#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n58 s MET 7 N 0.00 1.23 -0.18 -1.46 0.00 -1.26 -4.44 119.30 113.18 3n58 s MET 7 Ca 0.00 -0.45 -0.05 0.00 0.00 0.00 0.00 55.69 55.19 3n58 s MET 7 Cb 0.00 0.56 0.07 0.00 0.00 0.00 0.00 34.83 35.46 3n58 s MET 7 CO 0.00 -0.52 0.11 0.08 0.00 0.00 0.00 175.02 174.69 3n58 s VAL 8 N -3.55 -0.12 0.36 5.16 1.01 -0.16 -4.98 120.40 118.12 3n58 s VAL 8 Ca 0.00 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.82 3n58 s VAL 8 Cb -0.01 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 3n58 s VAL 8 CO -0.11 -0.30 0.10 0.68 0.00 0.00 0.00 175.10 175.46 3n58 s VAL 9 N 2.16 0.84 0.15 2.92 -7.23 -1.26 -1.43 120.40 116.55 3n58 s VAL 9 Ca 0.03 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.15 3n58 s VAL 9 Cb -0.16 -2.57 -0.13 0.00 0.56 0.00 0.00 36.38 34.09 3n58 s VAL 9 CO -0.11 0.00 1.38 0.07 -0.31 0.00 0.00 175.10 176.13 3n58 h LYS 10 N 2.00 0.52 -0.46 4.82 2.10 -1.87 -3.45 116.57 120.22 3n58 h LYS 10 Ca -0.38 -0.44 0.20 0.00 -2.00 0.00 0.00 60.65 58.03 3n58 h LYS 10 Cb 1.26 0.09 -0.20 0.00 -0.90 0.00 0.00 32.23 32.48 3n58 h LYS 10 CO 0.63 1.07 0.00 0.34 -2.00 0.00 0.00 179.45 179.48 3n58 s ASP 11 N -7.03 -0.67 0.36 7.07 -1.08 -1.26 -5.04 116.67 109.02 3n58 s ASP 11 Ca -0.07 0.30 0.27 0.00 -0.52 0.00 0.00 52.55 52.53 3n58 s ASP 11 Cb 0.10 1.52 1.11 0.00 -1.46 0.00 0.00 42.92 44.18 3n58 s ASP 11 CO 0.86 -0.12 1.81 -0.29 0.52 0.00 0.00 175.17 177.95 3n58 h ILE 12 N 5.28 0.00 0.00 4.11 6.09 -1.94 -2.33 117.51 128.72 3n58 h ILE 12 Ca -0.13 -0.34 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3n58 h ILE 12 Cb 1.17 1.18 0.00 0.00 0.47 0.00 0.00 36.82 39.64 3n58 h ILE 12 CO -0.03 0.00 0.00 -1.54 -3.07 0.00 0.00 178.15 173.51 3n58 n SER 13 N -2.55 0.08 -0.02 2.19 3.41 -1.26 -2.46 113.62 113.02 3n58 n SER 13 Ca 0.02 0.52 0.16 0.00 -0.26 0.00 0.00 58.87 59.30 3n58 n SER 13 Cb 0.26 -0.54 0.89 0.00 -0.26 0.00 0.00 64.21 64.57 3n58 n SER 13 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3n58 n LEU 14 N -1.59 0.07 -0.27 1.04 4.77 -0.88 -4.15 117.00 115.98 3n58 n LEU 14 Ca 0.03 0.04 -0.01 0.00 -0.03 0.00 0.00 56.01 56.04 3n58 n LEU 14 Cb 0.17 -0.06 0.11 0.00 -2.33 0.00 0.00 43.42 41.32 3n58 n LEU 14 CO 0.14 0.01 1.15 0.00 -1.33 0.00 0.00 177.39 177.36 3n58 h ALA 15 N 3.90 1.04 -0.33 -1.18 0.00 -1.72 -1.23 119.26 119.74 3n58 h ALA 15 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3n58 h ALA 15 Cb 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3n58 h ALA 15 CO 0.00 0.19 0.16 -0.44 0.00 0.00 0.00 179.25 179.17 3n58 h ASP 16 N 0.86 0.42 0.54 0.00 3.32 -1.86 0.29 116.42 119.99 3n58 h ASP 16 Ca 0.33 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 3n58 h ASP 16 Cb 0.14 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3n58 h ASP 16 CO -0.16 0.42 -0.35 -0.25 -1.72 0.00 0.00 179.24 177.18 3n58 h TRP 17 N 0.40 -0.94 -1.00 4.55 7.01 -1.76 -1.21 115.95 123.00 3n58 h TRP 17 Ca 0.11 -0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.29 3n58 h TRP 17 Cb 0.11 0.34 -0.18 0.00 -2.10 0.00 0.00 29.16 27.33 3n58 h TRP 17 CO -0.02 -0.53 -0.31 0.41 -2.79 0.00 0.00 178.44 175.20 3n58 n GLY 18 N -1.49 -1.84 0.36 2.65 0.00 -0.50 -0.80 105.19 103.57 3n58 n GLY 18 Ca -0.12 1.09 -0.02 0.00 0.00 0.00 0.00 46.02 46.97 3n58 n GLY 18 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n58 h ARG 19 N 0.00 1.18 -0.32 1.61 9.65 0.10 -1.12 114.38 125.47 3n58 h ARG 19 Ca 0.42 -0.10 -0.13 0.00 -1.10 0.00 0.00 59.98 59.07 3n58 h ARG 19 Cb 0.67 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 3n58 h ARG 19 CO -1.01 0.82 -0.31 0.87 2.80 0.00 0.00 179.97 183.14 3n58 h LYS 20 N 1.20 0.68 0.00 0.20 1.57 0.24 -2.18 116.57 118.28 3n58 h LYS 20 Ca 0.31 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 3n58 h LYS 20 Cb -0.05 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3n58 h LYS 20 CO -0.06 0.91 -0.32 0.93 -0.57 0.00 0.00 179.45 180.34 3n58 h GLU 21 N 0.58 0.00 -0.34 3.15 5.08 -0.56 -3.02 114.58 119.48 3n58 h GLU 21 Ca 0.07 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 3n58 h GLU 21 Cb 0.82 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3n58 h GLU 21 CO 0.07 0.32 -0.30 -0.07 -1.00 0.00 0.00 179.01 178.03 3n58 h LEU 22 N 0.00 0.85 -1.67 1.33 -0.00 -0.92 0.63 115.31 115.53 3n58 h LEU 22 Ca -0.00 -0.46 0.12 0.00 -0.00 0.00 0.00 57.88 57.54 3n58 h LEU 22 Cb 0.88 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 41.27 3n58 h LEU 22 CO 0.04 1.13 0.43 0.44 -0.00 0.00 0.00 178.44 180.49 3n58 h ASP 23 N 0.58 0.32 0.00 -0.43 3.32 -1.28 -0.48 116.42 118.44 3n58 h ASP 23 Ca 0.06 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 3n58 h ASP 23 Cb 0.88 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 3n58 h ASP 23 CO 0.08 0.18 -0.34 0.40 -1.72 0.00 0.00 179.24 177.84 3n58 h ILE 24 N 0.35 1.43 -0.90 0.35 2.04 -1.43 -3.35 117.51 116.00 3n58 h ILE 24 Ca 0.30 -2.20 0.19 0.00 1.00 0.00 0.00 64.86 64.15 3n58 h ILE 24 Cb 0.71 2.82 -0.07 0.00 -0.74 0.00 0.00 36.82 39.54 3n58 h ILE 24 CO -0.08 0.48 0.59 0.00 0.00 0.00 0.00 178.15 179.14 3n58 h ALA 25 N -0.21 2.08 -0.06 1.87 0.00 -0.64 0.33 119.26 122.63 3n58 h ALA 25 Ca -0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3n58 h ALA 25 Cb 1.