.33 -0.22 0.10 0.00 -1.26 0.00 0.00 59.98 58.93 2bs4 h ARG 87 Cb 0.54 -0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.77 2bs4 h ARG 87 CO -0.11 0.78 0.64 0.52 0.56 0.00 0.00 179.97 182.36 2bs4 h MET 88 N 0.15 1.04 0.00 0.04 2.86 -0.15 -2.14 114.93 116.72 2bs4 h MET 88 Ca 0.04 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2bs4 h MET 88 Cb 0.67 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2bs4 h MET 88 CO 0.04 0.69 0.00 0.34 1.06 0.00 0.00 176.91 179.04 2bs4 n PHE 89 N -4.57 0.00 -0.36 -0.22 7.35 0.13 -2.56 117.46 117.24 2bs4 n PHE 89 Ca 0.18 0.00 0.31 0.00 -0.76 0.00 0.00 57.45 57.17 2bs4 n PHE 89 Cb 0.29 -0.49 0.63 0.00 0.35 0.00 0.00 39.48 40.26 2bs4 n PHE 89 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 2bs4 h VAL 90 N 0.00 0.40 -0.26 -2.13 -1.51 -1.25 0.89 116.25 112.39 2bs4 h VAL 90 Ca 0.00 -0.07 -0.18 0.00 -1.23 0.00 0.00 66.70 65.23 2bs4 h VAL 90 Cb 0.00 0.19 0.00 0.00 -2.13 0.00 0.00 31.29 29.35 2bs4 h VAL 90 CO 0.00 0.03 -0.52 -1.13 -1.23 0.00 0.00 177.57 174.72 2bs4 h ASN 91 N 0.19 0.91 1.29 4.19 -0.73 -1.43 -3.30 115.58 116.71 2bs4 h ASN 91 Ca 0.63 -0.54 -0.11 0.00 1.87 0.00 0.00 56.30 58.15 2bs4 h ASN 91 Cb 2.03 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 40.34 2bs4 h ASN 91 CO -0.21 1.29 -0.74 0.74 -0.37 0.00 0.00 177.43 178.14 2bs4 h THR 92 N 0.58 0.67 -0.69 -3.57 2.02 -0.63 -3.37 112.91 107.91 2bs4 h THR 92 Ca 0.01 -2.02 0.15 0.00 0.77 0.00 0.00 66.41 65.32 2bs4 h THR 92 Cb 1.13 2.24 -0.12 0.00 -1.74 0.00 0.00 68.15 69.67 2bs4 h THR 92 CO 0.12 0.38 -0.01 0.00 0.37 0.00 0.00 175.52 176.38 2bs4 h ALA 93 N 1.54 0.69 -0.55 6.16 0.00 -1.12 -1.26 119.26 124.71 2bs4 h ALA 93 Ca -0.04 0.22 0.08 0.00 0.00 0.00 0.00 54.91 55.17 2bs4 h ALA 93 Cb 1.39 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 2bs4 h ALA 93 CO 0.05 -0.41 0.19 -1.35 0.00 0.00 0.00 179.25 177.74 2bs4 h PRO 94 N 0.10 0.36 0.00 0.00 0.11 -1.75 -0.86 132.00 129.96 2bs4 h PRO 94 Ca 0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2bs4 h PRO 94 Cb 0.62 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2bs4 h PRO 94 CO -0.61 0.24 0.00 0.36 -0.21 0.00 0.00 178.00 177.77 2bs4 n LYS 95 N -5.01 0.20 -0.02 1.05 2.85 -0.55 -2.30 118.16 114.38 2bs4 n LYS 95 Ca 0.07 0.34 -0.16 0.00 -1.05 0.00 0.00 58.31 57.51 2bs4 n LYS 95 Cb 0.24 -1.83 -0.09 0.00 -0.65 0.00 0.00 35.03 32.70 2bs4 n LYS 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2bs4 h ALA 96 N 2.37 0.14 0.21 0.58 0.00 -0.39 -1.90 119.26 120.26 2bs4 h ALA 96 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2bs4 h ALA 96 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2bs4 h ALA 96 CO 0.00 0.28 -0.17 0.82 0.00 0.00 0.00 179.25 180.18 2bs4 h ILE 97 N -0.07 0.63 -0.78 0.00 1.08 -1.22 -0.76 117.51 116.38 2bs4 h ILE 97 Ca -0.04 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.47 2bs4 h ILE 97 Cb 1.10 0.63 -0.04 0.00 -3.07 0.00 0.00 36.82 35.43 2bs4 h ILE 97 CO 0.09 0.00 0.51 0.03 -0.69 0.00 0.00 178.15 178.09 2bs4 h ARG 98 N -0.40 0.93 -0.26 2.37 3.08 -1.51 0.35 114.38 118.94 2bs4 h ARG 98 Ca -0.01 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 2bs4 h ARG 98 Cb 0.36 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2bs4 h ARG 98 CO -0.02 0.61 -0.10 1.49 -1.07 0.00 0.00 179.97 180.88 2bs4 h GLU 99 N 0.96 0.53 -0.46 0.04 4.81 -1.01 0.49 114.58 119.93 2bs4 h GLU 99 Ca 0.31 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2bs4 h GLU 99 Cb 0.05 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 2bs4 h GLU 99 CO -0.09 0.77 0.22 -0.07 -0.73 0.00 0.00 179.01 179.11 2bs4 h LEU 100 N 0.27 0.58 -0.54 1.64 3.38 -0.46 -0.23 115.31 119.94 2bs4 h LEU 100 Ca 0.06 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2bs4 h LEU 100 Cb 0.60 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2bs4 h LEU 100 CO 0.03 0.50 0.12 0.00 0.09 0.00 0.00 178.44 179.18 2bs4 h ALA 101 N 1.60 0.72 0.00 1.53 0.00 0.11 -1.29 119.26 121.92 2bs4 h ALA 101 Ca 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2bs4 h ALA 101 Cb 0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2bs4 h ALA 101 CO -0.02 0.43 -0.15 0.00 0.00 0.00 0.00 179.25 179.50 2bs4 h ALA 102 N 1.01 1.25 -0.16 0.00 0.00 0.27 -2.26 119.26 119.37 2bs4 h ALA 102 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2bs4 h ALA 102 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2bs4 h ALA 102 CO 0.00 0.19 0.00 0.91 0.00 0.00 0.00 179.25 180.36 2bs4 n TRP 103 N -3.64 0.21 0.00 0.00 8.01 -0.21 -4.93 117.44 116.88 2bs4 n TRP 103 Ca -0.01 -0.10 0.00 0.00 -1.31 0.00 0.00 57.50 56.07 2bs4 n TRP 103 Cb 0.28 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.58 2bs4 n TRP 103 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bs4 n GLY 104 N 1.05 0.25 3.62 6.99 0.00 -0.85 -4.93 105.19 111.32 2bs4 n GLY 104 Ca 0.15 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.67 2bs4 n GLY 104 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bs4 n VAL 105 N -1.77 0.44 -0.87 1.61 0.31 -0.63 -4.79 118.33 112.63 2bs4 n VAL 105 Ca 0.00 -0.18 -0.29 0.00 -0.01 0.00 0.00 64.34 63.86 2bs4 n VAL 105 Cb 0.00 -1.83 -0.03 0.00 -0.91 0.00 0.00 33.84 31.07 2bs4 n VAL 105 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2bs4 n PRO 106 N 7.14 1.80 -1.75 5.55 -0.04 -1.26 -4.62 135.00 141.81 2bs4 n PRO 106 Ca 0.28 -1.58 -0.42 0.00 -0.04 0.00 0.00 63.50 61.75 2bs4 n PRO 106 Cb 0.28 -2.62 -0.01 0.00 -0.04 0.00 0.00 33.50 31.11 2bs4 n PRO 106 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2bs4 n TRP 107 N 5.48 2.88 -1.89 0.54 7.02 -1.26 -4.56 117.44 125.66 2bs4 n TRP 107 Ca 0.45 0.27 -0.41 0.00 -1.02 0.00 0.00 57.50 56.79 2bs4 n TRP 107 Cb 0.23 -2.59 -0.02 0.00 -2.42 0.00 0.00 31.31 26.51 2bs4 n TRP 107 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2bs4 s THR 108 N -0.13 2.36 0.36 -0.99 2.01 0.52 -4.88 115.64 114.89 2bs4 s THR 108 Ca 0.63 0.29 0.07 0.00 0.31 0.00 0.00 61.69 62.99 2bs4 s THR 108 Cb -0.49 -3.19 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 2bs4 s THR 108 CO 0.50 0.04 0.45 -0.13 -0.69 0.00 0.00 174.62 174.80 2bs4 s ARG 109 N -0.23 2.95 0.07 4.92 1.81 -1.26 -1.01 118.95 126.20 2bs4 s ARG 109 Ca 0.63 -1.15 -0.15 0.00 -1.72 0.00 0.00 55.73 53.34 2bs4 s ARG 109 Cb -0.45 -2.71 -0.06 0.00 -0.45 0.00 0.00 34.95 31.27 2bs4 s ARG 109 CO 0.44 -0.02 0.49 0.42 -0.68 0.00 0.00 175.30 175.96 2bs4 s ILE 110 N -2.25 4.90 -0.04 1.52 1.01 -0.23 -4.65 121.20 121.47 2bs4 s ILE 110 Ca 0.46 0.90 0.03 0.00 0.00 0.00 0.00 60.65 62.05 2bs4 s ILE 110 Cb -0.08 -3.77 0.01 0.00 0.01 0.00 0.00 42.46 38.63 2bs4 s ILE 110 CO 0.30 0.45 -0.11 -1.38 0.00 0.00 0.00 174.94 174.20 2bs4 s HIS 111 N -1.23 1.20 0.26 3.97 -3.43 -1.26 0.29 115.29 115.09 2bs4 s HIS 111 Ca 0.30 -0.35 -0.29 0.00 -0.80 0.00 0.00 55.06 53.92 2bs4 s HIS 111 Cb -0.17 -0.86 -0.14 0.00 -1.43 0.00 0.00 32.58 29.98 2bs4 s HIS 111 CO 0.17 -0.16 1.08 1.17 -2.00 0.00 0.00 174.74 175.00 2bs4 n LYS 112 N 3.44 1.36 0.00 -0.38 4.81 -1.26 -4.74 118.16 121.39 2bs4 n LYS 112 Ca -0.20 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 2bs4 n LYS 112 Cb 0.53 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 33.68 2bs4 n LYS 112 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2bs4 n GLY 113 N 1.49 0.96 3.83 3.14 0.00 -0.81 -4.96 105.19 108.84 2bs4 n GLY 113 Ca 0.11 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 2bs4 n GLY 113 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bs4 s ASP 114 N -0.49 5.83 0.03 1.61 1.01 -1.26 -0.48 116.67 122.92 2bs4 s ASP 114 Ca 0.00 0.07 -0.04 0.00 0.71 0.00 0.00 52.55 53.29 2bs4 s ASP 114 Cb 0.00 -1.65 -0.01 0.00 1.01 0.00 0.00 42.92 42.27 2bs4 s ASP 114 CO 0.00 0.15 0.06 0.00 0.21 0.00 0.00 175.17 175.60 2bs4 s ARG 115 N -2.54 0.53 0.03 8.23 1.70 0.40 -4.96 118.95 122.34 2bs4 s ARG 115 Ca 0.31 -0.75 -0.30 0.00 -0.47 0.00 0.00 55.73 54.52 2bs4 s ARG 115 Cb -0.12 0.20 -0.06 0.00 -0.57 0.00 0.00 34.95 34.40 2bs4 s ARG 115 CO 0.24 -0.12 1.43 -1.64 -1.08 0.00 0.00 175.30 174.13 2bs4 s MET 116 N -2.44 4.28 0.02 3.89 -1.94 -1.26 -1.63 119.30 120.21 2bs4 s MET 116 Ca -0.06 2.03 0.01 0.00 -1.71 0.00 0.00 55.69 55.95 2bs4 s MET 116 Cb -0.02 -3.51 -0.01 0.00 2.01 0.00 0.00 34.83 33.30 2bs4 s MET 116 CO -0.04 -0.56 -0.04 0.00 -0.01 0.00 0.00 175.02 174.37 2bs4 s ALA 117 N 2.15 0.24 -0.23 3.03 0.00 -1.06 -4.90 121.76 120.98 2bs4 s ALA 117 Ca 0.65 -0.41 -0.04 0.00 0.00 0.00 0.00 51.96 52.16 2bs4 s ALA 117 Cb -0.34 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 2bs4 s ALA 117 CO 0.28 -0.04 -0.02 0.42 0.00 0.00 0.00 175.76 176.39 2bs4 s ILE 118 N -0.83 3.49 -0.18 0.00 1.01 -1.26 -3.33 121.20 120.10 2bs4 s ILE 118 Ca -0.07 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.11 2bs4 s ILE 118 Cb -0.06 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 2bs4 s ILE 118 CO -0.00 0.38 0.16 -0.38 0.00 0.00 0.00 174.94 175.10 2bs4 n ILE 119 N 4.81 0.00 -0.49 2.92 5.41 -1.22 -4.98 119.36 125.81 2bs4 n ILE 119 Ca -0.18 -0.40 -0.01 0.00 1.00 0.00 0.00 62.75 63.17 2bs4 n ILE 119 Cb 0.50 0.98 -0.00 0.00 -0.71 0.00 0.00 39.64 40.41 2bs4 n ILE 119 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2bs4 n ASN 120 N -1.11 -2.10 0.00 4.38 3.02 -1.26 -4.14 115.26 114.04 2bs4 n ASN 120 Ca 0.01 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 2bs4 n ASN 120 Cb 0.06 -1.64 0.00 0.00 -0.61 0.00 0.00 39.78 37.59 2bs4 n ASN 120 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bs4 n ALA 121 N 0.28 1.80 0.00 5.41 0.00 -1.26 -4.87 120.51 121.86 2bs4 n ALA 121 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2bs4 n ALA 121 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2bs4 n ALA 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bs4 n GLN 122 N -0.31 0.00 -0.84 0.00 6.02 -1.26 -5.04 117.38 115.95 2bs4 n GLN 122 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 2bs4 n GLN 122 Cb 0.03 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.20 2bs4 n GLN 122 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2bs4 n LYS 123 N 0.00 1.96 -0.69 -1.09 2.85 -1.26 -3.41 118.16 116.52 2bs4 n LYS 123 Ca 0.00 -1.11 -0.07 0.00 -1.05 0.00 0.00 58.31 56.08 2bs4 n LYS 123 Cb 0.00 -2.13 0.05 0.00 -0.65 0.00 0.00 35.03 32.30 2bs4 n LYS 123 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2bs4 n THR 124 N 3.07 0.00 -4.03 0.58 5.66 -1.21 -4.77 114.28 113.57 2bs4 n THR 124 Ca 0.42 -0.30 -0.32 0.00 -3.05 0.00 0.00 64.05 60.80 2bs4 n THR 124 Cb 0.52 -1.67 -0.06 0.00 -1.55 0.00 0.00 70.33 67.56 2bs4 n THR 124 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2bs4 s THR 125 N -1.37 4.83 0.02 1.09 2.01 -1.26 -2.55 115.64 118.41 2bs4 s THR 125 Ca 0.18 -0.52 0.06 0.00 0.31 0.00 0.00 61.69 61.72 2bs4 s THR 125 Cb -0.01 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.19 2bs4 s THR 125 CO 0.13 0.23 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.51 2bs4 s ILE 126 N -1.33 3.05 -0.13 1.82 1.01 -0.65 -4.93 121.20 120.04 2bs4 s ILE 126 Ca 0.28 -1.03 -0.00 0.00 0.00 0.00 0.00 60.65 59.89 2bs4 s ILE 126 Cb -0.12 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 2bs4 s ILE 126 CO 0.20 0.38 -0.13 -0.89 0.00 0.00 0.00 174.94 174.50 2bs4 s THR 127 N -0.93 3.05 -0.25 2.92 2.01 -1.26 -0.46 115.64 120.72 2bs4 s THR 127 Ca 0.15 -0.66 -0.06 0.00 0.31 0.00 0.00 61.69 61.43 2bs4 s THR 127 Cb -0.11 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 2bs4 s THR 127 CO 0.06 0.52 0.03 -1.61 -0.69 0.00 0.00 174.62 172.92 2bs4 s GLU 128 N 0.41 3.37 1.18 4.92 0.41 0.37 -4.70 118.70 124.65 2bs4 s GLU 128 Ca -0.10 -0.65 -0.13 0.00 -0.41 0.00 0.00 54.97 53.68 2bs4 s GLU 128 Cb -0.16 -3.21 0.29 0.00 -1.78 0.00 0.00 34.13 29.27 2bs4 s GLU 128 CO 0.05 -0.27 1.01 0.39 -0.49 0.00 0.00 175.26 175.95 2bs4 n GLU 129 N 4.85 -2.48 0.16 1.61 4.71 -1.26 -1.93 120.64 126.30 2bs4 n GLU 129 Ca -0.16 -0.69 0.02 0.00 -0.01 0.00 0.00 57.16 56.31 2bs4 n GLU 129 Cb 0.50 -2.17 0.20 0.00 -1.01 0.00 0.00 31.44 28.97 2bs4 n GLU 129 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 2bs4 h ASP 130 N -2.70 0.00 0.08 1.62 3.04 -1.97 -3.00 116.42 113.49 2bs4 h ASP 130 Ca -0.62 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.17 2bs4 h ASP 130 Cb 1.33 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.62 2bs4 h ASP 130 CO 0.49 0.52 -0.00 2.22 -2.04 0.00 0.00 179.24 180.42 2bs4 n PHE 131 N -3.53 0.00 0.01 4.15 1.16 -1.26 -2.65 117.46 115.34 2bs4 n PHE 131 Ca -0.00 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.69 2bs4 n PHE 131 Cb 0.61 -0.04 -0.14 0.00 -1.61 0.00 0.00 39.48 38.30 2bs4 n PHE 131 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 2bs4 n ARG 132 N -0.95 0.65 -1.66 3.97 1.74 -1.13 -4.96 116.66 114.32 2bs4 n ARG 132 Ca 0.22 -0.14 -0.49 0.00 -0.77 0.00 0.00 57.85 56.67 2bs4 n ARG 132 Cb 0.15 -1.57 -0.05 0.00 -1.02 0.00 0.00 32.46 29.97 2bs4 n ARG 132 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 2bs4 n HIS 133 N -2.33 2.10 -0.17 -1.55 -0.00 -1.09 -2.21 115.22 109.98 2bs4 n HIS 133 Ca -0.03 0.31 0.00 0.00 0.46 0.00 0.00 57.72 58.46 2bs4 n HIS 133 Cb 0.57 -2.52 0.00 0.00 -0.12 0.00 0.00 29.99 27.92 2bs4 n HIS 133 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2bs4 n GLY 134 N 3.48 1.37 3.92 1.57 0.00 0.15 -4.96 105.19 110.72 2bs4 n GLY 134 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 2bs4 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bs4 s LEU 135 N 0.00 3.14 0.05 0.99 1.43 -0.94 -4.72 118.68 118.64 2bs4 s LEU 135 Ca 0.00 0.61 -0.31 0.00 -1.03 0.00 0.00 54.13 53.40 2bs4 s LEU 135 Cb 0.00 -3.40 -0.07 0.00 0.03 0.00 0.00 46.19 42.75 2bs4 s LEU 135 CO 0.00 -1.19 1.56 -0.63 0.23 0.00 0.00 176.35 176.33 2bs4 s ILE 136 N -3.03 3.23 0.92 -0.59 1.01 -1.26 -1.06 121.20 120.41 2bs4 s ILE 136 Ca 0.55 0.68 -0.14 0.00 0.00 0.00 0.00 60.65 61.75 2bs4 s ILE 136 Cb -0.11 -3.44 0.15 0.00 0.01 0.00 0.00 42.46 39.07 2bs4 s ILE 136 CO 0.45 0.00 1.20 -2.28 0.00 0.00 0.00 174.94 174.31 2bs4 s HIS 137 N 2.46 2.23 0.05 3.97 2.46 -0.18 -4.50 115.29 121.77 2bs4 s HIS 137 Ca 0.70 0.64 -0.09 0.00 0.47 0.00 0.00 55.06 56.79 2bs4 s HIS 137 Cb -0.37 -3.63 0.00 0.00 -0.13 0.00 0.00 32.58 28.45 2bs4 s HIS 137 CO 0.30 -2.39 0.19 -1.12 -2.47 0.00 0.00 174.74 169.26 2bs4 s SER 138 N -4.43 0.06 0.18 9.88 0.01 -1.26 -4.40 113.70 113.73 2bs4 s SER 138 Ca 0.67 -0.43 0.04 0.00 1.31 0.00 0.00 55.95 57.54 2bs4 s SER 138 Cb -0.10 0.30 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 2bs4 s SER 138 CO 0.52 -0.59 -0.07 0.00 0.41 0.00 0.00 173.24 173.51 2bs4 s ARG 139 N -2.82 1.16 -0.25 12.44 1.70 0.55 -4.88 118.95 126.86 2bs4 s ARG 139 Ca -0.03 -1.53 -0.29 0.00 -0.47 0.00 0.00 55.73 53.41 2bs4 s ARG 139 Cb 0.00 -0.63 -0.01 0.00 -0.57 0.00 0.00 34.95 33.75 2bs4 s ARG 139 CO -0.05 0.02 1.30 0.34 -1.08 0.00 0.00 175.30 175.82 2bs4 s ASP 140 N -3.22 6.76 -0.29 -2.89 2.15 -1.26 -2.94 116.67 114.99 2bs4 s ASP 140 Ca 0.21 1.40 -0.17 0.00 0.43 0.00 0.00 52.55 54.41 2bs4 s ASP 140 Cb 0.04 -2.54 0.13 0.00 -0.30 0.00 0.00 42.92 40.25 2bs4 s ASP 140 CO 0.04 -0.97 0.94 0.12 -0.17 0.00 0.00 175.17 175.13 2bs4 s PHE 141 N 4.08 -0.64 0.00 -5.34 5.36 -1.26 -4.94 117.98 115.24 2bs4 s PHE 141 Ca 0.56 1.30 0.00 0.00 -0.96 0.00 0.00 56.93 57.83 2bs4 s PHE 141 Cb -0.19 0.39 0.00 0.00 -0.34 0.00 0.00 43.02 42.88 2bs4 s PHE 141 CO 0.20 -0.31 0.00 0.41 -1.46 0.00 0.00 175.22 174.06 2bs4 n GLY 142 N 3.57 0.65 3.03 13.12 0.00 -1.26 -4.35 105.19 119.95 2bs4 n GLY 142 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2bs4 n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs4 n GLY 143 N -2.03 0.50 3.77 -0.02 0.00 -1.26 -4.60 105.19 101.56 2bs4 n GLY 143 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2bs4 n GLY 143 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bs4 s THR 144 N -2.40 3.12 0.21 2.61 -4.23 -1.26 -4.93 115.64 108.76 2bs4 s THR 144 Ca 0.00 0.95 -0.09 0.00 -1.18 0.00 0.00 61.69 61.37 2bs4 s THR 144 Cb 0.00 -3.53 0.15 0.00 1.34 0.00 0.00 72.50 70.46 2bs4 s THR 144 CO 0.00 0.09 1.80 0.50 -0.54 0.00 0.00 174.62 176.47 2bs4 h LYS 145 N 2.64 1.09 -5.65 3.99 3.64 -1.98 -3.40 116.57 116.91 2bs4 h LYS 145 Ca -0.49 -0.15 -0.60 0.00 -1.27 0.00 0.00 60.65 58.14 2bs4 h LYS 145 Cb 1.23 -0.20 -0.10 0.00 -0.41 0.00 0.00 32.23 32.76 2bs4 h LYS 145 CO 0.62 0.84 0.14 0.21 -2.27 0.00 0.00 179.45 178.99 2bs4 s LYS 146 N -5.74 4.20 -0.54 1.90 2.47 -1.26 -5.02 119.74 115.75 2bs4 s LYS 146 Ca -0.13 0.62 -0.28 0.00 -1.56 0.00 0.00 55.97 54.63 2bs4 s LYS 146 Cb 0.15 -3.59 0.01 0.00 -1.46 0.00 0.00 37.83 32.94 2bs4 s LYS 146 CO 0.81 -0.27 1.49 -1.58 0.16 0.00 0.00 175.35 175.96 2bs4 s TRP 147 N 2.02 2.19 -0.05 4.03 0.52 -0.86 -4.81 118.94 121.97 2bs4 s TRP 147 Ca 0.29 0.52 0.07 0.00 0.02 0.00 0.00 56.10 57.00 2bs4 s TRP 147 Cb -0.16 -4.34 0.11 0.00 -1.15 0.00 0.00 33.47 27.94 2bs4 s TRP 147 CO 0.10 -2.09 1.03 2.89 0.02 0.00 0.00 176.95 178.90 2bs4 n ARG 148 N 8.68 0.63 -2.95 4.98 1.85 -1.25 -3.96 116.66 124.65 2bs4 n ARG 148 Ca 0.14 -1.61 -0.43 0.00 -1.00 0.00 0.00 57.85 54.95 2bs4 n ARG 148 Cb 0.49 -0.91 -0.05 0.00 -1.05 0.00 0.00 32.46 30.94 2bs4 n ARG 148 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2bs4 s THR 149 N -1.17 4.61 0.44 8.89 2.01 -1.15 -1.69 115.64 127.58 2bs4 s THR 149 Ca 0.13 0.39 -0.18 0.00 0.31 0.00 0.00 61.69 62.33 2bs4 s THR 149 Cb 0.11 -4.36 -0.09 0.00 0.01 0.00 0.00 72.50 68.17 2bs4 s THR 149 CO 0.01 -0.78 0.91 0.00 -0.69 0.00 0.00 174.62 174.07 2bs4 s TYR 151 N -2.30 -0.39 -0.71 0.00 1.13 -1.26 0.04 117.35 113.85 2bs4 s TYR 151 Ca 0.59 0.16 0.03 0.00 -1.41 0.00 0.00 57.07 56.43 2bs4 s TYR 151 Cb -0.10 0.42 0.17 0.00 -1.10 0.00 0.00 41.96 41.36 2bs4 s TYR 151 CO 0.21 -0.78 0.51 0.95 -2.51 0.00 0.00 175.55 173.93 2bs4 s THR 152 N -3.69 3.22 0.00 -3.49 -4.23 -1.26 -0.36 115.64 105.83 2bs4 s THR 152 Ca 0.01 -3.93 0.00 0.00 -1.18 0.00 0.00 61.69 56.60 2bs4 s THR 152 Cb 0.00 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2bs4 s THR 152 CO -0.12 -0.98 0.00 0.00 -0.54 0.00 0.00 174.62 172.98 2bs4 n ALA 153 N 2.36 0.00 -0.92 3.99 0.00 -1.26 -2.13 120.51 122.55 2bs4 n ALA 153 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.68 2bs4 n ALA 153 Cb 0.35 0.00 0.39 0.00 0.00 0.00 0.00 19.45 20.20 2bs4 n ALA 153 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2bs4 n ASP 154 N 1.49 5.60 -2.62 0.00 5.75 -1.26 -4.45 116.55 121.05 2bs4 n ASP 154 Ca 0.00 -2.95 -0.12 0.00 -0.01 0.00 0.00 54.79 51.71 2bs4 n ASP 154 Cb 0.00 -0.68 0.03 0.00 -1.03 0.00 0.00 41.12 39.44 2bs4 n ASP 154 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bs4 n ALA 155 N 0.51 3.67 0.16 2.12 0.00 -0.91 -4.69 120.51 121.37 2bs4 n ALA 155 Ca 0.27 -3.33 -0.14 0.00 0.00 0.00 0.00 53.44 50.25 2bs4 n ALA 155 Cb 1.18 -0.83 -0.06 0.00 0.00 0.00 0.00 19.45 19.74 2bs4 n ALA 155 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2bs4 h THR 156 N 3.28 0.48 -0.61 0.00 2.02 -1.60 -1.92 112.91 114.56 2bs4 h THR 156 Ca -0.01 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.25 2bs4 h THR 156 Cb 1.16 0.48 -0.06 0.00 -1.74 0.00 0.00 68.15 67.99 2bs4 h THR 156 CO 0.53 0.00 0.27 1.23 0.37 0.00 0.00 175.52 177.92 2bs4 h GLY 157 N -0.50 0.87 0.17 2.16 0.00 -1.39 -1.04 103.07 103.34 2bs4 h GLY 157 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.17 2bs4 h GLY 157 CO -0.07 0.05 -0.46 0.84 0.00 0.00 0.00 176.54 176.90 2bs4 h HIS 158 N 0.49 -1.33 -0.86 5.60 6.17 -1.26 -0.08 115.15 123.88 2bs4 h HIS 158 Ca 0.29 0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.38 2bs4 h HIS 158 Cb 0.29 0.56 -0.04 0.00 2.52 0.00 0.00 27.41 30.74 2bs4 h HIS 158 CO -0.13 -0.54 0.43 1.79 0.71 0.00 0.00 177.93 