#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bt3 s SER 10 N 0.00 6.63 0.00 0.00 0.15 -1.26 -4.88 113.70 114.34 2bt3 s SER 10 Ca 0.00 2.64 0.12 0.00 0.70 0.00 0.00 55.95 59.41 2bt3 s SER 10 Cb 0.00 -2.61 0.55 0.00 -1.71 0.00 0.00 66.02 62.25 2bt3 s SER 10 CO 0.00 -0.74 1.34 -0.81 1.20 0.00 0.00 173.24 174.22 2bt3 n PRO 11 N 2.92 0.08 -0.35 5.44 -0.04 -1.26 -2.16 135.00 139.62 2bt3 n PRO 11 Ca 0.09 0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.91 2bt3 n PRO 11 Cb 0.40 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.67 2bt3 n PRO 11 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2bt3 n PHE 12 N -1.40 0.92 -1.62 0.54 3.72 -1.26 -4.77 117.46 113.59 2bt3 n PHE 12 Ca 0.04 -0.46 -0.35 0.00 -0.05 0.00 0.00 57.45 56.63 2bt3 n PHE 12 Cb 0.12 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.73 2bt3 n PHE 12 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2bt3 s ARG 13 N -1.08 2.40 0.63 -1.08 1.70 -0.92 -4.75 118.95 115.86 2bt3 s ARG 13 Ca 0.47 1.85 -0.18 0.00 -0.47 0.00 0.00 55.73 57.40 2bt3 s ARG 13 Cb 0.25 -1.85 -0.03 0.00 -0.57 0.00 0.00 34.95 32.74 2bt3 s ARG 13 CO 0.33 -1.65 1.14 1.28 -1.08 0.00 0.00 175.30 175.31 2bt3 n LEU 14 N -2.30 4.95 -4.76 -1.89 4.77 -1.26 -4.95 117.00 111.56 2bt3 n LEU 14 Ca 0.14 0.82 -0.41 0.00 -0.03 0.00 0.00 56.01 56.53 2bt3 n LEU 14 Cb 0.50 -1.48 -0.01 0.00 -2.33 0.00 0.00 43.42 40.09 2bt3 n LEU 14 CO 0.47 -1.40 1.19 0.00 -1.33 0.00 0.00 177.39 176.32 2bt3 s ALA 15 N -1.45 3.69 0.30 -1.18 0.00 -1.26 -5.02 121.76 116.85 2bt3 s ALA 15 Ca 0.79 1.52 0.03 0.00 0.00 0.00 0.00 51.96 54.30 2bt3 s ALA 15 Cb -0.40 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.08 2bt3 s ALA 15 CO 0.43 -0.94 0.47 -1.54 0.00 0.00 0.00 175.76 174.18 2bt3 s SER 16 N 0.32 6.26 0.23 0.00 1.04 -1.26 -4.32 113.70 115.97 2bt3 s SER 16 Ca 0.60 0.23 -0.06 0.00 0.48 0.00 0.00 55.95 57.20 2bt3 s SER 16 Cb -0.46 -1.88 0.37 0.00 0.10 0.00 0.00 66.02 64.14 2bt3 s SER 16 CO 0.50 -0.22 1.77 0.00 0.98 0.00 0.00 173.24 176.27 2bt3 h ALA 17 N 0.93 1.02 -0.68 5.32 0.00 -1.95 -1.88 119.26 122.02 2bt3 h ALA 17 Ca -0.50 0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.54 2bt3 h ALA 17 Cb 1.23 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 2bt3 h ALA 17 CO 0.60 -0.06 0.35 0.78 0.00 0.00 0.00 179.25 180.92 2bt3 h GLY 18 N 0.60 1.00 1.05 0.00 0.00 -1.98 -0.96 103.07 102.77 2bt3 h GLY 18 Ca 0.37 -0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 2bt3 h GLY 18 CO -0.29 0.09 0.31 0.83 0.00 0.00 0.00 176.54 177.48 2bt3 h GLU 19 N 0.61 1.18 -0.24 4.80 5.08 -1.75 -0.61 114.58 123.65 2bt3 h GLU 19 Ca 0.32 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2bt3 h GLU 19 Cb 0.28 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2bt3 h GLU 19 CO -0.23 0.96 -0.07 0.82 -1.00 0.00 0.00 179.01 179.49 2bt3 h ILE 20 N 1.14 1.29 -0.19 3.13 2.04 -1.09 -0.51 117.51 123.33 2bt3 h ILE 20 Ca 0.26 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 2bt3 h ILE 20 Cb 0.23 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 2bt3 h ILE 20 CO -0.02 0.34 0.04 0.28 0.00 0.00 0.00 178.15 178.78 2bt3 h SER 21 N 0.21 0.23 -0.09 1.72 0.02 -1.08 -1.34 113.55 113.22 2bt3 h SER 21 Ca 0.06 -0.02 -0.18 0.00 -0.84 0.00 0.00 61.79 60.81 2bt3 h SER 21 Cb 0.54 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 2bt3 h SER 21 CO 0.03 0.25 -0.58 -0.08 -1.14 0.00 0.00 176.83 175.31 2bt3 h GLU 22 N 0.26 0.69 -0.45 3.45 4.57 -0.78 -1.11 114.58 121.20 2bt3 h GLU 22 Ca 0.06 -0.45 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 2bt3 h GLU 22 Cb 0.12 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2bt3 h GLU 22 CO -0.00 1.07 0.29 0.28 -1.18 0.00 0.00 179.01 179.47 2bt3 h VAL 23 N 0.52 1.13 -0.39 0.32 2.07 -0.56 0.09 116.25 119.43 2bt3 h VAL 23 Ca 0.00 -0.26 0.08 0.00 0.82 0.00 0.00 66.70 67.34 2bt3 h VAL 23 Cb 1.16 0.49 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 2bt3 h VAL 23 CO 0.12 0.13 -0.08 -0.61 0.02 0.00 0.00 177.57 177.15 2bt3 h GLN 24 N 0.61 0.02 -0.58 1.57 4.15 -1.09 -0.28 115.11 119.50 2bt3 h GLN 24 Ca 0.16 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.54 2bt3 h GLN 24 Cb -0.04 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 2bt3 h GLN 24 CO -0.03 0.01 0.21 0.78 -1.93 0.00 0.00 178.83 177.87 2bt3 h GLY 25 N 0.02 0.95 0.99 2.39 0.00 -0.67 -0.67 103.07 106.08 2bt3 h GLY 25 Ca 0.19 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 2bt3 h GLY 25 CO -0.39 0.51 0.17 -2.22 0.00 0.00 0.00 176.54 174.61 2bt3 h ILE 26 N 0.81 1.24 -0.57 2.60 2.04 -0.70 -0.10 117.51 122.83 2bt3 h ILE 26 Ca 0.19 -0.81 -0.08 0.00 1.00 0.00 0.00 64.86 65.16 2bt3 h ILE 26 Cb 0.24 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2bt3 h ILE 26 CO -0.01 0.30 0.02 -0.07 0.00 0.00 0.00 178.15 178.39 2bt3 h LEU 27 N 0.77 0.96 0.13 1.44 3.38 -0.81 -1.54 115.31 119.64 2bt3 h LEU 27 Ca 0.18 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2bt3 h LEU 27 Cb 0.29 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2bt3 h LEU 27 CO -0.00 1.02 -0.06 0.03 0.09 0.00 0.00 178.44 179.52 2bt3 h ARG 28 N 0.88 -0.16 -0.62 1.13 3.08 -0.88 -0.70 114.38 117.09 2bt3 h ARG 28 Ca 0.16 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.30 2bt3 h ARG 28 Cb 0.51 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 2bt3 h ARG 28 CO 0.02 -0.02 0.41 1.15 -1.07 0.00 0.00 179.97 180.46 2bt3 h THR 29 N -0.27 0.97 -0.00 2.04 2.02 -0.89 -1.41 112.91 115.37 2bt3 h THR 29 Ca -0.02 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2bt3 h THR 29 Cb 0.22 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2bt3 h THR 29 CO 0.03 0.10 -0.04 0.00 0.37 0.00 0.00 175.52 175.99 2bt3 n ALA 30 N -2.48 2.67 -0.94 6.16 0.00 -0.59 -4.91 120.51 120.41 2bt3 n ALA 30 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2bt3 n ALA 30 Cb 0.27 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2bt3 n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bt3 n GLY 31 N 1.16 0.43 0.75 0.00 0.00 -0.53 -4.94 105.19 102.05 2bt3 n GLY 31 Ca 0.19 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.42 2bt3 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bt3 n LEU 32 N 0.00 2.56 -2.82 0.99 4.77 -0.31 -4.65 117.00 117.55 2bt3 n LEU 32 Ca 0.00 -1.03 -0.11 0.00 -0.03 0.00 0.00 56.01 54.84 2bt3 n LEU 32 Cb 0.00 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2bt3 n LEU 32 CO 0.00 0.45 -0.05 -0.11 -1.33 0.00 0.00 177.39 176.35 2bt3 n LEU 33 N 1.04 0.67 0.00 2.23 7.94 -1.22 -4.92 117.00 122.74 2bt3 n LEU 33 Ca 0.11 -4.05 -0.25 0.00 -1.11 0.00 0.00 56.01 50.70 2bt3 n LEU 33 Cb 0.46 0.50 0.22 0.00 0.53 0.00 0.00 43.42 45.13 2bt3 n LEU 33 CO 0.12 1.84 0.48 0.61 -1.11 0.00 0.00 177.39 179.32 2bt3 n GLY 34 N 0.00 -2.90 0.30 -3.96 0.00 -1.26 -4.75 105.19 92.63 2bt3 n GLY 34 Ca 0.12 -1.46 0.19 0.00 0.00 0.00 0.00 46.02 44.87 2bt3 n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bt3 h PRO 35 N 0.00 0.00 -0.01 1.61 0.13 -2.01 -1.89 132.00 129.83 2bt3 h PRO 35 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2bt3 h PRO 35 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2bt3 h PRO 35 CO 0.22 0.03 -0.00 0.39 -0.23 0.00 0.00 178.00 178.40 2bt3 n GLU 36 N -3.23 1.61 -3.53 0.86 -0.58 -1.26 -4.92 120.64 109.58 2bt3 n GLU 36 Ca -0.02 -0.89 -0.34 0.00 -0.42 0.00 0.00 57.16 55.48 2bt3 n GLU 36 Cb 0.18 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.51 2bt3 n GLU 36 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2bt3 s LYS 37 N -2.01 3.80 -0.02 3.49 -0.14 -0.71 -1.22 119.74 122.92 2bt3 s LYS 37 Ca 0.38 0.23 0.02 0.00 -1.36 0.00 0.00 55.97 55.24 2bt3 s LYS 37 Cb 0.21 -2.96 0.01 0.00 -1.68 0.00 0.00 37.83 33.40 2bt3 s LYS 37 CO 0.34 0.53 -0.05 1.03 -0.76 0.00 0.00 175.35 176.44 2bt3 s ARG 38 N -1.99 0.61 -0.36 1.68 1.81 0.72 -4.83 118.95 116.60 2bt3 s ARG 38 Ca 0.35 -0.17 -0.26 0.00 -1.72 0.00 0.00 55.73 53.92 2bt3 s ARG 38 Cb -0.14 -0.62 0.01 0.00 -0.45 0.00 0.00 34.95 33.76 2bt3 s ARG 38 CO 0.19 0.05 0.95 0.42 -0.68 0.00 0.00 175.30 176.23 2bt3 s ILE 39 N 0.27 4.58 -0.10 1.52 1.01 0.17 -0.00 121.20 128.64 2bt3 s ILE 39 Ca -0.03 1.30 0.15 0.00 0.00 0.00 0.00 60.65 62.07 2bt3 s ILE 39 Cb -0.07 -4.34 -0.14 0.00 0.01 0.00 0.00 42.46 37.91 2bt3 s ILE 39 CO -0.00 -0.51 0.85 0.00 0.00 0.00 0.00 174.94 175.27 2bt3 h ALA 40 N 8.39 0.67 -2.59 9.38 0.00 -1.42 -3.40 119.26 130.30 2bt3 h ALA 40 Ca -0.23 -0.95 -0.11 0.00 0.00 0.00 0.00 54.91 53.62 2bt3 h ALA 40 Cb 1.08 0.29 -0.23 0.00 0.00 0.00 0.00 17.79 18.92 2bt3 h ALA 40 CO 0.99 1.05 -0.17 -0.47 0.00 0.00 0.00 179.25 180.65 2bt3 s TYR 41 N -2.85 -0.48 -0.15 0.00 5.04 -1.18 -4.78 117.35 112.94 2bt3 s TYR 41 Ca -0.03 1.15 -0.08 0.00 -2.44 0.00 0.00 57.07 55.67 2bt3 s TYR 41 Cb 0.08 0.18 0.06 0.00 0.35 0.00 0.00 41.96 42.63 2bt3 s TYR 41 CO 0.81 -0.27 0.36 -1.17 -1.34 0.00 0.00 175.55 173.94 2bt3 s LEU 42 N 0.05 -0.02 0.01 6.97 0.20 -1.26 -1.01 118.68 123.63 2bt3 s LEU 42 Ca -0.02 0.79 -0.23 0.00 0.69 0.00 0.00 54.13 55.36 2bt3 s LEU 42 Cb -0.03 1.15 0.05 0.00 -0.43 0.00 0.00 46.19 46.93 2bt3 s LEU 42 CO 0.01 -0.19 0.52 -0.83 -0.29 0.00 0.00 176.35 175.57 2bt3 s GLY 43 N 1.52 -0.41 0.37 7.98 0.00 -0.53 -4.58 107.32 111.68 2bt3 s GLY 43 Ca -0.08 0.72 -0.26 0.00 0.00 0.00 0.00 44.72 45.09 2bt3 s GLY 43 CO -0.11 0.42 1.13 0.54 0.00 0.00 0.00 173.10 175.07 2bt3 s VAL 44 N -1.96 3.35 0.20 1.40 0.11 -1.26 -0.37 120.40 121.88 2bt3 s VAL 44 Ca -0.08 1.17 -0.09 0.00 -2.93 0.00 0.00 61.98 60.05 2bt3 s VAL 44 Cb -0.01 -3.67 -0.07 0.00 -1.53 0.00 0.00 36.38 31.10 2bt3 s VAL 44 CO 0.02 0.13 0.52 -0.76 -3.33 0.00 0.00 175.10 171.68 2bt3 s LEU 45 N -2.27 4.20 0.54 2.54 1.43 0.12 -4.85 118.68 120.40 2bt3 s LEU 45 Ca 0.54 0.87 -0.18 0.00 -1.03 0.00 0.00 54.13 54.33 2bt3 s LEU 45 Cb -0.29 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.30 2bt3 s LEU 45 CO 0.37 -0.03 1.06 -1.81 0.23 0.00 0.00 176.35 176.17 2bt3 s ASP 46 N -2.30 5.99 0.55 2.29 1.01 -1.26 -4.62 116.67 118.33 2bt3 s ASP 46 Ca 0.45 1.93 -0.22 0.00 0.71 0.00 0.00 52.55 55.42 2bt3 s ASP 46 Cb -0.12 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.21 2bt3 s ASP 46 CO 0.21 -1.02 1.34 -2.65 0.21 0.00 0.00 175.17 173.26 2bt3 n PRO 47 N -1.47 1.65 -1.36 8.23 -0.02 -1.26 -4.98 135.00 135.80 2bt3 n PRO 47 Ca 0.09 0.61 -0.32 0.00 -2.02 0.00 0.00 63.50 61.86 2bt3 n PRO 47 Cb 0.52 -2.55 0.09 0.00 -0.02 0.00 0.00 33.50 31.54 2bt3 n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bt3 s ALA 48 N -1.29 2.16 0.16 3.55 0.00 -1.26 -4.94 121.76 120.14 2bt3 s ALA 48 Ca 0.72 0.54 -0.33 0.00 0.00 0.00 0.00 51.96 52.89 2bt3 s ALA 48 Cb -0.42 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 19.21 2bt3 s ALA 48 CO 0.49 -1.80 1.67 0.54 0.00 0.00 0.00 175.76 176.66 2bt3 n ARG 49 N -3.12 2.43 -1.03 0.00 5.12 -1.26 -2.13 116.66 116.67 2bt3 n ARG 49 Ca 0.11 0.88 -0.01 0.00 -1.93 0.00 0.00 57.85 56.90 2bt3 n ARG 49 Cb 0.52 -2.69 -0.00 0.00 -1.16 0.00 0.00 32.46 29.12 2bt3 n ARG 49 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2bt3 n GLY 50 N 3.73 0.48 0.08 -0.13 0.00 -1.26 -4.93 105.19 103.16 2bt3 n GLY 50 Ca 0.17 -0.87 0.12 0.00 0.00 0.00 0.00 46.02 45.44 2bt3 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt3 n ALA 51 N 1.02 2.71 -0.28 4.61 0.00 -0.91 -4.05 120.51 123.61 2bt3 n ALA 51 Ca -0.01 -0.17 0.06 0.00 0.00 0.00 0.00 53.44 53.32 2bt3 n ALA 51 Cb 0.04 -1.28 0.28 0.00 0.00 0.00 0.00 19.45 18.50 2bt3 n ALA 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2bt3 h GLY 52 N 4.53 1.26 1.09 0.00 0.00 -1.92 -2.43 103.07 105.60 2bt3 h GLY 52 Ca 0.00 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 2bt3 h GLY 52 CO 0.00 0.24 -0.04 0.23 0.00 0.00 0.00 176.54 176.97 2bt3 h SER 53 N 0.92 1.05 -4.28 0.19 0.87 -2.00 -3.44 113.55 106.85 2bt3 h SER 53 Ca 0.39 -0.32 -0.49 0.00 -1.23 0.00 0.00 61.79 60.14 2bt3 h SER 53 Cb 0.31 -0.28 0.07 0.00 -0.44 0.00 0.00 62.40 62.06 2bt3 h SER 53 CO -0.16 1.12 0.36 -1.61 -0.53 0.00 0.00 176.83 176.01 2bt3 s GLU 54 N -4.96 2.94 0.67 2.24 0.41 -0.91 -5.04 118.70 114.04 2bt3 s GLU 54 Ca -0.12 0.38 -0.16 0.00 -0.41 0.00 0.00 54.97 54.66 2bt3 s GLU 54 Cb 0.13 -2.08 0.01 0.00 -1.78 0.00 0.00 34.13 30.41 2bt3 s GLU 54 CO 0.86 -0.92 1.19 0.00 -0.49 0.00 0.00 175.26 175.91 2bt3 s ALA 55 N -3.26 2.33 0.42 5.21 0.00 -1.26 -4.96 121.76 120.24 2bt3 s ALA 55 Ca 0.57 0.87 -0.24 0.00 0.00 0.00 0.00 51.96 53.16 2bt3 s ALA 55 Cb -0.11 -3.44 -0.08 0.00 0.00 0.00 0.00 23.12 19.49 2bt3 s ALA 55 CO 0.50 -1.53 1.11 -1.83 0.00 0.00 0.00 175.76 174.01 2bt3 s GLU 56 N -3.74 4.00 -0.28 0.00 -1.05 -1.26 -5.02 118.70 111.36 2bt3 s GLU 56 Ca 0.74 1.65 -0.02 0.00 -0.15 0.00 0.00 54.97 57.18 2bt3 s GLU 56 Cb -0.28 -2.51 0.09 0.00 -0.44 0.00 0.00 34.13 30.99 2bt3 s GLU 56 CO 0.40 -0.31 0.10 0.34 0.95 0.00 0.00 175.26 176.73 2bt3 s ASP 57 N -1.44 3.60 -0.36 0.83 2.15 -1.26 -5.00 116.67 115.18 2bt3 s ASP 57 Ca 0.60 -1.33 -0.29 0.00 0.43 0.00 0.00 52.55 51.96 2bt3 s ASP 57 Cb -0.25 -0.63 0.02 0.00 -0.30 0.00 0.00 42.92 41.76 2bt3 s ASP 57 CO 0.31 -0.40 1.11 -0.13 -0.17 0.00 0.00 175.17 175.89 2bt3 s ARG 58 N 1.84 3.96 0.02 4.34 1.81 -1.26 -4.94 118.95 124.72 2bt3 s ARG 58 Ca 0.07 0.94 0.07 0.00 -1.72 0.00 0.00 55.73 55.09 2bt3 s ARG 58 Cb -0.17 -3.79 -0.03 0.00 -0.45 0.00 0.00 34.95 30.51 2bt3 s ARG 58 CO -0.25 -1.05 -0.20 1.03 -0.68 0.00 0.00 175.30 174.15 2bt3 s ARG 59 N 3.91 2.08 -0.00 3.54 0.52 -1.26 -1.27 118.95 126.47 2bt3 s ARG 59 Ca 0.47 -0.96 0.07 0.00 -0.52 0.00 0.00 55.73 54.78 2bt3 s ARG 59 Cb -0.11 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.19 2bt3 s ARG 59 CO 0.20 0.55 -0.21 -0.06 0.02 0.00 0.00 175.30 175.81 2bt3 s PHE 60 N -0.83 1.85 -0.11 -0.53 0.40 0.03 0.11 117.98 118.90 2bt3 s PHE 60 Ca 0.13 -0.35 -0.03 0.00 -0.60 0.00 0.00 56.93 56.08 2bt3 s PHE 60 Cb -0.10 -1.18 -0.03 0.00 0.51 0.00 0.00 43.02 42.22 2bt3 s PHE 60 CO 0.03 -0.01 -0.01 0.50 0.70 0.00 0.00 175.22 176.44 2bt3 s ARG 61 N -0.62 3.19 -0.02 0.44 3.52 0.51 -0.80 118.95 125.17 2bt3 s ARG 61 Ca 0.08 -0.43 0.01 0.00 -0.13 0.00 0.00 55.73 55.26 2bt3 s ARG 61 Cb -0.08 -2.84 0.01 0.00 -1.56 0.00 0.00 34.95 30.48 2bt3 s ARG 61 CO -0.00 0.57 -0.02 0.08 -0.81 0.00 0.00 175.30 175.12 2bt3 s VAL 62 N -0.53 0.30 -0.26 7.11 1.01 0.43 -1.45 120.40 127.01 2bt3 s VAL 62 Ca 0.09 -0.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 2bt3 s VAL 62 Cb -0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 2bt3 s VAL 62 CO 0.02 0.14 0.09 -0.36 0.00 0.00 0.00 175.10 174.99 2bt3 s PHE 63 N 0.56 3.11 -0.24 5.22 0.08 -0.18 -0.85 117.98 125.67 2bt3 s PHE 63 Ca -0.06 -0.43 -0.05 0.00 0.12 0.00 0.00 56.93 56.51 2bt3 s PHE 63 Cb -0.09 -2.26 -0.01 0.00 -0.57 0.00 0.00 43.02 40.09 2bt3 s PHE 63 CO -0.01 -0.37 -0.00 0.42 -0.10 0.00 0.00 175.22 175.16 2bt3 s ILE 64 N 1.62 3.66 0.29 0.64 1.01 0.03 -1.07 121.20 127.38 2bt3 s ILE 64 Ca 0.06 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 2bt3 s ILE 64 Cb -0.15 -2.71 -0.05 0.00 0.01 0.00 0.00 42.46 39.56 2bt3 s ILE 64 CO 0.04 0.36 0.54 -2.28 0.00 0.00 0.00 174.94 173.60 2bt3 s HIS 65 N 1.51 3.48 -0.16 3.97 5.65 0.99 -1.20 115.29 129.54 2bt3 s HIS 65 Ca 0.05 0.60 -0.00 0.00 0.25 0.00 0.00 55.06 55.96 2bt3 s HIS 65 Cb -0.15 -2.07 0.03 0.00 -1.18 0.00 0.00 32.58 29.21 2bt3 s HIS 65 CO -0.01 0.18 -0.09 0.34 -0.65 0.00 0.00 174.74 174.51 2bt3 s ASP 66 N -3.23 2.75 0.14 9.88 -1.08 -1.26 -0.20 116.67 123.66 2bt3 s ASP 66 Ca 0.43 -0.58 0.23 0.00 -0.52 0.00 0.00 52.55 52.12 2bt3 s ASP 66 Cb -0.11 -1.02 0.91 0.00 -1.46 0.00 0.00 42.92 41.24 2bt3 s ASP 66 CO 0.30 -0.13 1.72 1.33 0.52 0.00 0.00 175.17 178.91 2bt3 n VAL 67 N 4.83 0.63 1.32 1.11 0.24 -0.36 -2.87 118.33 123.24 2bt3 n VAL 67 Ca -0.14 0.05 0.14 0.00 -2.04 0.00 0.00 64.34 62.35 2bt3 n VAL 67 Cb 0.49 -0.84 0.55 0.00 -1.47 0.00 0.00 33.84 32.57 2bt3 n VAL 67 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2bt3 n SER 68 N -1.93 0.53 0.00 -1.34 3.41 -1.26 -4.92 113.62 108.10 2bt3 n SER 68 Ca 0.04 -0.52 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 2bt3 n SER 68 Cb 0.29 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 2bt3 n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bt3 n GLY 69 N 1.32 0.62 3.76 5.00 0.00 -1.14 -5.09 105.19 109.66 2bt3 n GLY 69 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2bt3 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt3 s ALA 70 N -2.00 1.96 0.41 4.61 0.00 -1.26 -4.98 121.76 120.50 2bt3 s ALA 70 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 51.96 51.71 2bt3 s ALA 70 Cb 0.00 -3.19 -0.08 0.00 0.00 0.00 0.00 23.12 19.84 2bt3 s ALA 70 CO 0.00 -1.99 1.21 1.03 0.00 0.00 0.00 175.76 176.01 2bt3 s ARG 71 N -4.98 3.97 0.82 0.00 0.52 -1.26 -4.46 118.95 113.56 2bt3 s ARG 71 Ca 0.62 1.93 -0.12 0.00 -0.52 0.00 0.00 55.73 57.64 2bt3 s ARG 71 Cb -0.17 -2.66 0.08 0.00 0.52 0.00 0.00 34.95 32.73 2bt3 s ARG 71 CO 0.56 -0.42 1.13 -1.25 0.02 0.00 0.00 175.30 175.34 2bt3 s PRO 72 N -2.34 1.89 0.06 3.54 0.04 -1.26 -4.76 135.00 132.17 2bt3 s PRO 72 Ca 0.58 0.39 0.06 0.00 0.04 0.00 0.00 61.00 62.07 2bt3 s PRO 72 Cb -0.33 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 2bt3 s PRO 72 CO 0.41 -1.70 -0.16 -0.65 0.04 0.00 0.00 177.00 174.94 2bt3 s GLN 73 N -5.32 1.01 -0.21 4.56 -0.21 -0.34 -1.02 119.66 118.13 2bt3 s GLN 73 Ca 0.62 -0.90 -0.07 0.00 0.02 0.00 0.00 55.36 55.02 2bt3 s GLN 73 Cb -0.13 -1.08 -0.04 0.00 1.00 0.00 0.00 33.01 32.76 2bt3 s GLN 73 CO 0.52 0.26 0.06 -2.00 -2.12 0.00 0.00 175.29 172.02 2bt3 s GLU 74 N -1.42 3.85 -0.02 2.91 2.12 -0.32 -0.79 118.70 125.03 2bt3 s GLU 74 Ca 0.02 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 54.98 2bt3 s GLU 74 Cb -0.09 -3.25 -0.00 0.00 0.26 0.00 0.00 34.13 31.05 2bt3 s GLU 74 CO 0.02 0.10 -0.10 0.08 -0.54 0.00 0.00 175.26 174.82 2bt3 s VAL 75 N 0.84 0.86 -0.12 3.70 1.01 -0.03 -1.22 120.40 125.44 2bt3 s VAL 75 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2bt3 s VAL 75 Cb -0.14 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 2bt3 s VAL 75 CO 0.02 0.26 -0.13 -0.89 0.00 0.00 0.00 175.10 174.36 2bt3 s THR 76 N -0.04 3.09 -0.03 3.92 2.01 -0.29 -0.43 115.64 123.87 2bt3 s THR 76 Ca 0.00 -0.66 0.07 0.00 0.31 0.00 0.00 61.69 61.42 2bt3 s THR 76 Cb -0.07 -2.29 -0.02 0.00 0.01 0.00 0.00 72.50 70.14 2bt3 s THR 76 CO 0.00 0.53 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.52 2bt3 s VAL 77 N 0.21 2.08 -0.51 3.82 1.01 0.02 -0.59 120.40 126.44 2bt3 s VAL 77 Ca -0.08 -1.09 -0.20 0.00 0.00 0.00 0.00 61.98 60.62 2bt3 s VAL 77 Cb -0.15 -1.73 0.05 0.00 0.00 0.00 0.00 36.38 34.56 2bt3 s VAL 77 CO 0.05 0.58 0.66 -0.55 0.00 0.00 0.00 175.10 175.84 2bt3 s SER 78 N -0.45 6.24 0.27 3.32 0.15 -0.09 -0.79 113.70 122.35 2bt3 s SER 78 Ca 0.05 -0.83 0.11 0.00 0.70 0.00 0.00 55.95 55.98 2bt3 s SER 78 Cb -0.11 -2.31 0.34 0.00 -1.71 0.00 0.00 66.02 62.23 2bt3 s SER 78 CO 0.01 -0.92 1.60 -0.37 1.20 0.00 0.00 173.24 174.75 2bt3 h VAL 79 N 5.88 1.43 -0.17 4.45 -1.51 -1.46 0.42 116.25 125.29 2bt3 h VAL 79 Ca -0.27 -2.16 0.02 0.00 -1.23 0.00 0.00 66.70 63.05 2bt3 h VAL 79 Cb 1.09 2.17 -0.02 0.00 -2.13 0.00 0.00 31.29 32.41 2bt3 h VAL 79 CO 0.98 0.61 0.06 0.74 -1.23 0.00 0.00 177.57 178.73 2bt3 h THR 80 N 0.00 0.96 -0.01 7.19 2.02 -1.92 -3.21 112.91 117.94 2bt3 h THR 80 Ca -0.01 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2bt3 h THR 80 Cb 1.12 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2bt3 h THR 80 CO 0.08 0.03 -0.44 0.59 0.37 0.00 0.00 175.52 176.15 2bt3 n ASN 81 N -5.05 1.39 -2.30 4.18 3.02 -1.14 -4.97 115.26 110.39 2bt3 n ASN 81 Ca -0.03 -1.10 -0.16 0.00 -0.03 0.00 0.00 54.58 53.25 2bt3 n ASN 81 Cb 0.06 0.37 0.03 0.00 -0.61 0.00 0.00 39.78 39.63 2bt3 n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bt3 n GLY 82 N 1.40 -0.20 3.35 7.41 0.00 0.09 -5.03 105.19 112.22 2bt3 n GLY 82 Ca 0.10 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 2bt3 n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bt3 s THR 83 N -3.02 1.85 -0.31 2.61 -4.23 -0.91 -4.95 115.64 106.68 2bt3 s THR 83 Ca 0.23 -2.09 -0.21 0.00 -1.18 0.00 0.00 61.69 58.44 2bt3 s THR 83 Cb -0.10 -1.97 -0.01 0.00 1.34 0.00 0.00 72.50 71.76 2bt3 s THR 83 CO 0.29 -0.45 0.68 -0.69 -0.54 0.00 0.00 174.62 173.92 2bt3 s VAL 84 N -2.49 4.89 -0.05 2.29 1.01 -1.26 -0.92 120.40 123.86 2bt3 s VAL 84 Ca 0.20 0.97 -0.27 0.00 0.00 0.00 0.00 61.98 62.88 2bt3 s VAL 84 Cb -0.04 -4.05 -0.22 0.00 0.00 0.00 0.00 36.38 32.07 2bt3 s VAL 84 CO 0.08 -0.18 1.14 0.40 0.00 0.00 0.00 175.10 176.53 2bt3 h ILE 85 N 5.56 1.50 -2.76 2.22 1.08 -1.18 -3.48 117.51 120.45 2bt3 h ILE 85 Ca -0.26 -1.47 -0.10 0.00 -0.39 0.00 0.00 64.86 62.64 2bt3 h ILE 85 Cb 1.11 2.50 -0.20 0.00 -3.07 0.00 0.00 36.82 37.16 2bt3 h ILE 85 CO 0.83 0.38 -0.15 -0.94 -0.69 0.00 0.00 178.15 177.58 2bt3 s SER 86 N -5.83 -0.32 -0.14 1.72 1.04 -1.07 -4.99 113.70 104.11 2bt3 s SER 86 Ca -0.17 0.26 -0.06 0.00 0.48 0.00 0.00 55.95 56.47 2bt3 s SER 86 Cb 0.00 0.38 0.07 0.00 0.10 0.00 0.00 66.02 66.57 2bt3 s SER 86 CO 0.68 -0.49 0.30 0.00 0.98 0.00 0.00 173.24 174.71 2bt3 s ALA 87 N -1.28 -0.72 -0.02 5.32 0.00 -1.26 -1.13 121.76 122.67 2bt3 s ALA 87 Ca -0.13 1.11 0.02 0.00 0.00 0.00 0.00 51.96 52.96 2bt3 s ALA 87 Cb -0.04 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.09 2bt3 s ALA 87 CO 0.06 -0.54 -0.05 0.54 0.00 0.00 0.00 175.76 175.76 2bt3 s VAL 88 N 2.14 0.49 0.14 0.00 0.11 -0.36 -4.99 120.40 