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3n58 h ALA 25 CO -0.06 -0.36 -0.18 0.93 0.00 0.00 0.00 179.25 179.58 3n58 h GLU 26 N 0.50 0.10 0.00 0.00 5.08 -1.21 -0.22 114.58 118.82 3n58 h GLU 26 Ca 0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 3n58 h GLU 26 Cb 1.05 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.28 3n58 h GLU 26 CO -0.20 0.29 0.00 1.79 -1.00 0.00 0.00 179.01 179.88 3n58 h THR 27 N 0.10 0.00 -0.02 1.13 1.35 -1.06 -2.67 112.91 111.73 3n58 h THR 27 Ca 0.02 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 3n58 h THR 27 Cb 0.38 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 3n58 h THR 27 CO 0.03 0.00 -0.20 -0.62 -0.25 0.00 0.00 175.52 174.48 3n58 n GLU 28 N -2.62 1.63 -3.41 4.72 -0.58 -0.14 -4.65 120.64 115.59 3n58 n GLU 28 Ca 0.03 -1.26 -0.26 0.00 -0.42 0.00 0.00 57.16 55.25 3n58 n GLU 28 Cb 0.34 -1.47 -0.08 0.00 -0.57 0.00 0.00 31.44 29.65 3n58 n GLU 28 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3n58 n MET 29 N 0.41 1.75 0.23 3.49 2.81 -0.90 -3.20 117.12 121.71 3n58 n MET 29 Ca 0.13 -4.12 0.07 0.00 -1.81 0.00 0.00 57.70 51.97 3n58 n MET 29 Cb 0.48 -1.92 0.56 0.00 -0.71 0.00 0.00 33.22 31.64 3n58 n MET 29 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3n58 h PRO 30 N 4.39 0.00 -0.22 0.03 0.13 -1.83 -2.34 132.00 132.16 3n58 h PRO 30 Ca 0.16 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3n58 h PRO 30 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 3n58 h PRO 30 CO 0.68 0.16 0.12 0.78 -0.23 0.00 0.00 178.00 179.51 3n58 h GLY 31 N 0.57 0.33 1.01 1.56 0.00 -1.84 0.13 103.07 104.82 3n58 h GLY 31 Ca -0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 3n58 h GLY 31 CO 0.02 0.14 -0.41 1.41 0.00 0.00 0.00 176.54 177.70 3n58 h LEU 32 N 0.25 0.79 -1.07 3.11 3.38 -1.71 -2.72 115.31 117.33 3n58 h LEU 32 Ca 0.08 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 3n58 h LEU 32 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3n58 h LEU 32 CO -0.01 1.16 0.04 0.24 0.09 0.00 0.00 178.44 179.96 3n58 h MET 33 N 0.45 0.69 -0.51 1.13 2.86 -1.40 -2.25 114.93 115.90 3n58 h MET 33 Ca 0.02 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 3n58 h MET 33 Cb 1.00 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.55 3n58 h MET 33 CO 0.09 0.68 0.12 0.00 1.06 0.00 0.00 176.91 178.87 3n58 h ALA 34 N 1.38 1.26 -0.47 6.32 0.00 -0.68 -2.34 119.26 124.74 3n58 h ALA 34 Ca 0.14 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3n58 h ALA 34 Cb 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3n58 h ALA 34 CO 0.01 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.69 3n58 h ALA 35 N 1.39 0.96 -0.25 0.00 0.00 -1.10 -0.18 119.26 120.07 3n58 h ALA 35 Ca 0.17 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3n58 h ALA 35 Cb 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3n58 h ALA 35 CO -0.00 0.62 0.12 0.00 0.00 0.00 0.00 179.25 179.98 3n58 h ARG 36 N 0.76 0.37 -0.59 0.00 3.08 -1.07 0.13 114.38 117.07 3n58 h ARG 36 Ca 0.13 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.13 3n58 h ARG 36 Cb 0.59 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3n58 h ARG 36 CO 0.04 0.38 0.38 0.93 -1.07 0.00 0.00 179.97 180.63 3n58 h GLU 37 N 0.27 0.74 -0.02 0.04 5.08 -1.27 0.01 114.58 119.43 3n58 h GLU 37 Ca 0.09 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 58.19 3n58 h GLU 37 Cb 0.14 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3n58 h GLU 37 CO -0.01 0.49 -0.88 1.49 -1.00 0.00 0.00 179.01 179.10 3n58 h GLU 38 N 0.76 0.42 0.00 2.33 4.81 -0.62 -3.37 114.58 118.92 3n58 h GLU 38 Ca 0.22 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 3n58 h GLU 38 Cb -0.05 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3n58 h GLU 38 CO -0.06 1.08 0.00 1.19 -0.73 0.00 0.00 179.01 180.48 3n58 n PHE 39 N -3.77 0.00 -0.13 0.92 3.72 0.41 -4.73 117.46 113.87 3n58 n PHE 39 Ca -0.06 -0.31 -0.09 0.00 -0.05 0.00 0.00 57.45 56.94 3n58 n PHE 39 Cb 0.80 -0.03 -0.00 0.00 -0.94 0.00 0.00 39.48 39.31 3n58 n PHE 39 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3n58 h GLY 40 N 0.00 0.61 1.03 1.37 0.00 -1.11 -1.28 103.07 103.69 3n58 h GLY 40 Ca 0.00 -0.30 -0.32 0.00 0.00 0.00 0.00 47.33 46.71 3n58 h GLY 40 CO 0.00 0.28 -1.47 0.07 0.00 0.00 0.00 176.54 175.42 3n58 h LYS 41 N 0.51 0.45 0.00 4.80 5.09 -1.84 -3.25 116.57 122.33 3n58 h LYS 41 Ca 0.14 -0.77 0.00 0.00 0.09 0.00 0.00 60.65 60.11 3n58 h LYS 41 Cb 0.10 0.29 0.00 0.00 0.10 0.00 0.00 32.23 32.72 3n58 h LYS 41 CO -0.02 1.37 0.00 0.66 -2.09 0.00 0.00 179.45 179.37 3n58 h SER 42 N 0.03 0.00 -6.50 7.07 4.64 -1.86 -3.48 113.55 113.46 3n58 h SER 42 Ca -0.27 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.55 3n58 h SER 42 Cb 2.06 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 64.16 3n58 h SER 42 CO 0.22 0.00 -0.95 0.00 -0.87 0.00 0.00 176.83 175.23 3n58 n GLN 43 N -2.45 -1.52 0.33 4.77 6.02 -0.48 -4.83 117.38 119.22 3n58 n GLN 43 Ca 0.03 0.34 0.22 0.00 -0.01 0.00 0.00 57.00 57.58 3n58 n GLN 43 Cb 0.35 -3.84 1.18 0.00 1.02 0.00 0.00 30.24 28.95 3n58 n GLN 43 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3n58 h PRO 44 N -2.05 0.00 -0.60 -1.09 0.13 -1.72 -1.83 132.00 124.85 3n58 h PRO 44 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3n58 h PRO 44 