180.19 2bs4 h THR 159 N -0.71 1.26 0.05 6.26 1.35 -1.18 -1.65 112.91 118.29 2bs4 h THR 159 Ca -0.02 -0.70 -0.00 0.00 -0.55 0.00 0.00 66.41 65.14 2bs4 h THR 159 Cb 0.69 0.13 -0.00 0.00 -1.73 0.00 0.00 68.15 67.24 2bs4 h THR 159 CO -0.22 0.31 -0.04 0.24 -0.25 0.00 0.00 175.52 175.56 2bs4 h MET 160 N 1.22 -0.09 -0.66 4.72 2.86 -0.99 -2.01 114.93 120.00 2bs4 h MET 160 Ca 0.30 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.95 2bs4 h MET 160 Cb 0.09 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 2bs4 h MET 160 CO -0.04 -0.06 0.44 1.25 1.06 0.00 0.00 176.91 179.56 2bs4 h LEU 161 N -0.09 0.75 -0.95 1.22 5.85 -0.83 -2.56 115.31 118.70 2bs4 h LEU 161 Ca -0.00 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2bs4 h LEU 161 Cb 0.08 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 2bs4 h LEU 161 CO 0.00 0.54 0.58 -0.26 -0.34 0.00 0.00 178.44 178.96 2bs4 h PHE 162 N 0.89 1.26 -0.24 1.25 -1.00 -1.11 -0.47 116.94 117.51 2bs4 h PHE 162 Ca 0.24 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.01 2bs4 h PHE 162 Cb -0.10 -0.41 -0.01 0.00 3.61 0.00 0.00 35.95 39.04 2bs4 h PHE 162 CO -0.03 0.83 0.09 0.00 -1.61 0.00 0.00 178.31 177.59 2bs4 h ALA 163 N 1.32 0.31 -0.52 2.45 0.00 -0.98 -0.52 119.26 121.32 2bs4 h ALA 163 Ca 0.34 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 2bs4 h ALA 163 Cb -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2bs4 h ALA 163 CO -0.07 -0.09 -0.08 0.28 0.00 0.00 0.00 179.25 179.29 2bs4 h VAL 164 N 0.23 1.26 -0.47 0.00 2.07 -1.25 -0.58 116.25 117.51 2bs4 h VAL 164 Ca 0.08 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2bs4 h VAL 164 Cb 0.18 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2bs4 h VAL 164 CO -0.01 0.42 0.18 0.00 0.02 0.00 0.00 177.57 178.19 2bs4 h ALA 165 N 1.05 0.61 -0.04 1.67 0.00 -0.96 -1.78 119.26 119.81 2bs4 h ALA 165 Ca 0.14 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2bs4 h ALA 165 Cb 0.62 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2bs4 h ALA 165 CO 0.04 0.22 -0.25 -0.91 0.00 0.00 0.00 179.25 178.35 2bs4 h ASN 166 N 0.61 0.06 -0.04 0.00 2.35 -0.82 -1.42 115.58 116.33 2bs4 h ASN 166 Ca 0.16 -0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.76 2bs4 h ASN 166 Cb 0.20 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 2bs4 h ASN 166 CO -0.01 0.32 -0.40 -0.33 -1.65 0.00 0.00 177.43 175.36 2bs4 h GLU 167 N 0.06 0.55 -0.69 0.81 4.39 -0.67 -0.76 114.58 118.26 2bs4 h GLU 167 Ca 0.01 -0.28 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 2bs4 h GLU 167 Cb 0.48 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 2bs4 h GLU 167 CO 0.03 0.86 0.30 0.00 -1.16 0.00 0.00 179.01 179.04 2bs4 h LEU 169 N 0.98 0.92 -0.70 0.00 3.38 -1.06 0.43 115.31 119.26 2bs4 h LEU 169 Ca 0.23 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2bs4 h LEU 169 Cb 0.18 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2bs4 h LEU 169 CO -0.02 1.00 0.46 0.50 0.09 0.00 0.00 178.44 180.47 2bs4 h LYS 170 N 0.81 0.92 0.00 1.13 3.64 -0.61 -1.70 116.57 120.76 2bs4 h LYS 170 Ca 0.15 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2bs4 h LYS 170 Cb 0.53 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2bs4 h LYS 170 CO 0.03 0.61 0.00 1.28 -2.27 0.00 0.00 179.45 179.10 2bs4 n LEU 171 N -4.60 0.00 -0.60 5.20 4.77 0.01 -4.91 117.00 116.87 2bs4 n LEU 171 Ca 0.06 0.25 -0.05 0.00 -0.03 0.00 0.00 56.01 56.24 2bs4 n LEU 171 Cb 0.02 -0.25 -0.00 0.00 -2.33 0.00 0.00 43.42 40.86 2bs4 n LEU 171 CO 0.36 -0.00 -0.05 0.61 -1.33 0.00 0.00 177.39 176.97 2bs4 n GLY 172 N 1.21 0.21 3.77 -0.72 0.00 -0.64 -4.94 105.19 104.07 2bs4 n GLY 172 Ca 0.15 -0.67 -0.35 0.00 0.00 0.00 0.00 46.02 45.15 2bs4 n GLY 172 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bs4 s VAL 173 N -2.31 2.95 -0.53 1.61 1.01 0.05 -4.96 120.40 118.23 2bs4 s VAL 173 Ca 0.01 0.58 -0.21 0.00 0.00 0.00 0.00 61.98 62.36 2bs4 s VAL 173 Cb -0.00 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 33.21 2bs4 s VAL 173 CO 0.01 -0.14 0.76 -0.55 0.00 0.00 0.00 175.10 175.19 2bs4 s SER 174 N -1.75 6.27 -0.38 3.32 0.15 -0.85 -4.79 113.70 115.66 2bs4 s SER 174 Ca 0.74 -0.71 -0.16 0.00 0.70 0.00 0.00 55.95 56.52 2bs4 s SER 174 Cb -0.26 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2bs4 s SER 174 CO 0.30 -1.05 0.41 -0.63 1.20 0.00 0.00 173.24 173.47 2bs4 s ILE 175 N 3.20 5.12 -0.35 6.45 1.01 -1.26 -0.03 121.20 135.34 2bs4 s ILE 175 Ca 0.21 -0.09 -0.00 0.00 0.00 0.00 0.00 60.65 60.77 2bs4 s ILE 175 Cb -0.17 -3.93 0.09 0.00 0.01 0.00 0.00 42.46 38.47 2bs4 s ILE 175 CO 0.14 -0.24 0.09 -1.10 0.00 0.00 0.00 174.94 173.83 2bs4 s GLN 176 N 2.10 1.98 0.75 2.79 -0.21 0.24 -4.97 119.66 122.35 2bs4 s GLN 176 Ca 0.13 -1.67 -0.00 0.00 0.02 0.00 0.00 55.36 53.83 2bs4 s GLN 176 Cb -0.17 -3.33 0.15 0.00 1.00 0.00 0.00 33.01 30.66 2bs4 s GLN 176 CO 0.13 -0.89 1.03 0.16 -2.12 0.00 0.00 175.29 173.59 2bs4 s ASP 177 N 1.38 4.18 -1.60 5.90 -4.77 -1.26 -1.58 116.67 118.92 2bs4 s ASP 177 Ca 0.05 -0.49 -0.14 0.00 -3.30 0.00 0.00 52.55 48.67 2bs4 s ASP 177 Cb -0.21 0.21 0.11 0.00 -1.09 0.00 0.00 42.92 41.94 2bs4 s ASP 177 CO -0.05 -1.99 0.80 0.54 0.70 0.00 0.00 175.17 175.17 2bs4 n ARG 178 N -2.90 -3.99 -4.14 2.11 1.74 0.43 -4.82 116.66 105.08 2bs4 n ARG 178 Ca 0.17 0.46 -0.20 0.00 -0.77 0.00 0.00 57.85 57.51 2bs4 n ARG 178 Cb 0.61 -5.15 -0.16 0.00 -1.02 0.00 0.00 32.46 26.74 2bs4 n ARG 178 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2bs4 s LYS 179 N -6.75 0.77 -0.07 5.56 2.47 -0.29 -1.44 119.74 119.98 2bs4 s LYS 179 Ca 0.59 -0.09 0.03 0.00 -1.56 0.00 0.00 55.97 54.95 2bs4 s LYS 179 Cb -0.31 -0.80 0.00 0.00 -1.46 0.00 0.00 37.83 35.26 2bs4 s LYS 179 CO 0.89 -0.08 -0.18 -2.00 0.16 0.00 0.00 175.35 174.13 2bs4 s GLU 180 N 0.91 2.28 -0.24 4.03 2.12 -0.25 -3.30 118.70 124.25 2bs4 s GLU 180 Ca -0.11 -0.65 -0.28 0.00 0.36 0.00 0.00 54.97 54.28 2bs4 s GLU 180 Cb -0.14 -1.81 0.01 0.00 0.26 0.00 0.00 34.13 32.44 2bs4 s GLU 180 CO 0.00 0.14 1.01 0.00 -0.54 0.00 0.00 175.26 175.87 2bs4 s ALA 181 N 0.39 3.67 -0.97 6.30 0.00 -1.26 -0.70 121.76 129.19 2bs4 s ALA 181 Ca -0.14 0.11 0.08 0.00 0.00 0.00 0.00 51.96 52.01 2bs4 s ALA 181 Cb -0.16 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.52 2bs4 s ALA 181 CO 0.05 -1.05 0.76 0.44 0.00 0.00 0.00 175.76 175.96 2bs4 n ILE 182 N 5.34 0.03 -3.59 0.00 -5.35 -0.81 -4.87 119.36 110.11 2bs4 n ILE 182 Ca 0.11 -0.52 -0.06 0.00 -0.27 0.00 0.00 62.75 62.01 2bs4 n ILE 182 Cb 0.46 1.14 -0.04 0.00 -1.74 0.00 0.00 39.64 39.47 2bs4 n ILE 182 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bs4 s ALA 183 N -0.66 -2.01 -0.06 -1.28 0.00 -1.20 -4.88 121.76 111.66 2bs4 s ALA 183 Ca 0.09 1.63 -0.01 0.00 0.00 0.00 0.00 51.96 53.68 2bs4 s ALA 183 Cb 0.07 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 2bs4 s ALA 183 CO 0.10 -0.40 -0.01 -0.51 0.00 0.00 0.00 175.76 174.95 2bs4 s LEU 184 N -1.48 3.52 -0.19 0.00 1.43 -1.26 -1.10 118.68 119.60 2bs4 s LEU 184 Ca 0.05 0.09 -0.18 0.00 -1.03 0.00 0.00 54.13 53.05 2bs4 s LEU 184 Cb -0.01 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2bs4 s LEU 184 CO -0.04 0.35 0.50 -0.63 0.23 0.00 0.00 176.35 176.76 2bs4 s ILE 185 N -0.93 5.13 -0.01 -0.59 1.01 0.11 -4.85 121.20 121.07 2bs4 s ILE 185 Ca 0.15 0.93 -0.19 0.00 0.00 0.00 0.00 60.65 61.54 2bs4 s ILE 185 Cb -0.11 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.56 2bs4 s ILE 185 CO 0.04 0.20 0.40 -1.38 0.00 0.00 0.00 174.94 174.21 2bs4 s HIS 186 N 1.47 -0.28 -0.20 3.97 -3.43 -1.26 -0.19 115.29 115.36 2bs4 s HIS 186 Ca 0.24 0.41 -0.21 0.00 -0.80 0.00 0.00 55.06 54.69 2bs4 s HIS 186 Cb -0.15 0.18 0.06 0.00 -1.43 0.00 0.00 32.58 31.24 2bs4 s HIS 186 CO 0.10 -0.47 0.59 -1.14 -2.00 0.00 0.00 174.74 171.82 2bs4 s GLN 187 N -1.59 0.73 -1.43 -0.38 0.74 -0.86 -4.92 119.66 111.96 2bs4 s GLN 187 Ca -0.11 0.74 -0.11 0.00 0.05 0.00 0.00 55.36 55.92 2bs4 s GLN 187 Cb -0.03 0.35 0.08 0.00 1.10 0.00 0.00 33.01 34.51 2bs4 s GLN 187 CO 0.04 -0.11 0.67 -0.25 -0.55 0.00 0.00 175.29 175.09 2bs4 n ASP 188 N 2.52 -4.25 -1.28 6.67 8.00 -1.26 -1.83 116.55 125.11 2bs4 n ASP 188 Ca -0.14 -0.55 -0.13 0.00 0.71 0.00 0.00 54.79 54.68 2bs4 n ASP 188 Cb 0.56 -3.47 -0.03 0.00 -0.02 0.00 0.00 41.12 38.17 2bs4 n ASP 188 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bs4 n GLY 189 N -1.37 0.52 3.07 0.44 0.00 -1.26 -5.02 105.19 101.57 2bs4 n GLY 189 Ca 0.00 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 2bs4 n GLY 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bs4 s LYS 190 N -3.97 0.87 -0.15 1.61 1.02 -0.76 -2.62 119.74 115.73 2bs4 s LYS 190 Ca 0.00 -0.47 -0.19 0.00 0.02 0.00 0.00 55.97 55.33 2bs4 s LYS 190 Cb 0.00 -0.84 -0.04 0.00 -0.52 0.00 0.00 37.83 36.43 2bs4 s LYS 190 CO 0.00 0.23 0.53 0.00 -0.92 0.00 0.00 175.35 175.18 2bs4 n TYR 192 N 4.22 0.29 0.00 0.00 4.01 0.74 -4.74 117.16 121.68 2bs4 n TYR 192 Ca -0.05 -0.39 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 2bs4 n TYR 192 Cb 0.51 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 2bs4 n TYR 192 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2bs4 n GLY 193 N 0.36 0.72 3.20 2.72 0.00 -1.22 -1.66 105.19 109.32 2bs4 n GLY 193 Ca 0.08 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 2bs4 n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs4 s ALA 194 N -1.14 -0.64 -0.15 4.61 0.00 0.72 -0.71 121.76 124.45 2bs4 s ALA 194 Ca 0.00 0.15 -0.21 0.00 0.00 0.00 0.00 51.96 51.90 2bs4 s ALA 194 Cb 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 2bs4 s ALA 194 CO 0.00 -0.26 0.63 0.08 0.00 0.00 0.00 175.76 176.21 2bs4 s VAL 195 N -1.50 5.05 0.03 0.00 1.01 -0.26 -0.21 120.40 124.53 2bs4 s VAL 195 Ca -0.13 1.23 0.09 0.00 0.00 0.00 0.00 61.98 63.17 2bs4 s VAL 195 Cb -0.05 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2bs4 s VAL 195 CO 0.03 0.17 -0.26 -0.69 0.00 0.00 0.00 175.10 174.35 2bs4 s VAL 196 N 1.47 2.12 -0.17 2.92 1.01 0.24 -1.93 120.40 126.07 2bs4 s VAL 196 Ca 0.31 -1.34 -0.04 0.00 0.00 0.00 0.00 61.98 60.90 2bs4 s VAL 196 Cb -0.16 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2bs4 s VAL 196 CO 0.12 0.40 -0.03 -0.60 0.00 0.00 0.00 175.10 175.00 2bs4 s ARG 197 N -1.13 3.65 -0.35 2.72 3.52 0.13 -0.21 118.95 127.27 2bs4 s ARG 197 Ca 0.11 -0.52 -0.29 0.00 -0.13 0.00 0.00 55.73 54.90 2bs4 s ARG 197 Cb -0.10 -2.96 0.02 0.00 -1.56 0.00 0.00 34.95 30.35 2bs4 s ARG 197 CO 0.02 0.17 1.08 0.34 -0.81 0.00 0.00 175.30 176.09 2bs4 s ASP 198 N 0.56 6.86 0.58 -2.12 -1.08 -0.08 -1.09 116.67 120.30 2bs4 s ASP 198 Ca -0.02 0.91 0.38 0.00 -0.52 0.00 0.00 52.55 53.30 2bs4 s ASP 198 Cb -0.14 -2.54 1.90 0.00 -1.46 0.00 0.00 42.92 40.68 2bs4 s ASP 198 CO 0.02 -0.95 2.16 -0.07 0.52 0.00 0.00 175.17 176.86 2bs4 h LEU 199 N 10.29 0.00 0.00 -1.34 3.38 -1.59 0.51 115.31 126.57 2bs4 h LEU 199 Ca -0.21 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.51 2bs4 h LEU 199 Cb 1.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2bs4 h LEU 199 CO 1.05 0.00 -1.42 0.52 0.09 0.00 0.00 178.44 178.68 2bs4 n VAL 200 N -2.98 1.52 0.01 1.22 0.31 -1.26 -2.71 118.33 114.45 2bs4 n VAL 200 Ca -0.01 -0.06 -0.05 0.00 -0.01 0.00 0.00 64.34 64.20 2bs4 n VAL 200 Cb 0.16 -2.05 -0.11 0.00 -0.91 0.00 0.00 33.84 30.93 2bs4 n VAL 200 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2bs4 h THR 201 N -1.00 0.85 0.00 2.52 1.35 -1.90 -2.37 112.91 112.36 2bs4 h THR 201 Ca -0.38 -2.55 0.00 0.00 -0.55 0.00 0.00 66.41 62.93 2bs4 h THR 201 Cb 1.29 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 70.07 2bs4 h THR 201 CO -0.23 0.48 0.00 0.61 -0.25 0.00 0.00 175.52 176.14 2bs4 n GLY 202 N 1.46 0.75 3.77 5.82 0.00 0.18 -4.10 105.19 113.07 2bs4 n GLY 202 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2bs4 n GLY 202 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bs4 s ASP 203 N -2.71 6.56 -0.25 1.61 1.01 -1.25 -4.65 116.67 116.98 2bs4 s ASP 203 Ca 0.00 2.53 -0.10 0.00 0.71 0.00 0.00 52.55 55.69 2bs4 s ASP 203 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 2bs4 s ASP 203 CO 0.00 -0.67 0.14 -0.63 0.21 0.00 0.00 175.17 174.23 2bs4 s ILE 204 N -1.28 5.04 0.04 0.77 1.09 -1.26 -0.90 121.20 124.70 2bs4 s ILE 204 Ca 0.54 0.07 0.06 0.00 -1.10 0.00 0.00 60.65 60.23 2bs4 s ILE 204 Cb -0.35 -3.37 -0.02 0.00 -1.06 0.00 0.00 42.46 37.65 2bs4 s ILE 204 CO 0.46 0.31 -0.19 -0.63 -0.10 0.00 0.00 174.94 174.80 2bs4 s ILE 205 N 1.42 1.49 -0.25 2.92 1.01 0.71 -4.62 121.20 123.87 2bs4 s ILE 205 Ca 0.07 -1.10 -0.11 0.00 0.00 0.00 0.00 60.65 59.51 2bs4 s ILE 205 Cb -0.15 -1.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 2bs4 s ILE 205 CO 0.07 0.17 0.17 0.00 0.00 0.00 0.00 174.94 175.35 2bs4 s ALA 206 N -0.77 3.59 -0.34 9.38 0.00 -0.58 0.83 121.76 133.87 2bs4 s ALA 206 Ca 0.06 -0.94 -0.08 0.00 0.00 0.00 0.00 51.96 51.00 2bs4 s ALA 206 Cb -0.08 -2.37 0.03 0.00 0.00 0.00 0.00 23.12 20.69 2bs4 s ALA 206 CO 0.01 -0.29 0.13 0.71 0.00 0.00 0.00 175.76 176.32 2bs4 s TYR 207 N 1.25 3.22 -0.05 0.00 1.51 0.71 -1.16 117.35 122.84 2bs4 s TYR 207 Ca 0.08 -1.13 -0.02 0.00 -1.01 0.00 0.00 57.07 54.99 2bs4 s TYR 207 Cb -0.14 -2.32 -0.04 0.00 -0.11 0.00 0.00 41.96 39.35 2bs4 s TYR 207 CO 0.06 -0.65 0.06 0.14 -1.11 0.00 0.00 175.55 174.06 2bs4 s VAL 208 N 1.48 4.72 0.20 0.71 -7.23 -0.34 -0.20 120.40 119.74 2bs4 s VAL 208 Ca 0.01 -0.26 -0.17 0.00 -1.81 0.00 0.00 61.98 59.75 2bs4 s VAL 208 Cb -0.19 -3.09 0.02 0.00 0.56 0.00 0.00 36.38 33.69 2bs4 s VAL 208 CO 0.04 0.48 0.52 0.00 -0.31 0.00 0.00 175.10 175.82 2bs4 s ALA 209 N -1.07 -0.87 -0.64 1.32 0.00 -0.66 -2.23 121.76 117.60 2bs4 s ALA 209 Ca 0.18 -0.28 0.26 0.00 0.00 0.00 0.00 51.96 52.12 2bs4 s ALA 209 Cb -0.12 0.86 0.75 0.00 0.00 0.00 0.00 23.12 24.61 2bs4 s ALA 209 CO 0.09 -0.80 1.75 0.87 0.00 0.00 0.00 175.76 177.66 2bs4 h LYS 210 N 2.21 0.00 -2.46 0.00 1.57 -1.46 -3.39 116.57 113.03 2bs4 h LYS 210 Ca -0.28 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.41 2bs4 h LYS 210 Cb 1.26 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.34 2bs4 h LYS 210 CO 0.37 0.00 -0.11 0.20 -0.57 0.00 0.00 179.45 179.34 2bs4 s GLY 211 N -3.71 -0.40 -0.08 3.86 0.00 -1.16 -4.75 107.32 101.08 2bs4 s GLY 211 Ca 0.09 1.54 0.03 0.00 0.00 0.00 0.00 44.72 46.38 2bs4 s GLY 211 CO 0.59 1.38 -0.20 -1.59 0.00 0.00 0.00 173.10 173.29 2bs4 s THR 212 N 0.47 1.70 -0.13 0.90 2.01 0.23 -1.55 115.64 119.27 2bs4 s THR 212 Ca -0.02 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.18 2bs4 s THR 212 Cb -0.04 -1.49 -0.00 0.00 0.01 0.00 0.00 72.50 70.98 2bs4 s THR 212 CO -0.02 0.48 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.99 2bs4 s LEU 213 N 0.42 2.38 -0.32 4.42 0.20 -0.18 0.47 118.68 126.07 2bs4 s LEU 213 Ca -0.16 -0.48 -0.11 0.00 0.69 0.00 0.00 54.13 54.07 2bs4 s LEU 213 Cb -0.17 -1.52 -0.02 0.00 -0.43 0.00 0.00 46.19 44.06 2bs4 s LEU 213 CO 0.07 0.13 0.19 -0.63 -0.29 0.00 0.00 176.35 175.81 2bs4 s ILE 214 N 0.56 4.94 -0.44 6.68 1.01 0.10 -0.35 121.20 133.70 2bs4 s ILE 214 Ca -0.11 -0.27 0.10 0.00 0.00 0.00 0.00 60.65 60.37 2bs4 s ILE 214 Cb -0.16 -3.50 0.37 0.00 0.01 0.00 0.00 42.46 39.18 2bs4 s ILE 214 CO 0.04 0.06 0.88 0.00 0.00 0.00 0.00 174.94 175.92 2bs4 n ALA 215 N 5.04 3.45 1.46 9.38 0.00 0.11 -2.50 120.51 137.45 2bs4 n ALA 215 Ca -0.13 -3.89 0.06 0.00 0.00 0.00 0.00 53.44 49.47 2bs4 n ALA 215 Cb 0.50 -0.82 0.22 0.00 0.00 0.00 0.00 19.45 19.34 2bs4 n ALA 215 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2bs4 n THR 216 N -0.03 0.20 -4.03 0.00 -2.24 -1.24 -4.36 114.28 102.58 2bs4 n THR 216 Ca 0.26 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2bs4 n THR 216 Cb 0.60 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.93 2bs4 n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bs4 n GLY 217 N 0.86 -1.61 3.96 3.38 0.00 -1.26 -4.84 105.19 105.67 2bs4 n GLY 217 Ca 0.09 -1.33 -0.23 0.00 0.00 0.00 0.00 46.02 44.56 2bs4 n GLY 217 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bs4 s GLY 218 N -0.45 1.77 -0.37 -0.02 0.00 -1.26 -2.89 107.32 104.10 2bs4 s GLY 218 Ca 0.00 -1.16 0.06 0.00 0.00 0.00 0.00 44.72 43.62 2bs4 s GLY 218 CO 0.00 -0.84 1.62 1.58 0.00 0.00 0.00 173.10 175.46 2bs4 n TYR 219 N -2.55 1.94 0.14 1.90 0.18 -1.26 -3.44 117.16 114.06 2bs4 n TYR 219 Ca 0.08 -1.86 0.16 0.00 1.88 0.00 0.00 57.90 58.15 2bs4 n TYR 219 Cb 0.60 -0.70 0.72 0.00 -0.38 0.00 0.00 39.34 39.59 2bs4 n TYR 219 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 2bs4 h GLY 220 N 1.19 0.00 -0.30 -7.48 0.00 -1.89 -2.93 103.07 91.66 2bs4 h GLY 220 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2bs4 h GLY 220 CO 0.72 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.80 2bs4 n ARG 221 N -4.22 0.74 -0.00 4.80 5.12 -0.10 -2.23 116.66 120.76 2bs4 n ARG 221 Ca 0.04 0.00 0.14 0.00 -1.93 0.00 0.00 57.85 56.10 2bs4 n ARG 221 Cb 0.38 -1.11 0.63 0.00 -1.16 0.00 0.00 32.46 31.20 2bs4 n ARG 221 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2bs4 n ILE 222 N -0.31 0.00 -4.17 0.55 -5.35 -1.11 -4.78 119.36 104.20 2bs4 n ILE 222 Ca 0.00 -0.19 -0.24 0.00 -0.27 0.00 0.00 62.75 62.05 2bs4 n ILE 222 Cb 0.06 0.25 -0.06 0.00 -1.74 0.00 0.00 39.64 38.14 2bs4 n ILE 222 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2bs4 s TYR 223 N -2.00 2.97 0.03 4.28 1.51 -0.95 -4.02 117.35 119.17 2bs4 s TYR 223 Ca 0.40 -0.12 -0.17 0.00 -1.01 0.00 0.00 57.07 56.17 2bs4 s TYR 223 Cb 0.21 -1.37 -0.30 0.00 -0.11 0.00 0.00 41.96 40.39 2bs4 s TYR 223 CO 0.34 0.54 1.05 -0.22 -1.11 0.00 0.00 175.55 176.16 2bs4 h LYS 224 N 2.02 0.53 -4.83 -0.62 3.64 -1.77 -3.43 116.57 112.11 2bs4 h LYS 224 Ca -0.47 -0.73 -0.67 0.00 -1.27 0.00 0.00 60.65 57.51 2bs4 h LYS 224 Cb 1.23 0.25 -0.24 0.00 -0.41 0.00 0.00 32.23 33.05 2bs4 h LYS 224 CO 0.61 1.33 -0.60 -0.80 -2.27 0.00 0.00 179.45 177.71 2bs4 s ASN 225 N -7.27 5.27 0.05 4.20 0.02 -1.26 -5.07 114.94 110.89 2bs4 s ASN 225 Ca -0.11 -0.52 -0.21 0.00 -1.02 0.00 0.00 52.86 51.00 2bs4 s ASN 225 Cb 0.04 -1.93 0.05 0.00 0.02 0.00 0.00 41.25 39.43 2bs4 s ASN 225 CO 0.90 -0.16 0.49 0.28 0.02 0.00 0.00 177.10 178.64 2bs4 s THR 226 N 1.57 0.04 -0.25 1.60 -1.32 -1.26 -2.35 115.64 113.67 2bs4 s THR 226 Ca 0.04 -0.29 0.18 0.00 -1.21 0.00 0.00 61.69 60.41 2bs4 s THR 226 Cb -0.17 -0.97 0.14 0.00 -1.51 0.00 0.00 72.50 69.99 2bs4 s THR 226 CO 0.04 -0.16 1.44 0.71 -2.21 0.00 0.00 174.62 174.44 2bs4 h THR 227 N 2.82 0.54 -3.64 5.08 1.35 -1.14 -3.43 112.91 114.50 2bs4 h THR 227 Ca -0.31 -1.77 -0.55 0.00 -0.55 0.00 0.00 66.41 63.23 2bs4 h THR 227 Cb 1.21 2.23 0.19 0.00 -1.73 0.00 0.00 68.15 70.05 2bs4 h THR 227 CO 0.42 0.31 -0.11 0.59 -0.25 0.00 0.00 175.52 176.47 2bs4 n ASN 228 N -3.14 -0.35 -4.75 5.36 5.03 -1.26 -4.85 115.26 111.29 2bs4 n ASN 228 Ca 0.02 0.57 -0.30 0.00 0.87 0.00 0.00 54.58 55.73 2bs4 n ASN 228 Cb 0.67 -1.34 0.11 0.00 -1.02 0.00 0.00 39.78 38.20 2bs4 n ASN 228 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2bs4 s ALA 229 N -2.02 1.98 -0.77 5.41 0.00 -1.26 -4.92 121.76 120.18 2bs4 s ALA 229 Ca 0.68 0.07 0.16 0.00 0.00 0.00 0.00 51.96 52.88 2bs4 s ALA 229 Cb -0.31 -3.22 0.71 0.00 0.00 0.00 0.00 23.12 20.31 2bs4 s ALA 229 CO 0.56 -1.98 1.51 1.33 0.00 0.00 0.00 175.76 177.18 2bs4 n VAL 230 N -3.64 1.05 0.47 0.00 0.24 -1.26 -2.54 118.33 112.66 2bs4 n VAL 230 Ca 0.08 0.30 0.10 0.00 -2.04 0.00 0.00 64.34 62.78 2bs4 n VAL 230 Cb 0.54 -1.16 0.26 0.00 -1.47 0.00 0.00 33.84 32.01 2bs4 n VAL 230 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 2bs4 n VAL 231 N -1.80 0.58 -3.04 3.34 0.24 -1.26 -4.63 118.33 111.75 2bs4 n VAL 231 Ca 0.02 -0.65 -0.44 0.00 -2.04 0.00 0.00 64.34 61.23 2bs4 n VAL 231 Cb 0.16 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.03 