117.93 2bt3 s VAL 88 Ca -0.02 -0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 58.54 2bt3 s VAL 88 Cb -0.11 -0.47 -0.07 0.00 -1.53 0.00 0.00 36.38 34.21 2bt3 s VAL 88 CO -0.10 0.17 1.04 -1.61 -3.33 0.00 0.00 175.10 171.27 2bt3 s GLU 89 N 0.33 4.63 -0.11 1.54 2.02 -1.26 -1.18 118.70 124.68 2bt3 s GLU 89 Ca -0.04 1.59 -0.09 0.00 0.02 0.00 0.00 54.97 56.45 2bt3 s GLU 89 Cb -0.08 -3.33 -0.04 0.00 0.10 0.00 0.00 34.13 30.77 2bt3 s GLU 89 CO -0.00 0.12 0.19 -0.51 0.02 0.00 0.00 175.26 175.08 2bt3 s LEU 90 N -0.08 4.38 -0.64 1.80 1.43 -0.19 -4.94 118.68 120.44 2bt3 s LEU 90 Ca 0.49 0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 53.96 2bt3 s LEU 90 Cb -0.26 -2.17 0.16 0.00 0.03 0.00 0.00 46.19 43.95 2bt3 s LEU 90 CO 0.32 0.36 0.59 -0.62 0.23 0.00 0.00 176.35 177.22 2bt3 s ASP 91 N -0.81 6.37 0.43 2.29 -1.08 -1.26 -4.32 116.67 118.29 2bt3 s ASP 91 Ca 0.16 -2.10 0.18 0.00 -0.52 0.00 0.00 52.55 50.27 2bt3 s ASP 91 Cb -0.13 -2.21 0.97 0.00 -1.46 0.00 0.00 42.92 40.10 2bt3 s ASP 91 CO 0.05 -0.76 1.91 0.71 0.52 0.00 0.00 175.17 177.60 2bt3 h THR 92 N 5.52 0.99 -0.07 1.71 1.35 -1.92 -1.23 112.91 119.25 2bt3 h THR 92 Ca -0.16 -0.98 -0.01 0.00 -0.55 0.00 0.00 66.41 64.71 2bt3 h THR 92 Cb 1.08 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.06 2bt3 h THR 92 CO 0.94 0.26 0.01 0.00 -0.25 0.00 0.00 175.52 176.48 2bt3 h ALA 93 N 1.73 1.89 0.00 6.62 0.00 -1.86 -1.06 119.26 126.58 2bt3 h ALA 93 Ca -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2bt3 h ALA 93 Cb 0.54 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2bt3 h ALA 93 CO 0.03 0.09 -0.44 0.00 0.00 0.00 0.00 179.25 178.93 2bt3 h ALA 94 N 1.92 0.03 -0.00 0.00 0.00 -1.69 -3.43 119.26 116.09 2bt3 h ALA 94 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2bt3 h ALA 94 Cb 0.06 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2bt3 h ALA 94 CO -0.00 0.38 -0.78 0.25 0.00 0.00 0.00 179.25 179.10 2bt3 n THR 95 N -4.64 0.00 0.00 0.00 -2.24 -0.60 -4.90 114.28 101.91 2bt3 n THR 95 Ca -0.08 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2bt3 n THR 95 Cb 0.25 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2bt3 n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bt3 n GLY 96 N 1.49 3.18 3.85 3.38 0.00 -0.40 -4.42 105.19 112.27 2bt3 n GLY 96 Ca 0.05 -1.84 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 2bt3 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bt3 s GLU 97 N -3.60 3.58 0.80 1.61 0.41 -0.41 -4.39 118.70 116.70 2bt3 s GLU 97 Ca 0.00 0.85 -0.11 0.00 -0.41 0.00 0.00 54.97 55.30 2bt3 s GLU 97 Cb 0.00 -2.08 0.07 0.00 -1.78 0.00 0.00 34.13 30.34 2bt3 s GLU 97 CO 0.00 -0.58 1.09 -0.51 -0.49 0.00 0.00 175.26 174.77 2bt3 s LEU 98 N -4.94 2.91 0.69 1.80 1.02 -1.26 -3.98 118.68 114.92 2bt3 s LEU 98 Ca 0.57 1.78 -0.16 0.00 0.02 0.00 0.00 54.13 56.34 2bt3 s LEU 98 Cb -0.11 -4.43 -0.03 0.00 0.02 0.00 0.00 46.19 41.64 2bt3 s LEU 98 CO 0.48 -2.17 0.73 -2.65 0.02 0.00 0.00 176.35 172.77 2bt3 n PRO 99 N -3.60 0.46 -1.75 1.29 -0.02 -1.26 -4.76 135.00 125.36 2bt3 n PRO 99 Ca 0.09 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 2bt3 n PRO 99 Cb 0.53 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 2bt3 n PRO 99 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2bt3 n VAL 100 N -2.28 1.39 -3.37 -1.45 0.31 -0.34 -4.96 118.33 107.63 2bt3 n VAL 100 Ca 0.12 -0.35 -0.38 0.00 -0.01 0.00 0.00 64.34 63.72 2bt3 n VAL 100 Cb 0.49 -1.91 -0.06 0.00 -0.91 0.00 0.00 33.84 31.46 2bt3 n VAL 100 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2bt3 s LEU 101 N -0.96 4.49 0.27 7.52 1.43 -1.26 -4.85 118.68 125.33 2bt3 s LEU 101 Ca 0.60 1.13 -0.05 0.00 -1.03 0.00 0.00 54.13 54.79 2bt3 s LEU 101 Cb -0.51 -2.81 0.53 0.00 0.03 0.00 0.00 46.19 43.44 2bt3 s LEU 101 CO 0.54 0.28 1.59 -0.33 0.23 0.00 0.00 176.35 178.67 2bt3 h GLU 102 N 4.51 0.04 0.00 1.70 5.08 -1.94 -1.10 114.58 122.87 2bt3 h GLU 102 Ca -0.50 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2bt3 h GLU 102 Cb 1.21 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2bt3 h GLU 102 CO 0.63 0.02 0.00 1.05 -1.00 0.00 0.00 179.01 179.71 2bt3 h GLU 103 N 0.04 0.00 0.00 2.33 4.11 -2.02 -2.55 114.58 116.49 2bt3 h GLU 103 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.91 2bt3 h GLU 103 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2bt3 h GLU 103 CO -0.84 0.00 -0.13 0.39 0.07 0.00 0.00 179.01 178.50 2bt3 n GLU 104 N -2.36 0.07 0.13 1.06 1.02 -0.41 -4.21 120.64 115.95 2bt3 n GLU 104 Ca 0.01 0.05 0.02 0.00 -0.02 0.00 0.00 57.16 57.22 2bt3 n GLU 104 Cb 0.22 -1.58 0.36 0.00 -0.02 0.00 0.00 31.44 30.42 2bt3 n GLU 104 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2bt3 h PHE 105 N 0.00 0.21 0.00 -0.32 0.04 -1.54 -2.30 116.94 113.02 2bt3 h PHE 105 Ca 0.00 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.68 2bt3 h PHE 105 Cb 0.57 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.65 2bt3 h PHE 105 CO 0.00 0.40 -0.61 1.05 -0.60 0.00 0.00 178.31 178.55 2bt3 h GLU 106 N 0.18 0.00 -0.25 1.51 4.11 -1.81 -3.39 114.58 114.93 2bt3 h GLU 106 Ca 0.03 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.41 2bt3 h GLU 106 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2bt3 h GLU 106 CO 0.03 0.21 -0.09 0.28 0.07 0.00 0.00 179.01 179.52 2bt3 h VAL 107 N 0.00 1.20 -0.09 -1.06 2.07 -1.62 -2.26 116.25 114.49 2bt3 h VAL 107 Ca -0.03 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 2bt3 h VAL 107 Cb 1.23 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2bt3 h VAL 107 CO 0.03 0.28 -0.00 0.58 0.02 0.00 0.00 177.57 178.47 2bt3 h VAL 108 N 0.38 1.26 -0.59 2.57 2.07 -1.75 -1.05 116.25 119.14 2bt3 h VAL 108 Ca 0.08 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 2bt3 h VAL 108 Cb 0.39 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2bt3 h VAL 108 CO 0.02 0.23 0.16 -0.08 0.02 0.00 0.00 177.57 177.92 2bt3 h GLU 109 N -0.14 0.93 -0.54 1.57 4.81 -1.75 -2.12 114.58 117.33 2bt3 h GLU 109 Ca 0.02 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.03 2bt3 h GLU 109 Cb 0.37 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 2bt3 h GLU 109 CO 0.01 0.85 0.29 1.96 -0.73 0.00 0.00 179.01 181.38 2bt3 h GLN 110 N 0.84 0.75 -0.27 1.92 4.20 -1.27 -1.96 115.11 119.32 2bt3 h GLN 110 Ca 0.19 -0.09 -0.14 0.00 0.06 0.00 0.00 58.65 58.66 2bt3 h GLN 110 Cb 0.32 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 2bt3 h GLN 110 CO -0.00 0.58 -0.39 -0.07 -0.67 0.00 0.00 178.83 178.28 2bt3 h LEU 111 N 0.72 0.81 -1.50 1.46 3.38 -1.14 -3.18 115.31 115.85 2bt3 h LEU 111 Ca 0.19 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 2bt3 h LEU 111 Cb 0.05 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2bt3 h LEU 111 CO -0.03 1.16 -0.22 -0.07 0.09 0.00 0.00 178.44 179.37 2bt3 h LEU 112 N 0.47 0.03 -2.09 1.67 3.38 -1.26 -3.05 115.31 114.47 2bt3 h LEU 112 Ca 0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bt3 h LEU 112 Cb 0.98 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 2bt3 h LEU 112 CO 0.09 0.26 -0.01 0.00 0.09 0.00 0.00 178.44 178.87 2bt3 h ALA 113 N 1.74 1.01 -0.31 1.53 0.00 -1.33 -1.79 119.26 120.11 2bt3 h ALA 113 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bt3 h ALA 113 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2bt3 h ALA 113 CO 0.03 0.01 0.00 0.25 0.00 0.00 0.00 179.25 179.54 2bt3 n THR 114 N -3.12 1.38 -3.29 0.00 -2.24 -1.15 -4.91 114.28 100.95 2bt3 n THR 114 Ca -0.01 -1.26 -0.39 0.00 -2.27 0.00 0.00 64.05 60.12 2bt3 n THR 114 Cb 0.21 0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.65 2bt3 n THR 114 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2bt3 s ASP 115 N -1.28 6.59 0.37 3.42 2.15 -0.68 -4.98 116.67 122.26 2bt3 s ASP 115 Ca 0.28 0.70 0.09 0.00 0.43 0.00 0.00 52.55 54.06 2bt3 s ASP 115 Cb 0.18 -2.28 0.72 0.00 -0.30 0.00 0.00 42.92 41.24 2bt3 s ASP 115 CO 0.13 -0.10 1.87 -0.33 -0.17 0.00 0.00 175.17 176.57 2bt3 h GLU 116 N 7.17 0.22 -0.20 4.34 5.08 -1.94 0.06 114.58 129.31 2bt3 h GLU 116 Ca -0.37 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.87 2bt3 h GLU 116 Cb 1.16 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 2bt3 h GLU 116 CO 0.74 0.42 -0.13 0.00 -1.00 0.00 0.00 179.01 179.04 2bt3 h ARG 117 N 0.20 0.43 -0.37 2.33 3.08 -1.94 -1.33 114.38 116.78 2bt3 h ARG 117 Ca 0.04 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 2bt3 h ARG 117 Cb 0.47 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 2bt3 h ARG 117 CO 0.03 0.74 0.20 2.35 -1.07 0.00 0.00 179.97 182.22 2bt3 h TRP 118 N 0.11 0.52 -0.55 3.04 2.91 -1.72 -1.97 115.95 118.29 2bt3 h TRP 118 Ca 0.04 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 2bt3 h TRP 118 Cb 0.63 -0.16 -0.03 0.00 -0.51 0.00 0.00 29.16 29.09 2bt3 h TRP 118 CO 0.07 0.41 0.26 -0.07 -1.03 0.00 0.00 178.44 178.08 2bt3 h LEU 119 N 0.47 0.70 -0.57 0.65 3.38 -0.97 -1.70 115.31 117.26 2bt3 h LEU 119 Ca 0.13 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2bt3 h LEU 119 Cb 0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2bt3 h LEU 119 CO -0.02 0.60 0.12 0.50 0.09 0.00 0.00 178.44 179.73 2bt3 h LYS 120 N 0.77 0.92 -0.77 1.13 3.64 -0.91 -0.68 116.57 120.68 2bt3 h LYS 120 Ca 0.19 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2bt3 h LYS 120 Cb 0.09 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2bt3 h LYS 120 CO -0.03 0.87 0.31 0.00 -2.27 0.00 0.00 179.45 178.33 2bt3 h ALA 121 N 1.01 1.00 -0.28 5.00 0.00 -0.76 -1.52 119.26 123.72 2bt3 h ALA 121 Ca 0.18 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 2bt3 h ALA 121 Cb 0.37 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2bt3 h ALA 121 CO 0.01 0.62 -0.54 -0.07 0.00 0.00 0.00 179.25 179.27 2bt3 h LEU 122 N 1.11 0.92 -1.15 0.00 3.38 -1.13 -3.04 115.31 115.40 2bt3 h LEU 122 Ca 0.26 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2bt3 h LEU 122 Cb 0.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2bt3 h LEU 122 CO -0.02 1.28 -0.01 0.00 0.09 0.00 0.00 178.44 179.77 2bt3 h ALA 123 N 0.74 1.31 0.00 1.53 0.00 -0.90 -1.39 119.26 120.55 2bt3 h ALA 123 Ca 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2bt3 h ALA 123 Cb 1.13 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2bt3 h ALA 123 CO 0.12 0.47 -0.07 0.00 0.00 0.00 0.00 179.25 179.76 2bt3 h ALA 124 N 1.45 1.28 -0.27 0.00 0.00 -1.16 -2.19 119.26 118.37 2bt3 h ALA 124 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bt3 h ALA 124 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bt3 h ALA 124 CO 0.01 0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.90 2bt3 n ARG 125 N -3.58 2.06 -3.73 0.00 1.74 -0.72 -4.99 116.66 107.43 2bt3 n ARG 125 Ca -0.02 -1.91 -0.26 0.00 -0.77 0.00 0.00 57.85 54.89 2bt3 n ARG 125 Cb 0.19 -1.37 0.05 0.00 -1.02 0.00 0.00 32.46 30.32 2bt3 n ARG 125 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2bt3 n ASN 126 N 1.00 -5.06 -4.59 0.55 3.02 -0.61 -4.98 115.26 104.58 2bt3 n ASN 126 Ca 0.14 -0.67 -0.34 0.00 -0.03 0.00 0.00 54.58 53.68 2bt3 n ASN 126 Cb 0.47 -4.47 -0.10 0.00 -0.61 0.00 0.00 39.78 35.06 2bt3 n ASN 126 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2bt3 s LEU 127 N -7.20 3.62 -0.17 3.41 1.43 -0.69 -5.03 118.68 114.05 2bt3 s LEU 127 Ca 0.54 0.01 -0.29 0.00 -1.03 0.00 0.00 54.13 53.36 2bt3 s LEU 127 Cb -0.26 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.04 2bt3 s LEU 127 CO 0.78 0.18 1.43 -0.62 0.23 0.00 0.00 176.35 178.34 2bt3 s ASP 128 N 0.34 6.73 0.47 2.29 -1.08 -1.26 -4.49 116.67 119.68 2bt3 s ASP 128 Ca 0.01 1.74 0.20 0.00 -0.52 0.00 0.00 52.55 53.97 2bt3 s ASP 128 Cb -0.13 -2.54 1.21 0.00 -1.46 0.00 0.00 42.92 40.00 2bt3 s ASP 128 CO 0.01 -0.94 1.96 1.62 0.52 0.00 0.00 175.17 178.34 2bt3 h VAL 129 N 5.70 0.78 0.00 1.11 3.04 -1.95 0.29 116.25 125.22 2bt3 h VAL 129 Ca -0.31 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 2bt3 h VAL 129 Cb 1.13 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 30.94 2bt3 h VAL 129 CO 0.98 0.04 0.00 0.77 -1.01 0.00 0.00 177.57 178.35 2bt3 h SER 130 N 0.23 0.00 -0.03 3.17 4.64 -1.99 -2.46 113.55 117.11 2bt3 h SER 130 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2bt3 h SER 130 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2bt3 h SER 130 CO -0.06 0.00 -0.07 0.29 -0.87 0.00 0.00 176.83 176.12 2bt3 n LYS 131 N -3.02 2.11 -3.31 4.77 5.02 0.09 -4.92 118.16 118.90 2bt3 n LYS 131 Ca -0.01 -1.76 -0.42 0.00 -2.02 0.00 0.00 58.31 54.10 2bt3 n LYS 131 Cb 0.19 -1.45 -0.09 0.00 -0.02 0.00 0.00 35.03 33.67 2bt3 n LYS 131 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2bt3 s VAL 132 N -2.04 5.07 0.20 -0.18 1.01 -0.93 -0.74 120.40 122.79 2bt3 s VAL 132 Ca 0.26 -0.11 -0.21 0.00 0.00 0.00 0.00 61.98 61.92 2bt3 s VAL 132 Cb 0.19 -3.99 -0.08 0.00 0.00 0.00 0.00 36.38 32.50 2bt3 s VAL 132 CO 0.34 -0.33 0.74 -0.13 0.00 0.00 0.00 175.10 175.71 2bt3 s ARG 133 N 2.22 4.35 -0.13 2.72 1.81 0.50 -4.92 118.95 125.50 2bt3 s ARG 133 Ca 0.14 0.96 0.01 0.00 -1.72 0.00 0.00 55.73 55.11 2bt3 s ARG 133 Cb -0.16 -3.01 0.02 0.00 -0.45 0.00 0.00 34.95 31.34 2bt3 s ARG 133 CO 0.14 0.46 -0.13 0.08 -0.68 0.00 0.00 175.30 175.17 2bt3 s VAL 134 N -1.39 1.41 0.17 3.52 1.01 -1.26 -1.16 120.40 122.69 2bt3 s VAL 134 Ca 0.40 -0.55 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 2bt3 s VAL 134 Cb -0.19 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.79 2bt3 s VAL 134 CO 0.22 0.43 1.10 0.00 0.00 0.00 0.00 175.10 176.86 2bt3 s ALA 135 N 1.39 3.37 -0.86 5.51 0.00 -0.55 -4.48 121.76 126.14 2bt3 s ALA 135 Ca 0.01 0.81 -0.20 0.00 0.00 0.00 0.00 51.96 52.59 2bt3 s ALA 135 Cb -0.13 -3.36 0.11 0.00 0.00 0.00 0.00 23.12 19.74 2bt3 s ALA 135 CO -0.07 -0.22 1.10 -1.25 0.00 0.00 0.00 175.76 175.31 2bt3 s PRO 136 N -0.26 3.46 -0.11 0.00 0.04 -1.26 -3.56 135.00 133.31 2bt3 s PRO 136 Ca 0.50 -1.47 -0.04 0.00 0.04 0.00 0.00 61.00 60.03 2bt3 s PRO 136 Cb -0.29 -4.76 -0.03 0.00 0.04 0.00 0.00 34.50 29.45 2bt3 s PRO 136 CO 0.34 -1.81 0.03 -0.51 0.04 0.00 0.00 177.00 175.09 2bt3 s LEU 137 N 3.20 3.72 0.61 -3.56 1.43 -0.11 -4.93 118.68 119.04 2bt3 s LEU 137 Ca 0.30 0.17 -0.19 0.00 -1.03 0.00 0.00 54.13 53.38 2bt3 s LEU 137 Cb -0.08 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 2bt3 s LEU 137 CO -0.04 0.34 1.24 -1.54 0.23 0.00 0.00 176.35 176.57 2bt3 n SER 138 N 2.43 1.95 -0.06 2.29 3.41 -1.26 -0.96 113.62 121.41 2bt3 n SER 138 Ca -0.18 0.87 -0.07 0.00 -0.26 0.00 0.00 58.87 59.22 2bt3 n SER 138 Cb 0.54 -1.52 -0.15 0.00 -0.26 0.00 0.00 64.21 62.81 2bt3 n SER 138 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bt3 n ALA 139 N -1.63 1.64 -0.85 7.33 0.00 -1.26 -4.63 120.51 121.11 2bt3 n ALA 139 Ca 0.14 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2bt3 n ALA 139 Cb 0.47 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.43 2bt3 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bt3 n GLY 140 N 1.62 0.66 2.70 0.00 0.00 -1.26 -4.76 105.19 104.15 2bt3 n GLY 140 Ca -0.24 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.69 2bt3 n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bt3 s VAL 141 N 0.00 0.27 0.00 1.61 1.01 -1.26 -4.51 120.40 117.52 2bt3 s VAL 141 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2bt3 s VAL 141 Cb 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 36.38 35.62 2bt3 s VAL 141 CO 0.00 -0.14 0.00 0.49 0.00 0.00 0.00 175.10 175.45 2bt3 n PHE 142 N 5.15 0.00 0.26 5.22 3.72 -1.26 -4.87 117.46 125.68 2bt3 n PHE 142 Ca -0.08 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.43 2bt3 n PHE 142 Cb 0.48 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.22 2bt3 n PHE 142 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 2bt3 n GLU 143 N 0.00 2.40 -3.04 -1.08 0.00 -1.26 -4.85 120.64 112.82 2bt3 n GLU 143 Ca 0.00 -2.20 -0.44 0.00 0.00 0.00 0.00 57.16 54.51 2bt3 n GLU 143 Cb 0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 31.44 29.93 2bt3 n GLU 143 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 2bt3 s TYR 144 N -1.39 3.10 0.47 -1.84 2.02 -1.26 -4.90 117.35 113.55 2bt3 s TYR 144 Ca 0.36 -1.21 0.16 0.00 -0.37 0.00 0.00 57.07 56.01 2bt3 s TYR 144 Cb 0.21 -4.13 1.13 0.00 -0.40 0.00 0.00 41.96 38.77 2bt3 s TYR 144 CO 0.29 -1.38 2.03 0.00 -1.57 0.00 0.00 175.55 174.92 2bt3 h ALA 145 N 8.91 2.07 0.00 3.71 0.00 -2.01 -2.02 119.26 129.92 2bt3 h ALA 145 Ca -0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2bt3 h ALA 145 Cb 1.05 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2bt3 h ALA 145 CO 1.06 -0.17 -0.01 1.05 0.00 0.00 0.00 179.25 181.19 2bt3 h GLU 146 N 0.26 0.00 0.00 0.00 9.09 -2.01 -2.85 114.58 119.07 2bt3 h GLU 146 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 2bt3 h GLU 146 Cb 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.55 2bt3 h GLU 146 CO -0.04 0.01 0.00 0.93 0.05 0.00 0.00 179.01 179.96 2bt3 h GLU 147 N 0.00 0.00 -6.24 1.06 5.08 -1.74 -3.43 114.58 109.31 2bt3 h GLU 147 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2bt3 h GLU 147 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2bt3 h GLU 147 CO 0.00 0.00 1.06 1.03 -1.00 0.00 0.00 179.01 180.10 2bt3 s ARG 148 N -3.19 4.13 0.00 2.33 0.52 -1.08 -1.73 118.95 119.93 2bt3 s ARG 148 Ca 0.08 2.00 0.00 0.00 -0.52 0.00 0.00 55.73 57.30 2bt3 s ARG 148 Cb 0.10 -3.95 0.00 0.00 0.52 0.00 0.00 34.95 31.62 2bt3 s ARG 148 CO 0.59 -0.89 0.00 0.41 0.02 0.00 0.00 175.30 175.44 2bt3 n GLY 149 N 4.11 1.29 3.70 -3.53 0.00 -1.26 -4.92 105.19 104.58 2bt3 n GLY 149 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2bt3 n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bt3 s ARG 150 N -0.40 2.81 -0.57 1.61 1.81 -0.70 -4.77 118.95 118.73 2bt3 s ARG 150 Ca 0.00 -0.62 -0.26 0.00 -1.72 0.00 0.00 55.73 53.14 2bt3 s ARG 150 Cb 0.00 -2.69 0.04 0.00 -0.45 0.00 0.00 34.95 31.85 2bt3 s ARG 150 CO 0.00 0.62 1.05 1.03 -0.68 0.00 0.00 175.30 177.32 2bt3 s ARG 151 N -1.68 3.41 -0.05 3.54 0.52 -1.26 -4.97 118.95 118.46 2bt3 s ARG 151 Ca 0.21 -0.05 0.02 0.00 -0.52 0.00 0.00 55.73 55.39 2bt3 s ARG 151 Cb -0.12 -4.04 -0.03 0.00 0.52 0.00 0.00 34.95 31.29 2bt3 s ARG 151 CO 0.12 -1.58 -0.08 0.42 0.02 0.00 0.00 175.30 174.20 2bt3 s ILE 152 N 4.41 3.60 0.08 1.52 -1.09 -1.26 -1.97 121.20 126.49 2bt3 s ILE 152 Ca 0.36 -0.57 0.09 0.00 -2.23 0.00 0.00 60.65 58.30 2bt3 s ILE 152 Cb -0.10 -2.48 -0.03 0.00 -1.58 0.00 0.00 42.46 38.27 2bt3 s ILE 152 CO 0.22 0.56 -0.23 -0.76 -1.23 0.00 0.00 174.94 173.50 2bt3 s LEU 153 N -0.90 2.25 0.05 2.97 1.43 -0.42 -4.31 118.68 119.75 2bt3 s LEU 153 Ca 0.13 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 2bt3 s LEU 153 Cb -0.11 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 2bt3 s LEU 153 CO 0.02 0.14 0.11 -0.13 0.23 0.00 0.00 176.35 176.72 2bt3 s ARG 154 N -1.63 3.05 -0.10 1.70 0.52 -0.14 -0.91 118.95 121.45 2bt3 s ARG 154 Ca 0.09 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.76 2bt3 s ARG 154 Cb -0.10 -2.83 0.00 0.00 0.52 0.00 0.00 34.95 32.54 2bt3 s ARG 154 CO 0.04 0.60 -0.23 0.20 0.02 0.00 0.00 175.30 175.93 2bt3 s GLY 155 N -2.22 1.28 0.00 -3.53 0.00 0.54 -0.93 107.32 102.46 2bt3 s GLY 155 Ca 0.28 -0.92 0.06 0.00 0.00 0.00 0.00 44.72 44.15 2bt3 s GLY 155 CO 0.21 -0.28 -0.19 1.08 0.00 0.00 0.00 173.10 173.92 2bt3 s LEU 156 N 0.38 2.52 -0.02 0.66 1.43 -1.23 -2.31 118.68 120.10 2bt3 s LEU 156 Ca -0.18 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2bt3 s LEU 156 Cb -0.18 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 2bt3 s LEU 156 CO 0.08 0.29 0.09 0.00 0.23 0.00 0.00 176.35 177.05 2bt3 s ALA 157 N -0.80 3.63 -0.05 4.21 0.00 -1.26 -1.48 121.76 126.01 2bt3 s ALA 157 Ca 0.13 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 2bt3 s ALA 157 Cb -0.10 -1.64 0.03 0.00 0.00 0.00 0.00 23.12 21.40 2bt3 s ALA 157 CO 0.03 0.68 0.11 -0.06 0.00 0.00 0.00 175.76 176.52 2bt3 s PHE 158 N -1.17 -0.11 -0.02 0.00 0.40 -0.31 -1.12 117.98 115.65 2bt3 s PHE 158 Ca 0.22 0.36 -0.22 0.00 -0.60 0.00 0.00 56.93 56.69 2bt3 s PHE 158 Cb -0.12 -0.11 -0.05 0.00 0.51 0.00 0.00 43.02 43.26 2bt3 s PHE 158 CO 0.13 -0.13 0.65 0.08 0.70 0.00 0.00 175.22 176.64 2bt3 s VAL 159 N 0.99 4.94 -0.32 -0.44 1.01 -0.40 -0.37 120.40 125.82 2bt3 s VAL 159 Ca -0.08 1.35 -0.02 0.00 0.00 0.00 0.00 61.98 63.24 2bt3 s VAL 159 Cb -0.10 -3.99 0.06 0.00 0.00 0.00 0.00 36.38 32.35 2bt3 s VAL 159 CO -0.04 0.35 0.03 -1.58 0.00 0.00 0.00 175.10 173.86 2bt3 s GLN 160 N 0.18 2.31 0.40 2.72 0.74 0.08 -4.35 119.66 121.75 2bt3 s GLN 160 Ca 0.34 -1.38 0.16 0.00 0.05 0.00 0.00 55.36 54.52 2bt3 s GLN 160 Cb -0.18 -3.23 0.85 0.00 1.10 0.00 0.00 33.01 31.54 2bt3 s GLN 160 CO 0.18 -0.70 1.87 -0.44 -0.55 0.00 0.00 175.29 175.65 2bt3 h ASP 161 N 7.98 0.00 -5.09 6.67 3.32 -1.89 -3.44 116.42 123.97 2bt3 h ASP 161 Ca -0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2bt3 h ASP 161 Cb 1.06 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.53 2bt3 h ASP 161 CO 0.55 0.32 0.07 0.72 -1.72 0.00 0.00 179.24 179.18 2bt3 s PHE 162 N -4.18 -0.04 0.42 4.55 -0.71 -1.26 -5.04 117.98 111.72 2bt3 s PHE 162 Ca -0.03 -0.34 0.16 0.00 -1.04 0.00 0.00 56.93 55.68 2bt3 s PHE 162 Cb 0.14 0.46 1.06 0.00 -1.21 0.00 0.00 43.02 43.47 2bt3 s PHE 162 CO 0.70 -1.05 1.89 -1.35 -1.34 0.00 0.00 175.22 174.08 2bt3 h PRO 163 N 2.13 0.40 -0.69 1.99 0.11 -2.02 -1.50 132.00 132.43 2bt3 h PRO 163 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2bt3 h PRO 163 Cb 1.26 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bt3 