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3n58 h PRO 44 CO 0.54 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.59 3n58 n LEU 45 N -3.05 4.73 -4.70 1.56 4.77 0.28 -4.78 117.00 115.81 3n58 n LEU 45 Ca -0.03 -2.52 -0.42 0.00 -0.03 0.00 0.00 56.01 53.01 3n58 n LEU 45 Cb 0.08 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 40.57 3n58 n LEU 45 CO 0.20 0.78 1.41 0.29 -1.33 0.00 0.00 177.39 178.74 3n58 n LYS 46 N 0.93 2.75 -0.30 3.23 4.76 -0.69 -1.11 118.16 127.73 3n58 n LYS 46 Ca 0.25 1.00 0.00 0.00 -2.87 0.00 0.00 58.31 56.69 3n58 n LYS 46 Cb 0.90 -2.86 0.00 0.00 -1.84 0.00 0.00 35.03 31.23 3n58 n LYS 46 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n58 n GLY 47 N 4.06 1.09 3.73 0.72 0.00 -1.26 -4.97 105.19 108.56 3n58 n GLY 47 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3n58 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n58 s ALA 48 N -2.81 3.40 -0.48 4.61 0.00 -0.27 -4.97 121.76 121.24 3n58 s ALA 48 Ca 0.00 0.88 0.04 0.00 0.00 0.00 0.00 51.96 52.87 3n58 s ALA 48 Cb 0.00 -3.41 0.12 0.00 0.00 0.00 0.00 23.12 19.83 3n58 s ALA 48 CO 0.00 -0.36 0.22 1.03 0.00 0.00 0.00 175.76 176.65 3n58 s ARG 49 N 0.28 1.89 -0.23 0.00 0.52 -1.26 -1.31 118.95 118.84 3n58 s ARG 49 Ca 0.55 -2.43 -0.16 0.00 -0.52 0.00 0.00 55.73 53.17 3n58 s ARG 49 Cb -0.31 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 3n58 s ARG 49 CO 0.33 -1.07 0.40 0.42 0.02 0.00 0.00 175.30 175.39 3n58 s ILE 50 N 0.02 5.18 -0.37 1.52 1.01 -0.23 -1.14 121.20 127.19 3n58 s ILE 50 Ca 0.15 0.66 -0.17 0.00 0.00 0.00 0.00 60.65 61.30 3n58 s ILE 50 Cb -0.24 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.51 3n58 s ILE 50 CO -0.02 0.20 0.44 -0.44 0.00 0.00 0.00 174.94 175.12 3n58 s SER 51 N 1.31 6.24 -0.16 3.58 0.01 -0.47 -1.08 113.70 123.12 3n58 s SER 51 Ca 0.18 -0.26 -0.05 0.00 1.31 0.00 0.00 55.95 57.12 3n58 s SER 51 Cb -0.15 -2.23 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 3n58 s SER 51 CO 0.09 -0.46 0.00 -0.83 0.41 0.00 0.00 173.24 172.45 3n58 s GLY 52 N 1.77 1.80 -0.41 3.44 0.00 -0.15 -1.90 107.32 111.87 3n58 s GLY 52 Ca 0.15 -0.79 0.03 0.00 0.00 0.00 0.00 44.72 44.11 3n58 s GLY 52 CO 0.13 -0.04 0.16 -0.45 0.00 0.00 0.00 173.10 172.89 3n58 s SER 53 N 0.30 4.33 -0.28 1.64 0.15 -0.36 -0.67 113.70 118.80 3n58 s SER 53 Ca -0.01 -2.45 -0.15 0.00 0.70 0.00 0.00 55.95 54.04 3n58 s SER 53 Cb -0.13 -1.43 0.09 0.00 -1.71 0.00 0.00 66.02 62.84 3n58 s SER 53 CO 0.02 -0.32 0.69 -0.22 1.20 0.00 0.00 173.24 174.61 3n58 s LEU 54 N 0.51 -0.98 -0.13 3.45 0.20 -0.54 -1.93 118.68 119.27 3n58 s LEU 54 Ca 0.14 1.52 -0.11 0.00 0.69 0.00 0.00 54.13 56.36 3n58 s LEU 54 Cb -0.22 2.37 -0.05 0.00 -0.43 0.00 0.00 46.19 47.86 3n58 s LEU 54 CO -0.06 -0.23 0.51 1.41 -0.29 0.00 0.00 176.35 177.68 3n58 n HIS 55 N 4.51 0.34 -2.50 5.38 8.25 -1.26 -4.26 115.22 125.68 3n58 n HIS 55 Ca -0.19 0.22 -0.41 0.00 -0.26 0.00 0.00 57.72 57.09 3n58 n HIS 55 Cb 0.57 -0.58 -0.01 0.00 1.12 0.00 0.00 29.99 31.09 3n58 n HIS 55 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 3n58 s MET 56 N 1.32 3.75 0.45 -0.41 1.75 -1.26 -4.56 119.30 120.34 3n58 s MET 56 Ca 0.30 -1.87 0.06 0.00 -1.25 0.00 0.00 55.69 52.93 3n58 s MET 56 Cb -0.38 -5.49 -0.03 0.00 2.84 0.00 0.00 34.83 31.77 3n58 s MET 56 CO 0.18 -2.54 0.22 0.95 -0.65 0.00 0.00 175.02 173.18 3n58 s THR 57 N 5.34 2.08 0.23 10.11 -4.23 -1.26 -0.45 115.64 127.46 3n58 s THR 57 Ca 0.56 -1.65 -0.07 0.00 -1.18 0.00 0.00 61.69 59.34 3n58 s THR 57 Cb 0.03 -2.74 0.19 0.00 1.34 0.00 0.00 72.50 71.32 3n58 s THR 57 CO 0.09 0.00 1.71 0.40 -0.54 0.00 0.00 174.62 176.28 3n58 h ILE 58 N 1.25 0.63 -0.25 2.99 1.08 -1.91 -0.51 117.51 120.79 3n58 h ILE 58 Ca -0.42 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 63.98 3n58 h ILE 58 Cb 1.27 0.28 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 3n58 h ILE 58 CO 0.67 0.06 0.01 1.56 -0.69 0.00 0.00 178.15 179.76 3n58 h GLN 59 N 0.33 0.09 -0.51 2.37 7.50 -1.94 -1.92 115.11 121.03 3n58 h GLN 59 Ca 0.36 -0.01 -0.05 0.00 0.50 0.00 0.00 58.65 59.46 3n58 h GLN 59 Cb 0.55 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.03 3n58 h GLN 59 CO -0.41 0.06 0.11 1.15 -1.50 0.00 0.00 178.83 178.24 3n58 h THR 60 N 0.09 1.22 -0.66 -0.54 2.02 -1.66 -2.18 112.91 111.19 3n58 h THR 60 Ca 0.12 -0.80 0.08 0.00 0.77 0.00 0.00 66.41 66.58 3n58 h THR 60 Cb 0.14 0.71 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 3n58 h THR 60 CO -0.19 0.29 0.33 0.00 0.37 0.00 0.00 175.52 176.33 3n58 h ALA 61 N 1.38 0.90 -0.21 6.16 0.00 -0.55 0.14 119.26 127.07 3n58 h ALA 61 Ca 0.17 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3n58 h ALA 61 Cb 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3n58 h ALA 61 CO -0.00 -0.04 -0.04 0.28 0.00 0.00 0.00 179.25 179.45 3n58 h VAL 62 N 0.59 1.15 -0.34 0.00 2.07 -0.75 -1.83 116.25 117.14 3n58 h VAL 62 Ca 0.32 -0.62 -0.12 0.00 0.82 0.00 0.00 66.70 67.10 3n58 h VAL 62 Cb 0.29 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3n58 h VAL 62 CO -0.24 0.20 -0.26 0.25 0.02 0.00 0.00 177.57 177.55 3n58 h LEU 63 N 0.30 0.82 -0.41 2.57 5.85 -0.63 -1.87 115.31 121.94 3n58 h LEU 63 Ca 0.07 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.31 3n58 h LEU 63 Cb 0.27 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3n58 