2bs4 n VAL 231 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bs4 n GLU 233 N 2.60 2.92 -1.19 0.00 1.02 -1.25 -0.93 120.64 123.82 2bs4 n GLU 233 Ca 0.28 -2.25 -0.06 0.00 -0.02 0.00 0.00 57.16 55.11 2bs4 n GLU 233 Cb 0.37 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 2bs4 n GLU 233 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bs4 n GLY 234 N 0.48 0.75 0.25 0.62 0.00 -1.22 -4.62 105.19 101.44 2bs4 n GLY 234 Ca 0.15 -0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.07 2bs4 n GLY 234 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2bs4 h THR 235 N 0.00 1.07 -0.32 2.61 1.35 -1.93 0.27 112.91 115.96 2bs4 h THR 235 Ca -0.13 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2bs4 h THR 235 Cb 0.79 1.14 -0.02 0.00 -1.73 0.00 0.00 68.15 68.33 2bs4 h THR 235 CO 0.19 0.09 0.21 1.23 -0.25 0.00 0.00 175.52 176.99 2bs4 h GLY 236 N 0.28 0.45 0.94 5.82 0.00 -1.89 -0.41 103.07 108.26 2bs4 h GLY 236 Ca 0.01 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.18 2bs4 h GLY 236 CO 0.01 0.17 0.22 -0.84 0.00 0.00 0.00 176.54 176.10 2bs4 h THR 237 N 0.43 1.06 0.01 4.70 2.02 -1.50 -3.06 112.91 116.57 2bs4 h THR 237 Ca 0.12 -0.15 0.03 0.00 0.77 0.00 0.00 66.41 67.17 2bs4 h THR 237 Cb -0.04 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 2bs4 h THR 237 CO -0.02 0.08 -0.19 0.00 0.37 0.00 0.00 175.52 175.76 2bs4 h ALA 238 N 1.15 -0.25 0.00 6.16 0.00 -0.31 -0.85 119.26 125.16 2bs4 h ALA 238 Ca 0.14 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2bs4 h ALA 238 Cb -0.02 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2bs4 h ALA 238 CO -0.05 -0.69 -0.01 -0.84 0.00 0.00 0.00 179.25 177.66 2bs4 h ILE 239 N -0.32 0.51 0.01 0.00 3.07 -1.06 0.30 117.51 120.01 2bs4 h ILE 239 Ca 0.05 -0.03 -0.09 0.00 1.55 0.00 0.00 64.86 66.35 2bs4 h ILE 239 Cb 0.38 1.02 0.01 0.00 -0.27 0.00 0.00 36.82 37.96 2bs4 h ILE 239 CO -0.17 0.01 -0.35 0.00 -1.05 0.00 0.00 178.15 176.59 2bs4 h ALA 240 N 1.99 0.03 -0.41 0.16 0.00 -1.28 -3.24 119.26 116.52 2bs4 h ALA 240 Ca -0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2bs4 h ALA 240 Cb 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2bs4 h ALA 240 CO 0.00 0.16 0.13 1.25 0.00 0.00 0.00 179.25 180.78 2bs4 h LEU 241 N -0.43 0.53 0.00 0.00 5.85 0.06 -2.58 115.31 118.75 2bs4 h LEU 241 Ca -0.04 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2bs4 h LEU 241 Cb 1.10 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2bs4 h LEU 241 CO 0.07 0.52 0.00 -0.62 -0.34 0.00 0.00 178.44 178.07 2bs4 n GLU 242 N -4.35 0.73 0.06 1.25 1.02 0.92 -2.20 120.64 118.08 2bs4 n GLU 242 Ca 0.03 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.28 2bs4 n GLU 242 Cb 0.17 -1.23 0.14 0.00 -0.02 0.00 0.00 31.44 30.50 2bs4 n GLU 242 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2bs4 h THR 243 N 0.00 0.00 0.00 2.62 1.35 -1.54 -3.47 112.91 111.87 2bs4 h THR 243 Ca 0.00 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 2bs4 h THR 243 Cb 0.00 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 2bs4 h THR 243 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2bs4 n GLY 244 N 1.32 1.74 0.41 5.82 0.00 -0.93 -4.78 105.19 108.78 2bs4 n GLY 244 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 2bs4 n GLY 244 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2bs4 n ILE 245 N -2.00 1.28 -1.55 -0.61 2.08 -1.26 -4.05 119.36 113.24 2bs4 n ILE 245 Ca 0.00 0.05 -0.35 0.00 0.56 0.00 0.00 62.75 63.01 2bs4 n ILE 245 Cb 0.00 -1.98 0.08 0.00 -0.75 0.00 0.00 39.64 36.99 2bs4 n ILE 245 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2bs4 s ALA 246 N -2.52 2.21 0.19 -1.39 0.00 -1.26 -4.71 121.76 114.29 2bs4 s ALA 246 Ca -0.22 0.96 0.11 0.00 0.00 0.00 0.00 51.96 52.82 2bs4 s ALA 246 Cb 0.05 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2bs4 s ALA 246 CO 0.30 -1.75 -0.24 -0.65 0.00 0.00 0.00 175.76 173.43 2bs4 s GLN 247 N -3.74 1.53 -0.11 0.00 -0.21 -1.26 -4.66 119.66 111.20 2bs4 s GLN 247 Ca 0.76 -1.52 -0.05 0.00 0.02 0.00 0.00 55.36 54.58 2bs4 s GLN 247 Cb -0.31 -1.85 -0.04 0.00 1.00 0.00 0.00 33.01 31.81 2bs4 s GLN 247 CO 0.43 0.40 0.06 -0.51 -2.12 0.00 0.00 175.29 173.55 2bs4 s LEU 248 N -2.68 3.89 -0.13 2.90 1.43 0.43 -0.26 118.68 124.27 2bs4 s LEU 248 Ca 0.21 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.52 2bs4 s LEU 248 Cb -0.08 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 2bs4 s LEU 248 CO 0.10 0.35 -0.01 -0.83 0.23 0.00 0.00 176.35 176.19 2bs4 s GLY 249 N -0.71 1.80 -1.56 -3.19 0.00 0.19 -0.04 107.32 103.82 2bs4 s GLY 249 Ca 0.12 -0.80 -0.01 0.00 0.00 0.00 0.00 44.72 44.02 2bs4 s GLY 249 CO 0.02 -0.27 0.04 0.70 0.00 0.00 0.00 173.10 173.59 2bs4 n ASN 250 N 2.93 0.79 0.31 1.64 3.02 0.08 -2.09 115.26 121.95 2bs4 n ASN 250 Ca -0.18 -1.27 0.19 0.00 -0.03 0.00 0.00 54.58 53.29 2bs4 n ASN 250 Cb 0.53 -1.63 1.05 0.00 -0.61 0.00 0.00 39.78 39.12 2bs4 n ASN 250 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2bs4 h MET 251 N -1.75 0.00 0.00 3.52 2.86 -1.85 0.15 114.93 117.86 2bs4 h MET 251 Ca -0.66 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 56.98 2bs4 h MET 251 Cb 1.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.06 2bs4 h MET 251 CO 0.72 0.00 0.00 -0.85 1.06 0.00 0.00 176.91 177.84 2bs4 n GLU 252 N -3.49 0.03 -2.69 1.72 0.00 -1.26 -4.44 120.64 110.51 2bs4 n GLU 252 Ca -0.03 0.10 -0.43 0.00 0.00 0.00 0.00 57.16 56.80 2bs4 n GLU 252 Cb 0.09 -1.54 -0.01 0.00 0.00 0.00 0.00 31.44 29.98 2bs4 n GLU 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bs4 s ALA 253 N -3.02 3.33 -0.10 -1.84 0.00 0.53 -4.77 121.76 115.89 2bs4 s ALA 253 Ca 0.12 -2.84 -0.01 0.00 0.00 0.00 0.00 51.96 49.22 2bs4 s ALA 253 Cb 0.16 -4.44 -0.03 0.00 0.00 0.00 0.00 23.12 18.80 2bs4 s ALA 253 CO 0.46 -3.23 -0.03 0.08 0.00 0.00 0.00 175.76 173.05 2bs4 s VAL 254 N 3.67 4.04 -0.05 0.00 1.01 -1.26 -2.11 120.40 125.70 2bs4 s VAL 254 Ca 0.47 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2bs4 s VAL 254 Cb 0.01 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 2bs4 s VAL 254 CO 0.00 0.58 -0.03 -1.58 0.00 0.00 0.00 175.10 174.07 2bs4 s GLN 255 N -0.57 2.81 0.17 2.72 0.74 -0.02 -4.73 119.66 120.78 2bs4 s GLN 255 Ca 0.09 -0.53 0.08 0.00 0.05 0.00 0.00 55.36 55.05 2bs4 s GLN 255 Cb -0.12 -2.66 -0.04 0.00 1.10 0.00 0.00 33.01 31.29 2bs4 s GLN 255 CO 0.02 0.66 -0.06 -0.06 -0.55 0.00 0.00 175.29 175.30 2bs4 s PHE 256 N -0.92 2.73 -0.09 1.67 0.40 -1.26 -0.53 117.98 119.98 2bs4 s PHE 256 Ca 0.15 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.28 2bs4 s PHE 256 Cb -0.11 -1.34 -0.03 0.00 0.51 0.00 0.00 43.02 42.05 2bs4 s PHE 256 CO 0.04 0.51 -0.02 -1.58 0.70 0.00 0.00 175.22 174.87 2bs4 s HIS 257 N -1.66 3.10 -0.12 0.36 5.65 0.11 -4.83 115.29 117.88 2bs4 s HIS 257 Ca 0.25 0.11 0.15 0.00 0.25 0.00 0.00 55.06 55.82 2bs4 s HIS 257 Cb -0.09 -1.79 0.07 0.00 -1.18 0.00 0.00 32.58 29.59 2bs4 s HIS 257 CO 0.16 0.39 1.44 -1.00 -0.65 0.00 0.00 174.74 175.08 2bs4 h PRO 258 N 5.34 0.00 -1.49 2.88 0.13 -1.88 -1.05 132.00 135.93 2bs4 h PRO 258 Ca -0.48 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.07 2bs4 h PRO 258 Cb 1.19 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.90 2bs4 h PRO 258 CO 0.55 0.54 -0.75 0.25 -0.23 0.00 0.00 178.00 178.35 2bs4 n THR 259 N -3.25 2.31 -2.55 1.56 -2.24 -1.26 -3.20 114.28 105.64 2bs4 n THR 259 Ca 0.02 -4.84 -0.33 0.00 -2.27 0.00 0.00 64.05 56.63 2bs4 n THR 259 Cb 0.74 -1.18 -0.05 0.00 -2.10 0.00 0.00 70.33 67.75 2bs4 n THR 259 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2bs4 s PRO 260 N -3.52 4.03 0.26 -0.78 0.02 -1.25 -3.56 135.00 130.20 2bs4 s PRO 260 Ca 0.47 1.05 -0.30 0.00 0.02 0.00 0.00 61.00 62.24 2bs4 s PRO 260 Cb 0.40 -2.15 -0.10 0.00 0.02 0.00 0.00 34.50 32.67 2bs4 s PRO 260 CO -0.18 -0.21 1.46 -1.17 -0.33 0.00 0.00 177.00 176.58 2bs4 s LEU 261 N -3.71 4.38 -0.15 -5.54 2.96 0.11 -3.26 118.68 113.47 2bs4 s LEU 261 Ca 0.61 2.72 -0.07 0.00 -0.22 0.00 0.00 54.13 57.17 2bs4 s LEU 261 Cb -0.10 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 2bs4 s LEU 261 CO 0.24 -0.73 0.11 0.12 -1.32 0.00 0.00 176.35 174.76 2bs4 s PHE 262 N -0.10 3.44 -2.52 5.38 5.36 0.57 0.45 117.98 130.55 2bs4 s PHE 262 Ca 0.59 0.36 0.23 0.00 -0.96 0.00 0.00 56.93 57.16 2bs4 s PHE 262 Cb -0.43 -2.00 0.11 0.00 -0.34 0.00 0.00 43.02 40.37 2bs4 s PHE 262 CO 0.45 0.49 1.19 -0.35 -1.46 0.00 0.00 175.22 175.54 2bs4 n PRO 263 N 2.65 1.77 -0.25 10.12 -0.04 -1.26 -4.73 135.00 143.26 2bs4 n PRO 263 Ca -0.18 -1.46 0.11 0.00 -0.04 0.00 0.00 63.50 61.93 2bs4 n PRO 263 Cb 0.54 -1.47 0.38 0.00 -0.04 0.00 0.00 33.50 32.91 2bs4 n PRO 263 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2bs4 h SER 264 N 3.56 0.64 0.00 3.54 4.64 -1.96 -3.46 113.55 120.52 2bs4 h SER 264 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2bs4 h SER 264 Cb 0.87 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2bs4 h SER 264 CO 0.00 0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.91 2bs4 n GLY 265 N -1.44 0.75 3.70 -0.77 0.00 0.17 -4.85 105.19 102.75 2bs4 n GLY 265 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2bs4 n GLY 265 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bs4 s ILE 266 N -2.50 2.96 0.33 -0.61 1.01 -1.25 -4.22 121.20 116.92 2bs4 s ILE 266 Ca 0.00 0.52 -0.29 0.00 0.00 0.00 0.00 60.65 60.88 2bs4 s ILE 266 Cb 0.00 -3.33 -0.10 0.00 0.01 0.00 0.00 42.46 39.04 2bs4 s ILE 266 CO 0.00 0.01 1.32 -0.22 0.00 0.00 0.00 174.94 176.05 2bs4 s LEU 267 N 2.17 4.42 -0.43 2.97 2.96 -1.26 0.07 118.68 129.58 2bs4 s LEU 267 Ca 0.72 2.70 0.04 0.00 -0.22 0.00 0.00 54.13 57.36 2bs4 s LEU 267 Cb -0.40 -3.65 0.12 0.00 0.50 0.00 0.00 46.19 42.75 2bs4 s LEU 267 CO 0.32 -0.55 0.16 -0.76 -1.32 0.00 0.00 176.35 174.20 2bs4 s LEU 268 N -1.74 4.59 0.21 -0.68 1.43 -1.23 -4.83 118.68 116.42 2bs4 s LEU 268 Ca 0.49 -2.57 -0.12 0.00 -1.03 0.00 0.00 54.13 50.90 2bs4 s LEU 268 Cb -0.40 -1.65 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 2bs4 s LEU 268 CO 0.53 -0.32 0.08 1.07 0.23 0.00 0.00 176.35 177.94 2bs4 n THR 269 N 3.71 0.47 0.16 5.49 5.66 -1.26 -4.78 114.28 123.72 2bs4 n THR 269 Ca 0.04 -0.28 0.11 0.00 -3.05 0.00 0.00 64.05 60.87 2bs4 n THR 269 Cb 0.37 0.00 0.58 0.00 -1.55 0.00 0.00 70.33 69.73 2bs4 n THR 269 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2bs4 n GLU 270 N 0.72 0.14 0.21 1.09 2.13 -1.26 -2.36 120.64 121.31 2bs4 n GLU 270 Ca 0.07 0.64 0.15 0.00 0.66 0.00 0.00 57.16 58.67 2bs4 n GLU 270 Cb 0.21 -1.95 0.74 0.00 0.27 0.00 0.00 31.44 30.71 2bs4 n GLU 270 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2bs4 h GLY 271 N 0.00 0.00 0.70 8.31 0.00 -1.94 -2.51 103.07 107.63 2bs4 h GLY 271 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2bs4 h GLY 271 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.49 2bs4 h ARG 273 N -0.45 0.01 -0.68 0.00 3.08 -1.75 1.37 114.38 115.96 2bs4 h ARG 273 Ca -0.02 -0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.15 2bs4 h ARG 273 Cb 0.37 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 2bs4 h ARG 273 CO 0.03 0.32 0.46 0.78 -1.07 0.00 0.00 179.97 180.48 2bs4 h GLY 274 N -0.30 0.65 1.66 0.04 0.00 -1.48 -0.81 103.07 102.83 2bs4 h GLY 274 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2bs4 h GLY 274 CO 0.00 0.08 -0.28 -0.55 0.00 0.00 0.00 176.54 175.79 2bs4 h ASP 275 N 0.42 0.00 0.00 0.19 5.19 -1.12 -3.46 116.42 117.64 2bs4 h ASP 275 Ca 0.32 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 2bs4 h ASP 275 Cb 0.69 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.20 2bs4 h ASP 275 CO -0.10 0.03 0.00 0.61 -3.12 0.00 0.00 179.24 176.66 2bs4 n GLY 276 N 1.25 0.08 3.32 2.75 0.00 -0.31 -5.02 105.19 107.25 2bs4 n GLY 276 Ca 0.04 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.59 2bs4 n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs4 n GLY 277 N 0.00 -1.80 3.40 -0.02 0.00 0.47 -4.94 105.19 102.30 2bs4 n GLY 277 Ca 0.00 0.30 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2bs4 n GLY 277 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bs4 s ILE 278 N -1.04 2.96 -0.17 -0.61 -1.09 0.84 -4.63 121.20 117.46 2bs4 s ILE 278 Ca 0.62 -0.72 -0.14 0.00 -2.23 0.00 0.00 60.65 58.18 2bs4 s ILE 278 Cb -0.89 -2.20 -0.05 0.00 -1.58 0.00 0.00 42.46 37.75 2bs4 s ILE 278 CO 0.55 0.55 0.30 -0.76 -1.23 0.00 0.00 174.94 174.36 2bs4 s LEU 279 N -0.09 4.22 0.19 2.97 1.43 -1.26 0.48 118.68 126.62 2bs4 s LEU 279 Ca -0.02 0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.63 2bs4 s LEU 279 Cb -0.14 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 2bs4 s LEU 279 CO 0.04 0.06 -0.15 -0.13 0.23 0.00 0.00 176.35 176.40 2bs4 s ARG 280 N 0.67 1.28 0.00 1.70 0.52 -0.51 -3.30 118.95 119.30 2bs4 s ARG 280 Ca 0.16 -1.52 0.00 0.00 -0.52 0.00 0.00 55.73 53.85 2bs4 s ARG 280 Cb -0.13 -1.10 0.00 0.00 0.52 0.00 0.00 34.95 34.24 2bs4 s ARG 280 CO 0.05 0.19 0.00 -0.40 0.02 0.00 0.00 175.30 175.16 2bs4 n ASP 281 N -0.18 0.32 0.05 0.23 5.68 -0.77 -1.64 116.55 120.23 2bs4 n ASP 281 Ca -0.10 -0.64 0.19 0.00 -0.50 0.00 0.00 54.79 53.74 2bs4 n ASP 281 Cb 0.60 0.00 0.70 0.00 -1.14 0.00 0.00 41.12 41.28 2bs4 n ASP 281 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 2bs4 h VAL 282 N 0.10 0.71 -0.02 2.12 3.04 -1.50 -0.49 116.25 120.21 2bs4 h VAL 282 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2bs4 h VAL 282 Cb 0.00 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 30.05 2bs4 h VAL 282 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.03 2bs4 n ASP 283 N -4.29 1.87 0.00 3.17 8.00 -1.26 -4.90 116.55 119.13 2bs4 n ASP 283 Ca 0.07 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.95 2bs4 n ASP 283 Cb 0.52 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2bs4 n ASP 283 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bs4 n GLY 284 N 1.22 0.64 3.69 0.44 0.00 -0.19 -5.01 105.19 105.97 2bs4 n GLY 284 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bs4 n GLY 284 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2bs4 s HIS 285 N -2.05 3.32 -0.48 1.61 5.04 -1.26 -4.68 115.29 116.79 2bs4 s HIS 285 Ca 0.00 1.37 -0.28 0.00 -1.54 0.00 0.00 55.06 54.61 2bs4 s HIS 285 Cb 0.00 -3.33 0.00 0.00 0.04 0.00 0.00 32.58 29.29 2bs4 s HIS 285 CO 0.00 -0.88 1.57 0.50 -2.34 0.00 0.00 174.74 173.59 2bs4 s ARG 286 N 2.14 3.27 -0.00 2.88 3.52 -1.26 -1.85 118.95 127.65 2bs4 s ARG 286 Ca 0.53 0.81 0.22 0.00 -0.13 0.00 0.00 55.73 57.16 2bs4 s ARG 286 Cb -0.22 -4.16 -0.29 0.00 -1.56 0.00 0.00 34.95 28.73 2bs4 s ARG 286 CO 0.20 -1.96 0.55 1.97 -0.81 0.00 0.00 175.30 175.26 2bs4 n PHE 287 N 10.05 0.15 -0.24 5.12 1.16 -1.21 -4.55 117.46 127.94 2bs4 n PHE 287 Ca 0.17 0.04 0.04 0.00 -1.87 0.00 0.00 57.45 55.84 2bs4 n PHE 287 Cb 0.49 -0.59 0.17 0.00 -1.61 0.00 0.00 39.48 37.93 2bs4 n PHE 287 CO 0.00 0.00 0.00 0.52 -1.87 0.00 0.00 176.76 175.41 2bs4 h MET 288 N 0.00 0.30 -0.54 3.97 2.86 -1.89 0.24 114.93 119.88 2bs4 h MET 288 Ca -0.02 -0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.71 2bs4 h MET 288 Cb 1.05 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.62 2bs4 h MET 288 CO 0.00 0.20 0.37 -1.35 1.06 0.00 0.00 176.91 177.19 2bs4 h PRO 289 N 0.31 0.24 -0.55 -0.22 0.11 -1.80 0.59 132.00 130.68 2bs4 h PRO 289 Ca 0.39 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.55 2bs4 h PRO 289 Cb 0.63 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.63 2bs4 h PRO 289 CO -0.46 0.16 0.24 -0.44 -0.21 0.00 0.00 178.00 177.29 2bs4 h ASP 290 N 0.24 0.31 0.20 -2.05 3.32 -0.79 -2.03 116.42 115.62 2bs4 h ASP 290 Ca 0.25 0.05 -0.35 0.00 0.02 0.00 0.00 57.03 57.00 2bs4 h ASP 290 Cb 0.67 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 2bs4 h ASP 290 CO -0.05 0.20 -1.91 1.88 -1.72 0.00 0.00 179.24 177.64 2bs4 h TYR 291 N 0.46 0.44 -2.73 4.55 -1.99 -0.99 -3.42 116.97 113.29 2bs4 h TYR 291 Ca 0.26 -0.32 -0.61 0.00 2.00 0.00 0.00 58.73 60.06 2bs4 h TYR 291 Cb 0.23 -0.02 -0.41 0.00 2.00 0.00 0.00 36.73 38.53 2bs4 h TYR 291 CO -0.13 1.65 -0.67 0.39 -0.00 0.00 0.00 178.16 179.39 2bs4 n GLU 292 N -3.43 1.63 -0.33 4.88 -0.58 0.19 -4.96 120.64 118.04 2bs4 n GLU 292 Ca -0.28 -4.23 0.14 0.00 -0.42 0.00 0.00 57.16 52.36 2bs4 n GLU 292 Cb 1.05 -2.12 0.36 0.00 -0.57 0.00 0.00 31.44 30.17 2bs4 n GLU 292 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2bs4 h PRO 293 N 5.12 0.68 0.00 3.49 0.11 -1.57 0.59 132.00 140.42 2bs4 h PRO 293 Ca 0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2bs4 h PRO 293 Cb 0.77 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2bs4 h PRO 293 CO 0.67 0.45 0.00 -1.91 -0.21 0.00 0.00 178.00 177.00 2bs4 n GLU 294 N -4.68 0.00 0.22 1.05 2.13 -1.26 -4.37 120.64 113.72 2bs4 n GLU 294 Ca 0.22 0.00 0.05 0.00 0.66 0.00 0.00 57.16 58.09 2bs4 n GLU 294 Cb 0.59 -0.60 0.48 0.00 0.27 0.00 0.00 31.44 32.17 2bs4 n GLU 294 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2bs4 h LYS 295 N 0.00 0.00 0.00 5.31 1.63 -1.94 -3.48 116.57 118.09 2bs4 h LYS 295 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2bs4 h LYS 295 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2bs4 h LYS 295 CO 0.00 0.23 0.00 1.63 -3.45 0.00 0.00 179.45 177.86 2bs4 n LYS 296 N -4.22 0.00 0.00 1.90 5.02 0.21 -0.93 118.16 120.14 2bs4 n LYS 296 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2bs4 n LYS 296 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.30 2bs4 n LYS 296 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2bs4 n GLU 297 N 14.00 0.53 -0.24 1.97 0.00 -1.26 -1.99 120.64 133.66 2bs4 n GLU 297 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.23 2bs4 n GLU 297 Cb 0.00 -1.04 0.19 0.00 0.00 0.00 0.00 31.44 30.59 2bs4 n GLU 297 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2bs4 n LEU 298 N -0.40 3.19 -4.62 -1.84 4.77 -0.10 -4.82 117.00 113.18 2bs4 n LEU 298 Ca 0.00 -2.10 -0.29 0.00 -0.03 0.00 0.00 56.01 53.59 2bs4 n LEU 298 Cb 0.02 -0.30 0.20 0.00 -2.33 0.00 0.00 43.42 41.01 2bs4 n LEU 298 CO 0.00 0.76 0.60 0.00 -1.33 0.00 0.00 177.39 177.42 2bs4 s ALA 299 N -1.18 0.56 0.63 -1.18 0.00 -0.84 -4.93 121.76 114.82 2bs4 s ALA 299 Ca 0.29 -0.21 -0.18 0.00 0.00 0.00 0.00 51.96 51.85 2bs4 s ALA 299 Cb 0.16 -3.