h PRO 163 CO 0.32 0.27 0.00 0.39 -0.21 0.00 0.00 178.00 178.76 2bt3 n GLU 164 N -4.49 2.63 -2.61 1.05 1.02 -1.26 -4.97 120.64 112.01 2bt3 n GLU 164 Ca 0.16 -2.53 -0.37 0.00 -0.02 0.00 0.00 57.16 54.41 2bt3 n GLU 164 Cb 0.60 -1.55 -0.05 0.00 -0.02 0.00 0.00 31.44 30.42 2bt3 n GLU 164 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2bt3 s ASP 165 N -1.03 7.02 -0.52 1.62 2.15 -0.57 -5.01 116.67 120.33 2bt3 s ASP 165 Ca 0.47 2.00 -0.26 0.00 0.43 0.00 0.00 52.55 55.19 2bt3 s ASP 165 Cb 0.24 -2.59 0.03 0.00 -0.30 0.00 0.00 42.92 40.31 2bt3 s ASP 165 CO 0.32 -0.30 1.00 -0.55 -0.17 0.00 0.00 175.17 175.46 2bt3 s SER 166 N -1.49 6.43 0.47 -0.34 0.15 -1.26 -4.86 113.70 112.80 2bt3 s SER 166 Ca 0.53 -0.06 0.26 0.00 0.70 0.00 0.00 55.95 57.38 2bt3 s SER 166 Cb -0.22 -2.47 1.10 0.00 -1.71 0.00 0.00 66.02 62.72 2bt3 s SER 166 CO 0.28 -1.22 1.91 0.00 1.20 0.00 0.00 173.24 175.41 2bt3 h ALA 167 N 9.28 1.09 -0.06 5.45 0.00 -1.94 -2.70 119.26 130.38 2bt3 h ALA 167 Ca -0.25 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.51 2bt3 h ALA 167 Cb 1.07 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2bt3 h ALA 167 CO 1.09 0.23 0.08 -1.49 0.00 0.00 0.00 179.25 179.17 2bt3 h TRP 168 N 0.00 0.00 0.00 0.00 4.06 -1.90 -0.16 115.95 117.95 2bt3 h TRP 168 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2bt3 h TRP 168 Cb 0.62 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.78 2bt3 h TRP 168 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 2bt3 h ALA 169 N 1.89 1.00 -1.98 1.49 0.00 -1.81 -3.36 119.26 116.49 2bt3 h ALA 169 Ca 0.03 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.42 2bt3 h ALA 169 Cb 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.57 2bt3 h ALA 169 CO -0.00 0.00 -0.94 0.72 0.00 0.00 0.00 179.25 179.03 2bt3 n HIS 170 N -2.58 2.07 -1.94 0.00 8.25 -0.07 -4.50 115.22 116.44 2bt3 n HIS 170 Ca 0.01 -3.73 -0.39 0.00 -0.26 0.00 0.00 57.72 53.35 2bt3 n HIS 170 Cb 0.21 -0.41 0.02 0.00 1.12 0.00 0.00 29.99 30.92 2bt3 n HIS 170 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2bt3 s PRO 171 N -3.00 3.54 -0.68 -0.41 0.04 -1.26 -1.27 135.00 131.96 2bt3 s PRO 171 Ca 0.43 2.15 -0.09 0.00 0.04 0.00 0.00 61.00 63.54 2bt3 s PRO 171 Cb 0.34 -2.47 0.18 0.00 0.04 0.00 0.00 34.50 32.59 2bt3 s PRO 171 CO -0.10 -0.84 0.56 0.08 0.04 0.00 0.00 177.00 176.74 2bt3 s VAL 172 N -1.33 4.61 0.64 -0.36 1.01 -0.28 -4.37 120.40 120.32 2bt3 s VAL 172 Ca 0.65 -2.55 -0.10 0.00 0.00 0.00 0.00 61.98 59.98 2bt3 s VAL 172 Cb -0.38 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 2bt3 s VAL 172 CO 0.47 -0.92 1.02 -0.62 0.00 0.00 0.00 175.10 175.04 2bt3 s ASP 173 N 1.67 5.80 0.00 3.32 -1.08 -1.26 -4.03 116.67 121.08 2bt3 s ASP 173 Ca 0.15 1.14 0.00 0.00 -0.52 0.00 0.00 52.55 53.32 2bt3 s ASP 173 Cb -0.17 -2.10 0.00 0.00 -1.46 0.00 0.00 42.92 39.19 2bt3 s ASP 173 CO -0.05 -1.08 0.00 0.61 0.52 0.00 0.00 175.17 175.17 2bt3 n GLY 174 N -2.79 0.72 2.89 2.66 0.00 -1.26 -4.10 105.19 103.31 2bt3 n GLY 174 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 2bt3 n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bt3 s LEU 175 N 0.00 0.75 -0.05 0.99 2.96 -1.26 -0.43 118.68 121.65 2bt3 s LEU 175 Ca 0.00 0.26 -0.13 0.00 -0.22 0.00 0.00 54.13 54.04 2bt3 s LEU 175 Cb 0.00 0.28 0.02 0.00 0.50 0.00 0.00 46.19 47.00 2bt3 s LEU 175 CO 0.00 -0.15 0.30 0.54 -1.32 0.00 0.00 176.35 175.72 2bt3 s VAL 176 N 1.19 0.04 0.09 1.68 0.11 -0.49 -4.61 120.40 118.42 2bt3 s VAL 176 Ca -0.09 -0.34 0.05 0.00 -2.93 0.00 0.00 61.98 58.67 2bt3 s VAL 176 Cb -0.12 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 2bt3 s VAL 176 CO -0.05 -0.19 -0.13 0.00 -3.33 0.00 0.00 175.10 171.40 2bt3 s ALA 177 N -0.86 1.24 -0.04 1.54 0.00 -0.98 -0.30 121.76 122.37 2bt3 s ALA 177 Ca -0.09 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 50.81 2bt3 s ALA 177 Cb -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 2bt3 s ALA 177 CO 0.03 0.10 -0.25 0.71 0.00 0.00 0.00 175.76 176.34 2bt3 s TYR 178 N -1.80 2.40 -0.01 0.00 2.02 0.03 -0.34 117.35 119.64 2bt3 s TYR 178 Ca 0.03 -0.61 0.01 0.00 -0.37 0.00 0.00 57.07 56.13 2bt3 s TYR 178 Cb -0.07 -1.56 0.00 0.00 -0.40 0.00 0.00 41.96 39.94 2bt3 s TYR 178 CO 0.02 -0.15 -0.05 0.08 -1.57 0.00 0.00 175.55 173.89 2bt3 s VAL 179 N -0.34 0.43 -0.48 0.71 1.01 -0.08 -1.10 120.40 120.54 2bt3 s VAL 179 Ca 0.02 -0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 2bt3 s VAL 179 Cb -0.12 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 35.90 2bt3 s VAL 179 CO 0.02 0.15 0.75 -0.62 0.00 0.00 0.00 175.10 175.39 2bt3 s ASP 180 N 0.20 6.33 0.00 3.32 -1.08 0.78 -1.29 116.67 124.94 2bt3 s ASP 180 Ca -0.02 -0.38 0.31 0.00 -0.52 0.00 0.00 52.55 51.94 2bt3 s ASP 180 Cb -0.06 -2.36 1.65 0.00 -1.46 0.00 0.00 42.92 40.69 2bt3 s ASP 180 CO -0.00 -0.94 2.10 1.33 0.52 0.00 0.00 175.17 178.18 2bt3 n VAL 181 N 5.97 0.00 -0.12 1.11 0.24 -0.83 -0.84 118.33 123.87 2bt3 n VAL 181 Ca -0.01 -0.02 -0.22 0.00 -2.04 0.00 0.00 64.34 62.06 2bt3 n VAL 181 Cb 0.47 -0.40 -0.08 0.00 -1.47 0.00 0.00 33.84 32.37 2bt3 n VAL 181 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2bt3 n VAL 182 N -1.04 1.51 0.80 3.34 0.31 -1.26 -4.38 118.33 117.62 2bt3 n VAL 182 Ca 0.19 -0.15 0.13 0.00 -0.01 0.00 0.00 64.34 64.49 2bt3 n VAL 182 Cb 0.19 -2.06 0.52 0.00 -0.91 0.00 0.00 33.84 31.58 2bt3 n VAL 182 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2bt3 n SER 183 N -4.36 0.22 -3.42 4.52 3.41 -1.25 -4.94 113.62 107.80 2bt3 n SER 183 Ca -0.37 0.53 -0.18 0.00 -0.26 0.00 0.00 58.87 58.59 2bt3 n SER 183 Cb 0.72 -0.58 0.08 0.00 -0.26 0.00 0.00 64.21 64.16 2bt3 n SER 183 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2bt3 n LYS 184 N -1.71 -4.90 -4.52 4.33 4.76 -0.02 -5.03 118.16 111.07 2bt3 n LYS 184 Ca 0.06 0.81 -0.25 0.00 -2.87 0.00 0.00 58.31 56.06 2bt3 n LYS 184 Cb 0.33 -5.71 -0.14 0.00 -1.84 0.00 0.00 35.03 27.67 2bt3 n LYS 184 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2bt3 s GLU 185 N -5.17 1.31 -0.39 1.97 2.02 -0.86 -4.99 118.70 112.58 2bt3 s GLU 185 Ca 0.15 -1.03 -0.21 0.00 0.02 0.00 0.00 54.97 53.90 2bt3 s GLU 185 Cb -0.02 -1.49 0.01 0.00 0.10 0.00 0.00 34.13 32.73 2bt3 s GLU 185 CO 0.75 0.37 0.67 0.08 0.02 0.00 0.00 175.26 177.15 2bt3 s VAL 186 N -0.93 4.82 0.05 2.63 1.01 -1.26 -0.15 120.40 126.57 2bt3 s VAL 186 Ca 0.07 0.46 -0.07 0.00 0.00 0.00 0.00 61.98 62.44 2bt3 s VAL 186 Cb -0.09 -4.16 -0.30 0.00 0.00 0.00 0.00 36.38 31.83 2bt3 s VAL 186 CO 0.03 -0.46 1.05 0.71 0.00 0.00 0.00 175.10 176.43 2bt3 h THR 187 N 5.78 1.38 -2.91 3.92 1.35 -1.47 -3.47 112.91 117.49 2bt3 h THR 187 Ca -0.26 -2.93 -0.13 0.00 -0.55 0.00 0.00 66.41 62.55 2bt3 h THR 187 Cb 1.10 2.93 -0.23 0.00 -1.73 0.00 0.00 68.15 70.22 2bt3 h THR 187 CO 0.88 0.86 -0.28 -0.13 -0.25 0.00 0.00 175.52 176.60 2bt3 s ARG 188 N -2.64 0.51 -0.15 4.72 0.52 -1.16 -4.99 118.95 115.77 2bt3 s ARG 188 Ca -0.06 0.27 -0.00 0.00 -0.52 0.00 0.00 55.73 55.41 2bt3 s ARG 188 Cb 0.06 0.24 0.03 0.00 0.52 0.00 0.00 34.95 35.81 2bt3 s ARG 188 CO 0.89 -0.10 -0.06 0.08 0.02 0.00 0.00 175.30 176.13 2bt3 s VAL 189 N -0.33 1.10 -0.22 3.52 1.01 -1.26 -0.79 120.40 123.42 2bt3 s VAL 189 Ca -0.05 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 2bt3 s VAL 189 Cb -0.03 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 2bt3 s VAL 189 CO 0.02 0.23 -0.01 -0.63 0.00 0.00 0.00 175.10 174.70 2bt3 s ILE 190 N 1.65 3.65 -0.29 2.22 1.01 0.59 -5.01 121.20 125.02 2bt3 s ILE 190 Ca 0.02 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.29 2bt3 s ILE 190 Cb -0.14 -2.67 0.08 0.00 0.01 0.00 0.00 42.46 39.74 2bt3 s ILE 190 CO -0.08 0.41 0.00 -0.62 0.00 0.00 0.00 174.94 174.65 2bt3 s ASP 191 N 1.41 4.35 0.00 3.58 -1.08 -1.26 -1.39 116.67 122.29 2bt3 s ASP 191 Ca 0.05 -1.68 0.28 0.00 -0.52 0.00 0.00 52.55 50.68 2bt3 s ASP 191 Cb -0.14 -1.37 1.15 0.00 -1.46 0.00 0.00 42.92 41.09 2bt3 s ASP 191 CO -0.01 -0.31 1.80 0.35 0.52 0.00 0.00 175.17 177.52 2bt3 n THR 192 N 4.49 0.00 0.00 1.71 -2.24 0.42 -5.00 114.28 113.66 2bt3 n THR 192 Ca -0.04 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2bt3 n THR 192 Cb 0.43 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 2bt3 n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bt3 n GLY 193 N 1.21 4.02 3.75 3.38 0.00 -1.25 -5.05 105.19 111.25 2bt3 n GLY 193 Ca 0.17 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 2bt3 n GLY 193 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bt3 s VAL 194 N -2.30 3.67 0.12 1.61 -7.23 -1.26 -4.30 120.40 110.71 2bt3 s VAL 194 Ca 0.00 1.61 0.11 0.00 -1.81 0.00 0.00 61.98 61.89 2bt3 s VAL 194 Cb 0.00 -4.03 -0.04 0.00 0.56 0.00 0.00 36.38 32.88 2bt3 s VAL 194 CO 0.00 0.36 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.53 2bt3 s PHE 195 N -0.92 2.36 0.25 2.82 0.40 -1.26 -5.02 117.98 116.61 2bt3 s PHE 195 Ca 0.45 -0.36 -0.31 0.00 -0.60 0.00 0.00 56.93 56.11 2bt3 s PHE 195 Cb -0.30 -1.28 -0.13 0.00 0.51 0.00 0.00 43.02 41.82 2bt3 s PHE 195 CO 0.38 0.34 1.55 -2.30 0.70 0.00 0.00 175.22 175.89 2bt3 n PRO 196 N 0.93 2.43 -2.81 0.24 -0.02 -1.26 -4.73 135.00 129.77 2bt3 n PRO 196 Ca -0.17 0.87 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 2bt3 n PRO 196 Cb 0.53 -2.62 -0.04 0.00 -0.02 0.00 0.00 33.50 31.36 2bt3 n PRO 196 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bt3 s VAL 197 N 0.26 4.73 0.31 -1.45 1.01 -1.26 -4.85 120.40 119.15 2bt3 s VAL 197 Ca 0.69 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.96 2bt3 s VAL 197 Cb -0.57 -4.22 -0.13 0.00 0.00 0.00 0.00 36.38 31.46 2bt3 s VAL 197 CO 0.45 -0.22 1.35 -2.65 0.00 0.00 0.00 175.10 174.03 2bt3 n PRO 198 N 6.29 2.16 -0.08 2.72 -0.02 -1.26 -4.93 135.00 139.88 2bt3 n PRO 198 Ca 0.08 0.76 -0.08 0.00 -2.02 0.00 0.00 63.50 62.23 2bt3 n PRO 198 Cb 0.47 -2.38 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 2bt3 n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bt3 n ALA 199 N 0.94 1.58 -1.77 3.55 0.00 -1.26 -4.40 120.51 119.14 2bt3 n ALA 199 Ca 0.07 -1.18 -0.40 0.00 0.00 0.00 0.00 53.44 51.93 2bt3 n ALA 199 Cb 0.35 -0.35 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2bt3 n ALA 199 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2bt3 s GLU 200 N -2.57 4.09 0.64 0.00 2.02 -1.26 -4.99 118.70 116.62 2bt3 s GLU 200 Ca -0.09 2.37 -0.11 0.00 0.02 0.00 0.00 54.97 57.16 2bt3 s GLU 200 Cb 0.07 -2.91 -0.03 0.00 0.10 0.00 0.00 34.13 31.36 2bt3 s GLU 200 CO 0.83 -0.47 1.04 -3.38 0.02 0.00 0.00 175.26 173.30 2bt3 s HIS 201 N -1.17 3.44 -0.27 1.61 -3.43 -1.26 -4.80 115.29 109.41 2bt3 s HIS 201 Ca 0.54 1.34 0.10 0.00 -0.80 0.00 0.00 55.06 56.24 2bt3 s HIS 201 Cb -0.43 -2.78 0.47 0.00 -1.43 0.00 0.00 32.58 28.41 2bt3 s HIS 201 CO 0.56 -0.87 1.18 0.41 -2.00 0.00 0.00 174.74 174.02 2bt3 n GLY 202 N -2.43 5.39 3.45 -1.38 0.00 -1.26 -5.02 105.19 103.94 2bt3 n GLY 202 Ca 0.07 -2.25 -0.44 0.00 0.00 0.00 0.00 46.02 43.40 2bt3 n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bt3 s ASN 203 N -3.58 6.44 0.00 1.61 0.01 -1.26 -4.78 114.94 113.38 2bt3 s ASN 203 Ca 0.45 -1.63 0.22 0.00 -0.71 0.00 0.00 52.86 51.20 2bt3 s ASN 203 Cb 0.39 -2.41 1.28 0.00 0.41 0.00 0.00 41.25 40.92 2bt3 s ASN 203 CO 0.01 -1.21 1.69 0.00 -1.51 0.00 0.00 177.10 176.09 2bt3 n TYR 204 N 7.01 0.00 0.26 2.20 0.18 -1.26 -1.30 117.16 124.26 2bt3 n TYR 204 Ca 0.13 0.00 0.07 0.00 1.88 0.00 0.00 57.90 59.98 2bt3 n TYR 204 Cb 0.48 -0.05 0.12 0.00 -0.38 0.00 0.00 39.34 39.50 2bt3 n TYR 204 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 2bt3 n THR 205 N -1.05 0.41 -2.73 -3.48 -2.24 -1.26 -4.82 114.28 99.11 2bt3 n THR 205 Ca 0.15 -0.71 -0.43 0.00 -2.27 0.00 0.00 64.05 60.80 2bt3 n THR 205 Cb 0.09 0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 2bt3 n THR 205 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2bt3 s ASP 206 N -1.13 6.98 0.57 3.42 -1.08 -0.42 -4.94 116.67 120.07 2bt3 s ASP 206 Ca 0.23 1.20 0.28 0.00 -0.52 0.00 0.00 52.55 53.74 2bt3 s ASP 206 Cb 0.14 -2.51 1.48 0.00 -1.46 0.00 0.00 42.92 40.57 2bt3 s ASP 206 CO 0.19 -0.66 1.94 -0.65 0.52 0.00 0.00 175.17 176.52 2bt3 h PRO 207 N 7.64 0.00 -0.06 4.34 0.11 -1.88 -1.09 132.00 141.06 2bt3 h PRO 207 Ca -0.21 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.85 2bt3 h PRO 207 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2bt3 h PRO 207 CO 0.96 0.00 -0.22 1.49 -0.21 0.00 0.00 178.00 180.01 2bt3 h GLU 208 N 0.00 0.10 0.06 1.05 4.81 -1.92 0.87 114.58 119.55 2bt3 h GLU 208 Ca 0.23 -0.03 -0.35 0.00 -0.13 0.00 0.00 59.36 59.08 2bt3 h GLU 208 Cb 1.13 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.46 2bt3 h GLU 208 CO -0.00 0.33 -2.05 -0.11 -0.73 0.00 0.00 179.01 176.45 2bt3 n LEU 209 N -4.23 2.03 0.09 1.64 7.94 -0.48 -4.34 117.00 119.65 2bt3 n LEU 209 Ca -0.02 0.18 -0.05 0.00 -1.11 0.00 0.00 56.01 55.01 2bt3 n LEU 209 Cb 0.31 -0.62 -0.01 0.00 0.53 0.00 0.00 43.42 43.62 2bt3 n LEU 209 CO 0.38 0.72 0.27 0.71 -1.11 0.00 0.00 177.39 178.37 2bt3 h THR 210 N 0.04 1.60 -1.15 1.96 1.35 -1.34 -3.50 112.91 111.87 2bt3 h THR 210 Ca -0.43 -2.90 0.04 0.00 -0.55 0.00 0.00 66.41 62.57 2bt3 h THR 210 Cb 2.03 2.57 -0.01 0.00 -1.73 0.00 0.00 68.15 71.01 2bt3 h THR 210 CO 0.05 0.83 -0.06 0.61 -0.25 0.00 0.00 175.52 176.71 2bt3 n GLY 211 N 0.92 -1.62 3.72 5.82 0.00 0.29 -4.80 105.19 109.52 2bt3 n GLY 211 Ca -0.01 -1.23 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 2bt3 n GLY 211 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bt3 n PRO 212 N -1.35 2.67 -2.24 1.61 -0.02 -1.26 -4.84 135.00 129.56 2bt3 n PRO 212 Ca 0.00 0.96 -0.39 0.00 -2.02 0.00 0.00 63.50 62.05 2bt3 n PRO 212 Cb 0.07 -2.78 -0.02 0.00 -0.02 0.00 0.00 33.50 30.76 2bt3 n PRO 212 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bt3 s LEU 213 N 0.70 4.21 0.28 2.45 1.43 -1.26 -4.95 118.68 121.54 2bt3 s LEU 213 Ca 0.73 2.42 -0.30 0.00 -1.03 0.00 0.00 54.13 55.94 2bt3 s LEU 213 Cb -0.53 -3.98 -0.13 0.00 0.03 0.00 0.00 46.19 41.58 2bt3 s LEU 213 CO 0.37 -0.71 1.33 0.54 0.23 0.00 0.00 176.35 178.12 2bt3 n ARG 214 N 0.11 2.01 -0.33 1.70 1.74 -1.26 -4.92 116.66 115.72 2bt3 n ARG 214 Ca 0.04 0.71 0.07 0.00 -0.77 0.00 0.00 57.85 57.90 2bt3 n ARG 214 Cb 0.46 -2.32 0.21 0.00 -1.02 0.00 0.00 32.46 29.79 2bt3 n ARG 214 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2bt3 n THR 215 N 1.22 1.67 1.01 0.55 -2.24 -1.26 -4.71 114.28 110.52 2bt3 n THR 215 Ca 0.09 -1.44 0.11 0.00 -2.27 0.00 0.00 64.05 60.54 2bt3 n THR 215 Cb 0.33 0.11 -0.00 0.00 -2.10 0.00 0.00 70.33 68.67 2bt3 n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2bt3 n THR 216 N 0.04 0.00 -2.96 4.28 -2.24 -1.26 -4.85 114.28 107.28 2bt3 n THR 216 Ca 0.17 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.32 2bt3 n THR 216 Cb 0.68 1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 70.02 2bt3 n THR 216 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2bt3 s GLN 217 N -2.57 3.73 0.33 -0.78 -0.21 -1.26 -5.04 119.66 113.86 2bt3 s GLN 217 Ca 0.17 0.27 -0.10 0.00 0.02 0.00 0.00 55.36 55.73 2bt3 s GLN 217 Cb 0.18 -3.82 -0.07 0.00 1.00 0.00 0.00 33.01 30.31 2bt3 s GLN 217 CO 0.62 -0.86 0.67 0.15 -2.12 0.00 0.00 175.29 173.75 2bt3 s LYS 218 N 3.09 3.78 0.47 2.91 -0.14 -1.26 -5.04 119.74 123.55 2bt3 s LYS 218 Ca 0.31 0.34 -0.24 0.00 -1.36 0.00 0.00 55.97 55.02 2bt3 s LYS 218 Cb -0.13 -2.51 -0.08 0.00 -1.68 0.00 0.00 37.83 33.43 2bt3 s LYS 218 CO 0.17 0.12 1.29 -2.30 -0.76 0.00 0.00 175.35 173.88 2bt3 n PRO 219 N -0.86 1.84 -4.14 -1.68 -0.02 -1.26 -5.03 135.00 123.85 2bt3 n PRO 219 Ca 0.01 0.66 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 2bt3 n PRO 219 Cb 0.54 -2.45 -0.16 0.00 -0.02 0.00 0.00 33.50 31.40 2bt3 n PRO 219 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2bt3 s ILE 220 N -1.25 2.25 -0.22 4.25 1.01 -1.26 -5.11 121.20 120.87 2bt3 s ILE 220 Ca 0.65 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 2bt3 s ILE 220 Cb -0.47 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.03 2bt3 s ILE 220 CO 0.55 0.52 -0.01 -0.55 0.00 0.00 0.00 174.94 175.45 2bt3 s SER 221 N 1.27 4.58 -0.25 3.58 0.15 -1.26 -5.08 113.70 116.70 2bt3 s SER 221 Ca 0.04 -0.31 -0.00 0.00 0.70 0.00 0.00 55.95 56.38 2bt3 s SER 221 Cb -0.13 -1.79 0.04 0.00 -1.71 0.00 0.00 66.02 62.42 2bt3 s SER 221 CO -0.11 0.00 -0.08 -0.63 1.20 0.00 0.00 173.24 173.62 2bt3 s ILE 222 N 1.35 2.60 0.17 6.45 1.01 -1.26 -5.11 121.20 126.42 2bt3 s ILE 222 Ca 0.04 -1.21 0.03 0.00 0.00 0.00 0.00 60.65 59.51 2bt3 s ILE 222 Cb -0.14 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.91 2bt3 s ILE 222 CO -0.00 0.15 -0.04 0.42 0.00 0.00 0.00 174.94 175.47 2bt3 s THR 223 N 1.25 0.94 -0.34 2.92 -4.23 -1.26 -4.16 115.64 110.77 2bt3 s THR 223 Ca -0.02 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.46 2bt3 s THR 223 Cb -0.17 -2.05 0.11 0.00 1.34 0.00 0.00 72.50 71.73 2bt3 s THR 223 CO -0.05 -0.56 0.15 -1.10 -0.54 0.00 0.00 174.62 172.51 2bt3 s GLN 224 N -3.84 0.72 0.51 3.99 -0.21 -1.26 -4.95 119.66 114.62 2bt3 s GLN 224 Ca 0.22 -1.21 0.27 0.00 0.02 0.00 0.00 55.36 54.66 2bt3 s GLN 224 Cb 0.05 -1.83 1.39 0.00 1.00 0.00 0.00 33.01 33.62 2bt3 s GLN 224 CO 0.03 -1.06 2.05 -1.00 -2.12 0.00 0.00 175.29 173.19 2bt3 h PRO 225 N 7.71 0.00 -0.24 2.91 0.13 -2.04 -1.71 132.00 138.77 2bt3 h PRO 225 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2bt3 h PRO 225 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2bt3 h PRO 225 CO 0.44 0.13 0.00 0.39 -0.23 0.00 0.00 178.00 178.73 2bt3 n GLU 226 N -3.62 2.06 0.00 0.86 1.02 -1.26 -5.11 120.64 114.59 2bt3 n GLU 226 Ca -0.02 -1.93 0.00 0.00 -0.02 0.00 0.00 57.16 55.20 2bt3 n GLU 226 Cb 0.26 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2bt3 n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bt3 n GLY 227 N 1.11 -3.14 3.88 0.62 0.00 -0.65 -5.01 105.19 102.00 2bt3 n GLY 227 Ca 0.14 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 2bt3 n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bt3 s PRO 228 N -0.83 3.21 0.00 1.61 0.04 -1.26 -4.87 135.00 132.90 2bt3 s PRO 228 Ca 0.00 0.61 0.27 0.00 0.04 0.00 0.00 61.00 61.92 2bt3 s PRO 228 Cb 0.00 -2.05 0.87 0.00 0.04 0.00 0.00 34.50 33.36 2bt3 s PRO 228 CO 0.00 -0.81 1.65 0.43 0.04 0.00 0.00 177.00 178.31 2bt3 n SER 229 N -2.89 0.47 -4.88 6.66 7.64 -1.26 -4.85 113.62 114.51 2bt3 n SER 229 Ca 0.06 -0.27 -0.27 0.00 1.01 0.00 0.00 58.87 59.40 2bt3 n SER 229 Cb 0.56 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.72 2bt3 n SER 229 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2bt3 s PHE 230 N -2.80 3.35 0.11 1.43 -0.12 -1.26 -4.58 117.98 114.11 2bt3 s PHE 230 Ca 0.18 0.08 0.08 0.00 -0.05 0.00 0.00 56.93 57.22 2bt3 s PHE 230 Cb 0.19 -1.62 -0.04 0.00 -0.63 0.00 0.00 43.02 40.92 2bt3 s PHE 230 CO 0.58 0.52 -0.15 0.95 -0.05 0.00 0.00 175.22 177.07 2bt3 s THR 231 N -1.70 3.01 -0.16 -4.49 -4.23 -0.68 -4.98 115.64 102.41 2bt3 s THR 231 Ca 0.33 -1.41 0.02 0.00 -1.18 0.00 0.00 61.69 59.45 2bt3 s THR 231 Cb -0.11 -2.38 0.01 0.00 1.34 0.00 0.00 72.50 71.36 2bt3 s THR 231 CO 0.26 0.12 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.56 2bt3 s VAL 232 N -1.15 2.05 0.15 2.29 1.01 -1.26 -2.13 120.40 121.37 2bt3 s VAL 232 Ca 0.19 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.27 2bt3 s VAL 232 Cb -0.11 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2bt3 s VAL 232 CO 0.11 0.54 -0.12 0.42 0.00 0.00 0.00 175.10 176.05 2bt3 s THR 233 N 1.04 1.35 -1.73 3.92 -4.23 -0.21 -4.78 115.64 110.99 2bt3 s THR 233 Ca -0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 2bt3 s THR 233 Cb -0.14 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2bt3 s THR 233 CO -0.07 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.01 2bt3 n GLY 234 N -0.02 0.58 3.30 3.99 0.00 -1.26 -0.75 105.19 111.02 2bt3 n GLY 234 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2bt3 n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bt3 n GLY 235 N -0.65 2.20 0.21 -0.02 0.00 -1.26 -4.47 105.19 101.20 2bt3 n GLY 235 Ca -0.20 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2bt3 n GLY 235 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bt3 n ASN 236 N 1.14 0.00 -4.61 1.61 6.94 -1.09 -4.98 115.26 114.26 2bt3 n ASN 236 Ca 0.00 -1.18 -0.39 0.00 -0.02 0.00 0.00 54.58 52.99 2bt3 n ASN 236 Cb 0.00 -0.04 -0.09 0.00 -2.36 0.00 0.00 39.78 37.30 2bt3 n ASN 236 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2bt3 s HIS 237 N 0.00 3.26 -0.13 -2.53 2.46 0.07 -0.85 115.29 117.58 2bt3 s HIS 237 Ca 0.00 0.48 -0.05 0.00 0.47 0.00 0.00 55.06 55.96 2bt3 s HIS 237 Cb 0.00 -2.60 -0.04 0.00 -0.13 0.00 0.00 32.58 29.82 2bt3 s HIS 237 CO 0.00 -0.22 0.04 0.42 -2.47 0.00 0.00 174.74 172.51 2bt3 s ILE 238 N 2.04 4.61 -0.09 0.89 -1.09 0.06 -1.05 121.20 126.56 2bt3 s ILE 238 Ca 0.17 -0.12 0.02 0.00 -2.23 0.00 0.00 60.65 58.48 2bt3 s ILE 238 Cb -0.16 -3.00 0.02 0.00 -1.58 0.00 0.00 42.46 37.74 2bt3 s ILE 238 CO 0.09 0.55 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.62 2bt3 s GLU 239 N -0.40 1.83 -0.25 2.79 0.41 -0.91 -2.05 118.70 120.12 2bt3 s GLU 239 Ca 0.09 -0.43 -0.07 0.00 -0.41 0.00 0.00 54.97 54.15 2bt3 s GLU 239 Cb -0.12 -1.59 0.12 0.00 -1.78 0.00 0.00 34.13 30.76 2bt3 s GLU 239 CO 0.02 -0.06 0.52 -0.46 -0.49 0.00 0.00 175.26 174.79 2bt3 s TRP 240 N 0.97 -1.11 -1.38 1.61 -0.00 -0.56 -1.69 118.94 116.78 2bt3 s TRP 240 Ca -0.08 1.77 -0.04 0.00 -0.00 0.00 0.00 