h LEU 63 CO 0.01 1.09 0.13 0.40 -0.34 0.00 0.00 178.44 179.73 3n58 h ILE 64 N 0.56 1.22 -0.24 4.05 2.04 -0.38 0.30 117.51 125.05 3n58 h ILE 64 Ca 0.06 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3n58 h ILE 64 Cb 0.82 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3n58 h ILE 64 CO 0.07 0.25 -0.23 -0.33 0.00 0.00 0.00 178.15 177.90 3n58 h GLU 65 N 0.51 0.44 -0.34 2.37 5.08 -1.36 -1.81 114.58 119.47 3n58 h GLU 65 Ca 0.13 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3n58 h GLU 65 Cb 0.26 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3n58 h GLU 65 CO -0.00 0.65 0.11 1.15 -1.00 0.00 0.00 179.01 179.92 3n58 h THR 66 N 0.40 1.21 -0.58 1.13 2.02 -0.67 -0.70 112.91 115.72 3n58 h THR 66 Ca 0.06 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 3n58 h THR 66 Cb 0.63 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 3n58 h THR 66 CO 0.04 0.23 0.31 -0.07 0.37 0.00 0.00 175.52 176.40 3n58 h LEU 67 N 0.40 0.71 -0.35 2.58 3.38 -0.73 -2.56 115.31 118.74 3n58 h LEU 67 Ca 0.11 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 3n58 h LEU 67 Cb 0.24 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3n58 h LEU 67 CO -0.00 0.58 -0.14 0.11 0.09 0.00 0.00 178.44 179.08 3n58 h LYS 68 N 0.80 0.71 -0.01 1.13 1.57 -1.06 -1.69 116.57 118.02 3n58 h LYS 68 Ca 0.20 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3n58 h LYS 68 Cb 0.04 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3n58 h LYS 68 CO -0.03 0.90 0.03 0.28 -0.57 0.00 0.00 179.45 180.05 3n58 h VAL 69 N 0.50 0.19 -0.04 0.50 2.07 -0.86 0.47 116.25 119.07 3n58 h VAL 69 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3n58 h VAL 69 Cb 0.67 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3n58 h VAL 69 CO 0.05 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.82 3n58 n LEU 70 N -3.35 1.57 0.00 2.57 4.77 -0.93 -4.50 117.00 117.13 3n58 n LEU 70 Ca -0.03 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 3n58 n LEU 70 Cb 0.11 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3n58 n LEU 70 CO 0.22 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3n58 n GLY 71 N 1.17 2.63 3.76 -0.72 0.00 0.16 -0.56 105.19 111.62 3n58 n GLY 71 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3n58 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n58 s ALA 72 N -2.39 2.93 -0.16 4.61 0.00 -0.68 -4.19 121.76 121.88 3n58 s ALA 72 Ca 0.00 1.30 -0.07 0.00 0.00 0.00 0.00 51.96 53.19 3n58 s ALA 72 Cb 0.00 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3n58 s ALA 72 CO 0.00 -1.23 0.08 -1.21 0.00 0.00 0.00 175.76 173.40 3n58 s GLU 73 N -2.77 3.80 0.17 0.00 2.02 -0.42 -4.21 118.70 117.29 3n58 s GLU 73 Ca 0.68 -0.29 0.08 0.00 0.02 0.00 0.00 54.97 55.46 3n58 s GLU 73 Cb -0.39 -3.19 -0.04 0.00 0.10 0.00 0.00 34.13 30.60 3n58 s GLU 73 CO 0.47 0.42 -0.17 0.14 0.02 0.00 0.00 175.26 176.15 3n58 s VAL 74 N -0.03 1.76 -0.07 2.63 -7.23 -1.26 -1.07 120.40 115.12 3n58 s VAL 74 Ca 0.07 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.27 3n58 s VAL 74 Cb -0.12 -1.88 0.01 0.00 0.56 0.00 0.00 36.38 34.96 3n58 s VAL 74 CO 0.01 -0.41 -0.12 -0.13 -0.31 0.00 0.00 175.10 174.14 3n58 s ARG 75 N -3.05 1.67 0.08 4.82 0.52 -0.24 -4.32 118.95 118.43 3n58 s ARG 75 Ca 0.17 -0.39 0.09 0.00 -0.52 0.00 0.00 55.73 55.08 3n58 s ARG 75 Cb -0.04 -1.41 -0.03 0.00 0.52 0.00 0.00 34.95 33.99 3n58 s ARG 75 CO 0.06 -0.00 -0.24 -0.46 0.02 0.00 0.00 175.30 174.68 3n58 s TRP 76 N 0.76 2.07 0.12 -0.53 -0.11 -0.63 -0.97 118.94 119.64 3n58 s TRP 76 Ca -0.13 -0.40 -0.04 0.00 1.22 0.00 0.00 56.10 56.76 3n58 s TRP 76 Cb -0.15 -1.18 -0.03 0.00 -1.50 0.00 0.00 33.47 30.61 3n58 s TRP 76 CO 0.03 0.20 0.11 0.00 -4.62 0.00 0.00 176.95 172.67 3n58 s ALA 77 N -0.96 0.43 0.49 5.86 0.00 0.15 -0.62 121.76 127.11 3n58 s ALA 77 Ca 0.10 -1.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 3n58 s ALA 77 Cb -0.10 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.66 3n58 s ALA 77 CO 0.04 -0.50 0.84 0.45 0.00 0.00 0.00 175.76 176.59 3n58 s SER 78 N -2.98 6.33 -0.13 0.00 0.15 -1.25 -1.46 113.70 114.37 3n58 s SER 78 Ca 0.16 1.11 0.16 0.00 0.70 0.00 0.00 55.95 58.08 3n58 s SER 78 Cb 0.06 -2.32 0.62 0.00 -1.71 0.00 0.00 66.02 62.66 3n58 s SER 78 CO -0.03 -0.60 1.53 0.00 1.20 0.00 0.00 173.24 175.34 3n58 s ASN 80 N -1.17 -0.64 0.55 0.00 3.84 -1.26 -4.92 114.94 111.34 3n58 s ASN 80 Ca 0.45 1.23 0.35 0.00 0.21 0.00 0.00 52.86 55.09 3n58 s ASN 80 Cb 0.31 1.24 1.56 0.00 -0.55 0.00 0.00 41.25 43.81 3n58 s ASN 80 CO 0.18 -0.22 2.04 0.16 -2.79 0.00 0.00 177.10 176.47 3n58 h ILE 81 N 4.15 0.00 -0.01 -5.21 3.07 -1.91 -3.16 117.51 114.44 3n58 h ILE 81 Ca -0.28 -0.38 0.00 0.00 1.55 0.00 0.00 64.86 65.75 3n58 h ILE 81 Cb 1.17 1.35 0.00 0.00 -0.27 0.00 0.00 36.82 39.07 3n58 h ILE 81 CO 0.12 0.00 -0.05 0.49 -1.05 0.00 0.00 178.15 177.66 3n58 n PHE 82 N -3.01 0.00 1.04 0.16 3.72 -1.26 -0.43 117.46 117.68 3n58 n PHE 82 Ca -0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 3n58 n PHE 82 Cb 0.25 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.00 3n58 n PHE 82 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3n58 n SER 83 N 0.14 0.70 -4.76 4.37 3.41 -1.19 -4.33 113.62 111.96 3n58 n SER 83 Ca 0.04 -0.50 -0.39 0.00 -0.26 0.00 0.00 58.87 