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 2bs4 s ALA 299 CO 0.17 -3.12 1.24 -1.13 0.00 0.00 0.00 175.76 172.92 2bs4 n SER 300 N -4.40 1.89 -0.10 0.00 3.41 -1.26 -4.71 113.62 108.45 2bs4 n SER 300 Ca 0.05 0.84 -0.07 0.00 -0.26 0.00 0.00 58.87 59.42 2bs4 n SER 300 Cb 0.56 -1.53 -0.01 0.00 -0.26 0.00 0.00 64.21 62.97 2bs4 n SER 300 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2bs4 h ARG 301 N 0.58 -0.21 -0.96 4.33 3.08 -1.97 -0.99 114.38 118.24 2bs4 h ARG 301 Ca -0.51 0.01 0.21 0.00 0.07 0.00 0.00 59.98 59.77 2bs4 h ARG 301 Cb 1.34 0.05 -0.18 0.00 0.08 0.00 0.00 29.97 31.26 2bs4 h ARG 301 CO 0.53 -0.14 -0.17 0.22 -1.07 0.00 0.00 179.97 179.34 2bs4 h ASP 302 N -0.22 -0.78 0.36 7.04 3.58 -1.90 -0.42 116.42 124.07 2bs4 h ASP 302 Ca 0.17 0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.89 2bs4 h ASP 302 Cb 0.50 0.56 0.00 0.00 1.72 0.00 0.00 39.33 42.12 2bs4 h ASP 302 CO -0.49 -0.32 -0.17 0.58 -2.88 0.00 0.00 179.24 175.95 2bs4 h VAL 303 N 0.00 0.62 -0.65 2.25 2.07 -1.56 -2.90 116.25 116.10 2bs4 h VAL 303 Ca 0.49 -0.49 0.14 0.00 0.82 0.00 0.00 66.70 67.66 2bs4 h VAL 303 Cb 0.83 0.86 -0.12 0.00 -1.52 0.00 0.00 31.29 31.35 2bs4 h VAL 303 CO -0.97 0.09 -0.07 0.58 0.02 0.00 0.00 177.57 177.23 2bs4 h VAL 304 N -0.77 0.41 -0.52 2.57 2.07 -0.35 0.31 116.25 119.97 2bs4 h VAL 304 Ca -0.05 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.50 2bs4 h VAL 304 Cb 0.51 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 2bs4 h VAL 304 CO 0.08 0.01 0.25 0.28 0.02 0.00 0.00 177.57 178.21 2bs4 h SER 305 N 0.06 0.33 -0.26 0.57 0.02 -1.17 0.10 113.55 113.20 2bs4 h SER 305 Ca 0.33 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.31 2bs4 h SER 305 Cb 0.54 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 2bs4 h SER 305 CO -0.61 0.23 0.12 0.03 -1.14 0.00 0.00 176.83 175.47 2bs4 h ARG 306 N 0.48 0.37 -0.66 3.45 3.08 -0.87 -2.18 114.38 118.04 2bs4 h ARG 306 Ca 0.24 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.27 2bs4 h ARG 306 Cb 0.18 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 2bs4 h ARG 306 CO -0.18 0.37 0.41 0.00 -1.07 0.00 0.00 179.97 179.49 2bs4 h ARG 307 N 0.28 0.77 -0.41 0.04 2.47 -0.53 0.63 114.38 117.63 2bs4 h ARG 307 Ca 0.09 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2bs4 h ARG 307 Cb 0.12 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.25 2bs4 h ARG 307 CO -0.01 0.51 0.19 0.52 0.56 0.00 0.00 179.97 181.74 2bs4 h MET 308 N 0.79 0.56 0.04 0.04 2.86 -0.79 0.13 114.93 118.57 2bs4 h MET 308 Ca 0.27 -0.06 -0.25 0.00 -2.06 0.00 0.00 59.70 57.60 2bs4 h MET 308 Cb 0.05 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 31.60 2bs4 h MET 308 CO -0.12 0.44 -1.05 0.82 1.06 0.00 0.00 176.91 178.07 2bs4 h ILE 309 N 0.57 1.40 0.28 -1.22 1.08 -0.66 -2.59 117.51 116.37 2bs4 h ILE 309 Ca 0.14 -2.58 -0.01 0.00 -0.39 0.00 0.00 64.86 62.02 2bs4 h ILE 309 Cb 0.06 2.57 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 2bs4 h ILE 309 CO -0.02 0.77 -0.13 -0.33 -0.69 0.00 0.00 178.15 177.74 2bs4 h GLU 310 N 0.21 -0.36 -0.60 2.37 5.08 -0.27 -0.97 114.58 120.03 2bs4 h GLU 310 Ca -0.11 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.38 2bs4 h GLU 310 Cb 1.71 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 30.96 2bs4 h GLU 310 CO 0.18 -0.13 0.18 1.25 -1.00 0.00 0.00 179.01 179.49 2bs4 h HIS 311 N -0.54 0.30 -0.71 4.33 2.76 -0.83 0.15 115.15 120.61 2bs4 h HIS 311 Ca -0.04 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2bs4 h HIS 311 Cb 0.40 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.28 2bs4 h HIS 311 CO -0.01 0.04 0.43 0.82 -1.30 0.00 0.00 177.93 177.90 2bs4 h ILE 312 N 0.33 1.20 -0.07 6.26 2.04 -1.32 -1.37 117.51 124.60 2bs4 h ILE 312 Ca 0.31 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 2bs4 h ILE 312 Cb 0.42 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 2bs4 h ILE 312 CO -0.35 0.21 -0.17 0.03 0.00 0.00 0.00 178.15 177.88 2bs4 h ARG 313 N 0.98 0.10 0.00 2.37 3.08 0.39 0.48 114.38 121.78 2bs4 h ARG 313 Ca 0.26 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2bs4 h ARG 313 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2bs4 h ARG 313 CO -0.05 0.28 0.00 1.63 -1.07 0.00 0.00 179.97 180.76 2bs4 n LYS 314 N -4.29 0.66 -1.03 0.04 5.02 0.33 -4.82 118.16 114.08 2bs4 n LYS 314 Ca -0.02 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.26 2bs4 n LYS 314 Cb 0.26 -1.20 -0.00 0.00 -0.02 0.00 0.00 35.03 34.07 2bs4 n LYS 314 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bs4 n GLY 315 N 0.22 0.47 1.41 0.72 0.00 0.16 -4.93 105.19 103.24 2bs4 n GLY 315 Ca 0.06 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.30 2bs4 n GLY 315 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2bs4 n LYS 316 N -2.94 3.49 -2.69 1.61 3.00 -1.01 -4.98 118.16 114.64 2bs4 n LYS 316 Ca -0.01 -2.78 -0.30 0.00 -0.00 0.00 0.00 58.31 55.22 2bs4 n LYS 316 Cb 0.04 -1.79 -0.02 0.00 0.00 0.00 0.00 35.03 33.25 2bs4 n LYS 316 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2bs4 s GLY 317 N -1.01 1.83 0.16 3.14 0.00 -1.26 -1.39 107.32 108.79 2bs4 s GLY 317 Ca 0.47 -0.23 -0.30 0.00 0.00 0.00 0.00 44.72 44.66 2bs4 s GLY 317 CO 0.24 -0.03 0.97 0.14 0.00 0.00 0.00 173.10 174.41 2bs4 s VAL 318 N -2.54 4.29 -0.19 1.40 1.01 0.67 -4.68 120.40 120.37 2bs4 s VAL 318 Ca 0.51 2.03 -0.19 0.00 0.00 0.00 0.00 61.98 64.33 2bs4 s VAL 318 Cb -0.10 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 31.95 2bs4 s VAL 318 CO 0.36 0.37 0.55 -1.10 0.00 0.00 0.00 175.10 175.28 2bs4 s GLN 319 N -0.44 4.22 0.12 2.72 -1.52 -1.26 -1.72 119.66 121.78 2bs4 s GLN 319 Ca 0.45 0.48 0.03 0.00 -1.95 0.00 0.00 55.36 54.37 2bs4 s GLN 319 Cb -0.25 -3.55 -0.04 0.00 -0.22 0.00 0.00 33.01 28.95 2bs4 s GLN 319 CO 0.31 -0.13 -0.08 0.45 -0.25 0.00 0.00 175.29 175.59 2bs4 s SER 320 N 1.09 1.42 0.14 5.90 0.15 -0.63 -5.00 113.70 116.78 2bs4 s SER 320 Ca 0.26 -1.01 0.15 0.00 0.70 0.00 0.00 55.95 56.05 2bs4 s SER 320 Cb -0.16 0.05 0.69 0.00 -1.71 0.00 0.00 66.02 64.90 2bs4 s SER 320 CO 0.10 -0.41 1.47 -0.81 1.20 0.00 0.00 173.24 174.79 2bs4 n PRO 321 N -0.12 0.08 -0.09 5.44 -0.04 -1.26 -1.90 135.00 137.12 2bs4 n PRO 321 Ca -0.11 0.44 0.06 0.00 -0.04 0.00 0.00 63.50 63.85 2bs4 n PRO 321 Cb 0.61 -1.70 0.10 0.00 -0.04 0.00 0.00 33.50 32.47 2bs4 n PRO 321 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2bs4 n TYR 322 N -1.87 0.24 0.00 0.54 4.01 -1.26 -5.09 117.16 113.73 2bs4 n TYR 322 Ca 0.01 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 2bs4 n TYR 322 Cb 0.12 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2bs4 n TYR 322 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2bs4 n GLY 323 N 0.62 0.56 3.84 2.72 0.00 -0.80 -5.06 105.19 107.07 2bs4 n GLY 323 Ca 0.09 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.59 2bs4 n GLY 323 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bs4 s GLN 324 N -0.84 3.90 0.19 1.61 -0.21 -1.26 -1.60 119.66 121.46 2bs4 s GLN 324 Ca 0.00 0.39 0.04 0.00 0.02 0.00 0.00 55.36 55.81 2bs4 s GLN 324 Cb 0.00 -3.17 -0.01 0.00 1.00 0.00 0.00 33.01 30.82 2bs4 s GLN 324 CO 0.00 0.66 0.17 -2.39 -2.12 0.00 0.00 175.29 171.62 2bs4 n HIS 325 N 1.63 -0.52 -4.24 0.91 1.44 -0.70 -4.91 115.22 108.83 2bs4 n HIS 325 Ca -0.13 -1.54 -0.12 0.00 -2.01 0.00 0.00 57.72 53.93 2bs4 n HIS 325 Cb 0.52 0.18 -0.03 0.00 0.12 0.00 0.00 29.99 30.78 2bs4 n HIS 325 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2bs4 n LEU 326 N 0.00 0.00 -4.38 2.39 4.77 0.07 -0.23 117.00 119.62 2bs4 n LEU 326 Ca 0.04 -1.44 -0.30 0.00 -0.03 0.00 0.00 56.01 54.28 2bs4 n LEU 326 Cb 0.34 0.44 -0.14 0.00 -2.33 0.00 0.00 43.42 41.73 2bs4 n LEU 326 CO 0.17 -0.22 -0.56 0.26 -1.33 0.00 0.00 177.39 175.71 2bs4 s TRP 327 N -2.20 2.34 -0.20 -1.77 0.52 -0.65 -0.95 118.94 116.03 2bs4 s TRP 327 Ca 0.09 -0.38 -0.00 0.00 0.02 0.00 0.00 56.10 55.82 2bs4 s TRP 327 Cb 0.00 -1.33 0.01 0.00 -1.15 0.00 0.00 33.47 31.00 2bs4 s TRP 327 CO 0.06 0.24 -0.15 -1.17 0.02 0.00 0.00 176.95 175.95 2bs4 s LEU 328 N -1.64 2.41 -0.35 2.99 2.96 0.10 -1.43 118.68 123.72 2bs4 s LEU 328 Ca 0.13 -0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 53.39 2bs4 s LEU 328 Cb -0.10 -1.56 0.05 0.00 0.50 0.00 0.00 46.19 45.08 2bs4 s LEU 328 CO 0.04 -0.01 0.11 -0.62 -1.32 0.00 0.00 176.35 174.55 2bs4 s ASP 329 N 1.34 5.26 -0.00 3.68 -1.08 0.18 -1.49 116.67 124.56 2bs4 s ASP 329 Ca 0.05 -1.30 0.13 0.00 -0.52 0.00 0.00 52.55 50.91 2bs4 s ASP 329 Cb -0.14 -1.85 -0.14 0.00 -1.46 0.00 0.00 42.92 39.34 2bs4 s ASP 329 CO -0.10 -0.36 0.51 2.30 0.52 0.00 0.00 175.17 178.05 2bs4 n ILE 330 N 4.76 0.00 -0.34 4.11 -0.00 -1.26 -0.11 119.36 126.52 2bs4 n ILE 330 Ca -0.11 -0.21 0.17 0.00 -0.00 0.00 0.00 62.75 62.60 2bs4 n ILE 330 Cb 0.44 0.93 0.39 0.00 -0.00 0.00 0.00 39.64 41.40 2bs4 n ILE 330 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 2bs4 h SER 331 N 0.00 0.68 0.02 7.28 4.64 -1.78 0.17 113.55 124.56 2bs4 h SER 331 Ca 0.00 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2bs4 h SER 331 Cb 0.32 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2bs4 h SER 331 CO 0.00 0.14 0.00 2.30 -0.87 0.00 0.00 176.83 178.40 2bs4 n ILE 332 N -4.84 0.23 1.17 0.95 -6.64 -1.26 -1.04 119.36 107.93 2bs4 n ILE 332 Ca 0.26 0.06 0.13 0.00 -1.77 0.00 0.00 62.75 61.42 2bs4 n ILE 332 Cb 0.73 -0.99 0.34 0.00 -1.44 0.00 0.00 39.64 38.27 2bs4 n ILE 332 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2bs4 n LEU 333 N -1.06 0.84 0.00 7.28 4.77 0.05 -5.05 117.00 123.83 2bs4 n LEU 333 Ca 0.03 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 2bs4 n LEU 333 Cb 0.02 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2bs4 n LEU 333 CO 0.02 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 2bs4 n GLY 334 N 1.39 0.45 0.19 -0.72 0.00 -0.20 -4.36 105.19 101.94 2bs4 n GLY 334 Ca 0.10 -1.68 -0.20 0.00 0.00 0.00 0.00 46.02 44.24 2bs4 n GLY 334 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2bs4 h ARG 335 N 0.00 0.68 -0.22 1.61 2.43 -1.89 -3.21 114.38 113.78 2bs4 h ARG 335 Ca 0.00 -0.71 -0.05 0.00 -0.81 0.00 0.00 59.98 58.41 2bs4 h ARG 335 Cb 0.00 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2bs4 h ARG 335 CO 0.00 1.30 -0.09 0.87 -1.51 0.00 0.00 179.97 180.54 2bs4 h LYS 336 N 0.34 0.34 -0.12 0.20 1.57 -1.98 -2.14 116.57 114.79 2bs4 h LYS 336 Ca -0.12 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.43 2bs4 h LYS 336 Cb 1.63 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.88 2bs4 h LYS 336 CO 0.19 0.44 -0.57 1.25 -0.57 0.00 0.00 179.45 180.20 2bs4 h HIS 337 N 0.33 0.47 0.01 -1.35 2.76 -1.76 -3.24 115.15 112.36 2bs4 h HIS 337 Ca 0.07 -0.17 -0.06 0.00 -2.20 0.00 0.00 60.37 58.01 2bs4 h HIS 337 Cb 0.36 -0.09 0.01 0.00 1.55 0.00 0.00 27.41 29.24 2bs4 h HIS 337 CO 0.01 0.85 -0.24 0.82 -1.30 0.00 0.00 177.93 178.07 2bs4 h ILE 338 N 0.28 1.58 0.00 6.26 2.04 -1.50 -2.00 117.51 124.17 2bs4 h ILE 338 Ca 0.00 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 63.84 2bs4 h ILE 338 Cb 1.08 2.87 0.00 0.00 -0.74 0.00 0.00 36.82 40.03 2bs4 h ILE 338 CO 0.10 0.55 0.00 -0.62 0.00 0.00 0.00 178.15 178.17 2bs4 n GLU 339 N -4.51 0.43 0.00 2.37 1.02 -0.83 0.39 120.64 119.51 2bs4 n GLU 339 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2bs4 n GLU 339 Cb 0.51 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 2bs4 n GLU 339 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2bs4 n THR 340 N -0.80 0.00 -0.09 2.62 -2.24 -1.22 -4.59 114.28 107.96 2bs4 n THR 340 Ca 0.06 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.75 2bs4 n THR 340 Cb 0.03 -0.32 -0.16 0.00 -2.10 0.00 0.00 70.33 67.78 2bs4 n THR 340 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2bs4 n ASN 341 N -2.08 0.12 -1.58 3.42 3.02 -0.75 -4.48 115.26 112.93 2bs4 n ASN 341 Ca 0.00 0.06 -0.06 0.00 -0.03 0.00 0.00 54.58 54.54 2bs4 n ASN 341 Cb 0.26 0.89 0.09 0.00 -0.61 0.00 0.00 39.78 40.41 2bs4 n ASN 341 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2bs4 n LEU 342 N -2.77 3.12 0.23 3.41 4.32 0.50 -4.81 117.00 120.99 2bs4 n LEU 342 Ca -0.30 -3.82 0.17 0.00 -0.02 0.00 0.00 56.01 52.05 2bs4 n LEU 342 Cb 1.12 -0.23 0.86 0.00 -1.62 0.00 0.00 43.42 43.55 2bs4 n LEU 342 CO 0.43 1.48 1.15 -0.09 -1.22 0.00 0.00 177.39 179.15 2bs4 h ARG 343 N 1.68 0.00 0.00 3.23 2.43 -0.29 -0.27 114.38 121.15 2bs4 h ARG 343 Ca 0.08 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 2bs4 h ARG 343 Cb 1.36 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 2bs4 h ARG 343 CO 0.32 0.00 -0.89 0.22 -1.51 0.00 0.00 179.97 178.11 2bs4 h ASP 344 N 0.00 0.00 0.70 -3.80 3.58 -1.87 -3.18 116.42 111.84 2bs4 h ASP 344 Ca 0.07 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.34 2bs4 h ASP 344 Cb 0.45 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 2bs4 h ASP 344 CO -0.00 0.60 -0.83 1.62 -2.88 0.00 0.00 179.24 177.75 2bs4 h VAL 345 N 0.00 1.54 -0.05 2.25 3.04 -1.42 -2.91 116.25 118.70 2bs4 h VAL 345 Ca -0.06 -2.67 -0.09 0.00 -1.01 0.00 0.00 66.70 62.87 2bs4 h VAL 345 Cb 1.51 2.46 -0.01 0.00 -2.01 0.00 0.00 31.29 33.24 2bs4 h VAL 345 CO 0.07 0.77 -0.37 -0.61 -1.01 0.00 0.00 177.57 176.41 2bs4 h GLN 346 N 0.05 0.09 -0.02 4.17 4.15 -1.46 -2.82 115.11 119.27 2bs4 h GLN 346 Ca -0.02 -0.04 -0.26 0.00 0.77 0.00 0.00 58.65 59.10 2bs4 h GLN 346 Cb 1.44 -0.00 0.02 0.00 0.21 0.00 0.00 27.48 29.15 2bs4 h GLN 346 CO 0.12 0.46 -1.01 0.93 -1.93 0.00 0.00 178.83 177.40 2bs4 h GLU 347 N 0.08 0.70 -0.17 1.69 5.08 -1.52 -2.98 114.58 117.45 2bs4 h GLU 347 Ca 0.01 -0.73 0.02 0.00 -1.00 0.00 0.00 59.36 57.66 2bs4 h GLU 347 Cb 0.70 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 2bs4 h GLU 347 CO 0.05 1.31 0.03 0.82 -1.00 0.00 0.00 179.01 180.22 2bs4 h ILE 348 N 0.41 0.92 -0.24 3.13 1.08 -1.38 0.09 117.51 121.51 2bs4 h ILE 348 Ca -0.12 -0.03 -0.08 0.00 -0.39 0.00 0.00 64.86 64.24 2bs4 h ILE 348 Cb 1.65 0.81 -0.01 0.00 -3.07 0.00 0.00 36.82 36.20 2bs4 h ILE 348 CO 0.20 0.02 -0.21 0.00 -0.69 0.00 0.00 178.15 177.47 2bs4 h GLU 350 N 0.39 -0.14 -0.73 0.00 5.08 -1.14 0.46 114.58 118.50 2bs4 h GLU 350 Ca 0.06 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2bs4 h GLU 350 Cb 0.58 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2bs4 h GLU 350 CO 0.04 0.32 0.43 1.88 -1.00 0.00 0.00 179.01 180.68 2bs4 h TYR 351 N -0.91 0.98 0.00 4.33 0.05 -1.03 -1.73 116.97 118.67 2bs4 h TYR 351 Ca -0.02 -0.01 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 2bs4 h TYR 351 Cb 0.53 -0.32 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 2bs4 h TYR 351 CO 0.11 0.68 -1.76 1.19 -1.05 0.00 0.00 178.16 177.32 2bs4 n PHE 352 N -4.50 0.00 0.53 4.88 3.01 -0.37 -4.59 117.46 116.42 2bs4 n PHE 352 Ca 0.07 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.58 2bs4 n PHE 352 Cb 0.07 -0.46 -0.05 0.00 -0.01 0.00 0.00 39.48 39.03 2bs4 n PHE 352 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2bs4 n ALA 353 N -2.20 3.36 -3.49 4.37 0.00 -0.05 -5.01 120.51 117.50 2bs4 n ALA 353 Ca -0.10 -0.35 -0.21 0.00 0.00 0.00 0.00 53.44 52.78 2bs4 n ALA 353 Cb 0.60 -0.41 0.08 0.00 0.00 0.00 0.00 19.45 19.72 2bs4 n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bs4 n GLY 354 N 1.21 -0.43 3.20 0.00 0.00 0.14 -4.92 105.19 104.39 2bs4 n GLY 354 Ca 0.03 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 2bs4 n GLY 354 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2bs4 s ILE 355 N -3.32 0.10 -0.44 -0.61 -4.36 -0.14 -4.93 121.20 107.50 2bs4 s ILE 355 Ca 0.39 -0.79 -0.16 0.00 -0.26 0.00 0.00 60.65 59.84 2bs4 s ILE 355 Cb -0.17 -0.87 0.04 0.00 1.25 0.00 0.00 42.46 42.70 2bs4 s ILE 355 CO 0.69 -0.44 0.37 -0.62 0.24 0.00 0.00 174.94 175.19 2bs4 s ASP 356 N -1.99 6.14 0.44 4.36 2.15 -1.26 -2.01 116.67 124.49 2bs4 s ASP 356 Ca -0.06 -0.99 0.18 0.00 0.43 0.00 0.00 52.55 52.12 2bs4 s ASP 356 Cb -0.02 -2.19 1.00 0.00 -0.30 0.00 0.00 42.92 41.42 2bs4 s ASP 356 CO -0.03 -0.55 1.50 1.55 -0.17 0.00 0.00 175.17 177.46 2bs4 h PRO 357 N 8.70 0.00 -0.01 4.34 0.13 -1.84 0.59 132.00 143.92 2bs4 h PRO 357 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2bs4 h PRO 357 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2bs4 h PRO 357 CO 0.80 0.00 -0.38 0.00 -0.23 0.00 0.00 178.00 178.19 2bs4 n ALA 358 N -1.67 3.33 0.00 -0.56 0.00 -1.26 -2.61 120.51 117.74 2bs4 n ALA 358 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2bs4 n ALA 358 Cb 0.34 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2bs4 n ALA 358 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2bs4 n GLU 359 N -0.90 1.24 -4.70 0.00 1.02 0.17 -4.74 120.64 112.74 2bs4 n GLU 359 Ca 0.10 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.93 2bs4 n GLU 359 Cb 0.35 -0.90 -0.09 0.00 -0.02 0.00 0.00 31.44 30.78 2bs4 n GLU 359 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2bs4 s LYS 360 N -1.80 2.09 -0.09 3.49 1.02 0.96 -5.03 119.74 120.38 2bs4 s LYS 360 Ca 0.00 -2.28 -0.05 0.00 0.02 0.00 0.00 55.97 53.66 2bs4 s LYS 360 Cb 0.00 -1.54 -0.04 0.00 -0.52 0.00 0.00 37.83 35.73 2bs4 s LYS 360 CO 0.00 -0.24 0.13 -1.58 -0.92 0.00 0.00 175.35 172.75 2bs4 s TRP 361 N -2.83 3.54 -0.12 3.18 0.51 -1.26 -4.42 118.94 117.54 2bs4 s TRP 361 Ca 0.18 0.45 -0.17 0.00 -2.12 0.00 0.00 56.10 54.44 2bs4 s TRP 361 Cb 0.05 -1.89 -0.04 0.00 -0.81 0.00 0.00 33.47 30.77 2bs4 s TRP 361 CO 0.09 0.69 0.45 0.00 -0.51 0.00 0.00 176.95 177.67 2bs4 s ALA 362 N -1.08 3.50 0.06 0.98 0.00 -0.55 -4.86 121.76 119.80 2bs4 s ALA 362 Ca 0.18 -0.23 -0.31 0.00 0.00 0.00 0.00 51.96 51.60 2bs4 s ALA 362 Cb -0.12 -2.60 -0.06 0.00 0.00 0.00 0.00 23.12 20.33 2bs4 s ALA 362 CO 0.07 0.03 1.36 -1.25 0.00 0.00 0.00 175.76 175.97 2bs4 s PRO 363 N 0.55 4.33 0.22 0.00 0.04 -1.26 -0.72 135.00 138.16 2bs4 s PRO 363 Ca 0.25 1.97 0.02 0.00 0.04 0.00 0.00 61.00 63.28 2bs4 s PRO 363 Cb -0.15 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.94 2bs4 s PRO 363 CO 0.09 -0.46 0.05 0.14 0.04 0.00 0.00 177.00 176.86 2bs4 s VAL 364 N 1.62 0.69 -0.29 -0.36 -7.23 -0.12 -0.32 120.40 114.39 2bs4 s VAL 364 Ca 0.63 -2.00 -0.25 0.00 -1.81 0.00 0.00 61.98 58.55 2bs4 s VAL 364 Cb -0.33 -2.41 0.16 0.00 0.56 0.00 0.00 36.38 34.36 2bs4 s VAL 364 CO 0.28 -0.22 1.26 -0.22 -0.31 0.00 0.00 175.10 175.89 2bs4 s LEU 365 N -3.26 -0.22 0.49 1.32 2.96 -1.20 -0.75 118.68 118.01 2bs4 s LEU 365 Ca 0.31 0.42 -0.23 0.00 -0.22 0.00 0.00 54.13 54.41 2bs4 s LEU 365 Cb 0.07 1.44 -0.07 0.00 0.50 0.00 0.00 46.19 48.14 2bs4 s LEU 365 CO 0.09 -0.08 1.35 -2.84 -1.32 0.00 0.00 176.35 173.55 2bs4 s PRO 366 N 0.04 3.49 0.11 0.98 0.02 -1.19 -3.75 135.00 134.70 2bs4 s PRO 366 Ca 0.05 2.22 -0.10 0.00 0.02 0.00 0.00 61.00 63.20 2bs4 s PRO 366 Cb -0.05 -2.46 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2bs4 s PRO 366 CO -0.11 -0.91 0.25 -1.64 -0.33 0.00 0.00 177.00 174.26 2bs4 s MET 367 N -2.65 0.95 0.30 5.54 -1.94 -0.40 -4.95 119.30 116.14 2bs4 s MET 367 Ca 0.65 -0.95 -0.30 0.00 -1.71 0.00 0.00 55.69 53.38 2bs4 s MET 367 Cb -0.40 0.37 -0.12 0.00 2.01 0.00 0.00 34.83 36.70 2bs4 s MET 367 CO 0.49 -0.33 1.54 0.94 -0.01 0.00 0.00 175.02 177.65 2bs4 n GLN 368 N -0.12 2.58 0.05 2.03 0.00 -0.99 -0.71 117.38 120.22 2bs4 n GLN 368 Ca -0.14 0.92 0.00 0.00 -0.00 0.00 0.00 57.00 57.78 2bs4 n GLN 368 Cb 0.63 -2.67 0.00 0.00 0.00 0.00 0.00 30.24 28.20 2bs4 n GLN 368 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 2bs4 n HIS 369 N 1.76 -0.67 -4.31 3.69 -0.00 0.31 -0.80 115.22 115.20 2bs4 n HIS 369 Ca 0.08 0.12 -0.23 0.00 -0.00 0.00 0.00 57.72 57.69 2bs4 n HIS 369 Cb 0.36 0.32 -0.13 0.00 -0.00 0.00 0.00 29.99 30.54 2bs4 n HIS 369 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 2bs4 s TYR 370 N -2.00 1.61 -0.44 1.57 5.04 -0.93 -4.68 117.35 117.52 2bs4 s TYR 370 Ca 0.00 -0.42 -0.05 0.00 -2.44 0.00 0.00 57.07 54.17 2bs4 s TYR 370 Cb 0.00 -0.90 0.12 0.00 0.35 0.00 0.00 41.96 41.52 2bs4 s TYR 370 CO 0.00 0.14 0.26 -1.12 -1.34 0.00 0.00 175.55 173.50 2bs4 s SER 371 N -1.70 5.40 0.30 4.32 0.01 -1.26 -0.84 113.70 119.92 2bs4 s SER 371 Ca 0.04 -2.06 0.02 0.00 1.31 0.00 0.00 55.95 55.27 2bs4 s SER 371 Cb -0.10 -1.89 0.46 0.00 0.21 0.00 0.00 66.02 64.71 2bs4 s SER 371 CO 0.03 -0.58 1.77 0.24 0.41 0.00 0.00 173.24 175.12 2bs4 h MET 372 N 8.10 0.54 -7.27 12.44 2.86 -1.75 -3.44 114.93 126.40 2bs4 h MET 372 Ca -0.14 -0.16 -0.43 0.00 -2.06 0.00 0.00 59.70 56.90 2bs4 h MET 372 Cb 1.05 -0.05 0.19 0.00 0.06 0.00 0.00 31.60 32.84 2bs4 h MET 372 CO 0.75 0.67 0.10 0.20 1.06 0.00 0.00 176.91 179.68 2bs4 s GLY 373 N -3.92 1.54 0.00 8.32 0.00 -1.21 -4.61 107.32 107.45 2bs4 s GLY 373 Ca -0.07 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2bs4 s GLY 373 CO 0.79 0.30 0.00 0.61 0.00 0.00 0.00 173.10 174.80 2bs4 n GLY 374 N -0.26 -1.70 3.70 0.20 0.00 -0.89 -4.52 105.19 101.71 2bs4 n GLY 374 Ca 0.06 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.38 2bs4 n GLY 374 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bs4 s ILE 375 N -2.72 2.69 0.17 -0.61 1.01 0.03 0.57 121.20 122.34 2bs4 s ILE 375 Ca 0.00 0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 2bs4 s ILE 375 Cb 0.00 -3.19 -0.07 0.00 0.01 0.00 0.00 42.46 39.21 2bs4 