56.10 57.74 2bt3 s TRP 240 Cb -0.15 0.49 0.00 0.00 -0.00 0.00 0.00 33.47 33.81 2bt3 s TRP 240 CO -0.00 -0.63 0.42 0.39 -0.00 0.00 0.00 176.95 177.13 2bt3 n GLU 241 N 5.41 -2.57 0.00 5.86 -0.58 -1.26 -0.93 120.64 126.57 2bt3 n GLU 241 Ca -0.08 0.35 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 2bt3 n GLU 241 Cb 0.50 -4.25 0.00 0.00 -0.57 0.00 0.00 31.44 27.12 2bt3 n GLU 241 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2bt3 n LYS 242 N -4.44 0.00 -2.76 3.49 4.76 -1.26 -4.93 118.16 113.02 2bt3 n LYS 242 Ca -0.28 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 54.83 2bt3 n LYS 242 Cb 0.67 -0.83 -0.06 0.00 -1.84 0.00 0.00 35.03 32.97 2bt3 n LYS 242 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2bt3 s TRP 243 N -1.66 3.27 -0.02 2.13 0.52 -0.11 0.13 118.94 123.20 2bt3 s TRP 243 Ca 0.00 1.61 0.00 0.00 0.02 0.00 0.00 56.10 57.74 2bt3 s TRP 243 Cb 0.00 -2.90 0.02 0.00 -1.15 0.00 0.00 33.47 29.44 2bt3 s TRP 243 CO 0.00 -0.24 0.01 0.45 0.02 0.00 0.00 176.95 177.18 2bt3 s SER 244 N -2.10 0.20 0.20 2.95 0.15 -0.22 -1.49 113.70 113.39 2bt3 s SER 244 Ca 0.62 -0.00 -0.23 0.00 0.70 0.00 0.00 55.95 57.04 2bt3 s SER 244 Cb -0.11 -0.09 0.05 0.00 -1.71 0.00 0.00 66.02 64.15 2bt3 s SER 244 CO 0.15 -0.07 0.83 -1.48 1.20 0.00 0.00 173.24 173.87 2bt3 s LEU 245 N 0.65 -0.24 -0.08 3.45 2.34 -0.87 -1.21 118.68 122.72 2bt3 s LEU 245 Ca -0.06 -0.45 0.04 0.00 0.06 0.00 0.00 54.13 53.72 2bt3 s LEU 245 Cb -0.09 2.43 -0.01 0.00 -0.56 0.00 0.00 46.19 47.96 2bt3 s LEU 245 CO -0.02 -1.09 -0.21 -1.81 -1.06 0.00 0.00 176.35 172.16 2bt3 s ASP 246 N -2.90 3.36 -0.49 1.48 1.01 -0.34 -0.76 116.67 118.02 2bt3 s ASP 246 Ca 0.11 -0.45 -0.17 0.00 0.71 0.00 0.00 52.55 52.75 2bt3 s ASP 246 Cb -0.03 -1.06 0.07 0.00 1.01 0.00 0.00 42.92 42.91 2bt3 s ASP 246 CO 0.03 0.23 0.49 -0.69 0.21 0.00 0.00 175.17 175.44 2bt3 s VAL 247 N -0.07 5.10 0.60 -1.27 1.01 -0.03 -1.06 120.40 124.67 2bt3 s VAL 247 Ca -0.05 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 2bt3 s VAL 247 Cb -0.14 -4.20 0.05 0.00 0.00 0.00 0.00 36.38 32.09 2bt3 s VAL 247 CO 0.04 -0.67 0.85 -0.83 0.00 0.00 0.00 175.10 174.49 2bt3 s GLY 248 N 2.65 1.79 -0.14 4.51 0.00 0.10 -4.73 107.32 111.50 2bt3 s GLY 248 Ca 0.08 -1.31 -0.08 0.00 0.00 0.00 0.00 44.72 43.41 2bt3 s GLY 248 CO 0.09 -0.96 0.35 -0.12 0.00 0.00 0.00 173.10 172.45 2bt3 s PHE 249 N -2.90 -0.48 0.01 1.90 5.36 -1.26 -1.51 117.98 119.09 2bt3 s PHE 249 Ca 0.59 1.07 0.04 0.00 -0.96 0.00 0.00 56.93 57.67 2bt3 s PHE 249 Cb -0.10 0.17 -0.01 0.00 -0.34 0.00 0.00 43.02 42.74 2bt3 s PHE 249 CO 0.40 -0.28 -0.13 0.34 -1.46 0.00 0.00 175.22 174.09 2bt3 s ASP 250 N 1.18 1.54 0.48 6.13 2.15 -0.15 -4.87 116.67 123.13 2bt3 s ASP 250 Ca -0.08 -0.31 0.23 0.00 0.43 0.00 0.00 52.55 52.82 2bt3 s ASP 250 Cb -0.08 -0.14 1.24 0.00 -0.30 0.00 0.00 42.92 43.63 2bt3 s ASP 250 CO -0.09 0.11 2.01 1.62 -0.17 0.00 0.00 175.17 178.65 2bt3 h VAL 251 N 4.72 0.77 0.00 1.11 3.04 -1.86 0.24 116.25 124.27 2bt3 h VAL 251 Ca -0.35 -0.67 -0.01 0.00 -1.01 0.00 0.00 66.70 64.66 2bt3 h VAL 251 Cb 1.17 1.41 -0.00 0.00 -2.01 0.00 0.00 31.29 31.85 2bt3 h VAL 251 CO 0.47 0.17 -0.17 -0.09 -1.01 0.00 0.00 177.57 176.94 2bt3 h ARG 252 N 0.00 0.00 0.00 4.17 2.43 -1.89 0.53 114.38 119.62 2bt3 h ARG 252 Ca -0.00 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 2bt3 h ARG 252 Cb 0.39 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2bt3 h ARG 252 CO 0.02 0.14 -0.55 0.93 -1.51 0.00 0.00 179.97 179.01 2bt3 h GLU 253 N -1.00 0.00 0.00 0.20 5.08 -1.82 -2.68 114.58 114.36 2bt3 h GLU 253 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2bt3 h GLU 253 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2bt3 h GLU 253 CO -0.01 0.29 0.00 0.41 -1.00 0.00 0.00 179.01 178.70 2bt3 n GLY 254 N 1.21 0.47 3.71 -3.84 0.00 0.83 -4.62 105.19 102.95 2bt3 n GLY 254 Ca 0.01 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 2bt3 n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bt3 s VAL 255 N 0.00 2.95 -0.07 1.61 1.01 -1.26 -0.98 120.40 123.65 2bt3 s VAL 255 Ca 0.00 0.64 0.03 0.00 0.00 0.00 0.00 61.98 62.66 2bt3 s VAL 255 Cb 0.00 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.97 2bt3 s VAL 255 CO 0.00 0.04 -0.17 -0.69 0.00 0.00 0.00 175.10 174.28 2bt3 s VAL 256 N 1.36 1.52 -0.14 2.92 1.01 -0.57 -4.63 120.40 121.86 2bt3 s VAL 256 Ca 0.68 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 2bt3 s VAL 256 Cb -0.40 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 2bt3 s VAL 256 CO 0.31 0.44 0.18 -0.76 0.00 0.00 0.00 175.10 175.27 2bt3 s LEU 257 N 0.43 4.31 0.04 3.92 1.43 -0.28 0.00 118.68 128.54 2bt3 s LEU 257 Ca -0.14 0.43 0.09 0.00 -1.03 0.00 0.00 54.13 53.48 2bt3 s LEU 257 Cb -0.16 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2bt3 s LEU 257 CO 0.05 0.28 -0.24 -1.00 0.23 0.00 0.00 176.35 175.67 2bt3 s HIS 258 N -0.34 2.13 -1.31 0.29 3.76 -0.22 -0.69 115.29 118.90 2bt3 s HIS 258 Ca 0.13 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.61 2bt3 s HIS 258 Cb -0.12 -1.27 0.01 0.00 1.11 0.00 0.00 32.58 32.31 2bt3 s HIS 258 CO 0.03 0.11 0.94 0.09 -0.85 0.00 0.00 174.74 175.06 2bt3 n ASN 259 N 1.82 -3.00 -4.66 1.40 3.02 -0.35 -1.20 115.26 112.28 2bt3 n ASN 259 Ca -0.17 -0.69 -0.42 0.00 -0.03 0.00 0.00 54.58 53.26 2bt3 n ASN 259 Cb 0.52 -4.59 -0.03 0.00 -0.61 0.00 0.00 39.78 35.08 2bt3 n ASN 259 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bt3 s ILE 260 N -3.44 3.85 0.11 2.41 1.01 0.46 -3.98 121.20 121.61 2bt3 s ILE 260 Ca 0.21 1.05 -0.06 0.00 0.00 0.00 0.00 60.65 61.85 2bt3 s ILE 260 Cb -0.10 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 2bt3 s ILE 260 CO 0.77 -0.09 0.16 0.00 0.00 0.00 0.00 174.94 175.79 2bt3 s ALA 261 N 3.71 0.10 -0.05 9.38 0.00 -0.35 -0.73 121.76 133.83 2bt3 s ALA 261 Ca 0.66 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.73 2bt3 s ALA 261 Cb -0.29 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.45 2bt3 s ALA 261 CO 0.24 -0.52 -0.07 0.12 0.00 0.00 0.00 175.76 175.52 2bt3 s PHE 262 N -3.92 0.97 -0.59 0.00 2.19 -0.07 -1.05 117.98 115.50 2bt3 s PHE 262 Ca 0.11 -0.31 -0.23 0.00 0.33 0.00 0.00 56.93 56.84 2bt3 s PHE 262 Cb 0.05 -0.78 0.06 0.00 -1.31 0.00 0.00 43.02 41.04 2bt3 s PHE 262 CO -0.06 -0.21 0.91 0.50 1.83 0.00 0.00 175.22 178.19 2bt3 s ARG 263 N 0.77 3.21 -0.49 10.12 3.52 0.12 -1.04 118.95 135.16 2bt3 s ARG 263 Ca -0.12 -0.58 -0.12 0.00 -0.13 0.00 0.00 55.73 54.77 2bt3 s ARG 263 Cb -0.14 -4.13 0.11 0.00 -1.56 0.00 0.00 34.95 29.23 2bt3 s ARG 263 CO 0.01 -1.59 0.40 0.34 -0.81 0.00 0.00 175.30 173.65 2bt3 s ASP 264 N 3.17 5.92 1.76 -2.12 2.15 -0.17 -4.86 116.67 122.52 2bt3 s ASP 264 Ca 0.25 -1.76 0.00 0.00 0.43 0.00 0.00 52.55 51.47 2bt3 s ASP 264 Cb -0.15 -2.10 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 2bt3 s ASP 264 CO 0.14 -0.73 0.00 0.61 -0.17 0.00 0.00 175.17 175.02 2bt3 n GLY 265 N 5.07 3.85 0.07 2.66 0.00 -1.26 -2.39 105.19 113.18 2bt3 n GLY 265 Ca -0.11 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.04 2bt3 n GLY 265 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bt3 h ASP 266 N 0.00 0.00 -3.20 1.61 3.32 -2.00 -3.47 116.42 112.68 2bt3 h ASP 266 Ca 0.00 -0.21 -0.61 0.00 0.02 0.00 0.00 57.03 56.23 2bt3 h ASP 266 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 2bt3 h ASP 266 CO 0.00 0.10 -0.52 -0.13 -1.72 0.00 0.00 179.24 176.98 2bt3 s ARG 267 N -3.21 4.00 -0.48 3.56 0.52 -1.01 -5.05 118.95 117.28 2bt3 s ARG 267 Ca 0.04 -0.25 -0.26 0.00 -0.52 0.00 0.00 55.73 54.74 2bt3 s ARG 267 Cb 0.13 -3.31 0.03 0.00 0.52 0.00 0.00 34.95 32.32 2bt3 s ARG 267 CO 0.75 0.36 0.97 -1.17 0.02 0.00 0.00 175.30 176.23 2bt3 s LEU 268 N 0.16 3.93 -0.30 2.53 2.96 -1.26 -1.00 118.68 125.70 2bt3 s LEU 268 Ca 0.07 0.11 -0.10 0.00 -0.22 0.00 0.00 54.13 54.00 2bt3 s LEU 268 Cb -0.12 -3.21 -0.02 0.00 0.50 0.00 0.00 46.19 43.35 2bt3 s LEU 268 CO -0.01 -1.13 0.16 -0.13 -1.32 0.00 0.00 176.35 173.93 2bt3 s ARG 269 N 3.95 3.52 0.58 1.98 0.52 -0.20 -4.90 118.95 124.40 2bt3 s ARG 269 Ca 0.38 -0.60 -0.19 0.00 -0.52 0.00 0.00 55.73 54.80 2bt3 s ARG 269 Cb -0.10 -3.58 -0.04 0.00 0.52 0.00 0.00 34.95 31.75 2bt3 s ARG 269 CO 0.26 -0.34 1.22 -2.14 0.02 0.00 0.00 175.30 174.32 2bt3 s PRO 270 N 1.66 3.01 0.13 3.54 0.02 -1.26 -0.90 135.00 141.20 2bt3 s PRO 270 Ca 0.06 1.88 0.00 0.00 0.02 0.00 0.00 61.00 62.95 2bt3 s PRO 270 Cb -0.17 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.37 2bt3 s PRO 270 CO 0.07 -1.19 0.00 -0.89 -0.33 0.00 0.00 177.00 174.66 2bt3 n ILE 271 N -1.49 0.71 -4.25 2.83 5.41 0.10 -0.86 119.36 121.81 2bt3 n ILE 271 Ca 0.13 0.24 -0.27 0.00 1.00 0.00 0.00 62.75 63.85 2bt3 n ILE 271 Cb 0.49 -1.25 -0.17 0.00 -0.71 0.00 0.00 39.64 38.00 2bt3 n ILE 271 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2bt3 s ILE 272 N -2.00 1.26 0.10 1.39 1.01 -0.95 -1.15 121.20 120.86 2bt3 s ILE 272 Ca 0.00 -0.49 -0.13 0.00 0.00 0.00 0.00 60.65 60.03 2bt3 s ILE 272 Cb 0.00 -1.20 -0.15 0.00 0.01 0.00 0.00 42.46 41.13 2bt3 s ILE 272 CO 0.00 0.40 1.31 -1.13 0.00 0.00 0.00 174.94 175.52 2bt3 h ASN 273 N 7.64 0.92 -3.27 3.58 -1.24 -0.93 0.13 115.58 122.41 2bt3 h ASN 273 Ca -0.32 -0.61 -0.11 0.00 0.71 0.00 0.00 56.30 55.98 2bt3 h ASN 273 Cb 1.16 -0.27 -0.26 0.00 0.73 0.00 0.00 38.32 39.68 2bt3 h ASN 273 CO 0.46 1.38 -0.26 -0.60 -1.29 0.00 0.00 177.43 177.12 2bt3 s ARG 274 N -3.81 0.43 -0.07 6.67 3.52 -1.04 -1.22 118.95 123.42 2bt3 s ARG 274 Ca -0.11 0.81 0.02 0.00 -0.13 0.00 0.00 55.73 56.32 2bt3 s ARG 274 Cb 0.08 0.02 0.01 0.00 -1.56 0.00 0.00 34.95 33.50 2bt3 s ARG 274 CO 0.89 -0.15 -0.13 0.00 -0.81 0.00 0.00 175.30 175.11 2bt3 s ALA 275 N 1.30 1.33 0.17 6.12 0.00 0.13 -0.61 121.76 130.20 2bt3 s ALA 275 Ca -0.09 -0.47 -0.16 0.00 0.00 0.00 0.00 51.96 51.24 2bt3 s ALA 275 Cb -0.08 -0.62 0.03 0.00 0.00 0.00 0.00 23.12 22.45 2bt3 s ALA 275 CO -0.12 0.07 0.46 -1.54 0.00 0.00 0.00 175.76 174.63 2bt3 s SER 276 N 0.75 -0.24 -0.51 0.00 1.04 -0.87 -1.12 113.70 112.75 2bt3 s SER 276 Ca -0.13 -0.44 -0.19 0.00 0.48 0.00 0.00 55.95 55.68 2bt3 s SER 276 Cb -0.16 0.53 0.07 0.00 0.10 0.00 0.00 66.02 66.56 2bt3 s SER 276 CO 0.03 -0.97 0.62 -0.63 0.98 0.00 0.00 173.24 173.27 2bt3 s ILE 277 N -3.85 4.90 -0.66 -1.02 -1.09 -1.26 -0.82 121.20 117.39 2bt3 s ILE 277 Ca 0.07 -0.60 0.24 0.00 -2.23 0.00 0.00 60.65 58.13 2bt3 s ILE 277 Cb 0.00 -4.31 0.05 0.00 -1.58 0.00 0.00 42.46 36.62 2bt3 s ILE 277 CO -0.06 -0.83 1.33 0.00 -1.23 0.00 0.00 174.94 174.15 2bt3 n ALA 278 N 6.11 2.94 -3.47 9.38 0.00 0.25 -4.70 120.51 131.02 2bt3 n ALA 278 Ca -0.07 -0.25 -0.15 0.00 0.00 0.00 0.00 53.44 52.97 2bt3 n ALA 278 Cb 0.45 -1.17 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 2bt3 n ALA 278 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2bt3 s GLU 279 N -3.16 1.15 -0.13 0.00 2.56 -1.22 -4.51 118.70 113.39 2bt3 s GLU 279 Ca 0.06 -0.10 -0.10 0.00 0.00 0.00 0.00 54.97 54.83 2bt3 s GLU 279 Cb 0.14 0.53 0.04 0.00 2.00 0.00 0.00 34.13 36.84 2bt3 s GLU 279 CO 0.72 -0.44 0.34 1.41 -0.56 0.00 0.00 175.26 176.74 2bt3 s MET 280 N -2.45 0.37 0.02 4.30 -2.45 -1.26 -1.12 119.30 116.72 2bt3 s MET 280 Ca -0.05 0.55 0.03 0.00 -1.25 0.00 0.00 55.69 54.97 2bt3 s MET 280 Cb -0.01 0.11 -0.02 0.00 1.25 0.00 0.00 34.83 36.17 2bt3 s MET 280 CO -0.02 -0.09 -0.10 0.54 1.05 0.00 0.00 175.02 176.41 2bt3 s VAL 281 N 0.57 0.74 -0.54 10.11 0.11 0.43 -1.78 120.40 130.04 2bt3 s VAL 281 Ca -0.03 -0.78 0.04 0.00 -2.93 0.00 0.00 61.98 58.28 2bt3 s VAL 281 Cb -0.05 -0.70 0.14 0.00 -1.53 0.00 0.00 36.38 34.25 2bt3 s VAL 281 CO -0.03 -0.06 0.31 -0.69 -3.33 0.00 0.00 175.10 171.29 2bt3 s VAL 282 N -0.77 2.41 0.12 2.04 1.01 0.37 -0.44 120.40 125.14 2bt3 s VAL 282 Ca -0.01 -3.38 -0.29 0.00 0.00 0.00 0.00 61.98 58.30 2bt3 s VAL 282 Cb -0.07 -2.65 -0.06 0.00 0.00 0.00 0.00 36.38 33.60 2bt3 s VAL 282 CO 0.00 -0.87 0.90 -2.16 0.00 0.00 0.00 175.10 172.98 2bt3 s PRO 283 N -0.42 4.68 -0.04 2.72 0.04 -1.19 -1.76 135.00 139.02 2bt3 s PRO 283 Ca 0.19 1.36 -0.03 0.00 0.04 0.00 0.00 61.00 62.56 2bt3 s PRO 283 Cb -0.21 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 2bt3 s PRO 283 CO -0.04 0.31 0.11 0.71 0.04 0.00 0.00 177.00 178.14 2bt3 s TYR 284 N -0.31 3.42 -0.21 0.56 1.51 -0.97 -1.54 117.35 119.80 2bt3 s TYR 284 Ca 0.43 0.32 0.15 0.00 -1.01 0.00 0.00 57.07 56.96 2bt3 s TYR 284 Cb -0.23 -1.81 0.58 0.00 -0.11 0.00 0.00 41.96 40.38 2bt3 s TYR 284 CO 0.29 0.61 1.50 0.41 -1.11 0.00 0.00 175.55 177.25 2bt3 n GLY 285 N 1.40 4.02 3.56 0.71 0.00 0.24 -4.89 105.19 110.24 2bt3 n GLY 285 Ca -0.15 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.42 2bt3 n GLY 285 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bt3 s ASP 286 N -1.82 6.17 0.00 1.61 2.15 -1.26 -4.83 116.67 118.70 2bt3 s ASP 286 Ca 0.45 -0.12 0.23 0.00 0.43 0.00 0.00 52.55 53.54 2bt3 s ASP 286 Cb 0.37 -2.19 1.34 0.00 -0.30 0.00 0.00 42.92 42.14 2bt3 s ASP 286 CO 0.09 -0.28 1.73 -0.81 -0.17 0.00 0.00 175.17 175.73 2bt3 n PRO 287 N 5.34 0.69 -1.73 4.34 -0.04 -1.26 -3.68 135.00 138.65 2bt3 n PRO 287 Ca -0.10 0.01 -0.42 0.00 -0.04 0.00 0.00 63.50 62.95 2bt3 n PRO 287 Cb 0.50 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.45 2bt3 n PRO 287 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2bt3 n SER 288 N -1.02 3.43 0.29 3.54 2.88 -1.26 -4.70 113.62 116.78 2bt3 n SER 288 Ca 0.17 1.18 0.20 0.00 -1.33 0.00 0.00 58.87 59.08 2bt3 n SER 288 Cb 0.08 -1.55 1.03 0.00 -0.75 0.00 0.00 64.21 63.02 2bt3 n SER 288 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2bt3 h PRO 289 N 3.74 0.00 -0.05 -1.46 0.13 -1.99 0.25 132.00 132.62 2bt3 h PRO 289 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.59 2bt3 h PRO 289 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2bt3 h PRO 289 CO 0.71 0.00 -0.26 0.82 -0.23 0.00 0.00 178.00 179.04 2bt3 h ILE 290 N 0.00 1.21 0.00 -3.56 1.08 -1.95 -3.35 117.51 110.94 2bt3 h ILE 290 Ca 0.00 -0.99 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 2bt3 h ILE 290 Cb 0.06 1.46 0.00 0.00 -3.07 0.00 0.00 36.82 35.27 2bt3 h ILE 290 CO 0.00 0.29 0.00 0.54 -0.69 0.00 0.00 178.15 178.29 2bt3 n ARG 291 N -4.20 -0.28 0.06 2.37 1.74 -0.65 -4.86 116.66 110.84 2bt3 n ARG 291 Ca -0.02 -0.28 0.09 0.00 -0.77 0.00 0.00 57.85 56.87 2bt3 n ARG 291 Cb 0.33 -0.72 0.39 0.00 -1.02 0.00 0.00 32.46 31.44 2bt3 n ARG 291 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2bt3 n SER 292 N -0.02 0.32 -0.13 0.55 3.41 0.79 -1.50 113.62 117.03 2bt3 n SER 292 Ca 0.00 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.32 2bt3 n SER 292 Cb 0.16 -0.65 0.48 0.00 -0.26 0.00 0.00 64.21 63.95 2bt3 n SER 292 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 2bt3 n TRP 293 N -1.85 0.00 -2.46 7.33 4.27 -1.26 -4.93 117.44 118.54 2bt3 n TRP 293 Ca 0.03 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.21 2bt3 n TRP 293 Cb 0.19 -0.19 -0.02 0.00 -1.36 0.00 0.00 31.31 29.93 2bt3 n TRP 293 CO 0.00 0.00 0.00 -0.65 -2.29 0.00 0.00 177.69 174.75 2bt3 s GLN 294 N -2.59 3.74 -0.21 -2.67 -0.21 -0.57 -4.71 119.66 112.44 2bt3 s GLN 294 Ca 0.24 0.93 -0.04 0.00 0.02 0.00 0.00 55.36 56.51 2bt3 s GLN 294 Cb 0.19 -3.93 0.10 0.00 1.00 0.00 0.00 33.01 30.37 2bt3 s GLN 294 CO 0.52 -1.35 0.27 -0.80 -2.12 0.00 0.00 175.29 171.81 2bt3 s ASN 295 N 3.07 1.05 -0.38 5.90 0.01 -1.26 -2.29 114.94 121.03 2bt3 s ASN 295 Ca 0.55 -0.09 -0.15 0.00 -0.71 0.00 0.00 52.86 52.46 2bt3 s ASN 295 Cb -0.13 0.59 0.01 0.00 0.41 0.00 0.00 41.25 42.13 2bt3 s ASN 295 CO 0.29 -0.32 0.34 -0.31 -1.51 0.00 0.00 177.10 175.59 2bt3 s TYR 296 N 2.39 3.21 -1.03 2.20 2.02 -0.72 -4.86 117.35 120.56 2bt3 s TYR 296 Ca 0.08 -0.32 -0.18 0.00 -0.37 0.00 0.00 57.07 56.28 2bt3 s TYR 296 Cb -0.16 -2.67 0.12 0.00 -0.40 0.00 0.00 41.96 38.86 2bt3 s TYR 296 CO -0.13 -0.54 1.28 -0.06 -1.57 0.00 0.00 175.55 174.53 2bt3 s PHE 297 N 1.89 3.10 0.29 2.71 0.40 -1.26 -0.48 117.98 124.63 2bt3 s PHE 297 Ca 0.09 -1.49 -0.01 0.00 -0.60 0.00 0.00 56.93 54.91 2bt3 s PHE 297 Cb -0.18 -4.38 0.46 0.00 0.51 0.00 0.00 43.02 39.44 2bt3 s PHE 297 CO 0.11 -1.55 1.92 -0.44 0.70 0.00 0.00 175.22 175.96 2bt3 h ASP 298 N 8.53 0.97 0.13 1.36 3.45 -1.73 0.60 116.42 129.72 2bt3 h ASP 298 Ca 0.22 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.67 2bt3 h ASP 298 Cb 0.98 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.54 2bt3 h ASP 298 CO 1.20 0.65 -0.06 0.74 -1.57 0.00 0.00 179.24 180.20 2bt3 h THR 299 N 1.12 0.59 -0.05 0.35 2.02 -1.86 -0.75 112.91 114.32 2bt3 h THR 299 Ca 0.38 -1.20 -0.19 0.00 0.77 0.00 0.00 66.41 66.18 2bt3 h THR 299 Cb 0.10 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 2bt3 h THR 299 CO -0.13 0.18 -0.77 1.23 0.37 0.00 0.00 175.52 176.39 2bt3 h GLY 300 N -0.98 0.39 0.37 2.16 0.00 -1.80 -2.40 103.07 100.81 2bt3 h GLY 300 Ca -0.02 -0.58 -0.37 0.00 0.00 0.00 0.00 47.33 46.36 2bt3 h GLY 300 CO 0.03 0.52 -2.11 1.18 0.00 0.00 0.00 176.54 176.15 2bt3 n GLU 301 N -3.80 0.71 -0.08 4.80 1.02 0.19 -4.49 120.64 118.99 2bt3 n GLU 301 Ca -0.04 0.25 -0.06 0.00 -0.02 0.00 0.00 57.16 57.29 2bt3 n GLU 301 Cb 0.73 -1.65 -0.16 0.00 -0.02 0.00 0.00 31.44 30.35 2bt3 n GLU 301 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2bt3 n TYR 302 N -3.51 0.00 -1.77 -0.32 4.02 -1.09 -1.20 117.16 113.30 2bt3 n TYR 302 Ca -0.37 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.51 2bt3 n TYR 302 Cb 1.00 -0.87 -0.01 0.00 -0.02 0.00 0.00 39.34 39.44 2bt3 n TYR 302 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2bt3 n LEU 303 N -2.63 -3.18 0.17 7.72 4.77 -0.31 -4.83 117.00 118.70 2bt3 n LEU 303 Ca -0.27 0.43 0.01 0.00 -0.03 0.00 0.00 56.01 56.16 2bt3 n LEU 303 Cb 1.03 -1.54 0.30 0.00 -2.33 0.00 0.00 43.42 40.88 2bt3 n LEU 303 CO 0.42 -0.84 0.66 -0.37 -1.33 0.00 0.00 177.39 175.93 2bt3 h VAL 304 N 0.82 1.31 -0.88 4.08 -1.51 -1.49 -2.74 116.25 115.85 2bt3 h VAL 304 Ca -0.06 -1.49 0.01 0.00 -1.23 0.00 0.00 66.70 63.92 2bt3 h VAL 304 Cb 0.14 1.79 -0.04 0.00 -2.13 0.00 0.00 31.29 31.05 2bt3 h VAL 304 CO 0.01 0.43 0.58 1.23 -1.23 0.00 0.00 177.57 178.59 2bt3 h GLY 305 N 1.29 1.23 2.00 5.19 0.00 -0.97 -2.86 103.07 108.96 2bt3 h GLY 305 Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2bt3 h GLY 305 CO 0.06 0.45 -0.11 0.06 0.00 0.00 0.00 176.54 177.00 2bt3 h GLN 306 N 1.19 0.00 -0.45 4.80 3.07 -1.10 -2.58 115.11 120.03 2bt3 h GLN 306 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.06 2bt3 h GLN 306 Cb -0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.43 2bt3 h GLN 306 CO -0.07 0.11 0.00 0.66 0.09 0.00 0.00 178.83 179.62 2bt3 n TYR 307 N -3.41 1.33 -1.69 0.06 4.01 -1.09 -4.99 117.16 111.39 2bt3 n TYR 307 Ca -0.01 -0.73 -0.44 0.00 -0.16 0.00 0.00 57.90 56.56 2bt3 n TYR 307 Cb 0.28 -0.32 -0.03 0.00 -0.31 0.00 0.00 39.34 38.96 2bt3 n TYR 307 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bt3 n ALA 308 N 0.32 1.58 -1.77 -0.72 0.00 -0.97 -2.55 120.51 116.39 2bt3 n ALA 308 Ca 0.23 0.41 -0.34 0.00 0.00 0.00 0.00 53.44 53.74 2bt3 n ALA 308 Cb 0.92 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 2bt3 n ALA 308 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2bt3 s ASN 309 N 0.45 6.08 -0.24 0.00 0.02 0.13 -4.95 114.94 116.44 2bt3 s ASN 309 Ca 0.69 1.98 -0.29 0.00 -1.02 0.00 0.00 52.86 54.22 2bt3 s ASN 309 Cb -0.61 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.10 2bt3 s ASN 309 CO 0.47 -0.96 1.13 -0.44 0.02 0.00 0.00 177.10 177.32 2bt3 s SER 310 N -2.03 6.97 -0.27 -1.22 0.01 -1.26 -4.30 113.70 111.61 2bt3 s SER 310 Ca 0.68 1.36 -0.15 0.00 1.31 0.00 0.00 55.95 59.16 2bt3 s SER 310 Cb -0.18 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.47 2bt3 s SER 310 CO 0.24 -0.79 0.37 -0.76 0.41 0.00 0.00 173.24 172.71 2bt3 s LEU 311 N 3.52 4.04 0.11 2.44 1.43 -0.54 -5.00 118.68 124.67 2bt3 s LEU 311 Ca 0.48 0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 53.68 2bt3 s LEU 311 Cb -0.16 -2.42 -0.07 0.00 0.03 0.00 0.00 46.19 43.57 2bt3 s LEU 311 CO 0.12 -0.17 0.61 -1.61 0.23 0.00 0.00 176.35 175.53 2bt3 s GLU 312 N 2.03 4.21 0.27 1.70 0.41 -1.26 -4.89 118.70 121.17 2bt3 s GLU 312 Ca 0.15 0.76 -0.29 0.00 -0.41 0.00 0.00 54.97 55.17 2bt3 s GLU 312 Cb -0.16 -3.15 -0.09 0.00 -1.78 0.00 0.00 34.13 28.95 2bt3 s GLU 312 CO 0.10 0.58 1.24 -1.17 -0.49 0.00 0.00 175.26 175.51 2bt3 s LEU 313 N -1.36 4.46 0.00 1.80 2.96 -1.26 -1.59 118.68 123.69 2bt3 s LEU 313 Ca 0.33 2.46 0.00 0.00 -0.22 0.00 0.00 54.13 56.70 2bt3 s LEU 313 Cb -0.19 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.87 2bt3 s LEU 313 CO 0.20 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.43 2bt3 n GLY 314 N 1.45 1.83 0.77 7.98 0.00 -0.97 -4.75 105.19 111.50 2bt3 n GLY 314 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 2bt3 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt3 h ASP 316 N -0.17 0.52 -3.20 0.00 3.32 -1.59 -3.45 116.42 111.85 2bt3 h ASP 316 Ca 0.00 -0.91 -0.52 0.00 0.02 0.00 0.00 57.03 55.63 2bt3 h ASP 316 Cb 0.17 -0.17 -0.37 0.00 0.22 0.00 0.00 39.33 39.18 2bt3 h ASP 316 CO 0.00 1.70 -0.80 0.00 -1.72 0.00 0.00 179.24 178.43 2bt3 s LEU 318 N 1.74 3.29 0.00 0.00 2.96 -1.26 -2.30 118.68 123.11 2bt3 s LEU 318 Ca 0.05 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.93 2bt3 s LEU 318 Cb -0.13 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.77 2bt3 s LEU 318 CO -0.08 0.33 0.00 0.61 -1.32 0.00 0.00 176.35 175.89 2bt3 n GLY 319 N 1.90 -0.42 3.45 7.98 0.00 -1.26 -4.88 105.19 111.97 2bt3 