57.76 3n58 n SER 83 Cb 0.17 0.34 0.03 0.00 -0.26 0.00 0.00 64.21 64.49 3n58 n SER 83 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3n58 s THR 84 N -2.90 2.13 -0.39 6.66 2.01 -1.26 -4.49 115.64 117.40 3n58 s THR 84 Ca 0.13 0.10 -0.10 0.00 0.31 0.00 0.00 61.69 62.14 3n58 s THR 84 Cb 0.18 -3.05 0.05 0.00 0.01 0.00 0.00 72.50 69.68 3n58 s THR 84 CO 0.69 0.00 0.22 -1.10 -0.69 0.00 0.00 174.62 173.74 3n58 s GLN 85 N -2.75 2.72 0.30 4.92 -0.21 0.41 -4.61 119.66 120.43 3n58 s GLN 85 Ca 0.68 -1.25 0.00 0.00 0.02 0.00 0.00 55.36 54.81 3n58 s GLN 85 Cb -0.41 -3.74 0.70 0.00 1.00 0.00 0.00 33.01 30.56 3n58 s GLN 85 CO 0.50 -0.81 1.58 -0.44 -2.12 0.00 0.00 175.29 174.00 3n58 h ASP 86 N 8.41 -0.47 0.79 5.90 3.32 -1.92 0.05 116.42 132.51 3n58 h ASP 86 Ca -0.24 0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 3n58 h ASP 86 Cb 1.09 0.47 -0.01 0.00 0.22 0.00 0.00 39.33 41.10 3n58 h ASP 86 CO 0.70 -0.32 -0.23 1.12 -1.72 0.00 0.00 179.24 178.79 3n58 h HIS 87 N 0.03 0.00 -0.05 4.55 2.07 -1.91 -0.70 115.15 119.14 3n58 h HIS 87 Ca 0.57 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.99 3n58 h HIS 87 Cb 1.13 0.00 0.01 0.00 2.57 0.00 0.00 27.41 31.12 3n58 h HIS 87 CO -0.49 0.23 -0.36 0.00 -3.07 0.00 0.00 177.93 174.24 3n58 h ALA 88 N 1.77 0.11 -0.35 6.11 0.00 -1.34 -2.51 119.26 123.04 3n58 h ALA 88 Ca -0.00 -0.47 0.07 0.00 0.00 0.00 0.00 54.91 54.51 3n58 h ALA 88 Cb 0.69 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 3n58 h ALA 88 CO 0.03 0.21 -0.10 0.00 0.00 0.00 0.00 179.25 179.39 3n58 h ALA 89 N 0.39 0.21 -0.66 0.00 0.00 -0.86 -2.32 119.26 116.02 3n58 h ALA 89 Ca -0.03 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3n58 h ALA 89 Cb 1.04 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 3n58 h ALA 89 CO 0.07 -0.47 0.40 0.00 0.00 0.00 0.00 179.25 179.25 3n58 h ALA 90 N 1.32 0.86 -0.49 0.00 0.00 -1.20 -0.05 119.26 119.70 3n58 h ALA 90 Ca 0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3n58 h ALA 90 Cb 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3n58 h ALA 90 CO -0.37 0.13 0.11 0.00 0.00 0.00 0.00 179.25 179.12 3n58 h ALA 91 N 1.30 1.28 -0.23 0.00 0.00 -1.09 -0.30 119.26 120.23 3n58 h ALA 91 Ca 0.27 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3n58 h ALA 91 Cb 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3n58 h ALA 91 CO -0.13 0.51 -0.32 0.82 0.00 0.00 0.00 179.25 180.13 3n58 h ILE 92 N 0.72 1.32 -0.72 0.00 1.08 -0.94 -3.04 117.51 115.94 3n58 h ILE 92 Ca 0.16 -1.52 0.01 0.00 -0.39 0.00 0.00 64.86 63.13 3n58 h ILE 92 Cb 0.28 1.76 -0.04 0.00 -3.07 0.00 0.00 36.82 35.75 3n58 h ILE 92 CO -0.00 0.47 0.48 0.00 -0.69 0.00 0.00 178.15 178.41 3n58 h ALA 93 N 0.64 1.51 0.00 1.87 0.00 -0.69 -2.45 119.26 120.14 3n58 h ALA 93 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3n58 h ALA 93 Cb 0.90 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3n58 h ALA 93 CO 0.07 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.77 3n58 n ALA 94 N -2.43 1.60 1.31 0.00 0.00 -0.15 -1.06 120.51 119.78 3n58 n ALA 94 Ca 0.08 0.09 0.14 0.00 0.00 0.00 0.00 53.44 53.75 3n58 n ALA 94 Cb 0.06 -1.38 0.50 0.00 0.00 0.00 0.00 19.45 18.63 3n58 n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3n58 n THR 95 N -2.23 0.00 0.00 0.00 -2.24 -0.93 -4.92 114.28 103.96 3n58 n THR 95 Ca 0.02 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3n58 n THR 95 Cb 0.21 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 3n58 n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n58 n GLY 96 N 1.32 1.07 3.69 3.38 0.00 -0.22 -5.04 105.19 109.38 3n58 n GLY 96 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3n58 n GLY 96 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n58 s THR 97 N -2.27 3.21 0.06 2.61 2.01 -1.21 -4.93 115.64 115.12 3n58 s THR 97 Ca 0.00 0.62 -0.31 0.00 0.31 0.00 0.00 61.69 62.31 3n58 s THR 97 Cb 0.00 -3.40 -0.08 0.00 0.01 0.00 0.00 72.50 69.04 3n58 s THR 97 CO 0.00 -0.01 1.57 -2.84 -0.69 0.00 0.00 174.62 172.65 3n58 s PRO 98 N 2.73 4.23 -0.02 4.92 0.02 -1.26 -3.99 135.00 141.62 3n58 s PRO 98 Ca 0.72 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.97 3n58 s PRO 98 Cb -0.38 -3.56 0.02 0.00 0.02 0.00 0.00 34.50 30.60 3n58 s PRO 98 CO 0.31 -0.68 -0.01 0.54 -0.33 0.00 0.00 177.00 176.84 3n58 s VAL 99 N 2.46 0.17 -0.42 3.83 0.11 -1.26 -1.61 120.40 123.68 3n58 s VAL 99 Ca 0.71 0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.82 3n58 s VAL 99 Cb -0.38 -0.24 0.13 0.00 -1.53 0.00 0.00 36.38 34.36 3n58 s VAL 99 CO 0.31 0.12 0.20 -0.36 -3.33 0.00 0.00 175.10 172.03 3n58 s PHE 100 N 0.73 2.29 -0.26 1.54 0.08 0.20 -0.99 117.98 121.58 3n58 s PHE 100 Ca -0.07 -2.49 -0.12 0.00 0.12 0.00 0.00 56.93 54.38 3n58 s PHE 100 Cb -0.10 -2.11 0.09 0.00 -0.57 0.00 0.00 43.02 40.34 3n58 s PHE 100 CO -0.01 -0.81 0.59 0.00 -0.10 0.00 0.00 175.22 174.89 3n58 s ALA 101 N 0.51 -1.70 -0.02 5.36 0.00 -0.51 -3.90 121.76 121.50 3n58 s ALA 101 Ca 0.16 2.13 0.02 0.00 0.00 0.00 0.00 51.96 54.27 3n58 s ALA 101 Cb -0.23 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.44 3n58 s ALA 101 CO -0.04 -0.60 -0.08 0.08 0.00 0.00 0.00 175.76 175.11 3n58 s VAL 102 N 2.17 0.72 -0.29 0.00 1.01 -1.26 -4.28 120.40 118.47 3n58 s VAL 102 Ca -0.07 -0.34 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 3n58 s VAL 102 Cb -0.09 -0.64 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 3n58 s VAL 102 CO -0.17 0.23 1.59 -0.75 0.00 0.00 0.00 175.10 175.99 3n58 s LYS 103 N 0.15 3.66 0.00 2.72 2.20 -1.26 -2.99 119.74 124.22 3n58 s LYS 103 Ca -0.02 1.43 0.00 0.00 -0.36 0.00 0.00 55.97 57.02 3n58 s LYS 103 Cb -0.08 -4.