s ILE 375 CO 0.00 0.01 1.10 -0.60 0.00 0.00 0.00 174.94 175.44 2bs4 s ARG 376 N 2.20 4.59 0.25 2.79 6.06 0.65 -0.18 118.95 135.31 2bs4 s ARG 376 Ca 0.75 1.71 0.01 0.00 -2.50 0.00 0.00 55.73 55.70 2bs4 s ARG 376 Cb -0.44 -3.29 -0.04 0.00 0.06 0.00 0.00 34.95 31.25 2bs4 s ARG 376 CO 0.33 0.06 0.14 0.95 -2.50 0.00 0.00 175.30 174.28 2bs4 s THR 377 N -0.14 0.21 0.21 4.11 -4.23 -1.24 -4.25 115.64 110.31 2bs4 s THR 377 Ca 0.50 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.00 2bs4 s THR 377 Cb -0.29 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.06 2bs4 s THR 377 CO 0.34 0.00 0.29 -0.90 -0.54 0.00 0.00 174.62 173.81 2bs4 n ASP 378 N -0.58 0.31 0.32 3.99 5.68 -0.65 -4.78 116.55 120.83 2bs4 n ASP 378 Ca 0.02 -1.28 0.21 0.00 -0.50 0.00 0.00 54.79 53.23 2bs4 n ASP 378 Cb 0.65 -0.19 1.03 0.00 -1.14 0.00 0.00 41.12 41.47 2bs4 n ASP 378 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 2bs4 h TYR 379 N -0.56 0.00 0.00 2.11 -0.00 -1.91 -1.79 116.97 114.81 2bs4 h TYR 379 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.64 2bs4 h TYR 379 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.06 2bs4 h TYR 379 CO 0.00 0.01 -0.23 0.54 -0.00 0.00 0.00 178.16 178.47 2bs4 n ARG 380 N -3.12 0.17 -0.15 0.10 1.74 -1.26 -4.92 116.66 109.22 2bs4 n ARG 380 Ca -0.02 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2bs4 n ARG 380 Cb 0.15 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 2bs4 n ARG 380 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bs4 n GLY 381 N 1.39 0.84 3.83 -0.13 0.00 -0.67 -4.54 105.19 105.91 2bs4 n GLY 381 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2bs4 n GLY 381 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bs4 s GLU 382 N -0.85 3.86 0.87 1.61 2.12 -1.26 -1.01 118.70 124.04 2bs4 s GLU 382 Ca 0.00 0.28 -0.12 0.00 0.36 0.00 0.00 54.97 55.49 2bs4 s GLU 382 Cb 0.00 -3.24 0.19 0.00 0.26 0.00 0.00 34.13 31.35 2bs4 s GLU 382 CO 0.00 0.66 1.19 0.00 -0.54 0.00 0.00 175.26 176.56 2bs4 n ALA 383 N 2.05 -1.03 0.28 6.30 0.00 -0.05 -1.64 120.51 126.42 2bs4 n ALA 383 Ca -0.15 -1.71 0.17 0.00 0.00 0.00 0.00 53.44 51.75 2bs4 n ALA 383 Cb 0.53 0.02 0.75 0.00 0.00 0.00 0.00 19.45 20.74 2bs4 n ALA 383 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2bs4 h LYS 384 N 0.00 0.00 -5.45 0.00 3.64 -1.87 -3.37 116.57 109.52 2bs4 h LYS 384 Ca -0.39 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.35 2bs4 h LYS 384 Cb 1.14 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.81 2bs4 h LYS 384 CO 0.30 0.04 0.36 -1.17 -2.27 0.00 0.00 179.45 176.72 2bs4 s LEU 385 N -6.35 4.49 0.20 5.20 2.96 -1.26 -4.88 118.68 119.03 2bs4 s LEU 385 Ca -0.00 -0.67 -0.32 0.00 -0.22 0.00 0.00 54.13 52.91 2bs4 s LEU 385 Cb 0.10 -2.62 -0.15 0.00 0.50 0.00 0.00 46.19 44.02 2bs4 s LEU 385 CO 0.54 -1.13 1.24 0.29 -1.32 0.00 0.00 176.35 175.96 2bs4 n LYS 386 N 7.00 1.45 -0.09 1.98 4.01 -1.08 -1.91 118.16 129.53 2bs4 n LYS 386 Ca -0.02 0.52 0.00 0.00 -0.51 0.00 0.00 58.31 58.29 2bs4 n LYS 386 Cb 0.46 -2.06 0.00 0.00 -0.51 0.00 0.00 35.03 32.92 2bs4 n LYS 386 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2bs4 n GLY 387 N 2.04 1.63 3.52 0.72 0.00 -1.26 -0.09 105.19 111.75 2bs4 n GLY 387 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2bs4 n GLY 387 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bs4 s LEU 388 N 0.00 3.68 0.37 0.99 2.96 -0.80 -0.60 118.68 125.28 2bs4 s LEU 388 Ca 0.00 -0.09 0.08 0.00 -0.22 0.00 0.00 54.13 53.90 2bs4 s LEU 388 Cb 0.00 -1.99 -0.06 0.00 0.50 0.00 0.00 46.19 44.64 2bs4 s LEU 388 CO 0.00 0.00 -0.01 -0.36 -1.32 0.00 0.00 176.35 174.66 2bs4 s PHE 389 N 1.42 2.50 -0.02 5.38 0.40 0.18 -0.87 117.98 126.96 2bs4 s PHE 389 Ca 0.06 -0.54 -0.10 0.00 -0.60 0.00 0.00 56.93 55.75 2bs4 s PHE 389 Cb -0.15 -1.59 0.01 0.00 0.51 0.00 0.00 43.02 41.81 2bs4 s PHE 389 CO 0.05 0.48 0.22 0.45 0.70 0.00 0.00 175.22 177.12 2bs4 s SER 390 N -3.70 -0.11 -0.01 1.36 0.15 -0.18 0.02 113.70 111.24 2bs4 s SER 390 Ca 0.35 0.04 -0.19 0.00 0.70 0.00 0.00 55.95 56.85 2bs4 s SER 390 Cb 0.04 0.31 0.04 0.00 -1.71 0.00 0.00 66.02 64.69 2bs4 s SER 390 CO 0.18 -0.34 0.42 0.00 1.20 0.00 0.00 173.24 174.71 2bs4 s ALA 391 N -1.05 -1.07 0.00 5.45 0.00 -1.04 -4.74 121.76 119.31 2bs4 s ALA 391 Ca -0.11 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2bs4 s ALA 391 Cb -0.06 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2bs4 s ALA 391 CO 0.02 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.86 2bs4 n GLY 392 N 0.99 -1.73 0.33 0.00 0.00 -1.26 -4.14 105.19 99.37 2bs4 n GLY 392 Ca -0.20 -1.52 0.19 0.00 0.00 0.00 0.00 46.02 44.49 2bs4 n GLY 392 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2bs4 h GLU 393 N 0.00 0.00 0.00 1.61 4.81 -1.88 -0.56 114.58 118.55 2bs4 h GLU 393 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2bs4 h GLU 393 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2bs4 h GLU 393 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.28 2bs4 n ALA 394 N -2.17 1.83 -2.14 2.92 0.00 -1.14 -4.54 120.51 115.27 2bs4 n ALA 394 Ca -0.02 0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.27 2bs4 n ALA 394 Cb 0.18 -1.41 0.02 0.00 0.00 0.00 0.00 19.45 18.24 2bs4 n ALA 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bs4 s ALA 395 N -3.26 4.53 -0.41 0.00 0.00 -0.22 -0.79 121.76 121.61 2bs4 s ALA 395 Ca 0.06 -1.83 0.11 0.00 0.00 0.00 0.00 51.96 50.29 2bs4 s ALA 395 Cb 0.10 -1.27 0.36 0.00 0.00 0.00 0.00 23.12 22.32 2bs4 s ALA 395 CO 0.45 -0.58 0.82 0.00 0.00 0.00 0.00 175.76 176.45 2bs4 h TRP 397 N 2.98 0.32 -4.71 0.00 7.01 -1.87 -3.28 115.95 116.39 2bs4 h TRP 397 Ca 0.09 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.10 2bs4 h TRP 397 Cb 0.89 -0.11 -0.08 0.00 -2.10 0.00 0.00 29.16 27.76 2bs4 h TRP 397 CO 0.56 0.19 -1.19 -3.47 -2.79 0.00 0.00 178.44 171.74 2bs4 n ASP 398 N -4.49 -2.69 0.00 2.65 -0.08 -1.26 -4.77 116.55 105.91 2bs4 n ASP 398 Ca 0.03 1.16 0.00 0.00 -1.51 0.00 0.00 54.79 54.47 2bs4 n ASP 398 Cb 0.14 -4.63 0.00 0.00 2.34 0.00 0.00 41.12 38.97 2bs4 n ASP 398 CO 0.00 0.00 0.00 1.15 0.12 0.00 0.00 177.20 178.47 2bs4 n MET 399 N 1.16 0.26 -0.09 -0.67 0.00 -1.26 -1.84 117.12 114.68 2bs4 n MET 399 Ca -0.24 -0.03 -0.09 0.00 0.00 0.00 0.00 57.70 57.34 2bs4 n MET 399 Cb 0.38 -0.33 -0.14 0.00 0.00 0.00 0.00 33.22 33.12 2bs4 n MET 399 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2bs4 n HIS 400 N -0.05 0.00 0.00 3.17 8.25 -1.26 -4.83 115.22 120.50 2bs4 n HIS 400 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2bs4 n HIS 400 Cb 0.13 -0.87 0.00 0.00 1.12 0.00 0.00 29.99 30.36 2bs4 n HIS 400 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bs4 n GLY 401 N 1.92 3.60 1.24 -1.41 0.00 -1.26 -2.05 105.19 107.22 2bs4 n GLY 401 Ca -0.29 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 45.77 2bs4 n GLY 401 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2bs4 n PHE 402 N 13.81 0.85 -3.15 1.61 3.01 -0.91 -4.82 117.46 127.87 2bs4 n PHE 402 Ca 0.00 -0.47 0.04 0.00 1.01 0.00 0.00 57.45 58.04 2bs4 n PHE 402 Cb 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.46 2bs4 n PHE 402 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 2bs4 s ASN 403 N -1.05 -1.28 0.40 4.37 0.02 -0.87 0.39 114.94 116.93 2bs4 s ASN 403 Ca 0.44 0.35 -0.24 0.00 -1.02 0.00 0.00 52.86 52.39 2bs4 s ASN 403 Cb 0.23 1.89 -0.09 0.00 0.02 0.00 0.00 41.25 43.31 2bs4 s ASN 403 CO 0.31 -0.23 1.07 -0.60 0.02 0.00 0.00 177.10 177.66 2bs4 s ARG 404 N 2.87 4.12 0.09 -0.60 3.00 -1.25 -3.50 118.95 123.68 2bs4 s ARG 404 Ca 0.15 1.55 -0.28 0.00 -1.00 0.00 0.00 55.73 56.15 2bs4 s ARG 404 Cb -0.10 -2.54 -0.06 0.00 0.00 0.00 0.00 34.95 32.26 2bs4 s ARG 404 CO -0.23 -0.19 0.87 -0.51 0.00 0.00 0.00 175.30 175.24 2bs4 s LEU 405 N -2.67 4.49 0.04 -0.88 1.43 -1.26 -4.98 118.68 114.85 2bs4 s LEU 405 Ca 0.58 1.64 -0.32 0.00 -1.03 0.00 0.00 54.13 55.01 2bs4 s LEU 405 Cb -0.23 -3.42 -0.10 0.00 0.03 0.00 0.00 46.19 42.46 2bs4 s LEU 405 CO 0.29 -0.01 1.89 0.61 0.23 0.00 0.00 176.35 179.36 2bs4 n GLY 406 N 2.26 1.68 0.00 -3.19 0.00 -1.26 -0.13 105.19 104.54 2bs4 n GLY 406 Ca -0.00 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.81 2bs4 n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs4 n GLY 407 N 4.36 0.23 0.07 -0.02 0.00 -1.26 -4.29 105.19 104.28 2bs4 n GLY 407 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2bs4 n GLY 407 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bs4 n ASN 408 N 0.00 0.71 0.00 1.61 5.03 0.81 -0.11 115.26 123.31 2bs4 n ASN 408 Ca 0.00 0.10 -0.17 0.00 0.87 0.00 0.00 54.58 55.37 2bs4 n ASN 408 Cb 0.00 0.44 -0.12 0.00 -1.02 0.00 0.00 39.78 39.09 2bs4 n ASN 408 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2bs4 h SER 409 N 0.00 0.47 0.61 6.41 4.64 -1.93 0.14 113.55 123.90 2bs4 h SER 409 Ca 0.00 -0.79 -0.13 0.00 -0.47 0.00 0.00 61.79 60.40 2bs4 h SER 409 Cb 0.82 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 2bs4 h SER 409 CO 0.00 1.21 -0.63 -0.37 -0.87 0.00 0.00 176.83 176.17 2bs4 h VAL 410 N -0.21 1.45 -0.24 0.95 -1.51 -1.89 -1.66 116.25 113.15 2bs4 h VAL 410 Ca -0.08 -2.14 -0.02 0.00 -1.23 0.00 0.00 66.70 63.24 2bs4 h VAL 410 Cb 1.31 2.15 -0.01 0.00 -2.13 0.00 0.00 31.29 32.61 2bs4 h VAL 410 CO 0.11 0.61 0.09 -1.28 -1.23 0.00 0.00 177.57 175.87 2bs4 h SER 411 N 0.01 0.33 -0.87 4.19 0.87 -1.67 -2.93 113.55 113.49 2bs4 h SER 411 Ca -0.01 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.35 2bs4 h SER 411 Cb 1.11 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.94 2bs4 h SER 411 CO 0.08 0.43 0.44 -0.08 -0.53 0.00 0.00 176.83 177.17 2bs4 h GLU 412 N 0.22 1.23 -0.11 2.24 4.81 -0.42 -0.54 114.58 122.02 2bs4 h GLU 412 Ca 0.08 -0.17 0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2bs4 h GLU 412 Cb 0.20 -0.23 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 2bs4 h GLU 412 CO -0.00 0.93 -0.19 0.00 -0.73 0.00 0.00 179.01 179.02 2bs4 h ALA 413 N 1.25 -0.14 -0.19 2.92 0.00 -1.14 0.64 119.26 122.61 2bs4 h ALA 413 Ca 0.30 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 2bs4 h ALA 413 Cb 0.08 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2bs4 h ALA 413 CO -0.04 -0.65 -0.19 0.28 0.00 0.00 0.00 179.25 178.65 2bs4 h VAL 414 N -0.25 1.33 0.22 0.00 2.07 -1.42 -0.98 116.25 117.23 2bs4 h VAL 414 Ca 0.09 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 2bs4 h VAL 414 Cb 0.38 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2bs4 h VAL 414 CO -0.25 0.41 -0.11 0.58 0.02 0.00 0.00 177.57 178.22 2bs4 h VAL 415 N 0.12 0.83 -0.75 2.57 2.07 -0.86 -1.23 116.25 119.00 2bs4 h VAL 415 Ca 0.03 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.29 2bs4 h VAL 415 Cb 0.73 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2bs4 h VAL 415 CO 0.05 0.07 0.49 0.00 0.02 0.00 0.00 177.57 178.20 2bs4 h ALA 416 N 0.31 1.53 -0.42 1.67 0.00 0.21 0.78 119.26 123.34 2bs4 h ALA 416 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2bs4 h ALA 416 Cb 0.34 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2bs4 h ALA 416 CO 0.05 0.40 0.27 0.78 0.00 0.00 0.00 179.25 180.75 2bs4 h GLY 417 N 0.94 0.60 0.18 0.00 0.00 -0.73 0.73 103.07 104.79 2bs4 h GLY 417 Ca 0.29 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 2bs4 h GLY 417 CO -0.08 0.22 -0.00 -0.33 0.00 0.00 0.00 176.54 176.35 2bs4 h MET 418 N 0.58 0.00 0.12 4.80 2.86 0.24 -1.68 114.93 121.85 2bs4 h MET 418 Ca 0.15 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 2bs4 h MET 418 Cb -0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.61 2bs4 h MET 418 CO -0.03 0.82 -0.06 0.82 1.06 0.00 0.00 176.91 179.52 2bs4 h ILE 419 N -0.82 0.94 -0.41 -1.22 2.04 -0.71 -2.30 117.51 115.03 2bs4 h ILE 419 Ca -0.00 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 2bs4 h ILE 419 Cb 0.82 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 2bs4 h ILE 419 CO 0.00 0.26 0.15 0.58 0.00 0.00 0.00 178.15 179.14 2bs4 h VAL 420 N -0.86 1.16 -0.93 1.67 2.07 0.29 -1.33 116.25 118.32 2bs4 h VAL 420 Ca -0.02 -0.52 0.13 0.00 0.82 0.00 0.00 66.70 67.10 2bs4 h VAL 420 Cb 0.55 0.69 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 2bs4 h VAL 420 CO 0.03 0.20 0.55 1.23 0.02 0.00 0.00 177.57 179.60 2bs4 h GLY 421 N 0.75 1.52 0.59 2.17 0.00 -1.27 0.85 103.07 107.69 2bs4 h GLY 421 Ca 0.14 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 2bs4 h GLY 421 CO -0.01 0.09 -0.17 0.83 0.00 0.00 0.00 176.54 177.28 2bs4 h GLU 422 N 0.85 -0.46 -0.88 4.80 4.39 -0.66 0.14 114.58 122.76 2bs4 h GLU 422 Ca 0.48 0.03 0.08 0.00 0.34 0.00 0.00 59.36 60.29 2bs4 h GLU 422 Cb 0.53 0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 29.22 2bs4 h GLU 422 CO -0.29 -0.13 0.53 1.88 -1.16 0.00 0.00 179.01 179.83 2bs4 h TYR 423 N -0.89 0.97 -0.02 4.33 0.05 -0.99 0.15 116.97 120.57 2bs4 h TYR 423 Ca -0.05 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.76 2bs4 h TYR 423 Cb 0.53 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.96 2bs4 h TYR 423 CO 0.03 0.44 0.01 0.35 -1.05 0.00 0.00 178.16 177.94 2bs4 h PHE 424 N 0.92 0.04 -0.57 4.88 3.57 0.73 -0.44 116.94 126.06 2bs4 h PHE 424 Ca 0.41 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.97 2bs4 h PHE 424 Cb 0.29 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.96 2bs4 h PHE 424 CO -0.04 0.13 0.26 0.00 -2.23 0.00 0.00 178.31 176.44 2bs4 h ALA 425 N 0.90 0.74 -0.37 2.41 0.00 -0.13 -0.46 119.26 122.36 2bs4 h ALA 425 Ca 0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2bs4 h ALA 425 Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2bs4 h ALA 425 CO -0.00 -0.12 0.23 1.49 0.00 0.00 0.00 179.25 180.85 2bs4 h GLU 426 N 0.48 0.49 0.08 0.00 4.81 -0.42 -1.47 114.58 118.55 2bs4 h GLU 426 Ca 0.27 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.48 2bs4 h GLU 426 Cb 0.25 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2bs4 h GLU 426 CO -0.23 0.35 -0.24 1.25 -0.73 0.00 0.00 179.01 179.41 2bs4 h HIS 427 N 0.49 -0.64 -0.64 0.92 2.76 -0.29 -0.65 115.15 117.09 2bs4 h HIS 427 Ca 0.13 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.38 2bs4 h HIS 427 Cb -0.03 0.27 -0.06 0.00 1.55 0.00 0.00 27.41 29.15 2bs4 h HIS 427 CO -0.04 -0.33 0.34 0.00 -1.30 0.00 0.00 177.93 176.59 2bs4 h ALA 429 N 1.35 0.58 0.11 0.00 0.00 -1.03 -3.36 119.26 116.90 2bs4 h ALA 429 Ca 0.29 -0.38 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 2bs4 h ALA 429 Cb 0.22 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.88 2bs4 h ALA 429 CO -0.20 0.56 -0.95 -0.91 0.00 0.00 0.00 179.25 177.75 2bs4 h ASN 430 N 0.69 0.35 -4.16 0.00 -0.26 -0.83 -3.47 115.58 107.91 2bs4 h ASN 430 Ca 0.09 -0.89 -0.54 0.00 -0.56 0.00 0.00 56.30 54.39 2bs4 h ASN 430 Cb 0.79 -0.11 0.16 0.00 -1.06 0.00 0.00 38.32 38.10 2bs4 h ASN 430 CO 0.07 1.43 0.43 0.28 -1.06 0.00 0.00 177.43 178.57 2bs4 s THR 431 N -2.42 2.19 -0.10 2.81 -1.32 0.75 -5.02 115.64 112.53 2bs4 s THR 431 Ca -0.17 0.10 0.02 0.00 -1.21 0.00 0.00 61.69 60.42 2bs4 s THR 431 Cb 0.02 -2.78 0.01 0.00 -1.51 0.00 0.00 72.50 68.24 2bs4 s THR 431 CO 0.78 -0.04 -0.15 -1.10 -2.21 0.00 0.00 174.62 171.89 2bs4 s GLN 432 N -3.75 2.16 0.02 7.08 -1.52 -1.26 -4.92 119.66 117.48 2bs4 s GLN 432 Ca 0.77 -0.55 0.04 0.00 -1.95 0.00 0.00 55.36 53.67 2bs4 s GLN 432 Cb -0.32 -1.80 -0.03 0.00 -0.22 0.00 0.00 33.01 30.63 2bs4 s GLN 432 CO 0.44 -0.02 -0.07 0.08 -0.25 0.00 0.00 175.29 175.48 2bs4 s VAL 433 N 0.85 3.65 -0.45 1.09 1.01 -1.26 -5.09 120.40 120.20 2bs4 s VAL 433 Ca -0.10 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 60.95 2bs4 s VAL 433 Cb -0.15 -2.61 0.11 0.00 0.00 0.00 0.00 36.38 33.72 2bs4 s VAL 433 CO 0.01 0.34 0.30 -0.62 0.00 0.00 0.00 175.10 175.12 2bs4 s ASP 434 N -1.59 5.61 -0.47 3.32 -1.08 -1.26 -5.06 116.67 116.14 2bs4 s ASP 434 Ca 0.18 -1.81 -0.20 0.00 -0.52 0.00 0.00 52.55 50.20 2bs4 s ASP 434 Cb -0.11 -1.98 0.04 0.00 -1.46 0.00 0.00 42.92 39.41 2bs4 s ASP 434 CO 0.09 -0.63 0.64 -0.76 0.52 0.00 0.00 175.17 175.04 2bs4 s LEU 435 N 1.35 4.69 -0.26 -1.34 1.43 -1.26 -5.05 118.68 118.24 2bs4 s LEU 435 Ca 0.05 -0.61 -0.14 0.00 -1.03 0.00 0.00 54.13 52.40 2bs4 s LEU 435 Cb -0.25 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 2bs4 s LEU 435 CO -0.00 -0.85 0.35 -1.61 0.23 0.00 0.00 176.35 174.47 2bs4 s GLU 436 N 2.78 4.04 0.55 1.70 2.02 -1.26 -4.95 118.70 123.57 2bs4 s GLU 436 Ca 0.19 0.02 0.23 0.00 0.02 0.00 0.00 54.97 55.43 2bs4 s GLU 436 Cb -0.16 -3.63 1.47 0.00 0.10 0.00 0.00 34.13 31.90 2bs4 s GLU 436 CO 0.16 -0.21 2.11 1.79 0.02 0.00 0.00 175.26 179.12 2bs4 h THR 437 N 5.31 0.73 -0.77 3.63 1.35 -1.99 -0.34 112.91 120.84 2bs4 h THR 437 Ca -0.33 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.49 2bs4 h THR 437 Cb 1.16 0.88 -0.03 0.00 -1.73 0.00 0.00 68.15 68.43 2bs4 h THR 437 CO 0.65 0.00 0.33 0.50 -0.25 0.00 0.00 175.52 176.75 2bs4 h LYS 438 N 0.00 1.14 -0.05 4.72 3.64 -1.98 0.13 116.57 124.16 2bs4 h LYS 438 Ca 0.09 -0.19 -0.12 0.00 -1.27 0.00 0.00 60.65 59.17 2bs4 h LYS 438 Cb 0.41 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2bs4 h LYS 438 CO -0.00 0.91 -0.43 1.15 -2.27 0.00 0.00 179.45 178.81 2bs4 h THR 439 N 1.12 1.42 -0.35 1.00 2.02 -1.51 -1.61 112.91 115.00 2bs4 h THR 439 Ca 0.26 -1.86 0.04 0.00 0.77 0.00 0.00 66.41 65.62 2bs4 h THR 439 Cb 0.18 2.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.96 2bs4 h THR 439 CO -0.03 0.54 0.10 -0.07 0.37 0.00 0.00 175.52 176.44 2bs4 h LEU 440 N -0.11 0.09 -1.22 2.58 3.38 -1.17 -1.32 115.31 117.54 2bs4 h LEU 440 Ca -0.04 0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2bs4 h LEU 440 Cb 1.10 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 2bs4 h LEU 440 CO 0.09 0.09 0.53 -0.33 0.09 0.00 0.00 178.44 178.90 2bs4 h GLU 441 N 0.24 1.03 0.17 1.13 5.08 -0.75 -0.10 114.58 121.38 2bs4 h GLU 441 Ca 0.16 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2bs4 h GLU 441 Cb 0.15 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2bs4 h GLU 441 CO -0.18 0.68 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.21 2bs4 h LYS 442 N 1.06 -0.22 -0.63 2.33 3.64 -0.24 -0.11 116.57 122.40 2bs4 h LYS 442 Ca 0.30 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.62 2bs4 h LYS 442 Cb -0.09 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2bs4 h LYS 442 CO -0.07 -0.05 0.09 0.74 -2.27 0.00 0.00 179.45 177.89 2bs4 h PHE 443 N -0.35 1.11 -0.08 1.91 -1.00 -1.03 0.23 116.94 117.74 2bs4 h PHE 443 Ca -0.02 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.57 2bs4 h PHE 443 Cb 0.27 -0.31 -0.00 0.00 3.61 0.00 0.00 35.95 39.53 2bs4 h PHE 443 CO -0.03 0.94 -0.09 0.28 -1.61 0.00 0.00 178.31 177.81 2bs4 h VAL 444 N 0.98 1.38 -0.21 -0.55 2.07 -0.96 -2.13 116.25 116.82 2bs4 h VAL 444 Ca 0.19 -1.27 -0.05 0.00 0.82 0.00 0.00 66.70 66.39 2bs4 h VAL 444 Cb 0.44 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2bs4 h VAL 444 CO 0.01 0.35 -0.11 0.11 0.02 0.00 0.00 177.57 177.96 2bs4 h LYS 445 N -0.24 0.33 -0.19 1.57 1.57 -0.99 -1.97 116.57 116.65 2bs4 h LYS 445 Ca 0.01 -0.08 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2bs4 h LYS 445 Cb 0.61 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 2bs4 h LYS 445 CO 0.02 0.45 0.07 0.78 -0.57 0.00 0.00 179.45 180.21 2bs4 h GLY 446 N 0.80 0.24 2.00 3.86 0.00 -0.34 -0.66 103.07 108.96 2bs4 h GLY 446 Ca 0.06 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.28 2bs4 h GLY 446 CO 0.02 0.04 -0.31 1.46 0.00 0.00 0.00 176.54 177.75 2bs4 h GLN 447 N 0.17 0.00 -0.30 4.80 1.08 -1.11 -2.19 115.11 117.56 2bs4 h GLN 447 Ca 0.08 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.10 2bs4 h GLN 447 Cb 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2bs4 h GLN 447 CO -0.07 0.31 -0.52 0.93 -0.95 0.00 0.00 178.83 178.53 2bs4 h GLU 448 N 0.00 0.88 -0.27 1.46 5.08 -1.02 -1.41 114.58 119.29 2bs4 h GLU 448 Ca -0.00 -0.55 -0.00 0.00 -1.00 0.00 0.00 59.36 57.81 2bs4 h GLU 448 Cb 0.96 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2bs4 h GLU 448 CO 0.04 1.18 0.16 0.00 -1.00 0.00 0.00 179.01 179.40 2bs4 h ALA 449 N 0.69 0.35 -0.01 3.43 0.00 -0.95 -1.83 119.26 120.94 2bs4 h ALA 449 Ca 0.02 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2bs4 h ALA 449 Cb 1.