n GLY 319 Ca -0.17 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.33 2bt3 n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bt3 s ASP 320 N -4.00 6.21 -0.14 1.61 -1.08 -1.26 -4.93 116.67 113.08 2bt3 s ASP 320 Ca 0.00 -1.09 -0.05 0.00 -0.52 0.00 0.00 52.55 50.90 2bt3 s ASP 320 Cb 0.00 -2.42 -0.04 0.00 -1.46 0.00 0.00 42.92 39.01 2bt3 s ASP 320 CO 0.00 -1.41 0.03 -0.63 0.52 0.00 0.00 175.17 173.68 2bt3 s ILE 321 N 3.95 4.50 -0.21 4.11 -1.09 -1.26 -4.63 121.20 126.57 2bt3 s ILE 321 Ca 0.23 -0.15 -0.06 0.00 -2.23 0.00 0.00 60.65 58.44 2bt3 s ILE 321 Cb -0.16 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.72 2bt3 s ILE 321 CO 0.08 0.53 0.02 -0.89 -1.23 0.00 0.00 174.94 173.45 2bt3 s THR 322 N -0.14 4.12 -0.00 2.92 2.01 0.12 -4.97 115.64 119.70 2bt3 s THR 322 Ca 0.06 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 61.79 2bt3 s THR 322 Cb -0.12 -2.87 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 2bt3 s THR 322 CO 0.02 0.41 0.15 -0.31 -0.69 0.00 0.00 174.62 174.20 2bt3 s TYR 323 N 1.05 3.45 0.05 4.92 2.02 -1.26 -0.65 117.35 126.93 2bt3 s TYR 323 Ca 0.03 0.29 0.04 0.00 -0.37 0.00 0.00 57.07 57.05 2bt3 s TYR 323 Cb -0.14 -1.79 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 2bt3 s TYR 323 CO 0.02 0.61 -0.01 -0.51 -1.57 0.00 0.00 175.55 174.09 2bt3 s LEU 324 N -1.93 3.44 -0.56 -1.29 1.43 -0.41 -5.00 118.68 114.37 2bt3 s LEU 324 Ca 0.26 -0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 2bt3 s LEU 324 Cb -0.12 -2.09 0.15 0.00 0.03 0.00 0.00 46.19 44.15 2bt3 s LEU 324 CO 0.18 0.22 0.35 -0.44 0.23 0.00 0.00 176.35 176.89 2bt3 s SER 325 N -1.97 4.06 0.57 2.29 0.01 -1.26 -1.91 113.70 115.48 2bt3 s SER 325 Ca 0.23 -3.24 -0.19 0.00 1.31 0.00 0.00 55.95 54.05 2bt3 s SER 325 Cb -0.12 -1.37 -0.05 0.00 0.21 0.00 0.00 66.02 64.69 2bt3 s SER 325 CO 0.15 -0.18 1.18 -2.16 0.41 0.00 0.00 173.24 172.63 2bt3 s PRO 326 N -0.54 3.16 -0.12 12.44 0.04 -1.22 -4.63 135.00 144.13 2bt3 s PRO 326 Ca 0.22 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 62.98 2bt3 s PRO 326 Cb -0.15 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2bt3 s PRO 326 CO -0.08 -1.04 -0.04 0.08 0.04 0.00 0.00 177.00 175.96 2bt3 s VAL 327 N -1.66 3.86 0.34 -0.36 1.01 -1.26 -0.76 120.40 121.58 2bt3 s VAL 327 Ca 0.75 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.39 2bt3 s VAL 327 Cb -0.28 -2.65 -0.07 0.00 0.00 0.00 0.00 36.38 33.39 2bt3 s VAL 327 CO 0.31 0.54 0.04 0.27 0.00 0.00 0.00 175.10 176.26 2bt3 s ILE 328 N -0.15 1.37 0.04 2.22 -4.36 -0.18 -4.82 121.20 115.33 2bt3 s ILE 328 Ca 0.03 -2.01 -0.18 0.00 -0.26 0.00 0.00 60.65 58.23 2bt3 s ILE 328 Cb -0.13 -2.82 -0.06 0.00 1.25 0.00 0.00 42.46 40.70 2bt3 s ILE 328 CO 0.03 -0.01 0.53 -0.55 0.24 0.00 0.00 174.94 175.17 2bt3 s SER 329 N -3.53 6.99 1.00 4.36 0.15 -1.26 -0.16 113.70 121.25 2bt3 s SER 329 Ca 0.36 1.17 -0.06 0.00 0.70 0.00 0.00 55.95 58.12 2bt3 s SER 329 Cb 0.09 -2.33 0.08 0.00 -1.71 0.00 0.00 66.02 62.14 2bt3 s SER 329 CO 0.16 0.27 0.44 -0.90 1.20 0.00 0.00 173.24 174.41 2bt3 n ASP 330 N 1.86 -0.02 0.24 5.45 5.68 0.05 -4.89 116.55 124.92 2bt3 n ASP 330 Ca -0.11 -1.14 0.16 0.00 -0.50 0.00 0.00 54.79 53.20 2bt3 n ASP 330 Cb 0.51 -0.34 0.75 0.00 -1.14 0.00 0.00 41.12 40.90 2bt3 n ASP 330 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bt3 h ALA 331 N -1.94 1.00 -0.03 2.12 0.00 -1.89 -2.75 119.26 115.76 2bt3 h ALA 331 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2bt3 h ALA 331 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2bt3 h ALA 331 CO 0.10 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.54 2bt3 n PHE 332 N -2.75 0.02 -0.28 0.00 3.72 -1.26 0.43 117.46 117.33 2bt3 n PHE 332 Ca -0.00 -0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2bt3 n PHE 332 Cb 0.19 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 2bt3 n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bt3 n GLY 333 N 0.88 0.78 3.77 1.37 0.00 -1.04 -4.94 105.19 106.02 2bt3 n GLY 333 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2bt3 n GLY 333 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bt3 s ASN 334 N -2.35 7.46 0.37 1.61 0.01 -1.26 -4.33 114.94 116.46 2bt3 s ASN 334 Ca 0.00 1.78 -0.27 0.00 -0.71 0.00 0.00 52.86 53.66 2bt3 s ASN 334 Cb 0.00 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.02 2bt3 s ASN 334 CO 0.00 0.14 1.21 -2.16 -1.51 0.00 0.00 177.10 174.78 2bt3 s PRO 335 N -1.35 4.17 -0.05 -0.60 0.04 -1.26 -0.77 135.00 135.18 2bt3 s PRO 335 Ca 0.40 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.41 2bt3 s PRO 335 Cb -0.23 -2.83 0.02 0.00 0.04 0.00 0.00 34.50 31.50 2bt3 s PRO 335 CO 0.28 -0.26 -0.02 0.50 0.04 0.00 0.00 177.00 177.53 2bt3 s ARG 336 N -2.09 0.67 -0.01 4.56 3.00 0.78 -4.85 118.95 121.01 2bt3 s ARG 336 Ca 0.54 -0.01 -0.19 0.00 -1.00 0.00 0.00 55.73 55.07 2bt3 s ARG 336 Cb -0.34 -0.81 -0.05 0.00 0.00 0.00 0.00 34.95 33.74 2bt3 s ARG 336 CO 0.43 -0.15 0.55 -2.00 0.00 0.00 0.00 175.30 174.13 2bt3 s GLU 337 N 1.23 4.25 -0.74 5.12 2.12 -1.26 -1.01 118.70 128.41 2bt3 s GLU 337 Ca -0.06 0.64 -0.17 0.00 0.36 0.00 0.00 54.97 55.74 2bt3 s GLU 337 Cb -0.14 -3.32 0.15 0.00 0.26 0.00 0.00 34.13 31.08 2bt3 s GLU 337 CO -0.02 0.42 0.82 0.42 -0.54 0.00 0.00 175.26 176.36 2bt3 s ILE 338 N -0.32 5.07 0.15 -3.70 1.01 0.06 -4.99 121.20 118.48 2bt3 s ILE 338 Ca 0.29 -1.63 -0.31 0.00 0.00 0.00 0.00 60.65 58.99 2bt3 s ILE 338 Cb -0.18 -4.55 -0.10 0.00 0.01 0.00 0.00 42.46 37.65 2bt3 s ILE 338 CO 0.16 -1.18 1.61 -0.60 0.00 0.00 0.00 174.94 174.94 2bt3 s ARG 339 N 1.83 4.20 -1.46 2.79 3.52 -1.26 -2.59 118.95 125.98 2bt3 s ARG 339 Ca 0.18 2.39 -0.10 0.00 -0.13 0.00 0.00 55.73 58.07 2bt3 s ARG 339 Cb -0.15 -3.25 0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2bt3 s ARG 339 CO -0.03 -0.66 0.95 0.09 -0.81 0.00 0.00 175.30 174.85 2bt3 n ASN 340 N 4.37 -4.20 0.20 -2.12 3.02 -1.25 -4.18 115.26 111.10 2bt3 n ASN 340 Ca 0.15 -0.76 0.11 0.00 -0.03 0.00 0.00 54.58 54.05 2bt3 n ASN 340 Cb 0.38 -4.08 0.14 0.00 -0.61 0.00 0.00 39.78 35.62 2bt3 n ASN 340 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2bt3 h GLY 341 N -2.12 0.00 -6.03 7.41 0.00 -1.16 -1.44 103.07 99.73 2bt3 h GLY 341 Ca -0.59 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.17 2bt3 h GLY 341 CO 0.63 0.00 -0.83 -0.42 0.00 0.00 0.00 176.54 175.92 2bt3 s ILE 342 N -3.18 1.42 -0.08 2.60 1.01 -0.80 -4.52 121.20 117.65 2bt3 s ILE 342 Ca 0.06 -0.59 -0.09 0.00 0.00 0.00 0.00 60.65 60.02 2bt3 s ILE 342 Cb 0.05 -1.31 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 2bt3 s ILE 342 CO 0.68 0.42 0.23 0.00 0.00 0.00 0.00 174.94 176.28 2bt3 s MET 344 N -1.08 0.81 0.15 0.00 -1.94 0.18 -1.41 119.30 116.01 2bt3 s MET 344 Ca 0.18 -0.03 -0.22 0.00 -1.71 0.00 0.00 55.69 53.92 2bt3 s MET 344 Cb -0.14 -0.98 0.06 0.00 2.01 0.00 0.00 34.83 35.79 2bt3 s MET 344 CO 0.07 -0.20 0.56 -3.38 -0.01 0.00 0.00 175.02 172.07 2bt3 s HIS 345 N 1.45 -0.47 0.05 -0.03 -3.43 -0.83 -0.70 115.29 111.33 2bt3 s HIS 345 Ca -0.02 0.25 0.01 0.00 -0.80 0.00 0.00 55.06 54.50 2bt3 s HIS 345 Cb -0.13 0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 31.47 2bt3 s HIS 345 CO -0.03 -0.81 0.11 -1.83 -2.00 0.00 0.00 174.74 170.17 2bt3 s GLU 346 N -3.71 3.06 0.04 -0.38 -1.05 -1.26 -0.08 118.70 115.32 2bt3 s GLU 346 Ca 0.01 -0.56 -0.02 0.00 -0.15 0.00 0.00 54.97 54.25 2bt3 s GLU 346 Cb -0.00 -2.84 -0.03 0.00 -0.44 0.00 0.00 34.13 30.82 2bt3 s GLU 346 CO -0.12 0.60 -0.00 -1.83 0.95 0.00 0.00 175.26 174.86 2bt3 s GLU 347 N -2.18 0.49 0.46 -4.83 -1.05 -0.39 -4.90 118.70 106.30 2bt3 s GLU 347 Ca 0.28 -0.88 -0.24 0.00 -0.15 0.00 0.00 54.97 53.98 2bt3 s GLU 347 Cb -0.12 0.18 -0.07 0.00 -0.44 0.00 0.00 34.13 33.67 2bt3 s GLU 347 CO 0.20 -0.10 1.29 0.34 0.95 0.00 0.00 175.26 177.94 2bt3 s ASP 348 N -2.18 5.98 -0.30 0.83 2.15 -1.26 -1.20 116.67 120.69 2bt3 s ASP 348 Ca -0.04 2.60 0.17 0.00 0.43 0.00 0.00 52.55 55.71 2bt3 s ASP 348 Cb -0.01 -2.63 0.48 0.00 -0.30 0.00 0.00 42.92 40.46 2bt3 s ASP 348 CO -0.05 -1.07 1.07 1.87 -0.17 0.00 0.00 175.17 176.82 2bt3 n TRP 349 N -0.35 1.65 -4.50 -5.34 -0.00 0.06 -4.79 117.44 104.18 2bt3 n TRP 349 Ca 0.06 -2.46 0.00 0.00 -0.00 0.00 0.00 57.50 55.11 2bt3 n TRP 349 Cb 0.45 -0.28 0.00 0.00 -0.00 0.00 0.00 31.31 31.48 2bt3 n TRP 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2bt3 n GLY 350 N -0.43 0.07 3.73 5.87 0.00 -1.26 -4.39 105.19 108.78 2bt3 n GLY 350 Ca 0.16 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 2bt3 n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bt3 s ILE 351 N 0.00 4.40 -0.19 -0.61 -1.09 -1.26 -0.26 121.20 122.20 2bt3 s ILE 351 Ca 0.00 1.98 -0.17 0.00 -2.23 0.00 0.00 60.65 60.23 2bt3 s ILE 351 Cb 0.00 -4.27 -0.21 0.00 -1.58 0.00 0.00 42.46 36.41 2bt3 s ILE 351 CO 0.00 0.30 0.23 -0.11 -1.23 0.00 0.00 174.94 174.13 2bt3 n LEU 352 N 2.81 2.09 -3.57 2.97 7.94 0.54 -4.54 117.00 125.23 2bt3 n LEU 352 Ca 0.03 0.36 -0.16 0.00 -1.11 0.00 0.00 56.01 55.12 2bt3 n LEU 352 Cb 0.49 -1.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.37 2bt3 n LEU 352 CO 0.52 0.45 0.43 0.00 -1.11 0.00 0.00 177.39 177.68 2bt3 s ALA 353 N -2.42 -1.77 -0.24 1.96 0.00 -1.15 -4.96 121.76 113.18 2bt3 s ALA 353 Ca -0.28 1.61 -0.15 0.00 0.00 0.00 0.00 51.96 53.15 2bt3 s ALA 353 Cb 0.06 -0.50 0.07 0.00 0.00 0.00 0.00 23.12 22.75 2bt3 s ALA 353 CO 0.64 -0.36 0.60 0.21 0.00 0.00 0.00 175.76 176.85 2bt3 s LYS 354 N -0.52 0.63 -0.18 0.00 2.20 -1.26 -1.18 119.74 119.43 2bt3 s LYS 354 Ca -0.06 1.04 -0.12 0.00 -0.36 0.00 0.00 55.97 56.47 2bt3 s LYS 354 Cb -0.02 0.14 0.05 0.00 -1.51 0.00 0.00 37.83 36.49 2bt3 s LYS 354 CO 0.06 -0.14 0.44 -1.58 -0.36 0.00 0.00 175.35 173.77 2bt3 s HIS 355 N 1.33 -0.58 -0.33 4.03 2.46 -0.44 -5.02 115.29 116.73 2bt3 s HIS 355 Ca -0.08 1.30 -0.01 0.00 0.47 0.00 0.00 55.06 56.74 2bt3 s HIS 355 Cb -0.06 0.25 0.07 0.00 -0.13 0.00 0.00 32.58 32.71 2bt3 s HIS 355 CO -0.14 -0.31 0.06 -1.12 -2.47 0.00 0.00 174.74 170.76 2bt3 s SER 356 N 0.92 4.97 -0.19 9.88 0.01 -1.26 -1.29 113.70 126.73 2bt3 s SER 356 Ca -0.05 -1.57 -0.16 0.00 1.31 0.00 0.00 55.95 55.47 2bt3 s SER 356 Cb -0.06 -1.73 -0.04 0.00 0.21 0.00 0.00 66.02 64.40 2bt3 s SER 356 CO -0.07 -0.35 0.40 -0.62 0.41 0.00 0.00 173.24 173.00 2bt3 s ASP 357 N 1.38 6.46 0.06 2.44 2.15 -0.65 -4.98 116.67 123.54 2bt3 s ASP 357 Ca 0.00 0.55 -0.24 0.00 0.43 0.00 0.00 52.55 53.29 2bt3 s ASP 357 Cb -0.21 -2.23 -0.16 0.00 -0.30 0.00 0.00 42.92 40.02 2bt3 s ASP 357 CO -0.03 -0.05 1.62 0.25 -0.17 0.00 0.00 175.17 176.79 2bt3 h LEU 358 N 7.44 0.01 -0.42 -1.34 5.85 -1.96 -2.11 115.31 122.78 2bt3 h LEU 358 Ca -0.37 -0.12 -0.18 0.00 0.84 0.00 0.00 57.88 58.05 2bt3 h LEU 358 Cb 1.16 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 2bt3 h LEU 358 CO 0.73 0.13 -0.60 -0.50 -0.34 0.00 0.00 178.44 177.86 2bt3 h TRP 359 N -0.11 0.80 0.00 1.25 6.55 -1.98 -3.23 115.95 119.23 2bt3 h TRP 359 Ca 0.00 -0.30 0.00 0.00 0.95 0.00 0.00 58.89 59.54 2bt3 h TRP 359 Cb 0.12 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 28.28 2bt3 h TRP 359 CO -0.03 1.07 -0.85 0.66 -1.05 0.00 0.00 178.44 178.23 2bt3 h SER 360 N 0.46 0.00 0.00 -3.49 4.64 -1.99 -3.47 113.55 109.70 2bt3 h SER 360 Ca -0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2bt3 h SER 360 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2bt3 h SER 360 CO 0.12 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 2bt3 n GLY 361 N 1.21 0.63 3.70 -0.77 0.00 -0.79 -5.00 105.19 104.17 2bt3 n GLY 361 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2bt3 n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bt3 s ILE 362 N -2.78 5.13 -0.14 -0.61 1.01 -1.25 -4.88 121.20 117.67 2bt3 s ILE 362 Ca 0.00 1.05 -0.03 0.00 0.00 0.00 0.00 60.65 61.67 2bt3 s ILE 362 Cb 0.00 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 2bt3 s ILE 362 CO 0.00 0.25 -0.05 0.20 0.00 0.00 0.00 174.94 175.34 2bt3 s ASN 363 N 0.86 4.68 -0.02 3.58 0.01 -1.26 -1.64 114.94 121.15 2bt3 s ASN 363 Ca 0.27 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.28 2bt3 s ASN 363 Cb -0.16 -1.71 0.02 0.00 0.41 0.00 0.00 41.25 39.82 2bt3 s ASN 363 CO 0.11 0.19 0.00 -0.47 -1.51 0.00 0.00 177.10 175.42 2bt3 s TYR 364 N 0.25 0.25 -0.05 2.20 5.04 -0.41 -5.02 117.35 119.61 2bt3 s TYR 364 Ca -0.04 0.01 -0.03 0.00 -2.44 0.00 0.00 57.07 54.57 2bt3 s TYR 364 Cb -0.14 -0.34 0.02 0.00 0.35 0.00 0.00 41.96 41.85 2bt3 s TYR 364 CO 0.03 -0.10 0.11 0.99 -1.34 0.00 0.00 175.55 175.24 2bt3 s THR 365 N 0.85 -0.02 0.04 4.34 2.01 -1.26 -1.33 115.64 120.27 2bt3 s THR 365 Ca -0.08 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.01 2bt3 s THR 365 Cb -0.12 -0.18 -0.02 0.00 0.01 0.00 0.00 72.50 72.20 2bt3 s THR 365 CO -0.02 0.03 -0.09 -0.13 -0.69 0.00 0.00 174.62 173.72 2bt3 s ARG 366 N 0.45 0.61 0.05 4.92 1.81 -0.33 -4.70 118.95 121.76 2bt3 s ARG 366 Ca -0.03 -0.72 -0.04 0.00 -1.72 0.00 0.00 55.73 53.21 2bt3 s ARG 366 Cb -0.05 -0.47 -0.05 0.00 -0.45 0.00 0.00 34.95 33.94 2bt3 s ARG 366 CO -0.02 0.10 0.28 1.03 -0.68 0.00 0.00 175.30 176.01 2bt3 s ARG 367 N -1.39 3.55 0.30 3.54 1.81 -1.26 -0.34 118.95 125.16 2bt3 s ARG 367 Ca -0.06 -0.17 0.01 0.00 -1.72 0.00 0.00 55.73 53.79 2bt3 s ARG 367 Cb -0.09 -3.01 -0.03 0.00 -0.45 0.00 0.00 34.95 31.36 2bt3 s ARG 367 CO 0.01 0.60 0.48 1.21 -0.68 0.00 0.00 175.30 176.91 2bt3 s ASN 368 N -2.07 6.31 0.14 0.23 2.47 0.64 -4.54 114.94 118.12 2bt3 s ASN 368 Ca 0.32 0.35 -0.10 0.00 0.42 0.00 0.00 52.86 53.85 2bt3 s ASN 368 Cb -0.13 -1.99 0.00 0.00 -1.45 0.00 0.00 41.25 37.69 2bt3 s ASN 368 CO 0.21 -0.21 0.29 0.00 -3.72 0.00 0.00 177.10 173.67 2bt3 s ARG 369 N -4.10 1.06 0.02 0.43 1.70 -1.26 -0.76 118.95 116.04 2bt3 s ARG 369 Ca 0.38 -1.02 0.02 0.00 -0.47 0.00 0.00 55.73 54.65 2bt3 s ARG 369 Cb -0.10 0.39 -0.01 0.00 -0.57 0.00 0.00 34.95 34.66 2bt3 s ARG 369 CO 0.33 -0.38 -0.08 -0.98 -1.08 0.00 0.00 175.30 173.11 2bt3 s ARG 370 N -3.90 0.55 0.02 3.89 1.70 -0.34 -2.85 118.95 118.01 2bt3 s ARG 370 Ca 0.11 -0.50 -0.24 0.00 -0.47 0.00 0.00 55.73 54.63 2bt3 s ARG 370 Cb 0.03 -0.44 -0.05 0.00 -0.57 0.00 0.00 34.95 33.92 2bt3 s ARG 370 CO -0.05 0.11 0.72 1.41 -1.08 0.00 0.00 175.30 176.40 2bt3 s MET 371 N -0.85 4.44 -0.12 3.89 -2.45 0.13 -1.26 119.30 123.08 2bt3 s MET 371 Ca -0.03 0.96 0.02 0.00 -1.25 0.00 0.00 55.69 55.40 2bt3 s MET 371 Cb -0.06 -3.37 0.00 0.00 1.25 0.00 0.00 34.83 32.65 2bt3 s MET 371 CO 0.00 0.27 -0.21 0.08 1.05 0.00 0.00 175.02 176.22 2bt3 s VAL 372 N 0.03 2.29 -0.16 10.11 1.01 0.89 -1.51 120.40 133.06 2bt3 s VAL 372 Ca 0.37 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2bt3 s VAL 372 Cb -0.20 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.30 2bt3 s VAL 372 CO 0.21 0.55 -0.13 -0.63 0.00 0.00 0.00 175.10 175.09 2bt3 s ILE 373 N 0.55 1.59 0.07 2.22 1.01 -0.25 -1.97 121.20 124.42 2bt3 s ILE 373 Ca -0.12 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.74 2bt3 s ILE 373 Cb -0.17 -1.54 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 2bt3 s ILE 373 CO 0.04 0.38 0.09 -0.94 0.00 0.00 0.00 174.94 174.52 2bt3 s SER 374 N 1.46 0.28 0.16 3.58 1.04 -0.50 -1.25 113.70 118.47 2bt3 s SER 374 Ca 0.03 -0.81 -0.06 0.00 0.48 0.00 0.00 55.95 55.59 2bt3 s SER 374 Cb -0.14 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 2bt3 s SER 374 CO -0.10 -0.67 0.21 0.72 0.98 0.00 0.00 173.24 174.37 2bt3 s PHE 375 N -3.89 0.59 -0.03 5.02 -0.71 -0.96 -0.79 117.98 117.20 2bt3 s PHE 375 Ca 0.06 -0.95 0.02 0.00 -1.04 0.00 0.00 56.93 55.03 2bt3 s PHE 375 Cb 0.06 -0.21 0.01 0.00 -1.21 0.00 0.00 43.02 41.67 2bt3 s PHE 375 CO -0.10 -0.66 -0.09 0.12 -1.34 0.00 0.00 175.22 173.15 2bt3 s PHE 376 N -4.00 0.98 0.23 3.49 2.19 -1.26 -1.06 117.98 118.54 2bt3 s PHE 376 Ca 0.21 -0.26 0.09 0.00 0.33 0.00 0.00 56.93 57.30 2bt3 s PHE 376 Cb 0.05 -0.71 -0.05 0.00 -1.31 0.00 0.00 43.02 41.00 2bt3 s PHE 376 CO 0.01 -0.13 -0.16 -0.08 1.83 0.00 0.00 175.22 176.70 2bt3 s THR 377 N 0.31 1.97 -0.10 0.12 -1.32 0.39 0.20 115.64 117.21 2bt3 s THR 377 Ca -0.05 -2.27 0.01 0.00 -1.21 0.00 0.00 61.69 58.17 2bt3 s THR 377 Cb -0.10 -2.12 0.02 0.00 -1.51 0.00 0.00 72.50 68.79 2bt3 s THR 377 CO 0.01 -0.53 -0.12 -0.89 -2.21 0.00 0.00 174.62 170.87 2bt3 s THR 378 N -2.82 1.28 -0.44 5.08 2.01 -1.06 -1.32 115.64 118.38 2bt3 s THR 378 Ca 0.25 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.77 2bt3 s THR 378 Cb -0.02 -1.20 0.12 0.00 0.01 0.00 0.00 72.50 71.41 2bt3 s THR 378 CO 0.09 0.40 0.20 -0.63 -0.69 0.00 0.00 174.62 173.99 2bt3 s ILE 379 N 1.13 1.98 0.00 1.82 -1.09 -1.26 -4.81 121.20 118.97 2bt3 s ILE 379 Ca -0.05 -2.72 0.00 0.00 -2.23 0.00 0.00 60.65 55.65 2bt3 s ILE 379 Cb -0.14 -2.40 0.00 0.00 -1.58 0.00 0.00 42.46 38.33 2bt3 s ILE 379 CO -0.03 -0.78 0.00 0.61 -1.23 0.00 0.00 174.94 173.51 2bt3 n GLY 380 N 3.61 2.46 1.19 6.18 0.00 -1.26 -4.75 105.19 112.63 2bt3 n GLY 380 Ca 0.05 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2bt3 n GLY 380 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bt3 n ASN 381 N 10.53 3.47 -3.65 1.61 6.94 -1.26 -4.99 115.26 127.91 2bt3 n ASN 381 Ca 0.00 -1.98 0.03 0.00 -0.02 0.00 0.00 54.58 52.61 2bt3 n ASN 381 Cb 0.00 -0.65 -0.06 0.00 -2.36 0.00 0.00 39.78 36.71 2bt3 n ASN 381 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2bt3 s ASP 383 N 1.35 -0.04 -0.05 0.53 1.11 -0.92 -0.94 116.67 117.72 2bt3 s ASP 383 Ca 0.00 0.06 0.03 0.00 0.18 0.00 0.00 52.55 52.83 2bt3 s ASP 383 Cb 0.00 1.01 0.00 0.00 1.07 0.00 0.00 42.92 45.00 2bt3 s ASP 383 CO 0.00 -0.01 -0.14 -0.31 1.18 0.00 0.00 175.17 175.89 2bt3 s TYR 384 N 1.02 1.49 -0.19 4.23 2.02 -0.43 -1.01 117.35 124.48 2bt3 s TYR 384 Ca -0.08 -0.46 -0.11 0.00 -0.37 0.00 0.00 57.07 56.05 2bt3 s TYR 384 Cb -0.02 -1.04 -0.05 0.00 -0.40 0.00 0.00 41.96 40.45 2bt3 s TYR 384 CO -0.10 -0.19 0.17 0.20 -1.57 0.00 0.00 175.55 174.06 2bt3 s GLY 385 N 0.27 2.08 -0.25 0.71 0.00 0.02 -0.46 107.32 109.69 2bt3 s GLY 385 Ca -0.07 -0.64 -0.05 0.00 0.00 0.00 0.00 44.72 43.95 2bt3 s GLY 385 CO 0.02 0.22 0.02 -1.36 0.00 0.00 0.00 173.10 172.00 2bt3 s PHE 386 N 0.42 3.05 -0.13 1.90 0.40 -0.22 -0.48 117.98 122.92 2bt3 s PHE 386 Ca 0.10 -0.88 0.02 0.00 -0.60 0.00 0.00 56.93 55.57 2bt3 s PHE 386 Cb -0.12 -2.17 0.01 0.00 0.51 0.00 0.00 43.02 41.26 2bt3 s PHE 386 CO -0.00 -0.53 -0.18 0.71 0.70 0.00 0.00 175.22 175.92 2bt3 s TYR 387 N 1.50 2.34 -0.11 0.36 1.51 -0.03 -2.27 117.35 120.65 2bt3 s TYR 387 Ca 0.05 -1.19 -0.02 0.00 -1.01 0.00 0.00 57.07 54.89 2bt3 s TYR 387 Cb -0.15 -1.64 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 2bt3 s TYR 387 CO -0.00 -0.58 -0.02 -1.58 -1.11 0.00 0.00 175.55 172.25 2bt3 s TRP 388 N 1.01 3.08 -0.05 2.71 0.52 -0.38 -0.74 118.94 125.09 2bt3 s TRP 388 Ca -0.04 -0.01 0.05 0.00 0.02 0.00 0.00 56.10 56.11 2bt3 s TRP 388 Cb -0.15 -1.85 -0.00 0.00 -1.15 0.00 0.00 33.47 30.32 2bt3 s TRP 388 CO -0.04 0.25 -0.19 0.71 0.02 0.00 0.00 176.95 177.71 2bt3 s TYR 389 N -0.36 1.86 -0.12 -1.98 2.02 0.18 -1.09 117.35 117.86 2bt3 s TYR 389 Ca 0.06 -0.55 0.03 0.00 -0.37 0.00 0.00 57.07 56.25 2bt3 s TYR 389 Cb -0.12 -1.25 0.00 0.00 -0.40 0.00 0.00 41.96 40.19 2bt3 s TYR 389 CO 0.02 -0.18 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.09 2bt3 s LEU 390 N 0.02 2.16 0.21 -1.29 1.43 -0.57 -1.48 118.68 119.16 2bt3 s LEU 390 Ca -0.04 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 52.57 2bt3 s LEU 390 Cb -0.12 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2bt3 s LEU 390 CO 0.03 0.13 0.14 -0.31 0.23 0.00 0.00 176.35 176.57 2bt3 s TYR 391 N 0.50 3.06 0.36 0.29 2.02 -0.40 -0.70 117.35 122.48 2bt3 s TYR 391 Ca -0.14 -0.09 0.09 0.00 -0.37 0.00 0.00 57.07 56.55 2bt3 s TYR 391 Cb -0.17 -1.42 0.82 0.00 -0.40 0.00 0.00 41.96 40.79 2bt3 s TYR 391 CO 0.05 0.53 1.89 -0.07 -1.57 0.00 0.00 175.55 176.38 2bt3 h LEU 392 N 1.97 0.64 -0.35 -1.29 3.38 -1.85 -2.19 115.31 115.62 2bt3 h LEU 392 Ca -0.48 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2bt3 h LEU 392 Cb 1.22 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2bt3 h LEU 392 CO 0.61 0.34 0.00 -0.90 0.09 0.00 0.00 178.44 178.58 2bt3 n ASP 393 N -4.54 0.52 0.00 -0.43 5.75 -1.26 -4.76 116.55 111.83 2bt3 n ASP 393 Ca 0.16 -1.57 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 2bt3 n ASP 393 Cb 0.43 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 2bt3 n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bt3 n GLY 394 N 0.87 0.42 3.77 6.12 0.00 -0.82 -4.80 105.19 110.74 2bt3 n GLY 394 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2bt3 n GLY 394 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bt3 s THR 395 N -2.13 2.88 -0.07 2.61 2.01 -1.26 -4.49 115.64 115.19 2bt3 s THR 395 Ca 0.00 0.85 0.05 0.00 0.31 0.00 0.00 61.69 62.91 2bt3 s THR 395 Cb 0.00 -3.53 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 2bt3 s THR 395 CO 0.00 0.18 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.24 2bt3 s ILE 396 N -1.19 2.01 -0.00 1.82 1.01 -0.43 -1.27 121.20 123.14 2bt3 s ILE 396 Ca 0.50 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.11 2bt3 s ILE 396 Cb -0.37 -1.71 -0.00 0.00 0.01 0.00 0.00 42.46 40.38 2bt3 s ILE 396 CO 0.49 0.55 0.03 -0.70 0.00 0.00 0.00 174.94 175.31 2bt3 s GLU 397 N 0.04 0.17 -0.00 2.79 2.12 -0.55 -0.34 118.70 122.93 2bt3 s GLU 397 Ca -0.09 -0.18 0.06 0.00 0.36 0.00 0.00 54.97 55.11 2bt3 s GLU 397 Cb -0.15 0.07 -0.03 0.00 0.26 0.00 0.00 34.13 34.28 2bt3 s GLU 397 CO 0.06 -0.03 -0.16 