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.19 3n58 s LYS 103 CO 0.00 -1.45 0.00 0.41 -0.36 0.00 0.00 175.35 173.95 3n58 n GLY 104 N 4.87 0.81 3.86 5.54 0.00 0.43 -4.99 105.19 115.72 3n58 n GLY 104 Ca 0.19 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 3n58 n GLY 104 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3n58 s GLU 105 N -1.93 3.75 0.86 1.61 -1.05 -0.97 -5.04 118.70 115.92 3n58 s GLU 105 Ca 0.00 0.72 -0.13 0.00 -0.15 0.00 0.00 54.97 55.42 3n58 s GLU 105 Cb 0.00 -2.18 0.13 0.00 -0.44 0.00 0.00 34.13 31.64 3n58 s GLU 105 CO 0.00 -0.34 1.21 0.95 0.95 0.00 0.00 175.26 178.03 3n58 s THR 106 N -2.81 2.03 0.12 1.83 -4.23 -1.26 -4.84 115.64 106.49 3n58 s THR 106 Ca 0.55 -0.05 -0.18 0.00 -1.18 0.00 0.00 61.69 60.83 3n58 s THR 106 Cb -0.10 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 3n58 s THR 106 CO 0.41 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 176.13 3n58 h LEU 107 N -1.22 0.36 -0.33 4.79 3.38 -1.99 -0.82 115.31 119.48 3n58 h LEU 107 Ca -0.45 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 57.47 3n58 h LEU 107 Cb 1.29 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.90 3n58 h LEU 107 CO 0.53 0.36 0.09 -0.33 0.09 0.00 0.00 178.44 179.18 3n58 h GLU 108 N 0.34 0.21 -0.86 1.13 5.08 -1.94 -2.15 114.58 116.38 3n58 h GLU 108 Ca 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 3n58 h GLU 108 Cb 0.08 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 3n58 h GLU 108 CO -0.01 0.14 0.51 0.93 -1.00 0.00 0.00 179.01 179.57 3n58 h GLU 109 N 0.21 1.18 -0.30 2.33 5.08 -1.91 -1.77 114.58 119.41 3n58 h GLU 109 Ca 0.15 -0.11 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3n58 h GLU 109 Cb 0.15 -0.24 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 3n58 h GLU 109 CO -0.18 0.84 -0.04 -0.92 -1.00 0.00 0.00 179.01 177.71 3n58 h TYR 110 N 1.19 -0.08 -0.23 4.33 3.20 -0.52 0.04 116.97 124.89 3n58 h TYR 110 Ca 0.31 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 62.05 3n58 h TYR 110 Cb -0.03 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 3n58 h TYR 110 CO 0.00 -0.09 -0.46 -1.49 -1.64 0.00 0.00 178.16 174.48 3n58 h TRP 111 N 0.04 0.73 -0.52 -3.82 4.06 -1.23 -1.03 115.95 114.19 3n58 h TRP 111 Ca 0.14 -0.23 0.06 0.00 2.06 0.00 0.00 58.89 60.92 3n58 h TRP 111 Cb 0.21 -0.15 -0.05 0.00 -1.00 0.00 0.00 29.16 28.17 3n58 h TRP 111 CO -0.25 0.96 0.23 1.15 -3.56 0.00 0.00 178.44 176.96 3n58 h THR 112 N 0.48 0.90 -0.32 1.49 2.02 -0.83 -1.40 112.91 115.25 3n58 h THR 112 Ca 0.03 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 3n58 h THR 112 Cb 0.99 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 3n58 h THR 112 CO 0.09 0.08 0.11 1.88 0.37 0.00 0.00 175.52 178.05 3n58 h TYR 113 N 0.44 0.50 -0.94 3.16 0.05 -0.85 -2.04 116.97 117.29 3n58 h TYR 113 Ca 0.24 -0.05 0.18 0.00 0.05 0.00 0.00 58.73 59.15 3n58 h TYR 113 Cb 0.20 -0.15 -0.10 0.00 1.01 0.00 0.00 36.73 37.69 3n58 h TYR 113 CO -0.13 0.50 0.53 1.15 -1.05 0.00 0.00 178.16 179.17 3n58 h THR 114 N 0.36 0.69 -0.30 -2.88 2.02 -0.76 -0.14 112.91 111.91 3n58 h THR 114 Ca 0.10 -0.24 -0.13 0.00 0.77 0.00 0.00 66.41 66.92 3n58 h THR 114 Cb 0.22 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.57 3n58 h THR 114 CO -0.01 0.13 -0.33 -0.78 0.37 0.00 0.00 175.52 174.90 3n58 h ASP 115 N 0.69 0.68 -0.33 4.18 3.58 -1.05 -3.14 116.42 121.03 3n58 h ASP 115 Ca 0.54 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.69 3n58 h ASP 115 Cb 0.83 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 3n58 h ASP 115 CO -0.39 0.96 0.15 1.56 -2.88 0.00 0.00 179.24 178.64 3n58 h GLN 116 N 0.56 0.54 0.00 0.28 1.08 -0.29 -2.30 115.11 114.98 3n58 h GLN 116 Ca 0.06 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3n58 h GLN 116 Cb 0.84 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 3n58 h GLN 116 CO 0.07 0.46 0.00 0.44 -0.95 0.00 0.00 178.83 178.85 3n58 n ILE 117 N -4.38 1.19 0.74 2.54 -5.35 -1.00 -1.53 119.36 111.57 3n58 n ILE 117 Ca 0.02 0.58 0.08 0.00 -0.27 0.00 0.00 62.75 63.17 3n58 n ILE 117 Cb 0.15 -1.56 -0.02 0.00 -1.74 0.00 0.00 39.64 36.47 3n58 n ILE 117 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3n58 n PHE 118 N -2.07 0.00 -3.00 4.28 3.72 -0.87 -4.64 117.46 114.89 3n58 n PHE 118 Ca -0.00 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.96 3n58 n PHE 118 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 3n58 n PHE 118 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3n58 n GLN 119 N -0.34 3.48 -2.33 -1.08 1.13 -0.58 -4.58 117.38 113.08 3n58 n GLN 119 Ca 0.06 -4.01 -0.38 0.00 -1.94 0.00 0.00 57.00 50.73 3n58 n GLN 119 Cb 0.33 -2.88 -0.02 0.00 0.11 0.00 0.00 30.24 27.77 3n58 n GLN 119 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 3n58 s TRP 120 N 0.56 3.13 0.49 1.08 0.52 -1.26 -4.95 118.94 118.51 3n58 s TRP 120 Ca 0.39 1.57 0.17 0.00 0.02 0.00 0.00 56.10 58.25 3n58 s TRP 120 Cb -0.03 -3.37 1.21 