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2bs4 h ALA 449 CO 0.12 -0.15 -0.08 -0.92 0.00 0.00 0.00 179.25 178.22 2bs4 h TYR 450 N 0.34 -0.21 -0.35 0.00 3.20 -1.29 0.67 116.97 119.33 2bs4 h TYR 450 Ca 0.10 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.03 2bs4 h TYR 450 Cb 0.02 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 2bs4 h TYR 450 CO -0.04 -0.13 0.05 0.52 -1.64 0.00 0.00 178.16 176.92 2bs4 h MET 451 N -0.14 0.16 -0.60 1.82 2.86 -1.12 -0.60 114.93 117.31 2bs4 h MET 451 Ca 0.03 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.71 2bs4 h MET 451 Cb 0.18 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 2bs4 h MET 451 CO -0.09 0.10 0.33 -0.22 1.06 0.00 0.00 176.91 178.10 2bs4 h LYS 452 N 0.16 0.62 -0.58 1.72 3.64 -0.91 -1.14 116.57 120.07 2bs4 h LYS 452 Ca 0.17 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2bs4 h LYS 452 Cb 0.21 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 2bs4 h LYS 452 CO -0.24 0.41 0.21 0.66 -2.27 0.00 0.00 179.45 178.21 2bs4 h SER 453 N 0.64 0.79 -0.04 4.20 4.64 -0.18 -1.57 113.55 122.03 2bs4 h SER 453 Ca 0.26 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2bs4 h SER 453 Cb 0.12 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2bs4 h SER 453 CO -0.15 0.73 0.02 -0.07 -0.87 0.00 0.00 176.83 176.49 2bs4 h LEU 454 N 0.84 0.06 -2.22 5.97 3.38 -0.08 -0.69 115.31 122.57 2bs4 h LEU 454 Ca 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2bs4 h LEU 454 Cb 0.21 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2bs4 h LEU 454 CO -0.01 0.18 -0.05 0.58 0.09 0.00 0.00 178.44 179.23 2bs4 h VAL 455 N -0.07 0.58 -0.02 1.22 2.07 -0.97 -2.86 116.25 116.20 2bs4 h VAL 455 Ca 0.01 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2bs4 h VAL 455 Cb 0.14 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2bs4 h VAL 455 CO -0.00 0.05 -0.36 -0.62 0.02 0.00 0.00 177.57 176.66 2bs4 n GLU 456 N -3.82 1.48 -1.71 1.57 1.02 -0.62 -4.88 120.64 113.69 2bs4 n GLU 456 Ca -0.03 -1.08 -0.43 0.00 -0.02 0.00 0.00 57.16 55.61 2bs4 n GLU 456 Cb 0.14 -1.41 -0.02 0.00 -0.02 0.00 0.00 31.44 30.13 2bs4 n GLU 456 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2bs4 n SER 457 N 0.15 3.51 -1.09 1.62 2.88 -0.30 -4.87 113.62 115.52 2bs4 n SER 457 Ca 0.09 1.13 0.11 0.00 -1.33 0.00 0.00 58.87 58.87 2bs4 n SER 457 Cb 0.44 -1.53 0.26 0.00 -0.75 0.00 0.00 64.21 62.64 2bs4 n SER 457 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2bs4 n LYS 458 N 2.51 2.40 -1.18 -1.46 4.01 -1.26 -4.59 118.16 118.59 2bs4 n LYS 458 Ca 0.11 -2.14 -0.36 0.00 -0.51 0.00 0.00 58.31 55.41 2bs4 n LYS 458 Cb 0.34 -1.49 0.06 0.00 -0.51 0.00 0.00 35.03 33.43 2bs4 n LYS 458 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2bs4 n GLY 459 N 1.47 -2.16 0.52 0.72 0.00 -1.26 -4.93 105.19 99.56 2bs4 n GLY 459 Ca 0.20 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.83 2bs4 n GLY 459 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bs4 n THR 460 N -2.42 0.15 -2.26 2.61 -2.24 -0.98 -3.61 114.28 105.53 2bs4 n THR 460 Ca 0.08 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.95 2bs4 n THR 460 Cb 0.51 1.14 -0.01 0.00 -2.10 0.00 0.00 70.33 69.87 2bs4 n THR 460 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2bs4 s GLU 461 N -1.02 3.51 -0.22 -0.78 0.41 -0.79 -4.86 118.70 114.95 2bs4 s GLU 461 Ca 0.16 1.30 -0.07 0.00 -0.41 0.00 0.00 54.97 55.95 2bs4 s GLU 461 Cb 0.11 -2.05 -0.03 0.00 -1.78 0.00 0.00 34.13 30.37 2bs4 s GLU 461 CO 0.16 -0.66 0.06 0.34 -0.49 0.00 0.00 175.26 174.66 2bs4 s ASP 462 N -2.37 5.23 0.24 -0.19 -1.08 -1.26 -2.53 116.67 114.71 2bs4 s ASP 462 Ca 0.66 -0.13 -0.06 0.00 -0.52 0.00 0.00 52.55 52.50 2bs4 s ASP 462 Cb -0.17 -1.92 0.32 0.00 -1.46 0.00 0.00 42.92 39.69 2bs4 s ASP 462 CO 0.29 0.03 1.86 1.62 0.52 0.00 0.00 175.17 179.49 2bs4 h VAL 463 N 5.35 1.07 -0.40 1.11 3.04 -1.97 -1.36 116.25 123.09 2bs4 h VAL 463 Ca -0.37 -0.35 -0.11 0.00 -1.01 0.00 0.00 66.70 64.86 2bs4 h VAL 463 Cb 1.18 -0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 30.42 2bs4 h VAL 463 CO 0.61 0.18 -0.18 -0.26 -1.01 0.00 0.00 177.57 176.91 2bs4 h PHE 464 N 1.01 0.96 -0.45 3.17 0.04 -1.96 0.16 116.94 119.86 2bs4 h PHE 464 Ca 0.37 -0.23 -0.09 0.00 2.80 0.00 0.00 57.97 60.81 2bs4 h PHE 464 Cb 0.13 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 2bs4 h PHE 464 CO -0.03 0.99 -0.10 0.87 -0.60 0.00 0.00 178.31 179.45 2bs4 h LYS 465 N 0.64 0.80 -0.31 1.51 1.57 -1.94 0.20 116.57 119.05 2bs4 h LYS 465 Ca 0.09 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.55 2bs4 h LYS 465 Cb 0.74 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 2bs4 h LYS 465 CO 0.06 0.87 -0.02 0.82 -0.57 0.00 0.00 179.45 180.61 2bs4 h ILE 466 N 0.73 1.26 -0.28 1.86 1.08 -1.07 -1.61 117.51 119.48 2bs4 h ILE 466 Ca 0.12 -0.99 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 2bs4 h ILE 466 Cb 0.58 1.29 -0.01 0.00 -3.07 0.00 0.00 36.82 35.61 2bs4 h ILE 466 CO 0.04 0.32 0.11 0.50 -0.69 0.00 0.00 178.15 178.42 2bs4 h LYS 467 N 0.35 0.42 -0.46 2.37 3.64 -0.22 -2.41 116.57 120.26 2bs4 h LYS 467 Ca 0.09 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 2bs4 h LYS 467 Cb 0.47 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2bs4 h LYS 467 CO 0.02 0.46 0.12 -0.91 -2.27 0.00 0.00 179.45 176.86 2bs4 h ASN 468 N 0.30 0.63 -0.21 4.20 -0.26 -0.59 -1.84 115.58 117.80 2bs4 h ASN 468 Ca 0.09 -0.10 -0.08 0.00 -0.56 0.00 0.00 56.30 55.66 2bs4 h ASN 468 Cb 0.20 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.28 2bs4 h ASN 468 CO -0.01 0.62 -0.11 -0.09 -1.06 0.00 0.00 177.43 176.78 2bs4 h ARG 469 N 0.67 0.59 -0.24 0.81 9.65 -1.12 -2.51 114.38 122.23 2bs4 h ARG 469 Ca 0.15 -0.18 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 2bs4 h ARG 469 Cb 0.24 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.75 2bs4 h ARG 469 CO -0.00 0.70 0.07 1.98 2.80 0.00 0.00 179.97 185.52 2bs4 h MET 470 N 0.55 0.37 0.00 0.20 4.05 -0.84 -2.03 114.93 117.23 2bs4 h MET 470 Ca 0.10 -0.08 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 2bs4 h MET 470 Cb 0.52 -0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 31.26 2bs4 h MET 470 CO 0.03 0.45 -0.14 1.57 0.23 0.00 0.00 176.91 179.05 2bs4 h LYS 471 N 0.21 0.00 -0.03 0.39 2.10 -1.21 -1.89 116.57 116.14 2bs4 h LYS 471 Ca 0.08 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.68 2bs4 h LYS 471 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2bs4 h LYS 471 CO -0.00 0.14 -0.15 -0.44 -2.00 0.00 0.00 179.45 177.00 2bs4 h ASP 472 N 0.00 0.19 -0.46 7.07 3.32 -1.18 -2.06 116.42 123.29 2bs4 h ASP 472 Ca -0.00 -0.67 0.08 0.00 0.02 0.00 0.00 57.03 56.46 2bs4 h ASP 472 Cb 0.37 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.80 2bs4 h ASP 472 CO 0.02 0.82 0.04 0.58 -1.72 0.00 0.00 179.24 178.98 2bs4 h VAL 473 N -0.44 0.68 -0.48 -1.35 2.07 -1.05 0.14 116.25 115.82 2bs4 h VAL 473 Ca -0.01 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2bs4 h VAL 473 Cb 0.82 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2bs4 h VAL 473 CO 0.03 0.03 0.26 0.24 0.02 0.00 0.00 177.57 178.16 2bs4 h MET 474 N 0.16 0.67 -0.36 1.57 2.86 -1.38 0.34 114.93 118.79 2bs4 h MET 474 Ca 0.23 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 2bs4 h MET 474 Cb 0.33 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2bs4 h MET 474 CO -0.35 0.52 0.09 -0.44 1.06 0.00 0.00 176.91 177.80 2bs4 h ASP 475 N 0.64 0.54 0.80 1.22 3.32 -0.79 0.14 116.42 122.28 2bs4 h ASP 475 Ca 0.17 -0.23 -0.15 0.00 0.02 0.00 0.00 57.03 56.85 2bs4 h ASP 475 Cb 0.05 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2bs4 h ASP 475 CO -0.03 0.63 -0.69 0.44 -1.72 0.00 0.00 179.24 177.86 2bs4 h ASP 476 N 0.43 0.00 0.00 6.45 3.32 -0.88 -3.36 116.42 122.38 2bs4 h ASP 476 Ca 0.11 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 2bs4 h ASP 476 Cb 0.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2bs4 h ASP 476 CO 0.00 0.69 -1.34 0.59 -1.72 0.00 0.00 179.24 177.46 2bs4 n ASN 477 N -3.61 3.51 -1.79 6.45 3.02 0.10 -4.74 115.26 118.20 2bs4 n ASN 477 Ca -0.01 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.35 2bs4 n ASN 477 Cb 0.70 1.06 0.07 0.00 -0.61 0.00 0.00 39.78 41.00 2bs4 n ASN 477 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2bs4 n VAL 478 N -1.91 2.59 -0.26 2.41 0.31 0.48 -4.67 118.33 117.28 2bs4 n VAL 478 Ca -0.04 -3.85 0.00 0.00 -0.01 0.00 0.00 64.34 60.43 2bs4 n VAL 478 Cb 0.36 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 2bs4 n VAL 478 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bs4 n GLY 479 N -0.82 1.58 0.24 2.92 0.00 -1.23 -4.88 105.19 103.01 2bs4 n GLY 479 Ca 0.41 -1.68 -0.04 0.00 0.00 0.00 0.00 46.02 44.72 2bs4 n GLY 479 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bs4 h ILE 480 N 0.00 1.07 -3.32 -0.61 2.04 -1.91 -3.41 117.51 111.37 2bs4 h ILE 480 Ca 0.00 -0.25 -0.65 0.00 1.00 0.00 0.00 64.86 64.96 2bs4 h ILE 480 Cb 0.00 0.26 -0.25 0.00 -0.74 0.00 0.00 36.82 36.09 2bs4 h ILE 480 CO 0.00 0.13 -0.73 -0.36 0.00 0.00 0.00 178.15 177.20 2bs4 s PHE 481 N -6.13 2.90 0.02 1.37 0.08 -1.26 -4.17 117.98 110.79 2bs4 s PHE 481 Ca -0.13 -0.57 0.04 0.00 0.12 0.00 0.00 56.93 56.39 2bs4 s PHE 481 Cb 0.14 -1.91 -0.01 0.00 -0.57 0.00 0.00 43.02 40.67 2bs4 s PHE 481 CO 0.76 -0.19 -0.11 1.03 -0.10 0.00 0.00 175.22 176.60 2bs4 s ARG 482 N 0.48 0.84 0.03 0.44 0.52 -0.29 -4.82 118.95 116.15 2bs4 s ARG 482 Ca -0.07 -0.56 0.01 0.00 -0.52 0.00 0.00 55.73 54.59 2bs4 s ARG 482 Cb -0.15 -0.81 -0.02 0.00 0.52 0.00 0.00 34.95 34.49 2bs4 s ARG 482 CO 0.04 0.21 -0.05 0.16 0.02 0.00 0.00 175.30 175.67 2bs4 s ASP 483 N -0.73 0.55 0.12 0.23 -4.77 -1.26 -0.41 116.67 110.41 2bs4 s ASP 483 Ca 0.02 -0.48 -0.33 0.00 -3.30 0.00 0.00 52.55 48.46 2bs4 s ASP 483 Cb -0.06 0.06 -0.11 0.00 -1.09 0.00 0.00 42.92 41.71 2bs4 s ASP 483 CO 0.00 -0.22 1.54 1.23 0.70 0.00 0.00 175.17 178.42 2bs4 h GLY 484 N 4.72 -1.05 -0.73 2.12 0.00 -1.94 -1.96 103.07 104.22 2bs4 h GLY 484 Ca -0.33 0.71 0.16 0.00 0.00 0.00 0.00 47.33 47.87 2bs4 h GLY 484 CO 0.42 -0.15 -0.25 -2.55 0.00 0.00 0.00 176.54 174.00 2bs4 h PRO 485 N -0.44 -0.02 -0.26 4.80 0.11 -2.00 -0.35 132.00 133.85 2bs4 h PRO 485 Ca 0.06 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.04 2bs4 h PRO 485 Cb 0.61 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 2bs4 h PRO 485 CO -0.54 -0.01 -0.38 0.45 -0.21 0.00 0.00 178.00 177.31 2bs4 h HIS 486 N -0.02 0.70 -0.49 0.65 3.86 -1.88 -2.89 115.15 115.09 2bs4 h HIS 486 Ca 0.39 -0.20 -0.04 0.00 -1.16 0.00 0.00 60.37 59.36 2bs4 h HIS 486 Cb 0.62 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 2bs4 h HIS 486 CO -0.70 0.89 0.14 -0.07 0.86 0.00 0.00 177.93 179.05 2bs4 h LEU 487 N 0.49 0.67 -0.83 2.43 3.38 -0.34 -0.65 115.31 120.47 2bs4 h LEU 487 Ca 0.05 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 2bs4 h LEU 487 Cb 0.88 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2bs4 h LEU 487 CO 0.08 0.65 -0.20 -0.33 0.09 0.00 0.00 178.44 178.72 2bs4 h GLU 488 N 0.71 0.65 -0.45 1.13 5.08 -1.13 0.01 114.58 120.58 2bs4 h GLU 488 Ca 0.16 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2bs4 h GLU 488 Cb 0.24 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2bs4 h GLU 488 CO -0.01 0.81 0.00 -0.22 -1.00 0.00 0.00 179.01 178.59 2bs4 h LYS 489 N 0.58 0.79 0.17 2.33 3.64 -1.18 -1.95 116.57 120.95 2bs4 h LYS 489 Ca 0.09 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 2bs4 h LYS 489 Cb 0.66 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2bs4 h LYS 489 CO 0.05 0.85 -0.08 0.00 -2.27 0.00 0.00 179.45 178.00 2bs4 h ALA 490 N 0.91 -0.22 -0.45 5.00 0.00 -0.79 -2.11 119.26 121.60 2bs4 h ALA 490 Ca 0.13 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2bs4 h ALA 490 Cb 0.49 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2bs4 h ALA 490 CO 0.02 -0.50 0.03 0.28 0.00 0.00 0.00 179.25 179.08 2bs4 h VAL 491 N -0.47 0.69 -0.54 0.00 2.07 -0.99 0.21 116.25 117.21 2bs4 h VAL 491 Ca -0.02 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2bs4 h VAL 491 Cb 0.37 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 2bs4 h VAL 491 CO 0.04 0.03 0.31 0.11 0.02 0.00 0.00 177.57 178.07 2bs4 h LYS 492 N 0.15 0.59 -0.28 1.57 1.79 -1.31 -1.39 116.57 117.69 2bs4 h LYS 492 Ca 0.22 -0.04 -0.17 0.00 -2.18 0.00 0.00 60.65 58.49 2bs4 h LYS 492 Cb 0.31 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2bs4 h LYS 492 CO -0.34 0.39 -0.51 1.49 -1.08 0.00 0.00 179.45 179.39 2bs4 h GLU 493 N 0.60 0.78 -0.87 3.15 4.81 -0.66 -2.40 114.58 119.99 2bs4 h GLU 493 Ca 0.23 -0.48 -0.03 0.00 -0.13 0.00 0.00 59.36 58.96 2bs4 h GLU 493 Cb 0.07 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 2bs4 h GLU 493 CO -0.12 1.10 0.45 -0.07 -0.73 0.00 0.00 179.01 179.64 2bs4 h LEU 494 N 0.61 1.12 -1.27 1.64 3.38 -0.36 0.17 115.31 120.60 2bs4 h LEU 494 Ca 0.02 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 2bs4 h LEU 494 Cb 1.10 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2bs4 h LEU 494 CO 0.11 0.92 -0.21 -0.08 0.09 0.00 0.00 178.44 179.27 2bs4 h GLU 495 N 1.24 0.23 0.01 1.13 4.81 -1.15 0.22 114.58 121.07 2bs4 h GLU 495 Ca 0.30 -0.07 -0.21 0.00 -0.13 0.00 0.00 59.36 59.25 2bs4 h GLU 495 Cb 0.08 -0.02 0.02 0.00 0.63 0.00 0.00 28.75 29.45 2bs4 h GLU 495 CO -0.04 0.44 -0.83 1.49 -0.73 0.00 0.00 179.01 179.34 2bs4 h GLU 496 N 0.22 0.55 -0.71 1.92 4.81 -0.86 -2.94 114.58 117.56 2bs4 h GLU 496 Ca 0.04 -0.60 0.04 0.00 -0.13 0.00 0.00 59.36 58.70 2bs4 h GLU 496 Cb 0.50 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.02 2bs4 h GLU 496 CO 0.03 1.22 0.47 1.25 -0.73 0.00 0.00 179.01 181.25 2bs4 h LEU 497 N 0.13 0.74 -0.38 1.64 5.85 -0.36 -1.48 115.31 121.44 2bs4 h LEU 497 Ca -0.11 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 2bs4 h LEU 497 Cb 1.52 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 2bs4 h LEU 497 CO 0.16 0.51 0.14 0.22 -0.34 0.00 0.00 178.44 179.13 2bs4 h TYR 498 N 0.86 0.60 -0.66 1.25 3.20 -0.92 -1.01 116.97 120.28 2bs4 h TYR 498 Ca 0.29 -0.05 -0.08 0.00 3.14 0.00 0.00 58.73 62.02 2bs4 h TYR 498 Cb 0.07 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 2bs4 h TYR 498 CO -0.00 0.55 0.09 0.87 -1.64 0.00 0.00 178.16 178.03 2bs4 h LYS 499 N 0.47 1.11 0.00 1.82 1.57 -1.20 -2.54 116.57 117.79 2bs4 h LYS 499 Ca 0.13 -0.31 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 2bs4 h LYS 499 Cb 0.22 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2bs4 h LYS 499 CO -0.01 1.02 -0.52 0.87 -0.57 0.00 0.00 179.45 180.25 2bs4 h LYS 500 N 1.03 0.00 0.00 3.15 1.57 -1.18 -2.63 116.57 118.50 2bs4 h LYS 500 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2bs4 h LYS 500 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2bs4 h LYS 500 CO 0.02 0.52 0.00 0.66 -0.57 0.00 0.00 179.45 180.07 2bs4 h SER 501 N 0.00 0.00 -0.17 0.86 4.64 -0.73 0.10 113.55 118.25 2bs4 h SER 501 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2bs4 h SER 501 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2bs4 h SER 501 CO 0.07 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.32 2bs4 n LYS 502 N -2.42 1.84 -0.51 4.77 5.02 -0.99 -3.61 118.16 122.25 2bs4 n LYS 502 Ca -0.02 -1.25 0.07 0.00 -2.02 0.00 0.00 58.31 55.09 2bs4 n LYS 502 Cb 0.05 -1.42 0.19 0.00 -0.02 0.00 0.00 35.03 33.83 2bs4 n LYS 502 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2bs4 n ASN 503 N 0.48 1.81 -4.80 4.39 3.02 0.35 -5.00 115.26 115.51 2bs4 n ASN 503 Ca 0.17 -3.69 -0.34 0.00 -0.03 0.00 0.00 54.58 50.69 2bs4 n ASN 503 Cb 0.38 -0.50 -0.05 0.00 -0.61 0.00 0.00 39.78 39.00 2bs4 n ASN 503 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bs4 s VAL 504 N -3.08 3.99 0.00 2.41 1.01 -1.24 -1.89 120.40 121.60 2bs4 s VAL 504 Ca 0.36 1.27 0.03 0.00 0.00 0.00 0.00 61.98 63.65 2bs4 s VAL 504 Cb 0.35 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 2bs4 s VAL 504 CO -0.05 -0.23 -0.09 -0.83 0.00 0.00 0.00 175.10 173.89 2bs4 s GLY 505 N -1.99 0.48 0.01 4.51 0.00 -1.05 -4.17 107.32 105.11 2bs4 s GLY 505 Ca 0.64 -0.46 0.08 0.00 0.00 0.00 0.00 44.72 44.98 2bs4 s GLY 505 CO 0.18 -0.41 -0.24 -0.26 0.00 0.00 0.00 173.10 172.38 2bs4 s ILE 506 N -0.36 1.88 0.03 0.90 -5.25 -1.26 -4.72 121.20 112.42 2bs4 s ILE 506 Ca 0.02 -1.14 -0.27 0.00 -0.99 0.00 0.00 60.65 58.27 2bs4 s ILE 506 Cb -0.04 -1.59 -0.17 0.00 2.95 0.00 0.00 42.46 43.61 2bs4 s ILE 506 CO -0.00 0.42 1.37 0.11 -1.79 0.00 0.00 174.94 175.05 2bs4 h LYS 507 N 5.22 -0.53 -6.25 0.37 1.57 -1.98 -3.43 116.57 111.54 2bs4 h LYS 507 Ca -0.43 0.04 -0.56 0.00 -1.87 0.00 0.00 60.65 57.83 2bs4 h LYS 507 Cb 1.14 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.55 2bs4 h LYS 507 CO 0.46 -0.25 0.88 -0.80 -0.57 0.00 0.00 179.45 179.16 2bs4 s ASN 508 N -4.86 6.90 0.14 0.86 0.01 -1.26 -4.94 114.94 111.80 2bs4 s ASN 508 Ca -0.15 1.89 0.23 0.00 -0.71 0.00 0.00 52.86 54.12 2bs4 s ASN 508 Cb 0.03 -2.55 0.14 0.00 0.41 0.00 0.00 41.25 39.28 2bs4 s ASN 508 CO 0.56 -0.74 1.14 1.17 -1.51 0.00 0.00 177.10 177.73 2bs4 n LYS 509 N 6.15 0.42 -0.66 -0.60 3.00 -1.26 -4.83 118.16 120.37 2bs4 n LYS 509 Ca 0.14 0.08 -0.31 0.00 -0.00 0.00 0.00 58.31 58.22 2bs4 n LYS 509 Cb 0.45 -1.72 0.17 0.00 0.00 0.00 0.00 35.03 33.92 2bs4 n LYS 509 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2bs4 n ARG 510 N -2.31 -0.71 -0.00 1.64 1.85 -1.26 -4.94 116.66 110.91 2bs4 n ARG 510 Ca 0.02 -0.15 0.09 0.00 -1.00 0.00 0.00 57.85 56.80 2bs4 n ARG 510 Cb 0.49 -2.27 -0.12 0.00 -1.05 0.00 0.00 32.46 29.51 2bs4 n ARG 510 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2bs4 n LEU 511 N -3.89 0.43 -4.92 2.89 4.77 -1.26 -4.85 117.00 110.17 2bs4 n LEU 511 Ca 0.10 -0.27 -0.23 0.00 -0.03 0.00 0.00 56.01 55.58 2bs4 n LEU 511 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 2bs4 n LEU 511 CO 0.50 0.11 -0.10 -1.38 -1.33 0.00 0.00 177.39 175.20 2bs4 s HIS 512 N -2.91 3.38 -0.33 -1.77 -3.43 -1.26 -4.10 115.29 104.87 2bs4 s HIS 512 Ca 0.00 0.01 -0.08 0.00 -0.80 0.00 0.00 55.06 54.19 2bs4 s HIS 512 Cb 0.12 -1.57 0.01 0.00 -1.43 0.00 0.00 32.58 29.71 2bs4 s HIS 512 CO 0.72 0.48 0.19 0.00 -2.00 0.00 0.00 174.74 174.14 2bs4 n ALA 513 N -0.99 -1.49 -3.97 -1.38 0.00 -0.89 -4.88 120.51 106.91 2bs4 n ALA 513 Ca -0.08 -0.15 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 2bs4 n ALA 513 Cb 0.56 -0.61 -0.14 0.00 0.00 0.00 0.00 19.45 19.25 2bs4 n ALA 513 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2bs4 s ASN 514 N -4.03 4.44 0.53 0.00 3.84 -1.26 -4.96 114.94 113.49 2bs4 s ASN 514 Ca 0.11 -2.76 0.20 0.00 0.21 0.00 0.00 52.86 50.61 2bs4 s ASN 514 Cb -0.06 -1.63 1.38 0.00 -0.55 0.00 0.00 41.25 40.38 2bs4 s ASN 514 CO 0.28 -0.27 2.15 1.55 -2.79 0.00 0.00 177.10 178.02 2bs4 h PRO 515 N 6.82 0.00 -0.28 0.43 0.13 -1.95 -1.79 132.00 135.36 2bs4 h PRO 515 Ca -0.07 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.95 2bs4 h PRO 515 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 2bs4 h PRO 515 CO 0.64 0.03 -0.27 1.49 -0.23 0.00 0.00 178.00 179.66 2bs4 h GLU 516 N 0.00 0.68 -0.12 0.86 4.81 -1.95 -2.48 114.58 116.38 2bs4 h GLU 516 Ca -0.00 -0.36 -0.08 0.00 -0.13 0.00 0.00 59.36 58.79 2bs4 h GLU 516 Cb 0.06 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2bs4 h GLU 516 CO 0.00 0.97 -0.28 1.25 -0.73 0.00 0.00 179.01 180.22 2bs4 h LEU 517 N 0.41 0.22 -0.19 1.64 5.85 -1.75 -1.60 115.31 119.90 2bs4 h LEU 517 Ca 0.04 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2bs4 h LEU 517 Cb 0.84 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 2bs4 h LEU 517 CO 0.07 0.50 0.10 -0.33 -0.34 0.00 0.00 178.44 178.44 2bs4 h GLU 518 N 0.20 0.27 -0.45 1.25 5.08 -1.17 -2.28 114.58 117.49 2bs4 h GLU 518 Ca 0.03 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2bs4 h GLU 518 Cb 0.60 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2bs4 h GLU 518 CO 0.04 0.28 0.14 0.93 -1.00 0.00 0.00 179.01 179.40 2bs4 h GLU 519 N 0.20 0.66 -0.63 2.33 4.39 -1.11 -1.64 114.58 118.77 2bs4 h GLU 519 Ca 0.07 -0.10 0.09 0.00 0.34 0.00 0.00 59.36 59.75 2bs4 h GLU 519 Cb 0.09 -0.11 -0.07 0.00 -0.10 0.00 0.00 28.75 28.55 2bs4 h GLU 519 CO -0.01 0.57 0.26 0.00 -1.16 0.00 0.00 179.01 178.67 2bs4 h ALA 520 N 1.51 0.83 0.00 3.43 0.00 -0.71 -1.15 119.26 123.17 2bs4 h ALA 520 Ca 0.15 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2bs4 h ALA 520 Cb 0.