0.12 -0.54 0.00 0.00 175.26 174.70 2bt3 s PHE 398 N -0.55 2.62 -0.02 5.30 5.36 -0.78 -0.65 117.98 129.27 2bt3 s PHE 398 Ca -0.06 -0.22 0.00 0.00 -0.96 0.00 0.00 56.93 55.70 2bt3 s PHE 398 Cb -0.04 -1.54 0.02 0.00 -0.34 0.00 0.00 43.02 41.12 2bt3 s PHE 398 CO -0.00 0.21 0.00 -2.00 -1.46 0.00 0.00 175.22 171.98 2bt3 s GLU 399 N -1.11 0.20 -0.14 10.12 2.12 0.08 -2.25 118.70 127.72 2bt3 s GLU 399 Ca 0.13 0.08 -0.06 0.00 0.36 0.00 0.00 54.97 55.49 2bt3 s GLU 399 Cb -0.11 -0.38 -0.04 0.00 0.26 0.00 0.00 34.13 33.87 2bt3 s GLU 399 CO 0.03 -0.12 0.07 0.00 -0.54 0.00 0.00 175.26 174.70 2bt3 s ALA 400 N 0.87 3.51 -0.25 6.30 0.00 0.26 -0.85 121.76 131.60 2bt3 s ALA 400 Ca -0.08 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.13 2bt3 s ALA 400 Cb -0.12 -1.80 0.03 0.00 0.00 0.00 0.00 23.12 21.22 2bt3 s ALA 400 CO -0.02 0.43 -0.06 0.15 0.00 0.00 0.00 175.76 176.26 2bt3 s LYS 401 N -0.41 2.84 -0.23 0.00 1.02 0.37 -2.38 119.74 120.95 2bt3 s LYS 401 Ca 0.10 -0.97 -0.11 0.00 0.02 0.00 0.00 55.97 55.00 2bt3 s LYS 401 Cb -0.12 -2.99 -0.05 0.00 -0.52 0.00 0.00 37.83 34.16 2bt3 s LYS 401 CO 0.02 -0.40 0.19 0.00 -0.92 0.00 0.00 175.35 174.24 2bt3 s ALA 402 N 1.33 3.61 0.00 5.17 0.00 0.25 -0.80 121.76 131.31 2bt3 s ALA 402 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2bt3 s ALA 402 Cb -0.17 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.60 2bt3 s ALA 402 CO -0.04 -0.18 0.00 -2.37 0.00 0.00 0.00 175.76 173.17 2bt3 n THR 403 N 4.23 0.00 0.00 0.00 5.66 -0.18 -1.93 114.28 122.07 2bt3 n THR 403 Ca -0.14 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 2bt3 n THR 403 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 2bt3 n THR 403 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2bt3 n GLY 404 N 0.00 -0.34 3.38 1.09 0.00 -1.26 -2.15 105.19 105.91 2bt3 n GLY 404 Ca 0.00 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.79 2bt3 n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bt3 s VAL 405 N 0.00 2.86 0.47 1.61 1.01 -0.11 -0.96 120.40 125.29 2bt3 s VAL 405 Ca 0.00 -0.76 -0.23 0.00 0.00 0.00 0.00 61.98 61.00 2bt3 s VAL 405 Cb 0.00 -2.15 -0.07 0.00 0.00 0.00 0.00 36.38 34.16 2bt3 s VAL 405 CO 0.00 0.55 1.21 0.68 0.00 0.00 0.00 175.10 177.54 2bt3 s VAL 406 N -0.06 2.90 0.03 2.92 -7.23 -1.26 -4.76 120.40 112.95 2bt3 s VAL 406 Ca -0.03 0.68 -0.30 0.00 -1.81 0.00 0.00 61.98 60.51 2bt3 s VAL 406 Cb -0.14 -3.35 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 2bt3 s VAL 406 CO 0.04 -0.00 1.25 0.12 -0.31 0.00 0.00 175.10 176.20 2bt3 s PHE 407 N -1.49 3.28 0.38 2.82 5.36 -1.26 -5.01 117.98 122.06 2bt3 s PHE 407 Ca 0.65 1.17 0.08 0.00 -0.96 0.00 0.00 56.93 57.87 2bt3 s PHE 407 Cb -0.31 -3.49 -0.05 0.00 -0.34 0.00 0.00 43.02 38.83 2bt3 s PHE 407 CO 0.38 -1.58 0.14 0.95 -1.46 0.00 0.00 175.22 173.65 2bt3 s THR 408 N 1.50 2.60 0.35 0.12 -4.23 -1.26 -4.05 115.64 110.67 2bt3 s THR 408 Ca 0.60 -1.73 -0.02 0.00 -1.18 0.00 0.00 61.69 59.35 2bt3 s THR 408 Cb -0.30 -2.95 0.01 0.00 1.34 0.00 0.00 72.50 70.60 2bt3 s THR 408 CO 0.27 -0.09 0.49 -1.54 -0.54 0.00 0.00 174.62 173.21 2bt3 n SER 409 N -1.17 -1.38 -4.78 3.99 3.41 -0.45 -4.89 113.62 108.36 2bt3 n SER 409 Ca -0.02 -2.84 -0.34 0.00 -0.26 0.00 0.00 58.87 55.41 2bt3 n SER 409 Cb 0.63 2.55 0.02 0.00 -0.26 0.00 0.00 64.21 67.15 2bt3 n SER 409 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bt3 s ALA 410 N -2.72 2.60 -0.29 7.33 0.00 -1.26 -0.48 121.76 126.94 2bt3 s ALA 410 Ca 0.28 0.64 -0.14 0.00 0.00 0.00 0.00 51.96 52.74 2bt3 s ALA 410 Cb -0.01 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2bt3 s ALA 410 CO 0.20 -1.00 0.32 0.12 0.00 0.00 0.00 175.76 175.40 2bt3 s PHE 411 N -2.12 3.23 0.42 0.00 5.36 -0.30 -4.03 117.98 120.53 2bt3 s PHE 411 Ca 0.69 0.24 -0.26 0.00 -0.96 0.00 0.00 56.93 56.64 2bt3 s PHE 411 Cb -0.21 -2.54 -0.09 0.00 -0.34 0.00 0.00 43.02 39.84 2bt3 s PHE 411 CO 0.35 -0.25 1.38 -2.14 -1.46 0.00 0.00 175.22 173.09 2bt3 s PRO 412 N 1.97 3.89 0.16 10.12 0.02 -1.26 -4.80 135.00 145.10 2bt3 s PRO 412 Ca 0.12 2.33 -0.34 0.00 0.02 0.00 0.00 61.00 63.13 2bt3 s PRO 412 Cb -0.16 -2.76 -0.14 0.00 0.02 0.00 0.00 34.50 31.47 2bt3 s PRO 412 CO 0.11 -0.62 1.60 -1.91 -0.33 0.00 0.00 177.00 175.85 2bt3 n GLU 413 N 0.07 2.23 -0.73 5.54 2.13 -1.26 -1.67 120.64 126.94 2bt3 n GLU 413 Ca 0.04 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.66 2bt3 n GLU 413 Cb 0.42 -2.58 0.00 0.00 0.27 0.00 0.00 31.44 29.55 2bt3 n GLU 413 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bt3 n GLY 414 N 3.50 0.72 2.30 8.31 0.00 -1.26 -4.95 105.19 113.81 2bt3 n GLY 414 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2bt3 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bt3 n GLY 415 N -2.45 -2.48 3.56 -0.02 0.00 -0.67 -5.04 105.19 98.09 2bt3 n GLY 415 Ca 0.00 -1.69 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 2bt3 n GLY 415 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2bt3 s SER 416 N -2.65 -0.68 0.00 1.61 0.15 -1.26 -4.58 113.70 106.29 2bt3 s SER 416 Ca 0.00 1.29 0.29 0.00 0.70 0.00 0.00 55.95 58.23 2bt3 s SER 416 Cb 0.00 1.31 1.32 0.00 -1.71 0.00 0.00 66.02 66.93 2bt3 s SER 416 CO 0.00 -0.24 1.95 0.47 1.20 0.00 0.00 173.24 176.62 2bt3 n ASP 417 N 2.67 0.06 0.00 5.45 8.00 -1.26 -4.22 116.55 127.26 2bt3 n ASP 417 Ca -0.14 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2bt3 n ASP 417 Cb 0.56 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 2bt3 n ASP 417 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2bt3 n ASN 418 N -1.37 0.97 -3.79 -2.24 4.13 -1.26 -5.05 115.26 106.65 2bt3 n ASN 418 Ca 0.10 -1.43 -0.13 0.00 1.68 0.00 0.00 54.58 54.81 2bt3 n ASN 418 Cb 0.30 0.00 -0.12 0.00 -1.54 0.00 0.00 39.78 38.41 2bt3 n ASN 418 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2bt3 s ILE 419 N -0.43 -0.01 0.24 2.41 1.01 -1.26 -1.62 121.20 121.55 2bt3 s ILE 419 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.75 2bt3 s ILE 419 Cb 0.00 -0.32 -0.04 0.00 0.01 0.00 0.00 42.46 42.11 2bt3 s ILE 419 CO 0.00 0.01 0.13 -0.94 0.00 0.00 0.00 174.94 174.14 2bt3 s SER 420 N 0.28 5.25 -0.07 3.58 1.04 -0.61 -4.53 113.70 118.63 2bt3 s SER 420 Ca -0.01 -0.33 -0.17 0.00 0.48 0.00 0.00 55.95 55.91 2bt3 s SER 420 Cb -0.03 -1.26 -0.05 0.00 0.10 0.00 0.00 66.02 64.79 2bt3 s SER 420 CO -0.01 -0.01 0.45 -1.58 0.98 0.00 0.00 173.24 173.08 2bt3 s GLN 421 N -3.64 4.20 -0.09 4.02 0.74 -1.26 -0.78 119.66 122.84 2bt3 s GLN 421 Ca 0.32 0.43 0.09 0.00 0.05 0.00 0.00 55.36 56.25 2bt3 s GLN 421 Cb -0.08 -3.36 -0.12 0.00 1.10 0.00 0.00 33.01 30.55 2bt3 s GLN 421 CO 0.23 0.36 0.04 1.28 -0.55 0.00 0.00 175.29 176.65 2bt3 n LEU 422 N 2.98 0.00 -3.75 3.68 4.77 -0.17 -4.50 117.00 120.00 2bt3 n LEU 422 Ca -0.10 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.83 2bt3 n LEU 422 Cb 0.52 0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 41.82 2bt3 n LEU 422 CO 0.41 0.23 0.64 0.00 -1.33 0.00 0.00 177.39 177.34 2bt3 s ALA 423 N -2.26 -1.55 -0.20 -1.18 0.00 -1.23 -4.84 121.76 110.51 2bt3 s ALA 423 Ca -0.05 0.08 -0.34 0.00 0.00 0.00 0.00 51.96 51.66 2bt3 s ALA 423 Cb 0.03 0.69 -0.11 0.00 0.00 0.00 0.00 23.12 23.74 2bt3 s ALA 423 CO 0.40 -1.01 2.03 -2.30 0.00 0.00 0.00 175.76 174.89 2bt3 n PRO 424 N -0.45 1.76 -0.71 0.00 -0.02 -1.26 -0.87 135.00 133.45 2bt3 n PRO 424 Ca -0.06 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2bt3 n PRO 424 Cb 0.60 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2bt3 n PRO 424 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bt3 n GLY 425 N 5.30 1.24 3.61 -1.23 0.00 -1.26 -4.59 105.19 108.26 2bt3 n GLY 425 Ca 0.30 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.96 2bt3 n GLY 425 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bt3 s LEU 426 N 0.00 3.89 0.32 0.99 2.96 -0.05 -1.16 118.68 125.62 2bt3 s LEU 426 Ca 0.00 0.05 0.09 0.00 -0.22 0.00 0.00 54.13 54.05 2bt3 s LEU 426 Cb 0.00 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 2bt3 s LEU 426 CO 0.00 0.09 0.03 -0.83 -1.32 0.00 0.00 176.35 174.32 2bt3 s GLY 427 N 0.88 1.92 -0.23 7.98 0.00 0.37 -1.00 107.32 117.23 2bt3 s GLY 427 Ca 0.05 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 42.90 2bt3 s GLY 427 CO 0.03 -1.82 0.07 0.00 0.00 0.00 0.00 173.10 171.38 2bt3 s ALA 428 N -2.45 0.98 0.39 3.20 0.00 0.04 -1.34 121.76 122.59 2bt3 s ALA 428 Ca 0.34 -0.92 -0.27 0.00 0.00 0.00 0.00 51.96 51.11 2bt3 s ALA 428 Cb -0.03 -1.29 -0.10 0.00 0.00 0.00 0.00 23.12 21.70 2bt3 s ALA 428 CO 0.20 -1.36 1.46 -1.25 0.00 0.00 0.00 175.76 174.81 2bt3 s PRO 429 N 1.88 4.02 0.51 0.00 0.04 -1.26 -1.57 135.00 138.62 2bt3 s PRO 429 Ca 0.03 2.52 -0.23 0.00 0.04 0.00 0.00 61.00 63.37 2bt3 s PRO 429 Cb -0.17 -2.89 -0.06 0.00 0.04 0.00 0.00 34.50 31.42 2bt3 s PRO 429 CO -0.17 -0.59 1.34 -0.06 0.04 0.00 0.00 177.00 177.56 2bt3 s PHE 430 N -1.14 2.42 0.28 0.56 0.08 -0.64 -4.82 117.98 114.72 2bt3 s PHE 430 Ca 0.55 1.38 -0.20 0.00 0.12 0.00 0.00 56.93 58.77 2bt3 s PHE 430 Cb -0.45 -3.75 0.04 0.00 -0.57 0.00 0.00 43.02 38.28 2bt3 s PHE 430 CO 0.61 -2.67 0.80 -3.38 -0.10 0.00 0.00 175.22 170.48 2bt3 s HIS 431 N -1.32 -0.09 0.21 0.36 -3.43 -0.97 -0.59 115.29 109.46 2bt3 s HIS 431 Ca 0.68 -0.39 0.09 0.00 -0.80 0.00 0.00 55.06 54.64 2bt3 s HIS 431 Cb -0.39 0.73 -0.05 0.00 -1.43 0.00 0.00 32.58 31.44 2bt3 s HIS 431 CO 0.47 -1.23 -0.16 -0.65 -2.00 0.00 0.00 174.74 171.17 2bt3 s GLN 432 N -3.33 1.39 -0.25 -0.38 -0.21 -0.59 -0.85 119.66 115.44 2bt3 s GLN 432 Ca 0.13 -1.59 0.02 0.00 0.02 0.00 0.00 55.36 53.94 2bt3 s GLN 432 Cb -0.05 -1.29 0.06 0.00 1.00 0.00 0.00 33.01 32.73 2bt3 s GLN 432 CO 0.07 0.23 -0.08 -1.01 -2.12 0.00 0.00 175.29 172.38 2bt3 s HIS 433 N -2.71 2.81 -0.12 0.91 3.76 0.06 -3.16 115.29 116.84 2bt3 s HIS 433 Ca 0.23 -2.03 0.02 0.00 -0.15 0.00 0.00 55.06 53.13 2bt3 s HIS 433 Cb -0.02 -1.75 0.01 0.00 1.11 0.00 0.00 32.58 31.93 2bt3 s HIS 433 CO 0.08 -0.83 -0.19 0.42 -0.85 0.00 0.00 174.74 173.38 2bt3 s ILE 434 N 1.25 1.82 0.10 0.60 1.01 0.42 -0.86 121.20 125.53 2bt3 s ILE 434 Ca -0.07 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 59.77 2bt3 s ILE 434 Cb -0.19 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 2bt3 s ILE 434 CO -0.06 0.50 0.10 -0.36 0.00 0.00 0.00 174.94 175.13 2bt3 s PHE 435 N 0.86 3.21 -0.20 3.97 0.40 0.36 -0.43 117.98 126.15 2bt3 s PHE 435 Ca -0.07 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.34 2bt3 s PHE 435 Cb -0.15 -1.61 0.04 0.00 0.51 0.00 0.00 43.02 41.80 2bt3 s PHE 435 CO -0.01 0.53 -0.14 0.45 0.70 0.00 0.00 175.22 176.74 2bt3 s SER 436 N -2.55 3.50 -0.22 1.36 0.15 -0.28 -1.70 113.70 113.96 2bt3 s SER 436 Ca 0.30 -0.90 -0.18 0.00 0.70 0.00 0.00 55.95 55.88 2bt3 s SER 436 Cb -0.12 -1.38 -0.03 0.00 -1.71 0.00 0.00 66.02 62.78 2bt3 s SER 436 CO 0.23 -0.10 0.49 0.00 1.20 0.00 0.00 173.24 175.06 2bt3 s ALA 437 N 1.30 3.56 -0.36 5.45 0.00 -0.28 -0.58 121.76 130.85 2bt3 s ALA 437 Ca -0.01 -0.50 -0.13 0.00 0.00 0.00 0.00 51.96 51.33 2bt3 s ALA 437 Cb -0.16 -2.80 -0.00 0.00 0.00 0.00 0.00 23.12 20.16 2bt3 s ALA 437 CO -0.09 -0.51 0.24 0.50 0.00 0.00 0.00 175.76 175.90 2bt3 s ARG 438 N 1.80 3.30 -0.42 0.00 3.52 -0.00 -1.15 118.95 126.00 2bt3 s ARG 438 Ca 0.22 -0.77 0.01 0.00 -0.13 0.00 0.00 55.73 55.05 2bt3 s ARG 438 Cb -0.15 -3.82 0.11 0.00 -1.56 0.00 0.00 34.95 29.53 2bt3 s ARG 438 CO 0.09 -0.53 0.17 -0.51 -0.81 0.00 0.00 175.30 173.71 2bt3 s LEU 439 N 1.69 4.95 -0.66 -0.88 1.43 0.35 -2.04 118.68 123.52 2bt3 s LEU 439 Ca 0.05 -2.29 -0.27 0.00 -1.03 0.00 0.00 54.13 50.59 2bt3 s LEU 439 Cb -0.18 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.33 2bt3 s LEU 439 CO 0.10 -0.42 1.34 -0.62 0.23 0.00 0.00 176.35 176.98 2bt3 s ASP 440 N 1.08 6.13 0.41 2.29 2.15 0.22 -0.84 116.67 128.11 2bt3 s ASP 440 Ca 0.11 -0.10 -0.23 0.00 0.43 0.00 0.00 52.55 52.76 2bt3 s ASP 440 Cb -0.21 -2.55 -0.10 0.00 -0.30 0.00 0.00 42.92 39.76 2bt3 s ASP 440 CO -0.05 -1.78 1.00 -0.04 -0.17 0.00 0.00 175.17 174.12 2bt3 s MET 441 N 5.64 4.20 -0.39 4.34 -1.94 -0.90 -0.35 119.30 129.90 2bt3 s MET 441 Ca 0.43 1.33 0.11 0.00 -1.71 0.00 0.00 55.69 55.85 2bt3 s MET 441 Cb -0.09 -2.41 0.36 0.00 2.01 0.00 0.00 34.83 34.70 2bt3 s MET 441 CO 0.20 -0.08 0.94 0.00 -0.01 0.00 0.00 175.02 176.07 2bt3 n ALA 442 N -0.27 1.24 -1.85 3.03 0.00 -0.30 -4.54 120.51 117.82 2bt3 n ALA 442 Ca 0.06 -2.56 -0.42 0.00 0.00 0.00 0.00 53.44 50.52 2bt3 n ALA 442 Cb 0.51 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 2bt3 n ALA 442 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2bt3 s ILE 443 N -1.44 3.29 -1.32 0.00 -1.09 -1.08 -1.73 121.20 117.84 2bt3 s ILE 443 Ca 0.31 0.27 -0.04 0.00 -2.23 0.00 0.00 60.65 58.96 2bt3 s ILE 443 Cb 0.35 -3.45 0.03 0.00 -1.58 0.00 0.00 42.46 37.81 2bt3 s ILE 443 CO -0.06 -0.32 0.31 0.47 -1.23 0.00 0.00 174.94 174.11 2bt3 n ASP 444 N 11.57 -4.56 0.00 3.58 8.00 -0.04 -4.47 116.55 130.63 2bt3 n ASP 444 Ca 0.26 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2bt3 n ASP 444 Cb 0.48 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.80 2bt3 n ASP 444 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bt3 n GLY 445 N -1.12 -0.69 0.16 0.44 0.00 -0.70 -4.87 105.19 98.41 2bt3 n GLY 445 Ca -0.11 -2.23 0.12 0.00 0.00 0.00 0.00 46.02 43.80 2bt3 n GLY 445 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2bt3 h PHE 446 N 0.00 0.00 -1.40 1.61 0.04 -1.82 -3.38 116.94 111.98 2bt3 h PHE 446 Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 2bt3 h PHE 446 Cb 0.00 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.07 2bt3 h PHE 446 CO 0.00 0.00 1.22 0.99 -0.60 0.00 0.00 178.31 179.92 2bt3 s THR 447 N -3.25 3.71 0.26 -1.55 2.01 -1.26 -3.08 115.64 112.47 2bt3 s THR 447 Ca 0.05 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 61.81 2bt3 s THR 447 Cb 0.08 -4.67 -0.05 0.00 0.01 0.00 0.00 72.50 67.86 2bt3 s THR 447 CO 0.71 -1.59 -0.08 0.20 -0.69 0.00 0.00 174.62 173.17 2bt3 s ASN 448 N 5.72 2.68 0.12 3.53 0.02 -0.65 -4.10 114.94 122.25 2bt3 s ASN 448 Ca 0.51 -1.14 -0.07 0.00 -1.02 0.00 0.00 52.86 51.14 2bt3 s ASN 448 Cb -0.05 -0.15 -0.01 0.00 0.02 0.00 0.00 41.25 41.06 2bt3 s ASN 448 CO 0.01 -0.30 0.19 0.00 0.02 0.00 0.00 177.10 177.02 2bt3 s ARG 449 N -3.71 0.94 -0.07 -0.60 1.70 -0.35 -1.01 118.95 115.85 2bt3 s ARG 449 Ca 0.28 -1.12 0.05 0.00 -0.47 0.00 0.00 55.73 54.47 2bt3 s ARG 449 Cb 0.02 0.33 -0.01 0.00 -0.57 0.00 0.00 34.95 34.72 2bt3 s ARG 449 CO 0.10 -0.31 -0.24 0.08 -1.08 0.00 0.00 175.30 173.86 2bt3 s VAL 450 N -3.93 2.16 -0.03 4.99 1.01 -1.26 -1.06 120.40 122.29 2bt3 s VAL 450 Ca 0.12 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2bt3 s VAL 450 Cb 0.05 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 2bt3 s VAL 450 CO -0.06 0.57 -0.21 -1.61 0.00 0.00 0.00 175.10 173.80 2bt3 s GLU 451 N -0.07 2.29 -0.19 2.72 2.02 -0.14 -0.92 118.70 124.42 2bt3 s GLU 451 Ca -0.06 -0.82 -0.19 0.00 0.02 0.00 0.00 54.97 53.92 2bt3 s GLU 451 Cb -0.15 -2.20 -0.03 0.00 0.10 0.00 0.00 34.13 31.85 2bt3 s GLU 451 CO 0.05 0.59 0.53 -2.00 0.02 0.00 0.00 175.26 174.45 2bt3 s GLU 452 N -0.67 4.22 -0.18 1.61 2.12 -0.31 -0.37 118.70 125.11 2bt3 s GLU 452 Ca 0.11 0.46 -0.02 0.00 0.36 0.00 0.00 54.97 55.88 2bt3 s GLU 452 Cb -0.10 -3.55 -0.00 0.00 0.26 0.00 0.00 34.13 30.74 2bt3 s GLU 452 CO -0.00 -0.12 -0.10 -2.00 -0.54 0.00 0.00 175.26 172.49 2bt3 s GLU 453 N 1.53 3.29 0.05 4.30 2.12 -0.09 -1.02 118.70 128.88 2bt3 s GLU 453 Ca 0.25 -0.69 0.08 0.00 0.36 0.00 0.00 54.97 54.97 2bt3 s GLU 453 Cb -0.15 -2.80 -0.03 0.00 0.26 0.00 0.00 34.13 31.41 2bt3 s GLU 453 CO 0.10 -0.08 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.04 2bt3 s ASP 454 N 1.10 3.72 0.43 -1.70 1.01 -0.63 -1.36 116.67 119.25 2bt3 s ASP 454 Ca 0.01 -0.47 -0.25 0.00 0.71 0.00 0.00 52.55 52.55 2bt3 s ASP 454 Cb -0.14 -0.56 -0.08 0.00 1.01 0.00 0.00 42.92 43.15 2bt3 s ASP 454 CO -0.03 0.25 1.28 -0.69 0.21 0.00 0.00 175.17 176.19 2bt3 s VAL 455 N -0.93 2.66 -0.19 -1.27 1.01 0.09 -1.13 120.40 120.64 2bt3 s VAL 455 Ca 0.15 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.70 2bt3 s VAL 455 Cb -0.10 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 32.99 2bt3 s VAL 455 CO 0.05 0.05 -0.16 -0.69 0.00 0.00 0.00 175.10 174.36 2bt3 s VAL 456 N -1.33 1.93 0.37 2.92 1.01 -0.23 -4.82 120.40 120.25 2bt3 s VAL 456 Ca 0.60 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.35 2bt3 s VAL 456 Cb -0.36 -1.85 -0.10 0.00 0.00 0.00 0.00 36.38 34.07 2bt3 s VAL 456 CO 0.46 0.36 0.88 -0.13 0.00 0.00 0.00 175.10 176.67 2bt3 s ARG 457 N 1.31 4.22 0.05 2.72 0.52 -1.26 -1.07 118.95 125.44 2bt3 s ARG 457 Ca 0.01 1.02 0.09 0.00 -0.52 0.00 0.00 55.73 56.33 2bt3 s ARG 457 Cb -0.15 -2.38 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 2bt3 s ARG 457 CO -0.10 0.09 -0.24 -0.65 0.02 0.00 0.00 175.30 174.41 2bt3 s GLN 458 N -2.89 1.62 0.13 3.54 -0.21 -1.25 -4.93 119.66 115.66 2bt3 s GLN 458 Ca 0.57 -1.07 -0.24 0.00 0.02 0.00 0.00 55.36 54.65 2bt3 s GLN 458 Cb -0.11 -1.80 -0.07 0.00 1.00 0.00 0.00 33.01 32.03 2bt3 s GLN 458 CO 0.16 0.46 0.72 0.99 -2.12 0.00 0.00 175.29 175.50 2bt3 s THR 459 N -0.82 4.50 0.20 -0.19 2.01 -1.26 -4.87 115.64 115.21 2bt3 s THR 459 Ca 0.10 1.57 -0.31 0.00 0.31 0.00 0.00 61.69 63.36 2bt3 s THR 459 Cb -0.10 -4.07 -0.11 0.00 0.01 0.00 0.00 72.50 68.24 2bt3 s THR 459 CO 0.02 0.52 1.57 -0.32 -0.69 0.00 0.00 174.62 175.72 2bt3 s MET 460 N -1.03 4.20 0.00 4.92 1.75 -1.26 -4.78 119.30 123.10 2bt3 s MET 460 Ca 0.34 2.42 0.00 0.00 -1.25 0.00 0.00 55.69 57.20 2bt3 s MET 460 Cb -0.22 -3.12 0.00 0.00 2.84 0.00 0.00 34.83 34.33 2bt3 s MET 460 CO 0.24 -0.60 0.00 0.41 -0.65 0.00 0.00 175.02 174.42 2bt3 n GLY 461 N 3.33 -0.98 3.64 2.11 0.00 -0.97 -5.00 105.19 107.31 2bt3 n GLY 461 Ca 0.12 -1.10 -0.49 0.00 0.00 0.00 0.00 46.02 44.55 2bt3 n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bt3 n PRO 462 N 0.00 1.68 0.00 1.61 -0.02 -1.26 -0.11 135.00 136.89 2bt3 n PRO 462 Ca 0.00 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2bt3 n PRO 462 Cb 0.00 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 2bt3 n PRO 462 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bt3 n GLY 463 N 3.07 1.91 2.61 -1.23 0.00 -1.26 -4.83 105.19 105.46 2bt3 n GLY 463 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 2bt3 n GLY 463 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bt3 n ASN 464 N 0.00 -0.77 0.23 1.61 5.15 0.84 -5.00 115.26 117.31 2bt3 n ASN 464 Ca 0.00 -2.92 0.07 0.00 -0.60 0.00 0.00 54.58 51.13 2bt3 n ASN 464 Cb 0.00 0.61 0.53 0.00 -0.53 0.00 0.00 39.78 40.39 2bt3 n ASN 464 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2bt3 h GLU 465 N 2.65 0.00 -0.01 1.20 3.07 -1.74 -1.31 114.58 118.44 2bt3 h GLU 465 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 2bt3 h GLU 465 Cb 1.