0.00 -1.15 0.00 0.00 33.47 30.13 3n58 s TRP 120 CO -0.01 -1.20 2.10 -1.35 0.02 0.00 0.00 176.95 176.50 3n58 h PRO 121 N 2.76 0.00 -0.19 4.98 0.11 -1.96 -1.02 132.00 136.68 3n58 h PRO 121 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3n58 h PRO 121 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3n58 h PRO 121 CO 0.63 0.07 0.00 -0.40 -0.21 0.00 0.00 178.00 178.09 3n58 n ASP 122 N -4.39 1.33 0.00 -2.05 5.68 -1.26 -4.90 116.55 110.97 3n58 n ASP 122 Ca -0.03 -1.80 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 3n58 n ASP 122 Cb 0.15 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 3n58 n ASP 122 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3n58 n GLY 123 N 0.99 1.37 3.84 6.12 0.00 -0.39 -5.00 105.19 112.12 3n58 n GLY 123 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 3n58 n GLY 123 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n58 s GLU 124 N -0.15 4.04 0.85 1.61 0.41 -1.26 -4.93 118.70 119.27 3n58 s GLU 124 Ca 0.00 0.65 -0.11 0.00 -0.41 0.00 0.00 54.97 55.10 3n58 s GLU 124 Cb 0.00 -2.61 0.10 0.00 -1.78 0.00 0.00 34.13 29.84 3n58 s GLU 124 CO 0.00 0.26 1.09 -1.25 -0.49 0.00 0.00 175.26 174.88 3n58 s PRO 125 N -2.63 1.64 0.83 0.39 0.04 -1.26 -4.31 135.00 129.70 3n58 s PRO 125 Ca 0.49 0.74 -0.11 0.00 0.04 0.00 0.00 61.00 62.17 3n58 s PRO 125 Cb -0.12 -1.86 0.09 0.00 0.04 0.00 0.00 34.50 32.65 3n58 s PRO 125 CO 0.19 -1.96 1.10 -1.12 0.04 0.00 0.00 177.00 175.25 3n58 s SER 126 N -3.64 3.94 0.00 6.66 0.01 -1.26 -4.96 113.70 114.45 3n58 s SER 126 Ca 0.62 1.77 0.00 0.00 1.31 0.00 0.00 55.95 59.65 3n58 s SER 126 Cb -0.16 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3n58 s SER 126 CO 0.56 -2.38 0.27 -0.46 0.41 0.00 0.00 173.24 171.63 3n58 n ASN 127 N -3.74 0.54 -3.96 2.44 0.23 -0.29 -4.36 115.26 106.11 3n58 n ASN 127 Ca 0.09 -0.78 -0.09 0.00 -0.53 0.00 0.00 54.58 53.27 3n58 n ASN 127 Cb 0.54 0.38 -0.10 0.00 -2.08 0.00 0.00 39.78 38.51 3n58 n ASN 127 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 3n58 s MET 128 N -0.38 0.47 -0.03 -3.83 -1.94 -1.06 -0.54 119.30 111.99 3n58 s MET 128 Ca 0.00 -0.72 0.05 0.00 -1.71 0.00 0.00 55.69 53.31 3n58 s MET 128 Cb 0.00 0.18 -0.01 0.00 2.01 0.00 0.00 34.83 37.01 3n58 s MET 128 CO 0.00 -0.10 -0.18 0.42 -0.01 0.00 0.00 175.02 175.15 3n58 s ILE 129 N -2.21 1.47 -0.24 2.53 1.01 -0.84 -1.36 121.20 121.56 3n58 s ILE 129 Ca -0.09 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.81 3n58 s ILE 129 Cb -0.04 -1.25 0.06 0.00 0.01 0.00 0.00 42.46 41.24 3n58 s ILE 129 CO -0.03 0.42 -0.07 -0.22 0.00 0.00 0.00 174.94 175.03 3n58 s LEU 130 N -0.19 2.81 0.13 2.97 0.20 -0.80 -1.39 118.68 122.41 3n58 s LEU 130 Ca 0.01 -1.22 0.08 0.00 0.69 0.00 0.00 54.13 53.69 3n58 s LEU 130 Cb -0.10 -1.30 -0.04 0.00 -0.43 0.00 0.00 46.19 44.33 3n58 s LEU 130 CO 0.01 -0.21 -0.18 -0.62 -0.29 0.00 0.00 176.35 175.06 3n58 s ASP 131 N 1.30 2.43 -0.25 3.68 2.15 0.27 -1.22 116.67 125.03 3n58 s ASP 131 Ca -0.06 -0.78 -0.04 0.00 0.43 0.00 0.00 52.55 52.09 3n58 s ASP 131 Cb -0.19 -0.13 0.10 0.00 -0.30 0.00 0.00 42.92 42.40 3n58 s ASP 131 CO -0.06 -0.03 0.17 -0.62 -0.17 0.00 0.00 175.17 174.45 3n58 s ASP 132 N -2.34 2.58 0.00 -0.34 -1.08 -0.81 -1.06 116.67 113.61 3n58 s ASP 132 Ca 0.10 -0.87 0.00 0.00 -0.52 0.00 0.00 52.55 51.27 3n58 s ASP 132 Cb -0.07 -0.05 0.00 0.00 -1.46 0.00 0.00 42.92 41.34 3n58 s ASP 132 CO 0.05 -0.39 0.00 0.61 0.52 0.00 0.00 175.17 175.96 3n58 n GLY 133 N 5.28 2.82 1.57 2.66 0.00 -1.26 -4.60 105.19 111.67 3n58 n GLY 133 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3n58 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n58 n GLY 134 N -0.94 0.69 0.20 -0.02 0.00 -1.26 -4.08 105.19 99.78 3n58 n GLY 134 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3n58 n GLY 134 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n58 h ASP 135 N 0.00 0.56 -0.25 1.61 5.19 -1.95 -1.20 116.42 120.39 3n58 h ASP 135 Ca 0.00 -0.12 -0.13 0.00 -0.62 0.00 0.00 57.03 56.16 3n58 h ASP 135 Cb 0.00 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 3n58 h ASP 135 CO 0.00 0.52 -0.33 0.00 -3.12 0.00 0.00 179.24 176.31 3n58 h ALA 136 N 1.07 0.77 0.71 3.45 0.00 -1.93 -1.77 119.26 121.55 3n58 h ALA 136 Ca 0.15 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3n58 h ALA 136 Cb 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3n58 h ALA 136 CO -0.02 0.65 -0.34 1.15 0.00 0.00 0.00 179.25 180.69 3n58 h THR 137 N 0.65 0.18 -0.73 0.00 2.02 -1.95 -3.04 112.91 110.04 3n58 h THR 137 Ca 0.07 -0.21 0.16 0.00 0.77 0.00 0.00 66.41 67.20 3n58 h THR 137 Cb 0.86 0.23 -0.12 0.00 -1.74 0.00 0.00 68.15 67.38 3n58 h THR 137 CO 0.08 0.02 0.10 -0.03 0.37 0.00 0.00 175.52 176.05 3n58 h MET 138 N -1.12 0.18 -0.32 6.66 -1.53 -1.20 -1.60 114.93 115.99 3n58 h MET 138 Ca -0.10 -0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.22 3n58 h MET 138 Cb 0.76 -0.04 -0.07 0.00 -0.55 0.00 0.00 31.60 31.69 3n58 h MET 138 CO 0.16 0.12 -0.15 -0.92 0.14 0.00 0.00 176.91 176.26 3n58 h TYR 139 N 0.18 -0.36 -0.57 1.39 3.20 -1.34 0.40 116.97 119.87 3n58 h TYR 139 Ca 0.41 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 62.26 3n58 h TYR 139 Cb 0.72 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.17 3n58 h TYR 139 CO -0.33 -0.22 0.14 