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2bs4 h ALA 520 CO -0.01 -0.15 -1.29 2.48 0.00 0.00 0.00 179.25 180.28 2bs4 n TYR 521 N -4.96 0.65 -0.01 0.00 0.18 -1.11 -4.38 117.16 107.53 2bs4 n TYR 521 Ca 0.09 0.19 -0.16 0.00 1.88 0.00 0.00 57.90 59.90 2bs4 n TYR 521 Cb 0.27 -0.80 -0.12 0.00 -0.38 0.00 0.00 39.34 38.31 2bs4 n TYR 521 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2bs4 h ARG 522 N 0.00 0.25 -0.73 -3.48 3.08 -1.04 -3.30 114.38 109.16 2bs4 h ARG 522 Ca 0.00 -0.28 0.11 0.00 0.07 0.00 0.00 59.98 59.88 2bs4 h ARG 522 Cb 0.98 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 31.04 2bs4 h ARG 522 CO 0.00 1.01 0.35 0.28 -1.07 0.00 0.00 179.97 180.53 2bs4 h VAL 523 N -0.40 0.80 -0.56 2.04 2.07 -1.42 0.77 116.25 119.56 2bs4 h VAL 523 Ca -0.05 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.29 2bs4 h VAL 523 Cb 1.15 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2bs4 h VAL 523 CO 0.08 0.10 0.37 -0.65 0.02 0.00 0.00 177.57 177.49 2bs4 h PRO 524 N 0.57 0.68 -0.23 1.57 0.11 -1.77 0.69 132.00 133.62 2bs4 h PRO 524 Ca 0.37 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.36 2bs4 h PRO 524 Cb 0.44 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.39 2bs4 h PRO 524 CO -0.30 0.45 -0.17 0.52 -0.21 0.00 0.00 178.00 178.28 2bs4 h MET 525 N 0.70 0.52 -0.68 1.05 2.86 -1.09 -2.64 114.93 115.64 2bs4 h MET 525 Ca 0.22 -0.26 0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2bs4 h MET 525 Cb 0.01 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 2bs4 h MET 525 CO -0.05 0.83 0.45 0.52 1.06 0.00 0.00 176.91 179.71 2bs4 h MET 526 N 0.22 0.73 -0.47 1.72 2.86 0.04 -2.02 114.93 118.02 2bs4 h MET 526 Ca 0.04 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 2bs4 h MET 526 Cb 0.71 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2bs4 h MET 526 CO 0.05 0.48 -0.22 -0.07 1.06 0.00 0.00 176.91 178.21 2bs4 h LEU 527 N 0.75 1.00 -1.20 1.22 3.38 -0.72 -0.33 115.31 119.41 2bs4 h LEU 527 Ca 0.29 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2bs4 h LEU 527 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2bs4 h LEU 527 CO -0.09 1.17 -0.24 0.11 0.09 0.00 0.00 178.44 179.48 2bs4 h LYS 528 N 0.84 0.25 -0.16 1.13 1.57 -1.05 -0.85 116.57 118.30 2bs4 h LYS 528 Ca 0.11 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 2bs4 h LYS 528 Cb 0.79 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 2bs4 h LYS 528 CO 0.07 0.48 -0.22 0.28 -0.57 0.00 0.00 179.45 179.49 2bs4 h VAL 529 N 0.23 1.35 -0.93 0.50 2.07 -1.10 -2.91 116.25 115.46 2bs4 h VAL 529 Ca 0.04 -1.42 0.00 0.00 0.82 0.00 0.00 66.70 66.14 2bs4 h VAL 529 Cb 0.55 1.90 -0.05 0.00 -1.52 0.00 0.00 31.29 32.18 2bs4 h VAL 529 CO 0.04 0.42 0.58 0.00 0.02 0.00 0.00 177.57 178.64 2bs4 h ALA 530 N 0.59 1.29 -0.92 1.67 0.00 -0.74 -2.25 119.26 118.90 2bs4 h ALA 530 Ca 0.02 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2bs4 h ALA 530 Cb 0.78 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2bs4 h ALA 530 CO 0.05 0.63 0.61 -0.07 0.00 0.00 0.00 179.25 180.47 2bs4 h LEU 531 N 1.27 1.05 -0.81 0.00 3.38 -1.09 0.15 115.31 119.25 2bs4 h LEU 531 Ca 0.34 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.21 2bs4 h LEU 531 Cb -0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 2bs4 h LEU 531 CO -0.07 0.75 0.14 0.00 0.09 0.00 0.00 178.44 179.36 2bs4 h VAL 533 N 0.98 1.33 0.64 0.00 2.07 -1.01 -1.54 116.25 118.73 2bs4 h VAL 533 Ca 0.20 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 2bs4 h VAL 533 Cb 0.37 2.08 0.01 0.00 -1.52 0.00 0.00 31.29 32.22 2bs4 h VAL 533 CO 0.00 0.28 -0.31 0.00 0.02 0.00 0.00 177.57 177.57 2bs4 h ALA 534 N 0.45 -0.86 -0.41 1.67 0.00 -0.66 -0.69 119.26 118.77 2bs4 h ALA 534 Ca -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2bs4 h ALA 534 Cb 0.49 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2bs4 h ALA 534 CO 0.00 -0.93 0.16 -0.22 0.00 0.00 0.00 179.25 178.27 2bs4 h LYS 535 N -0.96 0.58 0.00 0.00 1.63 -0.88 -0.38 116.57 116.55 2bs4 h LYS 535 Ca -0.09 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 59.53 2bs4 h LYS 535 Cb 0.69 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.19 2bs4 h LYS 535 CO 0.14 0.48 -0.49 0.78 -3.45 0.00 0.00 179.45 176.91 2bs4 h GLY 536 N 0.73 0.00 2.00 5.01 0.00 -1.22 -1.54 103.07 108.05 2bs4 h GLY 536 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.33 2bs4 h GLY 536 CO -0.01 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.85 2bs4 h ALA 537 N 1.51 0.79 0.03 3.60 0.00 0.20 -2.65 119.26 122.74 2bs4 h ALA 537 Ca -0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.14 2bs4 h ALA 537 Cb 1.00 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.69 2bs4 h ALA 537 CO 0.06 0.84 -0.61 1.25 0.00 0.00 0.00 179.25 180.79 2bs4 h LEU 538 N 0.00 0.49 -0.97 0.00 5.85 -0.76 -3.32 115.31 116.61 2bs4 h LEU 538 Ca -0.01 -0.80 -0.04 0.00 0.84 0.00 0.00 57.88 57.88 2bs4 h LEU 538 Cb 1.26 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2bs4 h LEU 538 CO 0.09 1.24 -0.17 0.44 -0.34 0.00 0.00 178.44 179.69 2bs4 h ASP 539 N -0.19 0.00 -1.99 1.25 5.19 -1.32 -3.40 116.42 115.96 2bs4 h ASP 539 Ca -0.08 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.68 2bs4 h ASP 539 Cb 1.35 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 40.72 2bs4 h ASP 539 CO 0.12 0.17 1.04 -0.60 -3.12 0.00 0.00 179.24 176.84 2bs4 s ARG 540 N -3.54 3.51 -1.29 3.56 3.52 -1.00 -4.92 118.95 118.79 2bs4 s ARG 540 Ca 0.02 -1.35 -0.14 0.00 -0.13 0.00 0.00 55.73 54.13 2bs4 s ARG 540 Cb 0.09 -4.94 0.12 0.00 -1.56 0.00 0.00 34.95 28.66 2bs4 s ARG 540 CO 0.63 -1.95 1.74 0.25 -0.81 0.00 0.00 175.30 175.16 2bs4 n THR 541 N 6.07 4.07 -3.76 4.11 -2.24 -1.26 -4.83 114.28 116.44 2bs4 n THR 541 Ca 0.22 -4.23 -0.00 0.00 -2.27 0.00 0.00 64.05 57.77 2bs4 n THR 541 Cb 0.49 -2.43 0.00 0.00 -2.10 0.00 0.00 70.33 66.29 2bs4 n THR 541 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2bs4 s GLU 542 N 2.25 0.75 -0.24 -0.78 -1.05 -1.26 -4.88 118.70 113.49 2bs4 s GLU 542 Ca 0.46 -0.45 0.01 0.00 -0.15 0.00 0.00 54.97 54.84 2bs4 s GLU 542 Cb 0.04 0.24 0.06 0.00 -0.44 0.00 0.00 34.13 34.03 2bs4 s GLU 542 CO 0.01 -0.35 -0.06 -1.12 0.95 0.00 0.00 175.26 174.69 2bs4 s SER 543 N -3.19 3.89 -0.02 0.83 0.01 -0.84 -3.83 113.70 110.55 2bs4 s SER 543 Ca 0.18 -1.19 0.01 0.00 1.31 0.00 0.00 55.95 56.26 2bs4 s SER 543 Cb 0.01 -1.21 0.01 0.00 0.21 0.00 0.00 66.02 65.04 2bs4 s SER 543 CO -0.00 -0.23 -0.03 -0.60 0.41 0.00 0.00 173.24 172.79 2bs4 s ARG 544 N 1.37 0.44 3.52 12.44 3.52 0.58 -3.16 118.95 137.65 2bs4 s ARG 544 Ca -0.06 -0.07 0.00 0.00 -0.13 0.00 0.00 55.73 55.47 2bs4 s ARG 544 Cb -0.19 -0.50 0.00 0.00 -1.56 0.00 0.00 34.95 32.71 2bs4 s ARG 544 CO -0.06 -0.02 0.00 0.41 -0.81 0.00 0.00 175.30 174.82 2bs4 n GLY 545 N 3.60 3.07 0.08 8.12 0.00 -1.26 0.26 105.19 119.06 2bs4 n GLY 545 Ca -0.20 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.05 2bs4 n GLY 545 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs4 n ALA 546 N 10.27 2.00 -2.65 4.61 0.00 0.16 -4.62 120.51 130.28 2bs4 n ALA 546 Ca 0.00 -0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2bs4 n ALA 546 Cb 0.00 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.00 2bs4 n ALA 546 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2bs4 s HIS 547 N -3.14 2.76 -0.31 0.00 5.04 0.14 -4.87 115.29 114.91 2bs4 s HIS 547 Ca 0.09 0.02 -0.04 0.00 -1.54 0.00 0.00 55.06 53.59 2bs4 s HIS 547 Cb 0.12 -4.14 0.04 0.00 0.04 0.00 0.00 32.58 28.64 2bs4 s HIS 547 CO 0.47 -1.40 0.03 -0.80 -2.34 0.00 0.00 174.74 170.70 2bs4 s ASN 548 N 2.91 5.00 -0.40 9.88 0.01 -1.26 -0.30 114.94 130.77 2bs4 s ASN 548 Ca 0.32 -1.17 -0.14 0.00 -0.71 0.00 0.00 52.86 51.16 2bs4 s ASN 548 Cb -0.12 -1.77 0.02 0.00 0.41 0.00 0.00 41.25 39.80 2bs4 s ASN 548 CO 0.19 -0.27 0.28 -0.13 -1.51 0.00 0.00 177.10 175.66 2bs4 s ARG 549 N 1.32 2.92 0.28 -0.60 1.81 -1.25 -1.14 118.95 122.28 2bs4 s ARG 549 Ca -0.03 -1.06 -0.01 0.00 -1.72 0.00 0.00 55.73 52.91 2bs4 s ARG 549 Cb -0.19 -3.91 0.46 0.00 -0.45 0.00 0.00 34.95 30.86 2bs4 s ARG 549 CO 0.00 -0.75 1.88 0.93 -0.68 0.00 0.00 175.30 176.69 2bs4 h GLU 550 N 8.57 1.08 0.00 3.54 5.08 -1.11 0.14 114.58 131.89 2bs4 h GLU 550 Ca -0.26 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2bs4 h GLU 550 Cb 1.11 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2bs4 h GLU 550 CO 0.72 0.72 0.00 -0.40 -1.00 0.00 0.00 179.01 179.04 2bs4 n ASP 551 N -4.51 0.00 -3.04 1.42 5.68 -1.26 -3.84 116.55 111.00 2bs4 n ASP 551 Ca 0.15 -0.36 -0.15 0.00 -0.50 0.00 0.00 54.79 53.94 2bs4 n ASP 551 Cb 0.21 -0.19 0.01 0.00 -1.14 0.00 0.00 41.12 40.01 2bs4 n ASP 551 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2bs4 n TYR 552 N -1.19 -0.90 -0.05 2.11 4.02 0.36 -5.01 117.16 116.50 2bs4 n TYR 552 Ca 0.16 -3.22 0.24 0.00 -0.01 0.00 0.00 57.90 55.06 2bs4 n TYR 552 Cb 0.18 0.28 0.72 0.00 -0.02 0.00 0.00 39.34 40.49 2bs4 n TYR 552 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2bs4 h PRO 553 N 3.08 0.00 -6.35 -0.72 0.13 -1.31 -2.22 132.00 124.61 2bs4 h PRO 553 Ca 0.03 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.61 2bs4 h PRO 553 Cb 1.01 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.10 2bs4 h PRO 553 CO 0.38 0.00 -0.05 0.15 -0.23 0.00 0.00 178.00 178.24 2bs4 s LYS 554 N -4.91 4.03 -0.23 0.86 1.02 -1.26 -4.51 119.74 114.73 2bs4 s LYS 554 Ca -0.05 0.56 -0.29 0.00 0.02 0.00 0.00 55.97 56.21 2bs4 s LYS 554 Cb 0.19 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 34.56 2bs4 s LYS 554 CO 0.71 0.48 1.14 0.50 -0.92 0.00 0.00 175.35 177.26 2bs4 s ARG 555 N -1.89 4.18 -0.75 1.68 3.52 -0.63 -2.44 118.95 122.63 2bs4 s ARG 555 Ca 0.38 1.39 -0.19 0.00 -0.13 0.00 0.00 55.73 57.17 2bs4 s ARG 555 Cb -0.16 -3.72 0.11 0.00 -1.56 0.00 0.00 34.95 29.63 2bs4 s ARG 555 CO 0.19 -0.75 0.93 0.34 -0.81 0.00 0.00 175.30 175.21 2bs4 s ASP 556 N 1.66 6.39 0.00 -2.12 -1.08 -1.26 -0.55 116.67 119.71 2bs4 s ASP 556 Ca 0.49 -1.64 0.26 0.00 -0.52 0.00 0.00 52.55 51.13 2bs4 s ASP 556 Cb -0.17 -2.36 1.28 0.00 -1.46 0.00 0.00 42.92 40.22 2bs4 s ASP 556 CO 0.12 -1.14 1.87 0.47 0.52 0.00 0.00 175.17 177.00 2bs4 n ASP 557 N 6.58 0.00 -0.10 -0.34 9.92 -0.84 -1.29 116.55 130.49 2bs4 n ASP 557 Ca 0.06 -0.04 -0.18 0.00 -0.53 0.00 0.00 54.79 54.10 2bs4 n ASP 557 Cb 0.46 -0.30 -0.10 0.00 -0.64 0.00 0.00 41.12 40.54 2bs4 n ASP 557 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2bs4 h ILE 558 N 0.00 0.75 0.00 0.53 2.04 -1.85 -3.37 117.51 115.62 2bs4 h ILE 558 Ca 0.00 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 63.90 2bs4 h ILE 558 Cb 0.26 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 2bs4 h ILE 558 CO 0.00 0.26 -1.23 0.59 0.00 0.00 0.00 178.15 177.76 2bs4 n ASN 559 N -4.47 0.74 -0.19 1.72 3.02 -1.25 -4.60 115.26 110.23 2bs4 n ASN 559 Ca -0.27 -0.72 0.07 0.00 -0.03 0.00 0.00 54.58 53.64 2bs4 n ASN 559 Cb 0.60 1.22 0.10 0.00 -0.61 0.00 0.00 39.78 41.08 2bs4 n ASN 559 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2bs4 n TRP 560 N -1.70 0.00 -1.48 3.10 7.02 -0.41 -4.79 117.44 119.18 2bs4 n TRP 560 Ca 0.02 -0.72 -0.40 0.00 -1.02 0.00 0.00 57.50 55.38 2bs4 n TRP 560 Cb 0.39 -0.12 -0.02 0.00 -2.42 0.00 0.00 31.31 29.14 2bs4 n TRP 560 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2bs4 n LEU 561 N -1.04 8.31 0.00 -0.99 7.94 -1.23 -4.78 117.00 125.21 2bs4 n LEU 561 Ca 0.12 -4.39 0.00 0.00 -1.11 0.00 0.00 56.01 50.63 2bs4 n LEU 561 Cb 0.66 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 43.05 2bs4 n LEU 561 CO 0.01 1.88 0.00 -0.46 -1.11 0.00 0.00 177.39 177.71 2bs4 n ASN 562 N 3.86 0.02 -3.91 1.96 2.04 -1.26 -1.27 115.26 116.69 2bs4 n ASN 562 Ca 0.71 -0.97 -0.21 0.00 -0.44 0.00 0.00 54.58 53.67 2bs4 n ASN 562 Cb 0.26 0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.35 2bs4 n ASN 562 CO 0.00 0.00 0.00 -0.60 -0.44 0.00 0.00 177.26 176.22 2bs4 s ARG 563 N -1.92 1.01 0.08 -3.83 3.52 0.25 -4.82 118.95 113.25 2bs4 s ARG 563 Ca 0.00 -0.16 -0.31 0.00 -0.13 0.00 0.00 55.73 55.13 2bs4 s ARG 563 Cb 0.00 -0.97 -0.07 0.00 -1.56 0.00 0.00 34.95 32.35 2bs4 s ARG 563 CO 0.00 -0.07 1.28 0.99 -0.81 0.00 0.00 175.30 176.68 2bs4 s THR 564 N 0.93 3.74 -0.23 4.11 2.01 -1.26 -1.31 115.64 123.63 2bs4 s THR 564 Ca -0.11 1.25 0.02 0.00 0.31 0.00 0.00 61.69 63.16 2bs4 s THR 564 Cb -0.14 -3.80 0.05 0.00 0.01 0.00 0.00 72.50 68.61 2bs4 s THR 564 CO 0.00 0.10 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.13 2bs4 s LEU 565 N 1.08 2.95 -0.09 4.42 1.43 0.57 -0.74 118.68 128.30 2bs4 s LEU 565 Ca 0.61 -1.13 -0.06 0.00 -1.03 0.00 0.00 54.13 52.52 2bs4 s LEU 565 Cb -0.32 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2bs4 s LEU 565 CO 0.30 -0.12 0.16 0.00 0.23 0.00 0.00 176.35 176.91 2bs4 s ALA 566 N 1.18 3.90 0.20 4.21 0.00 0.94 -1.13 121.76 131.06 2bs4 s ALA 566 Ca -0.04 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 2bs4 s ALA 566 Cb -0.17 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 2bs4 s ALA 566 CO -0.08 0.65 0.30 -1.54 0.00 0.00 0.00 175.76 175.09 2bs4 s SER 567 N -1.26 0.04 -0.40 0.00 1.04 0.00 -0.43 113.70 112.70 2bs4 s SER 567 Ca 0.18 -1.02 0.10 0.00 0.48 0.00 0.00 55.95 55.69 2bs4 s SER 567 Cb -0.12 0.46 0.33 0.00 0.10 0.00 0.00 66.02 66.79 2bs4 s SER 567 CO 0.08 -0.95 0.80 1.87 0.98 0.00 0.00 173.24 176.02 2bs4 n TRP 568 N -0.27 -0.69 -0.04 5.02 -0.00 -1.26 -0.41 117.44 119.79 2bs4 n TRP 568 Ca -0.03 -3.34 0.16 0.00 -0.00 0.00 0.00 57.50 54.28 2bs4 n TRP 568 Cb 0.63 0.12 0.59 0.00 -0.00 0.00 0.00 31.31 32.65 2bs4 n TRP 568 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 2bs4 h PRO 569 N 3.14 0.20 -4.86 5.87 0.13 -1.87 -3.37 132.00 131.24 2bs4 h PRO 569 Ca 0.04 -0.01 -0.67 0.00 -0.87 0.00 0.00 66.00 64.49 2bs4 h PRO 569 Cb 0.99 -0.05 -0.27 0.00 0.13 0.00 0.00 31.00 31.81 2bs4 h PRO 569 CO 0.41 0.13 -0.65 1.21 -0.23 0.00 0.00 178.00 178.87 2bs4 s ASN 570 N -6.23 4.90 0.63 1.44 3.84 -1.26 -4.84 114.94 113.42 2bs4 s ASN 570 Ca -0.06 -0.62 0.42 0.00 0.21 0.00 0.00 52.86 52.80 2bs4 s ASN 570 Cb 0.20 -1.84 2.26 0.00 -0.55 0.00 0.00 41.25 41.32 2bs4 s ASN 570 CO 0.74 -0.14 2.29 1.55 -2.79 0.00 0.00 177.10 178.75 2bs4 h PRO 571 N 8.19 0.00 0.00 0.43 0.13 -1.98 -2.13 132.00 136.64 2bs4 h PRO 571 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2bs4 h PRO 571 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2bs4 h PRO 571 CO 0.60 0.00 -0.44 0.93 -0.23 0.00 0.00 178.00 178.86 2bs4 h GLU 572 N 0.00 0.00 -7.20 0.86 5.08 -1.94 -3.47 114.58 107.91 2bs4 h GLU 572 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 2bs4 h GLU 572 Cb 0.03 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.39 2bs4 h GLU 572 CO 0.00 0.00 0.37 1.14 -1.00 0.00 0.00 179.01 179.52 2bs4 s GLN 573 N -3.25 2.67 0.00 2.33 -2.07 -0.80 -4.97 119.66 113.56 2bs4 s GLN 573 Ca 0.05 1.43 0.10 0.00 -1.82 0.00 0.00 55.36 55.11 2bs4 s GLN 573 Cb 0.08 -1.93 0.13 0.00 -1.09 0.00 0.00 33.01 30.20 2bs4 s GLN 573 CO 0.71 -1.36 0.93 0.25 -1.32 0.00 0.00 175.29 174.50 2bs4 n THR 574 N -2.54 0.24 -4.05 3.63 -2.24 -1.26 -4.98 114.28 103.08 2bs4 n THR 574 Ca 0.11 -0.62 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 2bs4 n THR 574 Cb 0.52 1.04 -0.13 0.00 -2.10 0.00 0.00 70.33 69.66 2bs4 n THR 574 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bs4 s LEU 575 N -0.90 2.13 0.76 3.22 1.43 -1.26 -4.85 118.68 119.21 2bs4 s LEU 575 Ca 0.14 -0.29 -0.14 0.00 -1.03 0.00 0.00 54.13 52.81 2bs4 s LEU 575 Cb 0.09 -0.13 0.06 0.00 0.03 0.00 0.00 46.19 46.24 2bs4 s LEU 575 CO 0.13 -0.09 1.18 -2.16 0.23 0.00 0.00 176.35 175.64 2bs4 s PRO 576 N -0.80 2.01 -0.27 1.29 0.04 -1.26 -4.99 135.00 131.02 2bs4 s PRO 576 Ca -0.05 1.63 -0.10 0.00 0.04 0.00 0.00 61.00 62.52 2bs4 s PRO 576 Cb -0.06 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 2bs4 s PRO 576 CO -0.00 -1.90 0.17 0.99 0.04 0.00 0.00 177.00 176.30 2bs4 s THR 577 N -2.22 5.18 0.01 1.26 2.01 0.45 -4.94 115.64 117.39 2bs4 s THR 577 Ca 0.71 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.85 2bs4 s THR 577 Cb -0.26 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 2bs4 s THR 577 CO 0.48 0.27 0.02 -0.76 -0.69 0.00 0.00 174.62 173.94 2bs4 s LEU 578 N 1.68 3.57 0.23 4.42 1.43 -1.26 -0.82 118.68 127.94 2bs4 s LEU 578 Ca 0.07 -0.01 -0.04 0.00 -1.03 0.00 0.00 54.13 53.13 2bs4 s LEU 578 Cb -0.16 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 2bs4 s LEU 578 CO 0.10 0.26 0.25 -1.61 0.23 0.00 0.00 176.35 175.57 2bs4 s GLU 579 N -1.71 1.36 -0.01 1.70 2.02 -0.28 -4.97 118.70 116.81 2bs4 s GLU 579 Ca 0.21 -1.57 0.03 0.00 0.02 0.00 0.00 54.97 53.67 2bs4 s GLU 579 Cb -0.12 0.33 -0.01 0.00 0.10 0.00 0.00 34.13 34.44 2bs4 s GLU 579 CO 0.12 -0.49 -0.11 0.71 0.02 0.00 0.00 175.26 175.51 2bs4 s TYR 580 N -4.02 0.97 -0.25 1.61 1.51 -1.26 -0.32 117.35 115.59 2bs4 s TYR 580 Ca 0.34 -0.19 -0.06 0.00 -1.01 0.00 0.00 57.07 56.15 2bs4 s TYR 580 Cb 0.04 -0.63 -0.02 0.00 -0.11 0.00 0.00 41.96 41.24 2bs4 s TYR 580 CO 0.13 -0.03 0.05 -2.00 -1.11 0.00 0.00 175.55 172.59 2bs4 s GLU 581 N -0.21 3.49 0.14 -0.62 2.12 -0.42 -4.90 118.70 118.30 2bs4 s GLU 581 Ca 0.03 -0.58 -0.29 0.00 0.36 0.00 0.00 54.97 54.49 2bs4 s GLU 581 Cb -0.05 -3.27 -0.07 0.00 0.26 0.00 0.00 34.13 31.01 2bs4 s GLU 581 CO -0.00 -0.24 0.93 0.00 -0.54 0.00 0.00 175.26 175.40 2bs4 s ALA 582 N 1.56 3.29 -0.37 6.30 0.00 -1.26 0.88 121.76 132.16 2bs4 s ALA 582 Ca 0.06 0.54 -0.24 0.00 0.00 0.00 0.00 51.96 52.32 2bs4 s ALA 582 Cb -0.15 -3.22 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2bs4 s ALA 582 CO 0.02 0.05 0.81 -0.51 0.00 0.00 0.00 175.76 176.13 2bs4 s LEU 583 N -0.34 4.11 -0.55 0.00 1.43 -0.40 -4.93 118.68 118.00 2bs4 s LEU 583 Ca 0.44 0.37 -0.28 0.00 -1.03 0.00 0.00 54.13 53.63 2bs4 s LEU 583 Cb -0.24 -3.07 0.03 0.00 0.03 0.00 0.00 46.19 42.94 2bs4 s LEU 583 CO 0.29 -0.76 1.24 -0.62 0.23 0.00 0.00 176.35 176.73 2bs4 s ASP 584 N 1.86 6.41 0.40 2.29 2.15 -1.26 -4.88 116.67 123.64 2bs4 s ASP 584 Ca 0.32 0.23 0.15 0.00 0.43 0.00 0.00 52.55 53.68 2bs4 s ASP 584 Cb -0.13 -2.55 1.01 0.00 -0.30 0.00 0.00 42.92 40.95 2bs4 s ASP 584 CO 0.17 -1.49 1.88 0.58 -0.17 0.00 0.00 175.17 176.14 2bs4 h VAL 585 N 6.23 0.75 0.00 1.11 2.07 -1.95 -0.64 116.25 123.81 2bs4 h VAL 585 Ca -0.25 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2bs4 h VAL 585 Cb 1.07 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2bs4 h VAL 585 CO 1.17 0.09 0.00 0.59 0.02 0.00 0.00 177.57 179.44 2bs4 n ASN 586 