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2bt3 h GLU 465 CO 0.21 0.22 -0.21 0.54 -1.40 0.00 0.00 179.01 178.37 2bt3 n ARG 466 N -3.98 1.07 -2.49 2.33 1.74 -1.26 -4.67 116.66 109.40 2bt3 n ARG 466 Ca -0.02 -0.66 -0.13 0.00 -0.77 0.00 0.00 57.85 56.27 2bt3 n ARG 466 Cb 0.30 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.26 2bt3 n ARG 466 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bt3 n GLY 467 N 1.31 -0.10 0.01 -0.13 0.00 -0.53 -4.92 105.19 100.82 2bt3 n GLY 467 Ca 0.13 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 45.95 2bt3 n GLY 467 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bt3 n ASN 468 N -0.66 1.27 -4.77 1.61 6.94 -1.26 -4.87 115.26 113.52 2bt3 n ASN 468 Ca -0.11 -0.23 -0.39 0.00 -0.02 0.00 0.00 54.58 53.84 2bt3 n ASN 468 Cb 0.59 1.52 -0.01 0.00 -2.36 0.00 0.00 39.78 39.52 2bt3 n ASN 468 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2bt3 s ALA 469 N -2.89 3.14 0.08 -2.53 0.00 -1.26 -5.04 121.76 113.25 2bt3 s ALA 469 Ca -0.03 1.12 -0.08 0.00 0.00 0.00 0.00 51.96 52.97 2bt3 s ALA 469 Cb 0.10 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 2bt3 s ALA 469 CO 0.63 -0.77 0.17 -0.59 0.00 0.00 0.00 175.76 175.20 2bt3 s PHE 470 N -1.35 0.18 0.00 0.00 -0.12 -1.26 -3.94 117.98 111.48 2bt3 s PHE 470 Ca 0.59 -0.59 0.00 0.00 -0.05 0.00 0.00 56.93 56.89 2bt3 s PHE 470 Cb -0.35 -0.09 0.00 0.00 -0.63 0.00 0.00 43.02 41.95 2bt3 s PHE 470 CO 0.44 -0.51 0.00 0.45 -0.05 0.00 0.00 175.22 175.55 2bt3 n SER 471 N 0.08 0.00 -3.88 1.98 2.88 -0.23 -5.01 113.62 109.44 2bt3 n SER 471 Ca -0.16 -0.27 -0.10 0.00 -1.33 0.00 0.00 58.87 57.02 2bt3 n SER 471 Cb 0.62 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.02 2bt3 n SER 471 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bt3 s ARG 472 N 0.18 1.21 0.04 -1.46 1.70 -1.26 -1.07 118.95 118.28 2bt3 s ARG 472 Ca 0.00 -1.06 0.02 0.00 -0.47 0.00 0.00 55.73 54.23 2bt3 s ARG 472 Cb 0.00 0.42 -0.02 0.00 -0.57 0.00 0.00 34.95 34.78 2bt3 s ARG 472 CO 0.00 -0.46 -0.08 -1.59 -1.08 0.00 0.00 175.30 172.09 2bt3 s LYS 473 N -3.93 0.54 -0.06 3.89 -2.85 -0.28 -4.81 119.74 112.23 2bt3 s LYS 473 Ca 0.14 -0.68 0.04 0.00 -1.00 0.00 0.00 55.97 54.47 2bt3 s LYS 473 Cb 0.02 -0.35 0.00 0.00 -2.06 0.00 0.00 37.83 35.44 2bt3 s LYS 473 CO -0.02 0.07 -0.19 1.03 0.10 0.00 0.00 175.35 176.35 2bt3 s ARG 474 N -1.35 2.17 -0.21 1.78 0.52 -1.26 -1.60 118.95 119.00 2bt3 s ARG 474 Ca -0.07 -0.67 0.01 0.00 -0.52 0.00 0.00 55.73 54.48 2bt3 s ARG 474 Cb -0.09 -1.78 0.03 0.00 0.52 0.00 0.00 34.95 33.63 2bt3 s ARG 474 CO 0.00 0.19 -0.15 0.99 0.02 0.00 0.00 175.30 176.36 2bt3 s THR 475 N 0.23 2.31 0.22 0.02 2.01 -0.19 -4.93 115.64 115.31 2bt3 s THR 475 Ca -0.10 -1.04 -0.30 0.00 0.31 0.00 0.00 61.69 60.56 2bt3 s THR 475 Cb -0.14 -2.08 -0.09 0.00 0.01 0.00 0.00 72.50 70.20 2bt3 s THR 475 CO 0.04 0.37 1.17 -0.69 -0.69 0.00 0.00 174.62 174.83 2bt3 s VAL 476 N 1.28 3.51 -0.47 3.82 1.01 -1.26 -1.16 120.40 127.12 2bt3 s VAL 476 Ca 0.02 1.34 -0.20 0.00 0.00 0.00 0.00 61.98 63.15 2bt3 s VAL 476 Cb -0.15 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.41 2bt3 s VAL 476 CO -0.09 0.25 0.61 -0.76 0.00 0.00 0.00 175.10 175.11 2bt3 s LEU 477 N -0.67 4.74 -0.07 3.92 1.43 -0.10 -4.94 118.68 122.99 2bt3 s LEU 477 Ca 0.50 -0.63 0.10 0.00 -1.03 0.00 0.00 54.13 53.07 2bt3 s LEU 477 Cb -0.33 -2.56 -0.24 0.00 0.03 0.00 0.00 46.19 43.10 2bt3 s LEU 477 CO 0.39 -0.81 0.55 0.35 0.23 0.00 0.00 176.35 177.06 2bt3 n THR 478 N 5.70 1.61 -4.10 5.49 -2.24 -1.26 -4.38 114.28 115.10 2bt3 n THR 478 Ca -0.04 -0.78 -0.08 0.00 -2.27 0.00 0.00 64.05 60.87 2bt3 n THR 478 Cb 0.47 -1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 67.51 2bt3 n THR 478 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2bt3 s ARG 479 N -2.58 0.64 0.52 -0.78 0.52 -1.26 -1.75 118.95 114.26 2bt3 s ARG 479 Ca -0.08 -1.19 0.19 0.00 -0.52 0.00 0.00 55.73 54.13 2bt3 s ARG 479 Cb 0.08 0.08 1.29 0.00 0.52 0.00 0.00 34.95 36.92 2bt3 s ARG 479 CO 0.81 -0.08 2.08 0.93 0.02 0.00 0.00 175.30 179.07 2bt3 h GLU 480 N 3.26 0.04 0.00 3.54 5.08 -1.53 -0.67 114.58 124.29 2bt3 h GLU 480 Ca -0.34 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2bt3 h GLU 480 Cb 1.15 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 2bt3 h GLU 480 CO 0.63 0.03 -0.05 0.66 -1.00 0.00 0.00 179.01 179.28 2bt3 h SER 481 N 0.04 0.00 -0.38 1.42 4.64 -1.87 -1.96 113.55 115.44 2bt3 h SER 481 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2bt3 h SER 481 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2bt3 h SER 481 CO -0.01 0.05 0.00 -0.62 -0.87 0.00 0.00 176.83 175.38 2bt3 n GLU 482 N -3.59 2.40 -0.48 4.77 1.02 -0.26 -4.62 120.64 119.87 2bt3 n GLU 482 Ca -0.02 -2.11 0.05 0.00 -0.02 0.00 0.00 57.16 55.05 2bt3 n GLU 482 Cb 0.15 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.29 2bt3 n GLU 482 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bt3 n ALA 483 N 1.32 3.27 -3.28 0.62 0.00 -0.74 -4.85 120.51 116.85 2bt3 n ALA 483 Ca 0.19 -2.71 -0.39 0.00 0.00 0.00 0.00 53.44 50.54 2bt3 n ALA 483 Cb 0.56 -0.62 -0.11 0.00 0.00 0.00 0.00 19.45 19.28 2bt3 n ALA 483 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bt3 s VAL 484 N -3.00 3.96 0.15 0.00 1.01 -1.26 -1.95 120.40 119.31 2bt3 s VAL 484 Ca 0.40 -1.32 0.11 0.00 0.00 0.00 0.00 61.98 61.17 2bt3 s VAL 484 Cb 0.35 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2bt3 s VAL 484 CO 0.04 -0.36 -0.25 -0.13 0.00 0.00 0.00 175.10 174.39 2bt3 s ARG 485 N 1.39 1.40 0.21 2.72 1.81 0.28 -5.00 118.95 121.76 2bt3 s ARG 485 Ca 0.01 -1.39 0.08 0.00 -1.72 0.00 0.00 55.73 52.71 2bt3 s ARG 485 Cb -0.21 -1.78 -0.04 0.00 -0.45 0.00 0.00 34.95 32.46 2bt3 s ARG 485 CO 0.02 0.41 0.01 -1.83 -0.68 0.00 0.00 175.30 173.23 2bt3 s GLU 486 N -2.30 2.41 0.68 3.54 -1.05 -1.26 -1.93 118.70 118.78 2bt3 s GLU 486 Ca 0.16 -1.20 -0.16 0.00 -0.15 0.00 0.00 54.97 53.61 2bt3 s GLU 486 Cb -0.09 -2.31 0.01 0.00 -0.44 0.00 0.00 34.13 31.30 2bt3 s GLU 486 CO 0.07 0.42 1.18 0.00 0.95 0.00 0.00 175.26 177.88 2bt3 s ALA 487 N -1.95 2.31 -0.42 -0.84 0.00 -1.26 -4.93 121.76 114.67 2bt3 s ALA 487 Ca 0.29 0.83 0.04 0.00 0.00 0.00 0.00 51.96 53.12 2bt3 s ALA 487 Cb -0.08 -3.43 0.17 0.00 0.00 0.00 0.00 23.12 19.78 2bt3 s ALA 487 CO 0.19 -1.54 0.43 0.34 0.00 0.00 0.00 175.76 175.18 2bt3 s ASP 488 N -2.06 0.80 0.35 0.00 -1.08 -1.26 -5.02 116.67 108.39 2bt3 s ASP 488 Ca 0.73 -2.19 0.03 0.00 -0.52 0.00 0.00 52.55 50.60 2bt3 s ASP 488 Cb -0.27 0.43 0.63 0.00 -1.46 0.00 0.00 42.92 42.25 2bt3 s ASP 488 CO 0.41 -0.18 1.98 0.00 0.52 0.00 0.00 175.17 177.89 2bt3 h ALA 489 N 6.11 1.51 -0.33 3.66 0.00 -1.94 -1.93 119.26 126.34 2bt3 h ALA 489 Ca 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2bt3 h ALA 489 Cb 1.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2bt3 h ALA 489 CO 0.22 0.42 0.18 -0.09 0.00 0.00 0.00 179.25 179.98 2bt3 h ARG 490 N 0.77 0.45 -0.64 0.00 2.43 -1.99 -1.08 114.38 114.32 2bt3 h ARG 490 Ca 0.20 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2bt3 h ARG 490 Cb 0.00 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2bt3 h ARG 490 CO -0.03 0.34 0.00 -2.37 -1.51 0.00 0.00 179.97 176.40 2bt3 n THR 491 N -4.44 1.86 -2.83 0.20 5.66 -1.02 -4.96 114.28 108.75 2bt3 n THR 491 Ca 0.02 -1.22 -0.22 0.00 -3.05 0.00 0.00 64.05 59.58 2bt3 n THR 491 Cb 0.10 0.12 0.02 0.00 -1.55 0.00 0.00 70.33 69.02 2bt3 n THR 491 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2bt3 n GLY 492 N 1.08 -0.52 3.72 1.09 0.00 -0.41 -0.73 105.19 109.42 2bt3 n GLY 492 Ca 0.26 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 2bt3 n GLY 492 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bt3 s ARG 493 N -5.51 4.16 0.32 1.61 3.52 -0.75 -4.56 118.95 117.74 2bt3 s ARG 493 Ca 0.21 2.52 0.03 0.00 -0.13 0.00 0.00 55.73 58.36 2bt3 s ARG 493 Cb -0.09 -3.16 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2bt3 s ARG 493 CO 0.26 -0.71 0.15 0.95 -0.81 0.00 0.00 175.30 175.14 2bt3 s THR 494 N 1.34 0.44 -0.07 4.11 -4.23 -0.47 -4.75 115.64 112.01 2bt3 s THR 494 Ca 0.74 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 2bt3 s THR 494 Cb -0.47 -2.51 0.02 0.00 1.34 0.00 0.00 72.50 70.88 2bt3 s THR 494 CO 0.32 0.00 -0.11 0.26 -0.54 0.00 0.00 174.62 174.55 2bt3 s TRP 495 N -3.51 1.42 -0.20 3.99 0.51 -1.17 -0.91 118.94 119.07 2bt3 s TRP 495 Ca 0.34 -0.55 -0.06 0.00 -2.12 0.00 0.00 56.10 53.71 2bt3 s TRP 495 Cb 0.05 -1.07 -0.03 0.00 -0.81 0.00 0.00 33.47 31.61 2bt3 s TRP 495 CO 0.17 -0.30 0.04 0.42 -0.51 0.00 0.00 176.95 176.77 2bt3 s ILE 496 N 0.80 4.37 -0.30 2.03 1.01 0.50 -0.39 121.20 129.22 2bt3 s ILE 496 Ca -0.12 -0.17 -0.12 0.00 0.00 0.00 0.00 60.65 60.24 2bt3 s ILE 496 Cb -0.15 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.30 2bt3 s ILE 496 CO 0.02 0.42 0.24 -0.63 0.00 0.00 0.00 174.94 175.00 2bt3 s ILE 497 N 0.84 5.27 0.33 2.92 1.09 0.21 -0.96 121.20 130.89 2bt3 s ILE 497 Ca 0.02 0.09 0.05 0.00 -1.10 0.00 0.00 60.65 59.72 2bt3 s ILE 497 Cb -0.14 -3.63 -0.06 0.00 -1.06 0.00 0.00 42.46 37.56 2bt3 s ILE 497 CO 0.02 0.13 0.01 -0.94 -0.10 0.00 0.00 174.94 174.06 2bt3 s SER 498 N 1.73 2.80 -0.35 3.58 1.04 -0.22 -1.00 113.70 121.28 2bt3 s SER 498 Ca 0.08 -1.32 -0.04 0.00 0.48 0.00 0.00 55.95 55.16 2bt3 s SER 498 Cb -0.16 -0.17 0.07 0.00 0.10 0.00 0.00 66.02 65.85 2bt3 s SER 498 CO 0.11 -0.49 0.11 0.21 0.98 0.00 0.00 173.24 174.15 2bt3 s ASN 499 N -3.52 5.15 0.26 7.02 3.84 -0.63 -1.22 114.94 125.85 2bt3 s ASN 499 Ca 0.34 -1.52 0.21 0.00 0.21 0.00 0.00 52.86 52.11 2bt3 s ASN 499 Cb 0.07 -1.80 1.01 0.00 -0.55 0.00 0.00 41.25 39.98 2bt3 s ASN 499 CO 0.15 -0.39 1.65 -0.81 -2.79 0.00 0.00 177.10 174.91 2bt3 n PRO 500 N 4.67 0.16 0.00 0.43 -0.04 -1.26 -2.30 135.00 136.66 2bt3 n PRO 500 Ca -0.09 0.51 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 2bt3 n PRO 500 Cb 0.43 -1.88 0.08 0.00 -0.04 0.00 0.00 33.50 32.09 2bt3 n PRO 500 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2bt3 n GLU 501 N -2.19 1.88 -4.04 0.54 1.02 -1.26 -4.85 120.64 111.74 2bt3 n GLU 501 Ca 0.01 -1.67 -0.32 0.00 -0.02 0.00 0.00 57.16 55.16 2bt3 n GLU 501 Cb 0.14 -1.40 -0.15 0.00 -0.02 0.00 0.00 31.44 30.00 2bt3 n GLU 501 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2bt3 s SER 502 N -1.82 4.04 0.04 1.62 0.15 -0.97 -5.11 113.70 111.64 2bt3 s SER 502 Ca 0.24 -1.20 0.02 0.00 0.70 0.00 0.00 55.95 55.71 2bt3 s SER 502 Cb 0.17 -1.43 -0.04 0.00 -1.71 0.00 0.00 66.02 63.02 2bt3 s SER 502 CO 0.29 -0.17 0.03 -0.54 1.20 0.00 0.00 173.24 174.05 2bt3 s LYS 503 N 1.22 2.78 0.83 5.44 -0.14 -1.26 -1.35 119.74 127.26 2bt3 s LYS 503 Ca -0.06 -0.67 -0.14 0.00 -1.36 0.00 0.00 55.97 53.75 2bt3 s LYS 503 Cb -0.18 -2.67 0.19 0.00 -1.68 0.00 0.00 37.83 33.48 2bt3 s LYS 503 CO -0.07 0.59 1.12 0.27 -0.76 0.00 0.00 175.35 176.51 2bt3 n ASN 504 N 0.97 0.14 0.21 2.83 0.23 0.38 -4.86 115.26 115.16 2bt3 n ASN 504 Ca -0.12 -1.44 0.15 0.00 -0.53 0.00 0.00 54.58 52.64 2bt3 n ASN 504 Cb 0.52 -0.85 0.67 0.00 -2.08 0.00 0.00 39.78 38.04 2bt3 n ASN 504 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2bt3 h ARG 505 N 0.00 0.00 -0.53 -3.83 0.11 -1.90 -0.96 114.38 107.27 2bt3 h ARG 505 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 2bt3 h ARG 505 Cb 1.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.09 2bt3 h ARG 505 CO 0.26 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.61 2bt3 n LEU 506 N -2.61 2.52 -2.14 0.08 4.77 -1.26 -4.92 117.00 113.43 2bt3 n LEU 506 Ca 0.00 -1.27 -0.18 0.00 -0.03 0.00 0.00 56.01 54.54 2bt3 n LEU 506 Cb 0.19 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2bt3 n LEU 506 CO 0.20 0.48 -0.17 -3.20 -1.33 0.00 0.00 177.39 173.37 2bt3 n ASN 507 N 0.50 -5.22 -4.51 -1.43 5.15 -0.37 -5.03 115.26 104.35 2bt3 n ASN 507 Ca 0.13 -0.07 -0.33 0.00 -0.60 0.00 0.00 54.58 53.71 2bt3 n ASN 507 Cb 0.47 -4.25 -0.13 0.00 -0.53 0.00 0.00 39.78 35.34 2bt3 n ASN 507 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2bt3 s GLU 508 N -5.03 2.59 0.20 1.20 0.41 -1.26 -4.87 118.70 111.95 2bt3 s GLU 508 Ca 0.06 -0.65 -0.33 0.00 -0.41 0.00 0.00 54.97 53.64 2bt3 s GLU 508 Cb -0.03 -2.44 -0.14 0.00 -1.78 0.00 0.00 34.13 29.74 2bt3 s GLU 508 CO 0.07 0.63 1.47 -2.30 -0.49 0.00 0.00 175.26 174.64 2bt3 n PRO 509 N 2.31 2.03 -2.15 0.39 -0.02 -1.26 -0.47 135.00 135.83 2bt3 n PRO 509 Ca -0.17 0.73 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 2bt3 n PRO 509 Cb 0.52 -2.43 0.01 0.00 -0.02 0.00 0.00 33.50 31.58 2bt3 n PRO 509 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bt3 s VAL 510 N 0.35 2.89 0.25 -1.45 -7.23 -0.46 -4.82 120.40 109.94 2bt3 s VAL 510 Ca 0.73 0.63 -0.21 0.00 -1.81 0.00 0.00 61.98 61.32 2bt3 s VAL 510 Cb -0.68 -3.30 0.04 0.00 0.56 0.00 0.00 36.38 33.01 2bt3 s VAL 510 CO 0.45 -0.05 0.83 -0.83 -0.31 0.00 0.00 175.10 175.19 2bt3 s GLY 511 N -1.40 -0.04 -0.01 2.32 0.00 -1.07 -1.61 107.32 105.50 2bt3 s GLY 511 Ca 0.68 -0.25 0.03 0.00 0.00 0.00 0.00 44.72 45.18 2bt3 s GLY 511 CO 0.35 0.09 -0.08 -0.19 0.00 0.00 0.00 173.10 173.27 2bt3 s TYR 512 N -3.33 0.78 -0.19 1.90 1.51 -0.17 -0.61 117.35 117.24 2bt3 s TYR 512 Ca 0.13 -0.16 -0.05 0.00 -1.01 0.00 0.00 57.07 55.99 2bt3 s TYR 512 Cb -0.04 -0.52 -0.02 0.00 -0.11 0.00 0.00 41.96 41.27 2bt3 s TYR 512 CO 0.06 -0.03 -0.01 0.21 -1.11 0.00 0.00 175.55 174.67 2bt3 s LYS 513 N -0.12 3.62 -0.23 -0.62 2.20 0.85 -0.62 119.74 124.82 2bt3 s LYS 513 Ca 0.02 -0.53 -0.22 0.00 -0.36 0.00 0.00 55.97 54.89 2bt3 s LYS 513 Cb -0.04 -3.03 -0.02 0.00 -1.51 0.00 0.00 37.83 33.23 2bt3 s LYS 513 CO -0.00 0.06 0.70 -1.17 -0.36 0.00 0.00 175.35 174.58 2bt3 s LEU 514 N 0.86 4.10 -0.32 5.43 2.96 0.47 -0.84 118.68 131.34 2bt3 s LEU 514 Ca 0.00 0.86 -0.07 0.00 -0.22 0.00 0.00 54.13 54.71 2bt3 s LEU 514 Cb -0.14 -2.98 0.03 0.00 0.50 0.00 0.00 46.19 43.60 2bt3 s LEU 514 CO 0.02 -0.38 0.10 -1.00 -1.32 0.00 0.00 176.35 173.77 2bt3 s HIS 515 N 2.40 3.21 0.39 5.38 3.76 0.47 -3.07 115.29 127.83 2bt3 s HIS 515 Ca 0.30 -1.23 -0.01 0.00 -0.15 0.00 0.00 55.06 53.97 2bt3 s HIS 515 Cb -0.16 -2.28 -0.03 0.00 1.11 0.00 0.00 32.58 31.22 2bt3 s HIS 515 CO 0.09 -0.67 0.63 0.00 -0.85 0.00 0.00 174.74 173.94 2bt3 s ALA 516 N 1.45 3.60 -0.79 -1.40 0.00 -1.26 -2.21 121.76 121.15 2bt3 s ALA 516 Ca 0.00 -0.78 0.26 0.00 0.00 0.00 0.00 51.96 51.44 2bt3 s ALA 516 Cb -0.19 -2.27 0.65 0.00 0.00 0.00 0.00 23.12 21.31 2bt3 s ALA 516 CO 0.03 -0.14 1.56 0.72 0.00 0.00 0.00 175.76 177.93 2bt3 n HIS 517 N -1.95 0.46 -3.27 0.00 8.25 -1.26 -4.96 115.22 112.49 2bt3 n HIS 517 Ca -0.03 0.13 -0.23 0.00 -0.26 0.00 0.00 57.72 57.33 2bt3 n HIS 517 Cb 0.56 -0.63 0.05 0.00 1.12 0.00 0.00 29.99 31.08 2bt3 n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2bt3 n ASN 518 N -1.94 -6.00 -4.80 0.41 3.02 -1.26 -5.00 115.26 99.69 2bt3 n ASN 518 Ca 0.05 -0.40 -0.32 0.00 -0.03 0.00 0.00 54.58 53.88 2bt3 n ASN 518 Cb 0.40 -4.81 0.05 0.00 -0.61 0.00 0.00 39.78 34.82 2bt3 n ASN 518 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2bt3 s GLN 519 N -5.97 2.85 0.50 3.52 -1.52 -1.26 -4.98 119.66 112.80 2bt3 s GLN 519 Ca 0.42 1.10 -0.23 0.00 -1.95 0.00 0.00 55.36 54.70 2bt3 s GLN 519 Cb -0.19 -1.97 -0.07 0.00 -0.22 0.00 0.00 33.01 30.56 2bt3 s GLN 519 CO 0.52 -1.18 1.28 -2.30 -0.25 0.00 0.00 175.29 173.35 2bt3 n PRO 520 N -2.91 1.71 -0.31 2.91 -0.02 -1.26 -4.83 135.00 130.28 2bt3 n PRO 520 Ca 0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2bt3 n PRO 520 Cb 0.53 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 2bt3 n PRO 520 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2bt3 n THR 521 N -0.77 0.00 -1.71 3.45 -2.24 -1.26 -4.55 114.28 107.19 2bt3 n THR 521 Ca 0.09 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 2bt3 n THR 521 Cb 0.43 -1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 67.23 2bt3 n THR 521 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2bt3 n LEU 522 N 0.00 4.03 0.09 3.22 7.94 -0.02 -4.88 117.00 127.37 2bt3 n LEU 522 Ca 0.00 1.04 0.10 0.00 -1.11 0.00 0.00 56.01 56.05 2bt3 n LEU 522 Cb 0.00 -1.57 -0.01 0.00 0.53 0.00 0.00 43.42 42.37 2bt3 n LEU 522 CO 0.00 0.19 -0.04 0.18 -1.11 0.00 0.00 177.39 176.61 2bt3 n LEU 523 N 4.41 0.82 -4.56 -1.96 4.77 -1.26 -4.84 117.00 114.38 2bt3 n LEU 523 Ca 0.17 0.32 -0.38 0.00 -0.03 0.00 0.00 56.01 56.09 2bt3 n LEU 523 Cb 0.36 -0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.45 2bt3 n LEU 523 CO 0.64 -0.15 0.35 0.00 -1.33 0.00 0.00 177.39 176.90 2bt3 n ALA 524 N -2.20 -0.36 -1.63 -1.18 0.00 -1.26 -4.89 120.51 108.99 2bt3 n ALA 524 Ca -0.01 -0.02 -0.45 0.00 0.00 0.00 0.00 53.44 52.97 2bt3 n ALA 524 Cb 0.58 -2.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 2bt3 n ALA 524 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2bt3 n ASP 525 N -0.34 1.86 0.29 0.00 -0.08 -1.26 -4.86 116.55 112.17 2bt3 n ASP 525 Ca 0.13 1.18 0.20 0.00 -1.51 0.00 0.00 54.79 54.79 2bt3 n ASP 525 Cb 0.48 -1.35 1.05 0.00 2.34 0.00 0.00 41.12 43.64 2bt3 n ASP 525 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2bt3 h PRO 526 N 2.63 0.00 -0.07 -0.67 0.13 -1.97 -1.74 132.00 130.31 2bt3 h PRO 526 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2bt3 h PRO 526 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2bt3 h PRO 526 CO 0.65 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.83 2bt3 n GLY 527 N -1.03 -0.12 3.83 1.56 0.00 -1.26 -4.66 105.19 103.50 2bt3 n GLY 527 Ca -0.02 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 2bt3 n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bt3 s SER 528 N -1.79 5.34 0.15 1.61 1.04 -0.66 -4.98 113.70 114.41 2bt3 s SER 528 Ca 0.36 1.50 -0.17 0.00 0.48 0.00 0.00 55.95 58.12 2bt3 s SER 528 Cb 0.19 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.97 2bt3 s SER 528 CO 0.30 -1.46 1.75 -1.28 0.98 0.00 0.00 173.24 173.53 2bt3 h SER 529 N -0.73 0.11 -0.22 7.02 0.87 -1.89 -2.77 113.55 115.93 2bt3 h SER 529 Ca -0.44 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.11 2bt3 h SER 529 Cb 1.22 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 63.19 2bt3 h SER 529 CO 0.58 0.10 0.00 -0.29 -0.53 0.00 0.00 176.83 176.70 2bt3 h ILE 530 N 0.25 1.19 -0.06 2.23 6.09 -1.93 -0.50 117.51 124.77 2bt3 h ILE 530 Ca 0.15 -0.76 -0.04 0.00 -1.37 0.00 0.00 64.86 62.84 2bt3 h ILE 530 Cb 0.13 0.94 -0.01 0.00 0.47 0.00 0.00 36.82 38.35 2bt3 h ILE 530 CO -0.16 0.26 -0.16 0.00 -3.07 0.00 0.00 178.15 175.02 2bt3 h ALA 531 N 1.52 1.62 0.21 0.18 0.00 -1.74 0.24 119.26 121.29 2bt3 h ALA 531 Ca 0.11 -0.18 -0.28 0.00 0.00 0.00 0.00 54.91 54.55 2bt3 h ALA 531 Cb 0.31 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.08 2bt3 h ALA 531 CO 0.01 0.28 -1.23 0.00 0.00 0.00 0.00 179.25 178.31 2bt3 h ARG 532 N 0.09 0.46 -0.01 0.00 3.08 -1.19 -2.63 114.38 114.18 2bt3 h ARG 532 Ca 0.02 -0.78 -0.17 0.00 0.07 0.00 0.00 59.98 59.12 2bt3 h ARG 532 Cb 0.35 0.29 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 2bt3 h ARG 532 CO 0.02 1.37 -0.77 0.00 -1.07 0.00 0.00 179.97 179.52 2bt3 h ARG 533 N -0.05 0.12 -1.38 0.04 3.08 -0.93 -3.22 114.38 112.04 2bt3 h ARG 533 Ca -0.22 -0.11 -0.63 0.00 0.07 0.00 0.00 59.98 59.10 2bt3 h ARG 533 Cb 1.98 0.03 -0.38 0.00 0.08 0.00 0.00 29.97 31.68 2bt3 h ARG 533 CO 0.23 0.83 -0.23 0.00 -1.07 0.00 0.00 179.97 179.73 2bt3 n ALA 534 N -2.44 5.48 -0.20 0.04 0.00 0.82 -4.84 120.51 119.37 2bt3 n ALA 534 Ca -0.02 -4.08 0.13 0.00 0.00 0.00 0.00 53.44 49.47 2bt3 n ALA 534 Cb 0.74 -0.90 0.44 0.00 0.00 0.00 0.00 19.45 19.72 2bt3 n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bt3 h ALA 535 N 2.51 1.95 -0.69 0.00 0.00 -1.47 -0.04 119.26 121.52 2bt3 h ALA 535 Ca 0.40 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.48 2bt3 h ALA 535 Cb 0.87 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 2bt3 h ALA 535 CO 1.02 -0.15 0.48 0.27 0.00 0.00 0.00 179.25 180.87 2bt3 h PHE 536 N 0.56 0.22 0.00 0.00 -0.00 -1.86 -1.84 116.94 114.03 2bt3 h PHE 536 Ca 0.39 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.36 2bt3 h PHE 536 Cb 0.71 -0.07 0.00 0.00 -0.00 0.00 0.00 35.95 36.59 2bt3 h PHE 536 CO -0.00 0.08 0.00 0.00 -0.00 0.00 0.00 178.31 178.39 2bt3 n ALA 537 N -2.60 2.14 0.87 12.09 0.00 -0.03 -3.18 120.51 129.81 2bt3 n ALA 537 Ca 0.13 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.61 2bt3 n ALA 537 Cb 0.63 -1.40 0.44 0.00 0.00 0.00 0.00 19.45 19.12 2bt3 n ALA 537 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2bt3 n THR 538 N -1.47 0.17 -4.05 0.00 -2.24 -0.69 -0.84 114.28 105.16 2bt3 n THR 538 Ca 0.07 -0.09 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 2bt3 n THR 538 Cb 0.27 -0.31 -0.12 0.00 -2.10 0.00 0.00 70.33 68.08 2bt3 n THR 538 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2bt3 s LYS 539 N -3.04 0.46 0.20 -0.78 -0.14 -1.19 -4.75 119.74 110.49 2bt3 s LYS 539 Ca 0.12 -0.66 0.04 0.00 -1.36 0.00 0.00 55.97 54.11 2bt3 s LYS 539 Cb 0.17 -0.22 0.10 0.00 -1.68 0.00 0.00 37.83 36.19 2bt3 s LYS 539 CO 0.60 0.04 1.45 -0.44 -0.76 0.00 0.00 175.35 176.25 2bt3 h ASP 540 N 4.72 0.21 -3.37 2.83 5.19 -1.70 -3.39 116.42 120.90 2bt3 h ASP 540 Ca -0.34 -0.15 -0.19 0.00 -0.62 0.00 0.00 57.03 55.72 2bt3 h ASP 540 Cb 1.20 -0.06 -0.29 0.00 0.18 0.00 0.00 39.33 40.35 2bt3 h ASP 540 CO 0.42 0.90 -0.48 -0.22 -3.12 0.00 0.00 179.24 176.74 2bt3 s LEU 541 N -7.55 0.44 0.03 1.55 2.96 -0.81 -1.32 118.68 113.97 2bt3 s LEU 541 Ca -0.03 0.53 0.06 0.00 -0.22 0.00 0.00 54.13 54.47 2bt3 s LEU 541 Cb 0.11 0.75 -0.02 0.00 0.50 0.00 0.00 46.19 47.53 2bt3 s LEU 541 CO 0.81 -0.16 -0.19 0.26 -1.32 0.00 0.00 176.35 175.75 2bt3 s TRP 542 N 1.20 1.63 -0.11 5.38 0.52 -0.43 -0.56 118.94 126.58 2bt3 s TRP 542 Ca -0.09 -0.35 0.01 0.00 0.02 0.00 0.00 56.10 55.69 2bt3 s TRP 542 Cb -0.10 -0.99 0.02 0.00 -1.15 0.00 0.00 33.47 31.25 2bt3 s TRP 542 CO -0.08 0.05 -0.13 0.08 0.02 0.00 0.00 176.95 176.89 2bt3 s VAL 543 N -0.72 1.37 0.27 4.03 1.01 -0.82 -0.46 120.40 125.08 2bt3 s VAL 543 Ca 0.06 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 61.60 2bt3 s VAL 543 Cb -0.08 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2bt3 s VAL 543 CO 0.01 0.42 -0.14 0.42 0.00 0.00 0.00 175.10 175.81 2bt3 s THR 544 N 1.13 2.79 0.18 3.92 -4.23 -0.25 -4.69 115.64 114.49 2bt3 s THR 544 Ca -0.04 -2.23 -0.30 0.00 -1.18 0.00 0.00 61.69 57.94 2bt3 s THR 544 Cb -0.14 -2.47 -0.08 0.00 1.34 0.00 0.00 72.50 71.15 2bt3 s THR 544 CO -0.03 -0.38 1.17 -0.60 -0.54 0.00 0.00 174.62 174.24 2bt3 s ARG 545 N -3.52 4.52 0.29 3.99 6.06 -1.26 -0.83 118.95 128.20 2bt3 s ARG 545 Ca 0.30 1.82 -0.30 0.00 -2.50 0.00 0.00 55.73 55.05 2bt3 s ARG 545 Cb -0.06 -3.26 -0.11 0.00 0.06 0.00 0.00 34.95 31.59 2bt3 s ARG 545 CO 0.16 -0.05 1.57 -0.47 -2.50 0.00 0.00 175.30 174.01 2bt3 s TYR 546 N -0.06 2.80 -0.05 5.12 5.04 0.21 -4.84 117.35 125.57 2bt3 s TYR 546 Ca 0.52 0.83 -0.05 0.00 -2.44 0.00 0.00 57.07 55.92 2bt3 s TYR 546 Cb -0.31 -4.03 0.01 0.00 0.35 0.00 0.00 41.96 37.98 2bt3 s TYR 546 CO 0.36 -3.43 0.14 0.00 -1.34 0.00 0.00 175.55 171.28 2bt3 s ALA 547 N -0.01 -0.34 0.48 3.97 0.00 -1.26 -5.01 121.76 119.58 2bt3 s ALA 547 Ca 0.62 0.32 0.28 0.00 0.00 0.00 0.00 51.96 53.18 2bt3 s ALA 547 Cb -0.47 -0.18 1.56 0.00 0.00 0.00 0.00 23.12 24.03 2bt3 s ALA 547 CO 0.47 -0.09 2.13 0.38 0.00 0.00 0.00 175.76 178.66 2bt3 h ASP 548 N 5.67 0.00 -0.63 0.00 3.04 -2.04 -2.41 116.42 120.06 2bt3 h ASP 548 Ca -0.26 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.53 2bt3 h ASP 548 Cb 1.20 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.49 2bt3 h ASP 548 CO 0.42 0.08 0.00 -0.90 -2.04 0.00 0.00 179.24 176.80 2bt3 n ASP 549 N -3.75 3.48 -4.13 4.15 5.75 -1.26 -4.64 116.55 116.15 2bt3 n ASP 549 Ca -0.02 -1.99 -0.38 0.00 -0.01 0.00 0.00 54.79 52.39 2bt3 n ASP 549 Cb 0.18 -0.42 -0.05 0.00 -1.03 0.00 0.00 41.12 39.80 2bt3 n ASP 549 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2bt3 n GLU 550 N 1.41 2.88 -0.08 0.11 1.02 -0.91 -4.84 120.64 120.23 2bt3 n GLU 550 Ca 0.22 -4.49 -0.18 0.00 -0.02 0.00 0.00 57.16 52.70 2bt3 n GLU 550 Cb 0.55 -2.44 -0.13 0.00 -0.02 0.00 0.00 31.44 29.41 2bt3 n GLU 