N -4.52 0.45 -0.94 0.57 5.03 -1.26 -0.49 115.26 114.10 2bs4 n ASN 586 Ca 0.17 0.71 0.09 0.00 0.87 0.00 0.00 54.58 56.42 2bs4 n ASN 586 Cb 0.59 -0.77 0.21 0.00 -1.02 0.00 0.00 39.78 38.79 2bs4 n ASN 586 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2bs4 n GLU 587 N -2.11 2.54 -3.47 3.52 1.02 -0.25 -4.97 120.64 116.91 2bs4 n GLU 587 Ca -0.01 -2.20 -0.37 0.00 -0.02 0.00 0.00 57.16 54.55 2bs4 n GLU 587 Cb 0.03 -1.40 -0.06 0.00 -0.02 0.00 0.00 31.44 29.98 2bs4 n GLU 587 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2bs4 s MET 588 N -1.09 4.11 0.35 3.49 -1.94 0.35 -4.83 119.30 119.75 2bs4 s MET 588 Ca 0.33 0.31 0.19 0.00 -1.71 0.00 0.00 55.69 54.81 2bs4 s MET 588 Cb 0.18 -3.34 0.31 0.00 2.01 0.00 0.00 34.83 33.99 2bs4 s MET 588 CO 0.24 0.41 1.56 1.49 -0.01 0.00 0.00 175.02 178.72 2bs4 h GLU 589 N 5.86 0.00 -4.21 2.03 4.81 -1.87 -3.42 114.58 117.78 2bs4 h GLU 589 Ca -0.46 0.00 -0.52 0.00 -0.13 0.00 0.00 59.36 58.25 2bs4 h GLU 589 Cb 1.19 0.00 -0.37 0.00 0.63 0.00 0.00 28.75 30.20 2bs4 h GLU 589 CO 0.69 0.32 -0.80 0.42 -0.73 0.00 0.00 179.01 178.91 2bs4 s ILE 590 N -3.16 0.99 0.42 2.32 1.01 -1.26 -5.01 121.20 116.51 2bs4 s ILE 590 Ca 0.04 -0.27 -0.23 0.00 0.00 0.00 0.00 60.65 60.19 2bs4 s ILE 590 Cb 0.07 -1.01 -0.09 0.00 0.01 0.00 0.00 42.46 41.44 2bs4 s ILE 590 CO 0.70 0.36 1.01 0.00 0.00 0.00 0.00 174.94 177.01 2bs4 s ALA 591 N 1.66 3.04 0.01 9.38 0.00 -1.26 -4.95 121.76 129.64 2bs4 s ALA 591 Ca 0.04 0.58 -0.36 0.00 0.00 0.00 0.00 51.96 52.23 2bs4 s ALA 591 Cb -0.13 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.62 2bs4 s ALA 591 CO -0.07 -0.10 1.63 -2.30 0.00 0.00 0.00 175.76 174.91 2bs4 n PRO 592 N -0.33 1.75 0.00 0.00 -0.02 -1.26 -4.92 135.00 130.23 2bs4 n PRO 592 Ca 0.06 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2bs4 n PRO 592 Cb 0.51 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2bs4 n PRO 592 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bs4 n GLY 593 N 3.58 4.62 3.77 -1.23 0.00 -1.26 -4.92 105.19 109.75 2bs4 n GLY 593 Ca 0.20 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 2bs4 n GLY 593 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bs4 s TYR 594 N 0.27 3.71 -0.35 1.61 5.04 -1.26 -4.98 117.35 121.40 2bs4 s TYR 594 Ca 0.00 1.80 0.23 0.00 -2.44 0.00 0.00 57.07 56.65 2bs4 s TYR 594 Cb 0.00 -2.96 0.16 0.00 0.35 0.00 0.00 41.96 39.51 2bs4 s TYR 594 CO 0.00 0.17 1.27 0.07 -1.34 0.00 0.00 175.55 175.72 2bs4 h ARG 595 N 3.33 0.00 0.00 4.97 0.11 -1.94 -3.49 114.38 117.36 2bs4 h ARG 595 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2bs4 h ARG 595 Cb 1.20 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.28 2bs4 h ARG 595 CO 0.65 0.00 0.00 0.41 0.10 0.00 0.00 179.97 181.13 2bs4 n GLY 596 N 1.17 3.13 3.75 0.08 0.00 -1.26 -4.70 105.19 107.35 2bs4 n GLY 596 Ca 0.02 -1.01 -0.26 0.00 0.00 0.00 0.00 46.02 44.76 2bs4 n GLY 596 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2bs4 s TYR 597 N -0.27 3.03 0.00 1.61 -0.85 -1.26 -5.05 117.35 114.56 2bs4 s TYR 597 Ca 0.00 -0.07 0.00 0.00 -0.52 0.00 0.00 57.07 56.48 2bs4 s TYR 597 Cb 0.00 -1.45 0.00 0.00 0.38 0.00 0.00 41.96 40.89 2bs4 s TYR 597 CO 0.00 0.52 0.00 0.41 -1.52 0.00 0.00 175.55 174.96 2bs4 n GLY 598 N -0.31 -2.24 3.23 5.49 0.00 -1.26 -4.94 105.19 105.16 2bs4 n GLY 598 Ca -0.09 -1.52 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 2bs4 n GLY 598 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bs4 n ALA 599 N -0.54 -4.45 -2.43 4.61 0.00 -1.26 -5.02 120.51 111.42 2bs4 n ALA 599 Ca 0.00 -1.32 -0.27 0.00 0.00 0.00 0.00 53.44 51.85 2bs4 n ALA 599 Cb 0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 19.45 17.93 2bs4 n ALA 599 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2bs4 s LYS 600 N -3.22 1.54 -1.80 0.00 1.02 -1.26 -4.60 119.74 111.42 2bs4 s LYS 600 Ca 0.53 -1.52 0.00 0.00 0.02 0.00 0.00 55.97 55.00 2bs4 s LYS 600 Cb -0.08 -1.86 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 2bs4 s LYS 600 CO 0.66 0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.90 2bs4 n GLY 601 N 0.26 0.70 2.01 -3.33 0.00 -1.26 -4.83 105.19 98.74 2bs4 n GLY 601 Ca -0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.71 2bs4 n GLY 601 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bs4 n ASN 602 N -1.52 6.52 -3.68 1.61 4.05 -1.26 -4.84 115.26 116.14 2bs4 n ASN 602 Ca -0.20 -3.11 -0.09 0.00 0.45 0.00 0.00 54.58 51.62 2bs4 n ASN 602 Cb 0.64 -1.09 -0.10 0.00 1.23 0.00 0.00 39.78 40.46 2bs4 n ASN 602 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 2bs4 s TYR 603 N -1.86 -0.71 -0.48 1.20 -0.85 -1.26 -1.60 117.35 111.79 2bs4 s TYR 603 Ca 0.37 1.47 -0.27 0.00 -0.52 0.00 0.00 57.07 58.12 2bs4 s TYR 603 Cb 0.28 0.34 -0.04 0.00 0.38 0.00 0.00 41.96 42.92 2bs4 s TYR 603 CO -0.04 -0.40 2.02 0.42 -1.52 0.00 0.00 175.55 176.03 2bs4 s ILE 604 N 1.64 3.26 0.36 -3.49 1.09 0.28 -4.92 121.20 119.43 2bs4 s ILE 604 Ca -0.08 0.20 -0.28 0.00 -1.10 0.00 0.00 60.65 59.39 2bs4 s ILE 604 Cb -0.08 -3.55 -0.11 0.00 -1.06 0.00 0.00 42.46 37.66 2bs4 s ILE 604 CO -0.14 -0.48 1.46 -0.70 -0.10 0.00 0.00 174.94 174.98 2bs4 s GLU 605 N 6.97 4.16 -0.18 2.79 2.12 -1.26 -1.98 118.70 131.32 2bs4 s GLU 605 Ca 0.81 2.50 -0.12 0.00 0.36 0.00 0.00 54.97 58.52 2bs4 s GLU 605 Cb -0.18 -2.99 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 2bs4 s GLU 605 CO 0.26 -0.48 0.23 1.21 -0.54 0.00 0.00 175.26 175.95 2bs4 s ASN 606 N -0.14 6.34 0.39 -1.70 3.84 -1.26 -4.74 114.94 117.67 2bs4 s ASN 606 Ca 0.53 0.39 0.10 0.00 0.21 0.00 0.00 52.86 54.09 2bs4 s ASN 606 Cb -0.45 -2.15 0.89 0.00 -0.55 0.00 0.00 41.25 38.99 2bs4 s ASN 606 CO 0.60 0.12 1.94 1.55 -2.79 0.00 0.00 177.10 178.51 2bs4 h PRO 607 N 6.76 0.57 0.00 0.43 0.13 -1.94 -1.19 132.00 136.76 2bs4 h PRO 607 Ca -0.41 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2bs4 h PRO 607 Cb 1.16 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2bs4 h PRO 607 CO 0.75 0.38 0.00 -0.07 -0.23 0.00 0.00 178.00 178.83 2bs4 h LEU 608 N 0.59 0.00 0.02 1.56 4.07 -1.98 -2.61 115.31 116.95 2bs4 h LEU 608 Ca 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.29 2bs4 h LEU 608 Cb 0.52 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.26 2bs4 h LEU 608 CO -0.12 0.00 -0.01 0.28 -1.08 0.00 0.00 178.44 177.52 2bs4 h SER 609 N 0.00 -0.02 -0.16 -0.43 0.02 -1.59 -1.44 113.55 109.93 2bs4 h SER 609 Ca 0.00 -0.30 0.02 0.00 -0.84 0.00 0.00 61.79 60.67 2bs4 h SER 609 Cb 0.37 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 2bs4 h SER 609 CO 0.00 0.29 0.03 0.58 -1.14 0.00 0.00 176.83 176.59 2bs4 h VAL 610 N -0.34 0.92 -0.18 2.27 2.07 -1.54 0.56 116.25 120.01 2bs4 h VAL 610 Ca -0.00 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.52 2bs4 h VAL 610 Cb 0.32 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2bs4 h VAL 610 CO 0.00 0.02 -0.05 0.50 0.02 0.00 0.00 177.57 178.06 2bs4 h LYS 611 N 0.09 -0.01 -0.82 1.57 3.64 -1.51 -1.93 116.57 117.60 2bs4 h LYS 611 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2bs4 h LYS 611 Cb 0.07 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 2bs4 h LYS 611 CO -0.10 -0.01 0.52 -0.09 -2.27 0.00 0.00 179.45 177.51 2bs4 h ARG 612 N -0.01 1.10 -0.74 1.90 9.65 -0.81 -2.42 114.38 123.06 2bs4 h ARG 612 Ca 0.09 -0.08 0.12 0.00 -1.10 0.00 0.00 59.98 59.01 2bs4 h ARG 612 Cb 0.14 -0.24 -0.08 0.00 -1.39 0.00 0.00 29.97 28.40 2bs4 h ARG 612 CO -0.19 0.75 0.33 0.37 2.80 0.00 0.00 179.97 184.03 2bs4 h GLN 613 N 1.12 0.50 0.51 0.20 5.75 0.86 -0.39 115.11 123.67 2bs4 h GLN 613 Ca 0.30 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.74 2bs4 h GLN 613 Cb -0.09 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.35 2bs4 h GLN 613 CO -0.06 0.33 -0.24 0.93 -2.65 0.00 0.00 178.83 177.14 2bs4 h GLU 614 N 0.52 -0.66 -1.17 1.69 5.08 -0.96 0.30 114.58 119.38 2bs4 h GLU 614 Ca 0.39 0.04 0.42 0.00 -1.00 0.00 0.00 59.36 59.21 2bs4 h GLU 614 Cb 0.51 0.15 -0.15 0.00 0.50 0.00 0.00 28.75 29.76 2bs4 h GLU 614 CO -0.34 -0.38 0.71 1.49 -1.00 0.00 0.00 179.01 179.48 2bs4 h GLU 615 N -0.81 0.07 0.41 2.33 4.81 -0.91 1.03 114.58 121.51 2bs4 h GLU 615 Ca -0.07 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 2bs4 h GLU 615 Cb 0.58 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2bs4 h GLU 615 CO 0.11 0.05 -0.20 0.82 -0.73 0.00 0.00 179.01 179.07 2bs4 h ILE 616 N 0.07 0.26 -0.76 2.32 1.08 -0.30 -2.20 117.51 117.98 2bs4 h ILE 616 Ca 0.83 -0.64 0.12 0.00 -0.39 0.00 0.00 64.86 64.79 2bs4 h ILE 616 Cb 2.39 0.41 -0.09 0.00 -3.07 0.00 0.00 36.82 36.47 2bs4 h ILE 616 CO -0.58 0.06 0.36 0.44 -0.69 0.00 0.00 178.15 177.73 2bs4 h ASP 617 N -1.06 0.42 0.00 1.72 3.32 0.20 0.75 116.42 121.76 2bs4 h ASP 617 Ca -0.06 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2bs4 h ASP 617 Cb 0.51 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2bs4 h ASP 617 CO 0.09 0.20 0.00 1.17 -1.72 0.00 0.00 179.24 178.98 2bs4 n LYS 618 N -4.91 0.00 -0.33 3.56 4.81 0.31 -1.50 118.16 120.10 2bs4 n LYS 618 Ca 0.14 0.41 0.25 0.00 -0.87 0.00 0.00 58.31 58.24 2bs4 n LYS 618 Cb 0.36 -1.39 0.54 0.00 0.02 0.00 0.00 35.03 34.56 2bs4 n LYS 618 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 2bs4 h ILE 619 N 0.00 0.49 0.27 3.15 2.04 -1.29 -1.39 117.51 120.78 2bs4 h ILE 619 Ca 0.00 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 2bs4 h ILE 619 Cb 0.00 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 2bs4 h ILE 619 CO 0.00 0.06 -0.13 -0.61 0.00 0.00 0.00 178.15 177.47 2bs4 h GLN 620 N 0.34 -0.35 -0.51 2.37 4.15 -0.82 -3.02 115.11 117.27 2bs4 h GLN 620 Ca 0.60 0.02 0.05 0.00 0.77 0.00 0.00 58.65 60.09 2bs4 h GLN 620 Cb 1.63 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 29.35 2bs4 h GLN 620 CO -0.27 -0.01 0.26 0.77 -1.93 0.00 0.00 178.83 177.64 2bs4 h SER 621 N -0.77 0.37 -0.66 -0.69 0.02 -0.37 0.32 113.55 111.76 2bs4 h SER 621 Ca -0.04 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2bs4 h SER 621 Cb 0.50 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.96 2bs4 h SER 621 CO 0.06 0.25 0.39 -0.33 -1.14 0.00 0.00 176.83 176.07 2bs4 h GLU 622 N 0.50 0.74 0.11 3.45 5.08 -1.37 0.37 114.58 123.46 2bs4 h GLU 622 Ca 0.23 -0.04 -0.27 0.00 -1.00 0.00 0.00 59.36 58.27 2bs4 h GLU 622 Cb 0.14 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.23 2bs4 h GLU 622 CO -0.16 0.49 -1.19 -0.07 -1.00 0.00 0.00 179.01 177.07 2bs4 h LEU 623 N 0.76 0.55 -1.51 1.33 3.38 -1.37 -1.88 115.31 116.57 2bs4 h LEU 623 Ca 0.28 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 2bs4 h LEU 623 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2bs4 h LEU 623 CO -0.13 1.39 -0.09 -0.08 0.09 0.00 0.00 178.44 179.61 2bs4 h GLU 624 N 0.14 0.20 0.17 1.13 4.81 -0.06 -2.56 114.58 118.41 2bs4 h GLU 624 Ca -0.14 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 58.77 2bs4 h GLU 624 Cb 1.89 -0.03 0.02 0.00 0.63 0.00 0.00 28.75 31.25 2bs4 h GLU 624 CO 0.21 0.31 -1.33 0.00 -0.73 0.00 0.00 179.01 177.46 2bs4 h ALA 625 N 1.72 0.03 0.00 2.92 0.00 -0.96 -3.30 119.26 119.67 2bs4 h ALA 625 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 54.01 2bs4 h ALA 625 Cb 0.29 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2bs4 h ALA 625 CO 0.02 0.71 0.00 0.00 0.00 0.00 0.00 179.25 179.98 2bs4 n ALA 626 N -2.81 1.77 -2.96 0.00 0.00 -0.71 -4.81 120.51 110.99 2bs4 n ALA 626 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.12 2bs4 n ALA 626 Cb 0.96 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.42 2bs4 n ALA 626 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bs4 n GLY 627 N 0.38 -1.57 2.83 0.00 0.00 -1.14 -4.99 105.19 100.70 2bs4 n GLY 627 Ca 0.00 1.03 -0.13 0.00 0.00 0.00 0.00 46.02 46.92 2bs4 n GLY 627 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bs4 s LYS 628 N -2.31 -0.01 0.91 1.61 2.47 -1.00 -5.01 119.74 116.40 2bs4 s LYS 628 Ca 0.21 0.10 -0.11 0.00 -1.56 0.00 0.00 55.97 54.61 2bs4 s LYS 628 Cb -0.05 -0.11 0.14 0.00 -1.46 0.00 0.00 37.83 36.35 2bs4 s LYS 628 CO 0.75 -0.08 1.09 0.16 0.16 0.00 0.00 175.35 177.43 2bs4 s ASP 629 N 0.50 3.28 0.62 1.43 1.47 -1.26 -4.72 116.67 117.99 2bs4 s ASP 629 Ca -0.04 1.59 0.38 0.00 1.18 0.00 0.00 52.55 55.66 2bs4 s ASP 629 Cb -0.06 -2.26 2.08 0.00 -0.34 0.00 0.00 42.92 42.35 2bs4 s ASP 629 CO -0.01 -2.78 2.28 0.08 0.68 0.00 0.00 175.17 175.42 2bs4 h ARG 630 N -1.64 0.00 0.27 2.11 0.11 -2.00 -2.40 114.38 110.82 2bs4 h ARG 630 Ca -0.49 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.57 2bs4 h ARG 630 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2bs4 h ARG 630 CO 0.53 0.01 -0.13 0.45 0.10 0.00 0.00 179.97 180.93 2bs4 h HIS 631 N 0.00 -0.33 -0.77 4.08 3.86 -1.99 -1.51 115.15 118.49 2bs4 h HIS 631 Ca -0.00 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 2bs4 h HIS 631 Cb 0.08 0.11 -0.04 0.00 1.06 0.00 0.00 27.41 28.62 2bs4 h HIS 631 CO 0.00 0.03 0.51 0.00 0.86 0.00 0.00 177.93 179.33 2bs4 h ALA 632 N -0.39 1.49 -0.38 2.45 0.00 -1.85 -1.02 119.26 119.56 2bs4 h ALA 632 Ca -0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2bs4 h ALA 632 Cb 0.51 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2bs4 h ALA 632 CO 0.06 0.46 0.10 0.82 0.00 0.00 0.00 179.25 180.69 2bs4 h ILE 633 N 1.00 1.22 -0.02 0.00 2.04 -1.46 -2.30 117.51 117.99 2bs4 h ILE 633 Ca 0.29 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.42 2bs4 h ILE 633 Cb -0.06 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 2bs4 h ILE 633 CO -0.07 0.26 -0.02 -0.61 0.00 0.00 0.00 178.15 177.70 2bs4 h GLN 634 N 0.47 -0.03 -0.63 2.37 -0.00 -0.56 -1.80 115.11 114.93 2bs4 h GLN 634 Ca 0.12 0.00 0.15 0.00 -0.00 0.00 0.00 58.65 58.92 2bs4 h GLN 634 Cb 0.29 0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.74 2bs4 h GLN 634 CO -0.00 -0.02 0.43 0.93 0.00 0.00 0.00 178.83 180.17 2bs4 h GLU 635 N -0.03 0.18 0.00 1.69 5.08 -1.08 -0.32 114.58 120.10 2bs4 h GLU 635 Ca 0.02 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 2bs4 h GLU 635 Cb 0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2bs4 h GLU 635 CO -0.04 0.12 -0.56 0.00 -1.00 0.00 0.00 179.01 177.54 2bs4 h ALA 636 N 1.70 0.65 0.14 3.43 0.00 -0.77 -3.29 119.26 121.12 2bs4 h ALA 636 Ca 0.30 -0.51 -0.35 0.00 0.00 0.00 0.00 54.91 54.36 2bs4 h ALA 636 Cb 0.93 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2bs4 h ALA 636 CO -0.05 0.70 -1.81 -0.07 0.00 0.00 0.00 179.25 178.01 2bs4 h LEU 637 N 0.00 0.47 -5.84 0.00 3.38 -0.31 -3.46 115.31 109.54 2bs4 h LEU 637 Ca -0.01 -0.82 0.04 0.00 0.09 0.00 0.00 57.88 57.18 2bs4 h LEU 637 Cb 1.41 -0.15 -0.19 0.00 0.09 0.00 0.00 40.66 41.81 2bs4 h LEU 637 CO 0.07 1.71 -0.30 -0.32 0.09 0.00 0.00 178.44 179.69 2bs4 s MET 638 N -2.58 0.53 0.11 1.13 0.00 -0.52 -4.60 119.30 113.37 2bs4 s MET 638 Ca -0.17 0.05 -0.31 0.00 0.00 0.00 0.00 55.69 55.27 2bs4 s MET 638 Cb 0.06 0.12 -0.07 0.00 0.00 0.00 0.00 34.83 34.94 2bs4 s MET 638 CO 0.82 -0.83 1.29 -1.25 0.00 0.00 0.00 175.02 175.04 2bs4 s PRO 639 N 2.29 4.39 0.42 4.11 0.04 -1.24 -4.69 135.00 140.32 2bs4 s PRO 639 Ca 0.16 1.93 0.06 0.00 0.04 0.00 0.00 61.00 63.19 2bs4 s PRO 639 Cb -0.04 -3.28 -0.07 0.00 0.04 0.00 0.00 34.50 31.15 2bs4 s PRO 639 CO -0.16 -0.31 0.01 1.52 0.04 0.00 0.00 177.00 178.10 2bs4 s TYR 640 N 0.88 2.42 0.27 0.56 1.13 -1.26 -5.04 117.35 116.31 2bs4 s TYR 640 Ca 0.60 -0.72 0.07 0.00 -1.41 0.00 0.00 57.07 55.62 2bs4 s TYR 640 Cb -0.33 -1.74 -0.03 0.00 -1.10 0.00 0.00 41.96 38.76 2bs4 s TYR 640 CO 0.31 0.40 0.24 -1.21 -2.51 0.00 0.00 175.55 172.78 2bs4 s GLU 641 N -3.74 2.91 -0.28 -3.49 0.41 -1.26 -5.10 118.70 108.15 2bs4 s GLU 641 Ca 0.32 -1.10 -0.21 0.00 -0.41 0.00 0.00 54.97 53.57 2bs4 s GLU 641 Cb 0.09 -2.57 0.11 0.00 -1.78 0.00 0.00 34.13 29.99 2bs4 s GLU 641 CO 0.16 0.32 0.90 -0.51 -0.49 0.00 0.00 175.26 175.64 2bs4 s LEU 642 N -3.90 -0.60 0.50 1.80 1.43 -1.26 -4.76 118.68 111.89 2bs4 s LEU 642 Ca 0.35 1.07 -0.23 0.00 -1.03 0.00 0.00 54.13 54.30 2bs4 s LEU 642 Cb -0.07 2.04 -0.07 0.00 0.03 0.00 0.00 46.19 48.12 2bs4 s LEU 642 CO 0.26 -0.18 1.24 -2.65 0.23 0.00 0.00 176.35 175.25 2bs4 n PRO 643 N 3.01 1.63 -0.33 1.29 -0.02 -1.26 -4.77 135.00 134.55 2bs4 n PRO 643 Ca -0.15 0.59 0.01 0.00 -2.02 0.00 0.00 63.50 61.93 2bs4 n PRO 643 Cb 0.57 -2.40 0.08 0.00 -0.02 0.00 0.00 33.50 31.72 2bs4 n PRO 643 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bs4 h ALA 644 N 1.53 0.34 -1.16 3.55 0.00 -2.01 0.33 119.26 121.86 2bs4 h ALA 644 Ca -0.49 0.30 0.33 0.00 0.00 0.00 0.00 54.91 55.05 2bs4 h ALA 644 Cb 1.31 0.84 -0.07 0.00 0.00 0.00 0.00 17.79 19.87 2bs4 h ALA 644 CO 0.57 -0.52 0.80 -0.22 0.00 0.00 0.00 179.25 179.88 2bs4 h LYS 645 N -0.02 0.13 -0.29 0.00 3.64 -2.03 -1.54 116.57 116.46 2bs4 h LYS 645 Ca 0.38 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.68 2bs4 h LYS 645 Cb 0.63 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 2bs4 h LYS 645 CO -0.93 0.08 -0.01 0.66 -2.27 0.00 0.00 179.45 176.98 2bs4 n TYR 646 N -4.35 0.97 0.15 1.91 4.01 0.10 -4.62 117.16 115.33 2bs4 n TYR 646 Ca 0.26 -1.14 0.04 0.00 -0.16 0.00 0.00 57.90 56.90 2bs4 n TYR 646 Cb 1.15 -0.37 0.06 0.00 -0.31 0.00 0.00 39.34 39.87 2bs4 n TYR 646 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 2bs4 h LYS 647 N 1.40 0.00 -6.80 -0.72 3.64 -1.16 -3.47 116.57 109.47 2bs4 h LYS 647 Ca 0.09 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.91 2bs4 h LYS 647 Cb 1.51 0.00 0.18 0.00 -0.41 0.00 0.00 32.23 33.52 2bs4 h LYS 647 CO 0.28 0.44 -0.16 0.00 -2.27 0.00 0.00 179.45 177.74 2bs4 n ALA 648 N -2.21 -0.92 -1.97 5.00 0.00 -1.26 -5.00 120.51 114.14 2bs4 n ALA 648 Ca 0.02 -0.22 -0.29 0.00 0.00 0.00 0.00 53.44 52.95 2bs4 n ALA 648 Cb 0.70 -1.98 0.04 0.00 0.00 0.00 0.00 19.45 18.21 2bs4 n ALA 648 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2bs4 s ARG 649 N -3.06 2.89 -0.44 0.00 0.52 -1.26 -5.03 118.95 112.57 2bs4 s ARG 649 Ca 0.69 0.27 -0.14 0.00 -0.52 0.00 0.00 55.73 56.03 2bs4 s ARG 649 Cb -0.34 -2.13 0.05 0.00 0.52 0.00 0.00 34.95 33.05 2bs4 s ARG 649 CO 0.55 -0.89 0.33 -0.80 0.02 0.00 0.00 175.30 174.50 2bs4 s ASN 650 N -4.34 6.06 0.40 0.23 0.01 -1.26 -5.05 114.94 111.00 2bs4 s ASN 650 Ca 0.56 -1.16 -0.26 0.00 -0.71 0.00 0.00 52.86 51.29 2bs4 s ASN 650 Cb -0.11 -2.14 -0.10 0.00 0.41 0.00 0.00 41.25 39.31 2bs4 s ASN 650 CO 0.49 -0.54 1.37 1.21 -1.51 0.00 0.00 177.10 178.11 2bs4 n GLU 651 N 5.15 2.22 -4.21 -0.60 2.13 -1.26 -5.00 120.64 119.07 2bs4 n GLU 651 Ca -0.12 0.79 -0.12 0.00 0.66 0.00 0.00 57.16 58.37 2bs4 n GLU 651 Cb 0.45 -2.50 -0.10 0.00 0.27 0.00 0.00 31.44 29.56 2bs4 n GLU 651 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2bs4 s ARG 652 N -2.18 1.02 -0.02 5.31 0.52 -1.26 -5.09 118.95 117.25 2bs4 s ARG 652 Ca 0.58 -1.48 -0.30 0.00 -0.52 0.00 0.00 55.73 54.01 2bs4 s ARG 652 Cb -0.50 -0.15 -0.05 0.00 0.52 0.00 0.00 34.95 34.77 2bs4 s ARG 652 CO 0.60 -0.13 1.46 -1.17 0.02 0.00 0.00 175.30 176.07 2bs4 s LEU 653 N -3.12 4.31 0.00 2.53 2.96 -1.26 -3.29 118.68 120.80 2bs4 s LEU 653 Ca 0.21 2.13 0.00 0.00 -0.22 0.00 0.00 54.13 56.26 2bs4 s LEU 653 Cb 0.06 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.20 2bs4 s LEU 653 CO 0.02 -0.77 0.00 0.61 -1.32 0.00 0.00 176.35 174.88 2bs4 n GLY 654 N 3.76 0.59 3.02 7.98 0.00 -1.26 -4.99 105.19 114.30 2bs4 n GLY 654 Ca 0.14 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 2bs4 n GLY 654 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bs4 s ASP 655 N -2.03 4.68 0.00 1.61 1.11 -1.21 -5.14 116.67 115.69 2bs4 s ASP 655 Ca 0.00 -1.97 0.00 0.00 0.18 0.00 0.00 52.55 50.76 2bs4 s ASP 655 Cb 0.00 -1.59 0.00 0.00 1.07 0.00 0.00 42.92 42.40 2bs4 s ASP 655 CO 0.00 -0.34 0.00 2.29 1.18 0.00 0.00 175.17 178.30