550 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2bt3 n ARG 551 N 2.29 0.68 -4.67 3.49 1.74 -1.26 -4.81 116.66 114.11 2bt3 n ARG 551 Ca 0.23 0.17 -0.24 0.00 -0.77 0.00 0.00 57.85 57.24 2bt3 n ARG 551 Cb 0.37 -1.59 -0.15 0.00 -1.02 0.00 0.00 32.46 30.08 2bt3 n ARG 551 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2bt3 s TYR 552 N -2.53 1.51 -0.47 -1.55 2.02 -1.26 -4.92 117.35 110.16 2bt3 s TYR 552 Ca -0.27 -0.32 0.22 0.00 -0.37 0.00 0.00 57.07 56.33 2bt3 s TYR 552 Cb 0.08 -0.94 0.97 0.00 -0.40 0.00 0.00 41.96 41.66 2bt3 s TYR 552 CO 0.68 0.01 1.66 -0.35 -1.57 0.00 0.00 175.55 175.98 2bt3 n PRO 553 N 2.33 0.16 -0.15 -1.71 -0.04 -1.26 -2.11 135.00 132.22 2bt3 n PRO 553 Ca -0.16 0.47 0.06 0.00 -0.04 0.00 0.00 63.50 63.82 2bt3 n PRO 553 Cb 0.54 -1.85 0.14 0.00 -0.04 0.00 0.00 33.50 32.29 2bt3 n PRO 553 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2bt3 n THR 554 N -2.16 0.86 -0.27 0.52 -2.24 -1.26 -1.15 114.28 108.57 2bt3 n THR 554 Ca 0.01 -0.93 0.02 0.00 -2.27 0.00 0.00 64.05 60.89 2bt3 n THR 554 Cb 0.17 0.60 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 2bt3 n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bt3 n GLY 555 N 0.53 -2.22 0.15 3.38 0.00 -0.90 -4.46 105.19 101.68 2bt3 n GLY 555 Ca 0.11 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 2bt3 n GLY 555 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bt3 h ASP 556 N -0.16 0.36 -3.56 1.61 3.32 -1.92 -3.42 116.42 112.65 2bt3 h ASP 556 Ca 0.00 -0.25 -0.63 0.00 0.02 0.00 0.00 57.03 56.17 2bt3 h ASP 556 Cb 0.16 -0.11 -0.40 0.00 0.22 0.00 0.00 39.33 39.21 2bt3 h ASP 556 CO 0.00 1.00 -0.74 -0.36 -1.72 0.00 0.00 179.24 177.42 2bt3 s PHE 557 N -3.47 3.03 -0.13 4.55 0.08 -1.26 -4.97 117.98 115.81 2bt3 s PHE 557 Ca -0.04 -2.47 -0.00 0.00 0.12 0.00 0.00 56.93 54.54 2bt3 s PHE 557 Cb 0.10 -2.37 -0.24 0.00 -0.57 0.00 0.00 43.02 39.94 2bt3 s PHE 557 CO 0.83 -0.90 0.31 0.28 -0.10 0.00 0.00 175.22 175.63 2bt3 n VAL 558 N 4.47 1.68 -1.63 -0.44 0.31 -1.26 -4.51 118.33 116.96 2bt3 n VAL 558 Ca -0.01 -0.68 -0.49 0.00 -0.01 0.00 0.00 64.34 63.15 2bt3 n VAL 558 Cb 0.42 -1.47 -0.05 0.00 -0.91 0.00 0.00 33.84 31.83 2bt3 n VAL 558 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2bt3 n ASN 559 N -3.32 3.08 -2.99 4.52 5.15 -1.26 -1.82 115.26 118.64 2bt3 n ASN 559 Ca -0.31 0.77 -0.22 0.00 -0.60 0.00 0.00 54.58 54.22 2bt3 n ASN 559 Cb 1.05 -1.35 0.03 0.00 -0.53 0.00 0.00 39.78 38.97 2bt3 n ASN 559 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2bt3 n GLN 560 N 7.15 -4.48 -4.51 1.20 6.02 -1.26 -1.29 117.38 120.19 2bt3 n GLN 560 Ca 0.28 0.88 -0.33 0.00 -0.01 0.00 0.00 57.00 57.82 2bt3 n GLN 560 Cb 0.29 -5.72 -0.15 0.00 1.02 0.00 0.00 30.24 25.68 2bt3 n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2bt3 s HIS 561 N -3.14 2.80 1.23 1.08 2.46 -0.75 -4.58 115.29 114.37 2bt3 s HIS 561 Ca 0.28 -0.99 -0.19 0.00 0.47 0.00 0.00 55.06 54.63 2bt3 s HIS 561 Cb -0.13 -1.90 0.29 0.00 -0.13 0.00 0.00 32.58 30.72 2bt3 s HIS 561 CO 0.35 -0.45 1.08 -1.54 -2.47 0.00 0.00 174.74 171.71 2bt3 s SER 562 N 0.80 0.69 0.95 9.88 1.04 -1.26 -4.88 113.70 120.92 2bt3 s SER 562 Ca -0.05 0.71 -0.12 0.00 0.48 0.00 0.00 55.95 56.97 2bt3 s SER 562 Cb -0.15 -1.00 0.09 0.00 0.10 0.00 0.00 66.02 65.06 2bt3 s SER 562 CO 0.00 -4.28 0.71 0.61 0.98 0.00 0.00 173.24 171.27 2bt3 n GLY 563 N -0.57 -1.36 0.00 7.32 0.00 -1.26 -4.58 105.19 104.74 2bt3 n GLY 563 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2bt3 n GLY 563 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bt3 n GLY 564 N 1.00 1.23 0.95 -0.02 0.00 -1.26 -5.07 105.19 102.02 2bt3 n GLY 564 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 2bt3 n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt3 n ALA 565 N 0.00 0.12 -0.32 4.61 0.00 -1.26 -4.76 120.51 118.90 2bt3 n ALA 565 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2bt3 n ALA 565 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.79 2bt3 n ALA 565 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bt3 n GLY 566 N 3.12 -0.76 0.21 0.00 0.00 -1.26 -4.29 105.19 102.20 2bt3 n GLY 566 Ca -0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 46.02 44.78 2bt3 n GLY 566 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bt3 h LEU 567 N 0.00 0.21 -1.37 0.99 3.38 -1.38 -1.16 115.31 115.98 2bt3 h LEU 567 Ca 0.00 0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.11 2bt3 h LEU 567 Cb 0.00 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 2bt3 h LEU 567 CO 0.00 0.15 0.49 -0.65 0.09 0.00 0.00 178.44 178.52 2bt3 h PRO 568 N 0.38 0.71 -0.12 1.13 0.11 -1.85 -1.10 132.00 131.26 2bt3 h PRO 568 Ca 0.25 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 66.12 2bt3 h PRO 568 Cb 0.26 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 2bt3 h PRO 568 CO -0.24 0.47 -0.71 0.66 -0.21 0.00 0.00 178.00 177.96 2bt3 h SER 569 N 0.73 0.64 -0.14 -2.05 4.64 -1.43 -3.08 113.55 112.87 2bt3 h SER 569 Ca 0.34 -0.41 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 2bt3 h SER 569 Cb 0.36 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2bt3 h SER 569 CO -0.12 1.16 0.04 1.88 -0.87 0.00 0.00 176.83 178.92 2bt3 h TYR 570 N 0.38 0.23 0.00 4.77 0.05 -0.50 -3.14 116.97 118.76 2bt3 h TYR 570 Ca -0.03 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.72 2bt3 h TYR 570 Cb 1.30 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.98 2bt3 h TYR 570 CO 0.06 0.36 0.00 -0.84 -1.05 0.00 0.00 178.16 176.69 2bt3 h ILE 571 N 0.04 0.00 -0.08 -2.88 3.07 -1.32 -2.84 117.51 113.50 2bt3 h ILE 571 Ca 0.04 -0.58 0.02 0.00 1.55 0.00 0.00 64.86 65.90 2bt3 h ILE 571 Cb 0.24 1.57 -0.00 0.00 -0.27 0.00 0.00 36.82 38.36 2bt3 h ILE 571 CO -0.00 0.00 0.13 0.00 -1.05 0.00 0.00 178.15 177.23 2bt3 h ALA 572 N 2.01 1.49 0.00 0.16 0.00 -1.48 -0.75 119.26 120.69 2bt3 h ALA 572 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bt3 h ALA 572 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2bt3 h ALA 572 CO 0.00 -0.17 0.00 1.96 0.00 0.00 0.00 179.25 181.04 2bt3 h GLN 573 N 0.00 0.00 -6.21 0.00 4.20 -1.65 -3.47 115.11 107.97 2bt3 h GLN 573 Ca 0.04 0.00 -0.45 0.00 0.06 0.00 0.00 58.65 58.30 2bt3 h GLN 573 Cb 0.30 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.09 2bt3 h GLN 573 CO -0.00 0.00 -0.81 -3.47 -0.67 0.00 0.00 178.83 173.88 2bt3 n ASP 574 N -2.98 -2.45 -4.83 1.46 2.03 -0.29 -4.93 116.55 104.56 2bt3 n ASP 574 Ca -0.01 -0.82 -0.32 0.00 0.52 0.00 0.00 54.79 54.16 2bt3 n ASP 574 Cb 0.21 -3.88 -0.02 0.00 -0.72 0.00 0.00 41.12 36.71 2bt3 n ASP 574 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2bt3 s ARG 575 N -6.28 3.80 0.10 -0.67 0.52 -1.26 -4.51 118.95 110.65 2bt3 s ARG 575 Ca 0.26 1.01 -0.31 0.00 -0.52 0.00 0.00 55.73 56.17 2bt3 s ARG 575 Cb -0.13 -2.11 -0.09 0.00 0.52 0.00 0.00 34.95 33.14 2bt3 s ARG 575 CO 0.83 -0.40 1.64 0.34 0.02 0.00 0.00 175.30 177.73 2bt3 s ASP 576 N -3.02 6.59 -0.06 0.23 2.15 -1.26 -1.62 116.67 119.69 2bt3 s ASP 576 Ca 0.60 2.54 0.08 0.00 0.43 0.00 0.00 52.55 56.20 2bt3 s ASP 576 Cb -0.11 -2.57 0.12 0.00 -0.30 0.00 0.00 42.92 40.06 2bt3 s ASP 576 CO 0.33 -0.87 1.02 2.30 -0.17 0.00 0.00 175.17 177.77 2bt3 n ILE 577 N 4.50 1.19 -3.24 4.11 -5.35 -0.72 -4.78 119.36 115.07 2bt3 n ILE 577 Ca 0.15 -1.35 -0.46 0.00 -0.27 0.00 0.00 62.75 60.82 2bt3 n ILE 577 Cb 0.40 0.23 -0.02 0.00 -1.74 0.00 0.00 39.64 38.51 2bt3 n ILE 577 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2bt3 s ASP 578 N -1.71 6.83 0.00 7.28 -1.08 -1.20 -4.25 116.67 122.55 2bt3 s ASP 578 Ca 0.14 -2.72 0.00 0.00 -0.52 0.00 0.00 52.55 49.45 2bt3 s ASP 578 Cb 0.12 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.33 2bt3 s ASP 578 CO 0.01 -0.63 0.00 0.61 0.52 0.00 0.00 175.17 175.68 2bt3 n GLY 579 N 4.07 0.82 3.46 2.66 0.00 -0.18 -4.98 105.19 111.04 2bt3 n GLY 579 Ca 0.18 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 2bt3 n GLY 579 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bt3 s GLN 580 N -2.98 1.78 -0.57 1.61 -1.52 -0.35 -4.60 119.66 113.03 2bt3 s GLN 580 Ca 0.00 -1.70 -0.28 0.00 -1.95 0.00 0.00 55.36 51.43 2bt3 s GLN 580 Cb 0.00 0.42 0.02 0.00 -0.22 0.00 0.00 33.01 33.23 2bt3 s GLN 580 CO 0.00 -0.72 1.30 0.34 -0.25 0.00 0.00 175.29 175.95 2bt3 s ASP 581 N -3.21 6.30 0.31 5.90 -1.08 -1.18 -1.63 116.67 122.09 2bt3 s ASP 581 Ca 0.31 0.20 0.08 0.00 -0.52 0.00 0.00 52.55 52.62 2bt3 s ASP 581 Cb 0.01 -2.55 -0.06 0.00 -1.46 0.00 0.00 42.92 38.85 2bt3 s ASP 581 CO 0.19 -1.58 -0.08 0.27 0.52 0.00 0.00 175.17 174.48 2bt3 s ILE 582 N 5.45 1.95 -0.05 4.11 -4.36 -1.26 -0.62 121.20 126.42 2bt3 s ILE 582 Ca 0.47 -2.17 0.01 0.00 -0.26 0.00 0.00 60.65 58.70 2bt3 s ILE 582 Cb -0.09 -2.54 0.02 0.00 1.25 0.00 0.00 42.46 41.10 2bt3 s ILE 582 CO 0.25 -0.26 -0.04 -0.69 0.24 0.00 0.00 174.94 174.45 2bt3 s VAL 583 N -2.81 0.50 -0.18 8.37 1.01 -0.01 -2.12 120.40 125.17 2bt3 s VAL 583 Ca 0.31 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.11 2bt3 s VAL 583 Cb 0.03 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 2bt3 s VAL 583 CO 0.14 0.22 0.12 -0.69 0.00 0.00 0.00 175.10 174.90 2bt3 s VAL 584 N 1.02 5.33 -0.26 2.92 1.01 -0.02 -1.10 120.40 129.31 2bt3 s VAL 584 Ca -0.09 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.07 2bt3 s VAL 584 Cb -0.14 -3.40 0.06 0.00 0.00 0.00 0.00 36.38 32.90 2bt3 s VAL 584 CO -0.01 0.49 -0.11 0.26 0.00 0.00 0.00 175.10 175.74 2bt3 s TRP 585 N -0.01 3.27 -0.25 5.22 0.52 0.39 -0.49 118.94 127.59 2bt3 s TRP 585 Ca 0.09 -2.33 -0.07 0.00 0.02 0.00 0.00 56.10 53.81 2bt3 s TRP 585 Cb -0.11 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.25 2bt3 s TRP 585 CO -0.00 -0.88 0.08 -1.58 0.02 0.00 0.00 176.95 174.58 2bt3 s HIS 586 N 1.10 3.09 -0.06 -1.98 2.46 -0.30 -1.32 115.29 118.29 2bt3 s HIS 586 Ca -0.09 -0.39 -0.21 0.00 0.47 0.00 0.00 55.06 54.83 2bt3 s HIS 586 Cb -0.20 -2.24 -0.04 0.00 -0.13 0.00 0.00 32.58 29.96 2bt3 s HIS 586 CO -0.05 -0.35 0.61 0.99 -2.47 0.00 0.00 174.74 173.48 2bt3 s THR 587 N 1.61 5.04 -0.19 0.89 2.01 -0.43 -1.13 115.64 123.45 2bt3 s THR 587 Ca 0.06 1.26 -0.18 0.00 0.31 0.00 0.00 61.69 63.15 2bt3 s THR 587 Cb -0.15 -3.95 0.05 0.00 0.01 0.00 0.00 72.50 68.46 2bt3 s THR 587 CO 0.04 0.32 0.51 0.72 -0.69 0.00 0.00 174.62 175.52 2bt3 s PHE 588 N 0.47 -0.55 0.33 4.92 -0.71 -0.69 -4.72 117.98 117.02 2bt3 s PHE 588 Ca 0.33 1.35 -0.14 0.00 -1.04 0.00 0.00 56.93 57.42 2bt3 s PHE 588 Cb -0.17 0.19 0.03 0.00 -1.21 0.00 0.00 43.02 41.86 2bt3 s PHE 588 CO 0.16 -0.27 0.67 0.20 -1.34 0.00 0.00 175.22 174.63 2bt3 s GLY 589 N 0.24 0.49 -0.12 1.99 0.00 -1.26 -0.49 107.32 108.17 2bt3 s GLY 589 Ca -0.00 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 43.89 2bt3 s GLY 589 CO 0.01 -0.43 -0.05 1.08 0.00 0.00 0.00 173.10 173.71 2bt3 s LEU 590 N -3.06 3.24 -0.27 0.66 1.43 -0.04 -4.69 118.68 115.95 2bt3 s LEU 590 Ca 0.18 -0.08 -0.09 0.00 -1.03 0.00 0.00 54.13 53.11 2bt3 s LEU 590 Cb -0.04 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2bt3 s LEU 590 CO 0.12 0.24 0.12 -0.89 0.23 0.00 0.00 176.35 176.17 2bt3 s THR 591 N -0.09 4.72 -0.29 5.49 2.01 -1.26 -0.76 115.64 125.46 2bt3 s THR 591 Ca 0.02 -0.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.94 2bt3 s THR 591 Cb -0.13 -3.24 0.05 0.00 0.01 0.00 0.00 72.50 69.18 2bt3 s THR 591 CO 0.03 0.28 -0.02 -2.28 -0.69 0.00 0.00 174.62 171.94 2bt3 s HIS 592 N 1.67 3.23 -0.58 4.92 2.46 -0.03 -5.01 115.29 121.95 2bt3 s HIS 592 Ca 0.06 -1.84 -0.11 0.00 0.47 0.00 0.00 55.06 53.65 2bt3 s HIS 592 Cb -0.16 -2.09 0.15 0.00 -0.13 0.00 0.00 32.58 30.35 2bt3 s HIS 592 CO 0.07 -0.79 0.48 -0.06 -2.47 0.00 0.00 174.74 171.96 2bt3 s PHE 593 N 1.26 3.45 0.42 3.88 0.08 -1.26 -2.29 117.98 123.52 2bt3 s PHE 593 Ca -0.05 -1.86 -0.26 0.00 0.12 0.00 0.00 56.93 54.89 2bt3 s PHE 593 Cb -0.19 -3.60 -0.09 0.00 -0.57 0.00 0.00 43.02 38.56 2bt3 s PHE 593 CO -0.02 -0.98 1.41 -2.30 -0.10 0.00 0.00 175.22 173.23 2bt3 n PRO 594 N 4.64 2.28 -4.15 0.24 -0.02 -1.26 -5.00 135.00 131.73 2bt3 n PRO 594 Ca -0.03 0.81 -0.23 0.00 -2.02 0.00 0.00 63.50 62.03 2bt3 n PRO 594 Cb 0.41 -2.58 -0.05 0.00 -0.02 0.00 0.00 33.50 31.26 2bt3 n PRO 594 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2bt3 s ARG 595 N -2.30 2.77 0.42 -0.52 1.70 -1.26 -4.75 118.95 115.00 2bt3 s ARG 595 Ca 0.59 -1.11 0.13 0.00 -0.47 0.00 0.00 55.73 54.88 2bt3 s ARG 595 Cb -0.47 -2.48 0.99 0.00 -0.57 0.00 0.00 34.95 32.42 2bt3 s ARG 595 CO 0.59 0.41 1.94 0.28 -1.08 0.00 0.00 175.30 177.44 2bt3 h VAL 596 N 1.69 0.85 0.00 4.99 2.07 -1.89 -0.55 116.25 123.42 2bt3 h VAL 596 Ca -0.47 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2bt3 h VAL 596 Cb 1.23 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2bt3 h VAL 596 CO 0.61 0.09 0.00 -0.33 0.02 0.00 0.00 177.57 177.95 2bt3 h GLU 597 N 0.48 0.00 0.00 1.57 3.07 -1.95 -2.08 114.58 115.67 2bt3 h GLU 597 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 2bt3 h GLU 597 Cb 0.68 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 2bt3 h GLU 597 CO -0.11 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.25 2bt3 n ASP 598 N -2.57 0.03 -4.54 1.42 8.00 -0.21 -4.49 116.55 114.18 2bt3 n ASP 598 Ca -0.01 0.50 -0.34 0.00 0.71 0.00 0.00 54.79 55.66 2bt3 n ASP 598 Cb 0.12 -0.51 -0.12 0.00 -0.02 0.00 0.00 41.12 40.59 2bt3 n ASP 598 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2bt3 s TRP 599 N -3.00 2.89 -1.80 1.24 -0.11 -0.78 -2.44 118.94 114.93 2bt3 s TRP 599 Ca 0.13 -0.08 0.27 0.00 1.22 0.00 0.00 56.10 57.65 2bt3 s TRP 599 Cb 0.18 -1.72 0.92 0.00 -1.50 0.00 0.00 33.47 31.35 2bt3 s TRP 599 CO 0.50 0.24 1.67 -0.35 -4.62 0.00 0.00 176.95 174.39 2bt3 n PRO 600 N 2.41 0.88 -3.80 5.86 -0.04 -1.26 -4.98 135.00 134.08 2bt3 n PRO 600 Ca -0.18 -0.47 -0.13 0.00 -0.04 0.00 0.00 63.50 62.69 2bt3 n PRO 600 Cb 0.53 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.36 2bt3 n PRO 600 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2bt3 s ILE 601 N -2.44 -0.02 -0.06 0.52 2.07 -1.22 -4.76 121.20 115.29 2bt3 s ILE 601 Ca 0.27 0.06 -0.26 0.00 -1.41 0.00 0.00 60.65 59.31 2bt3 s ILE 601 Cb 0.20 -0.21 -0.03 0.00 0.13 0.00 0.00 42.46 42.54 2bt3 s ILE 601 CO 0.49 0.02 0.83 -0.32 -1.91 0.00 0.00 174.94 174.05 2bt3 s MET 602 N 0.43 4.45 0.55 3.50 -2.45 -0.13 -4.75 119.30 120.90 2bt3 s MET 602 Ca -0.03 1.10 -0.21 0.00 -1.25 0.00 0.00 55.69 55.30 2bt3 s MET 602 Cb -0.04 -3.48 -0.05 0.00 1.25 0.00 0.00 34.83 32.51 2bt3 s MET 602 CO -0.02 -0.06 1.28 -2.14 1.05 0.00 0.00 175.02 175.13 2bt3 s PRO 603 N 1.15 3.19 0.31 4.11 0.02 -1.26 -4.26 135.00 138.26 2bt3 s PRO 603 Ca 0.43 2.02 -0.30 0.00 0.02 0.00 0.00 61.00 63.17 2bt3 s PRO 603 Cb -0.19 -2.18 -0.12 0.00 0.02 0.00 0.00 34.50 32.04 2bt3 s PRO 603 CO 0.20 -1.08 1.57 0.28 -0.33 0.00 0.00 177.00 177.64 2bt3 n VAL 604 N -1.10 1.19 -4.40 3.83 0.31 -1.26 -4.79 118.33 112.11 2bt3 n VAL 604 Ca 0.11 -0.30 -0.21 0.00 -0.01 0.00 0.00 64.34 63.93 2bt3 n VAL 604 Cb 0.47 -1.94 -0.10 0.00 -0.91 0.00 0.00 33.84 31.36 2bt3 n VAL 604 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2bt3 s ASP 605 N 0.38 3.04 0.10 4.52 2.15 -0.81 -4.95 116.67 121.10 2bt3 s ASP 605 Ca 0.62 -1.01 0.04 0.00 0.43 0.00 0.00 52.55 52.64 2bt3 s ASP 605 Cb -0.50 -0.21 -0.04 0.00 -0.30 0.00 0.00 42.92 41.87 2bt3 s ASP 605 CO 0.51 -0.06 -0.11 0.42 -0.17 0.00 0.00 175.17 175.76 2bt3 s THR 606 N -2.67 1.04 0.14 1.71 -4.23 -1.26 -0.59 115.64 109.78 2bt3 s THR 606 Ca 0.25 -1.67 -0.16 0.00 -1.18 0.00 0.00 61.69 58.93 2bt3 s THR 606 Cb -0.03 -1.41 0.03 0.00 1.34 0.00 0.00 72.50 72.43 2bt3 s THR 606 CO 0.10 -0.53 0.42 0.54 -0.54 0.00 0.00 174.62 174.62 2bt3 s VAL 607 N -2.39 0.06 -0.59 2.29 0.11 -1.00 -4.99 120.40 113.89 2bt3 s VAL 607 Ca 0.06 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 58.51 2bt3 s VAL 607 Cb -0.03 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.58 2bt3 s VAL 607 CO 0.01 -0.27 0.00 0.61 -3.33 0.00 0.00 175.10 172.11 2bt3 n GLY 608 N -0.25 -0.60 3.73 6.54 0.00 -1.26 -0.58 105.19 112.78 2bt3 n GLY 608 Ca -0.15 -0.59 -0.06 0.00 0.00 0.00 0.00 46.02 45.22 2bt3 n GLY 608 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bt3 s PHE 609 N -3.19 -0.22 0.12 1.61 -0.12 -0.96 -4.21 117.98 111.01 2bt3 s PHE 609 Ca 0.00 -0.11 -0.08 0.00 -0.05 0.00 0.00 56.93 56.69 2bt3 s PHE 609 Cb 0.00 0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 2bt3 s PHE 609 CO 0.00 -0.95 0.21 -1.59 -0.05 0.00 0.00 175.22 172.84 2bt3 s LYS 610 N -3.55 0.96 -0.06 1.99 -2.85 -0.94 -1.86 119.74 113.43 2bt3 s LYS 610 Ca 0.10 -1.09 0.03 0.00 -1.00 0.00 0.00 55.97 54.01 2bt3 s LYS 610 Cb -0.03 0.34 0.01 0.00 -2.06 0.00 0.00 37.83 36.09 2bt3 s LYS 610 CO 0.01 -0.32 -0.15 -0.51 0.10 0.00 0.00 175.35 174.48 2bt3 s LEU 611 N -2.92 1.81 0.03 2.77 1.02 0.54 -0.40 118.68 121.53 2bt3 s LEU 611 Ca 0.11 -0.35 0.08 0.00 0.02 0.00 0.00 54.13 53.99 2bt3 s LEU 611 Cb 0.05 -0.95 -0.03 0.00 0.02 0.00 0.00 46.19 45.28 2bt3 s LEU 611 CO -0.06 0.09 -0.24 -0.13 0.02 0.00 0.00 176.35 176.03 2bt3 s ARG 612 N 0.39 1.93 0.40 1.70 0.52 -0.02 -1.31 118.95 122.56 2bt3 s ARG 612 Ca -0.11 -1.04 -0.27 0.00 -0.52 0.00 0.00 55.73 53.78 2bt3 s ARG 612 Cb -0.14 -2.05 -0.10 0.00 0.52 0.00 0.00 34.95 33.17 2bt3 s ARG 612 CO 0.04 0.53 1.48 -0.35 0.02 0.00 0.00 175.30 177.01 2bt3 n PRO 613 N 1.84 2.56 -3.52 3.54 -0.04 -1.26 -0.11 135.00 138.01 2bt3 n PRO 613 Ca -0.17 0.90 -0.29 0.00 -0.04 0.00 0.00 63.50 63.91 2bt3 n PRO 613 Cb 0.52 -2.67 -0.12 0.00 -0.04 0.00 0.00 33.50 31.19 2bt3 n PRO 613 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2bt3 s GLU 614 N -2.21 0.80 -1.36 0.54 2.56 0.22 -4.76 118.70 114.49 2bt3 s GLU 614 Ca 0.55 -1.62 0.00 0.00 0.00 0.00 0.00 54.97 53.91 2bt3 s GLU 614 Cb -0.47 -1.60 0.00 0.00 2.00 0.00 0.00 34.13 34.06 2bt3 s GLU 614 CO 0.62 -1.22 0.00 0.41 -0.56 0.00 0.00 175.26 174.51 2bt3 n GLY 615 N 3.75 1.35 0.16 -1.50 0.00 -1.26 -2.60 105.19 105.09 2bt3 n GLY 615 Ca 0.13 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2bt3 n GLY 615 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bt3 h PHE 616 N 0.00 0.57 -2.39 1.61 3.57 -1.86 -3.37 116.94 115.07 2bt3 h PHE 616 Ca -0.26 -0.16 -0.45 0.00 3.53 0.00 0.00 57.97 60.63 2bt3 h PHE 616 Cb 0.89 -0.13 0.02 0.00 2.79 0.00 0.00 35.95 39.53 2bt3 h PHE 616 CO 0.39 0.81 -0.17 -0.06 -2.23 0.00 0.00 178.31 177.06 2bt3 s PHE 617 N -4.43 3.13 -1.67 0.41 0.08 -1.26 -4.86 117.98 109.38 2bt3 s PHE 617 Ca -0.13 0.04 0.27 0.00 0.12 0.00 0.00 56.93 57.23 2bt3 s PHE 617 Cb 0.07 -2.28 0.87 0.00 -0.57 0.00 0.00 43.02 41.11 2bt3 s PHE 617 CO 0.78 -0.32 1.64 -0.25 -0.10 0.00 0.00 175.22 176.96 2bt3 n ASP 618 N -1.97 0.83 -4.02 1.36 8.00 -1.26 -4.89 116.55 114.59 2bt3 n ASP 618 Ca 0.02 -0.74 0.05 0.00 0.71 0.00 0.00 54.79 54.83 2bt3 n ASP 618 Cb 0.58 0.08 0.01 0.00 -0.02 0.00 0.00 41.12 41.77 2bt3 n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bt3 s ARG 619 N -2.53 0.04 0.16 -1.24 1.70 -1.26 -4.94 118.95 110.87 2bt3 s ARG 619 Ca 0.24 -0.03 -0.34 0.00 -0.47 0.00 0.00 55.73 55.14 2bt3 s ARG 619 Cb 0.19 0.01 -0.15 0.00 -0.57 0.00 0.00 34.95 34.43 2bt3 s ARG 619 CO 0.52 -0.02 1.29 0.45 -1.08 0.00 0.00 175.30 176.46 2bt3 n SER 620 N -1.00 1.84 -0.15 -2.89 2.88 -1.26 -4.86 113.62 108.18 2bt3 n SER 620 Ca 0.07 1.13 0.10 0.00 -1.33 0.00 0.00 58.87 58.84 2bt3 n SER 620 Cb 0.58 -1.27 0.54 0.00 -0.75 0.00 0.00 64.21 63.32 2bt3 n SER 620 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2bt3 n PRO 621 N 2.17 1.20 -0.51 -1.46 -0.04 -1.26 -4.08 135.00 131.02 2bt3 n PRO 621 Ca 0.15 -0.30 0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2bt3 n PRO 621 Cb 0.25 -1.34 0.19 0.00 -0.04 0.00 0.00 33.50 32.55 2bt3 n PRO 621 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2bt3 n VAL 622 N -0.51 2.06 0.26 0.52 0.24 -1.26 -4.65 118.33 114.99 2bt3 n VAL 622 Ca 0.15 -2.94 0.15 0.00 -2.04 0.00 0.00 64.34 59.66 2bt3 n VAL 622 Cb 0.14 -0.20 0.58 0.00 -1.47 0.00 0.00 33.84 32.90 2bt3 n VAL 622 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2bt3 h LEU 623 N 0.77 0.00 -1.84 1.34 3.38 -1.98 -3.04 115.31 113.95 2bt3 h LEU 623 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bt3 h LEU 623 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2bt3 h LEU 623 CO 0.00 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 177.68 2bt3 n ASP 624 N -3.15 2.71 -4.71 -0.43 5.75 -1.26 -4.88 116.55 110.58 2bt3 n ASP 624 Ca 0.01 -1.92 -0.42 0.00 -0.01 0.00 0.00 54.79 52.44 2bt3 n ASP 624 Cb 0.36 -0.26 -0.03 0.00 -1.03 0.00 0.00 41.12 40.15 2bt3 n ASP 624 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2bt3 s VAL 625 N -1.47 3.86 0.59 2.12 1.01 -1.15 -5.01 120.40 120.34 2bt3 s VAL 625 Ca 0.36 1.32 -0.13 0.00 0.00 0.00 0.00 61.98 63.52 2bt3 s VAL 625 Cb 0.19 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 2bt3 s VAL 625 CO 0.27 0.09 1.02 -2.16 0.00 0.00 0.00 175.10 174.31 2bt3 s PRO 626 N 1.28 3.64 0.78 2.72 0.04 -1.26 -5.04 135.00 137.15 2bt3 s PRO 626 Ca 0.60 0.86 -0.13 0.00 0.04 0.00 0.00 61.00 62.37 2bt3 s PRO 626 Cb -0.31 -2.09 0.07 0.00 0.04 0.00 0.00 34.50 32.21 2bt3 s PRO 626 CO 0.29 -0.53 1.19 0.00 0.04 0.00 0.00 177.00 177.98 2bt3 s ALA 627 N -2.95 1.97 0.00 8.56 0.00 -1.26 -4.82 121.76 123.26 2bt3 s ALA 627 Ca 0.57 0.78 0.00 0.00 0.00 0.00 0.00 51.96 53.31 2bt3 s ALA 627 Cb -0.11 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2bt3 s ALA 627 CO 0.46 -2.09 0.00 0.09 0.00 0.00 0.00 175.76 174.21