0.82 -1.64 0.00 0.00 178.16 176.93 3n58 h ILE 140 N -0.10 1.25 -0.08 1.81 1.08 -1.20 -0.79 117.51 119.47 3n58 h ILE 140 Ca 0.16 -0.88 -0.16 0.00 -0.39 0.00 0.00 64.86 63.60 3n58 h ILE 140 Cb 0.35 0.73 0.01 0.00 -3.07 0.00 0.00 36.82 34.84 3n58 h ILE 140 CO -0.39 0.32 -0.58 -0.07 -0.69 0.00 0.00 178.15 176.75 3n58 h LEU 141 N 0.81 0.65 -0.42 1.44 3.38 -0.57 0.30 115.31 120.91 3n58 h LEU 141 Ca 0.18 -0.67 -0.16 0.00 0.09 0.00 0.00 57.88 57.32 3n58 h LEU 141 Cb 0.34 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3n58 h LEU 141 CO 0.00 1.22 -0.46 0.40 0.09 0.00 0.00 178.44 179.70 3n58 h ILE 142 N 0.13 1.28 -0.76 1.22 2.04 -0.29 -2.08 117.51 119.06 3n58 h ILE 142 Ca -0.05 -1.64 0.01 0.00 1.00 0.00 0.00 64.86 64.18 3n58 h ILE 142 Cb 1.24 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 38.80 3n58 h ILE 142 CO 0.12 0.54 0.50 1.23 0.00 0.00 0.00 178.15 180.53 3n58 h GLY 143 N 0.83 1.06 0.98 5.37 0.00 -1.08 -1.33 103.07 108.91 3n58 h GLY 143 Ca 0.04 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 3n58 h GLY 143 CO 0.10 0.39 0.11 0.00 0.00 0.00 0.00 176.54 177.14 3n58 h ALA 144 N 1.28 0.67 -0.42 3.60 0.00 -0.72 -1.83 119.26 121.83 3n58 h ALA 144 Ca 0.28 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3n58 h ALA 144 Cb -0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3n58 h ALA 144 CO -0.06 0.37 0.15 0.00 0.00 0.00 0.00 179.25 179.71 3n58 h ARG 145 N 0.70 0.64 -0.96 0.00 3.08 -1.18 -0.83 114.38 115.84 3n58 h ARG 145 Ca 0.16 -0.13 0.14 0.00 0.07 0.00 0.00 59.98 60.22 3n58 h ARG 145 Cb 0.35 -0.10 -0.09 0.00 0.08 0.00 0.00 29.97 30.21 3n58 h ARG 145 CO 0.00 0.61 0.58 0.00 -1.07 0.00 0.00 179.97 180.09 3n58 h ALA 146 N 1.00 1.47 -0.13 0.04 0.00 -1.08 -1.36 119.26 119.19 3n58 h ALA 146 Ca 0.14 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 3n58 h ALA 146 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3n58 h ALA 146 CO -0.01 0.10 -0.35 0.93 0.00 0.00 0.00 179.25 179.92 3n58 h GLU 147 N 0.86 0.26 0.00 0.00 5.08 -0.39 -1.41 114.58 118.98 3n58 h GLU 147 Ca 0.50 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 3n58 h GLU 147 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3n58 h GLU 147 CO -0.30 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.28 3n58 n ALA 148 N -2.48 2.50 -0.02 3.43 0.00 -0.42 -4.87 120.51 118.64 3n58 n ALA 148 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3n58 n ALA 148 Cb 0.43 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.44 3n58 n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n58 n GLY 149 N 0.78 0.48 3.76 0.00 0.00 -0.53 -5.07 105.19 104.61 3n58 n GLY 149 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3n58 n GLY 149 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n58 s GLU 150 N -0.98 3.61 -1.20 1.61 2.12 -0.88 -4.95 118.70 118.03 3n58 s GLU 150 Ca 0.00 1.93 -0.13 0.00 0.36 0.00 0.00 54.97 57.13 3n58 s GLU 150 Cb 0.00 -2.40 0.19 0.00 0.26 0.00 0.00 34.13 32.18 3n58 s GLU 150 CO 0.00 -0.72 1.42 -3.47 -0.54 0.00 0.00 175.26 171.95 3n58 n ASP 151 N -0.58 5.26 -0.52 -1.70 2.03 -1.26 -4.28 116.55 115.50 3n58 n ASP 151 Ca 0.08 -2.99 0.05 0.00 0.52 0.00 0.00 54.79 52.45 3n58 n ASP 151 Cb 0.47 -1.54 0.09 0.00 -0.72 0.00 0.00 41.12 39.42 3n58 n ASP 151 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 3n58 n VAL 152 N 4.29 0.46 -1.20 5.18 0.24 -1.26 -4.57 118.33 121.47 3n58 n VAL 152 Ca 0.35 -0.73 0.08 0.00 -2.04 0.00 0.00 64.34 62.01 3n58 n VAL 152 Cb 0.42 0.89 0.17 0.00 -1.47 0.00 0.00 33.84 33.86 3n58 n VAL 152 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3n58 n LEU 153 N 0.55 2.73 -4.31 1.34 4.77 -1.26 -5.03 117.00 115.79 3n58 n LEU 153 Ca 0.09 -3.29 -0.20 0.00 -0.03 0.00 0.00 56.01 52.57 3n58 n LEU 153 Cb 0.34 -0.48 -0.11 0.00 -2.33 0.00 0.00 43.42 40.84 3n58 n LEU 153 CO 0.07 0.89 -0.46 -0.55 -1.33 0.00 0.00 177.39 176.01 3n58 s SER 154 N -2.82 2.44 -1.12 -1.43 0.15 -1.26 -4.80 113.70 104.87 3n58 s SER 154 Ca 0.35 -0.90 -0.07 0.00 0.70 0.00 0.00 55.95 56.03 3n58 s SER 154 Cb 0.31 -0.12 0.01 0.00 -1.71 0.00 0.00 66.02 64.51 3n58 s SER 154 CO 0.01 -0.11 0.98 0.59 1.20 0.00 0.00 173.24 175.91 3n58 n ASN 155 N 0.15 -5.48 -4.68 5.45 3.02 -1.26 -4.94 115.26 107.52 3n58 n ASN 155 Ca -0.12 -0.45 -0.44 0.00 -0.03 0.00 0.00 54.58 53.54 3n58 n ASN 155 Cb 0.58 -4.25 -0.03 0.00 -0.61 0.00 0.00 39.78 35.47 3n58 n ASN 155 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3n58 n PRO 156 N -4.20 2.17 0.09 3.52 -0.04 -1.26 -4.91 135.00 130.36 3n58 n PRO 156 Ca -0.00 0.77 -0.20 0.00 -0.04 0.00 0.00 63.50 64.03 3n58 n PRO 156 Cb 0.55 -2.46 -0.15 0.00 -0.04 0.00 0.00 33.50 31.40 3n58 n PRO 156 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3n58 h GLN 157 N 4.53 0.37 -6.08 0.54 4.20 -1.94 -3.47 115.11 113.25 3n58 h GLN 157 Ca -0.45 -0.62 -0.57 0.00 0.06 0.00 0.00 58.65 57.06 3n58 h GLN 157 Cb 1.26 0.23 -0.10 0.00 0.30 0.00 0.00 27.48 29.17 3n58 h GLN 157 CO 0.78 1.27 -0.62 0.45 -0.67 0.00 0.00 178.83 180.04 3n58 s SER 158 N -7.24 4.29 0.22 1.46 0.15 -1.26 -5.00 113.70 106.32 3n58 s SER 158 Ca -0.10 -0.89 -0.09 0.00 0.70 0.00 0.00 55.95 55.57 3n58 s SER 158 Cb 0.06 -0.61 0.20 0.00 -1.71 0.00 0.00 66.02 63.96 3n58 s SER 158 CO 0.88 -0.18 1.87 1.05 1.20 0.00 0.00 173.24 178.06 3n58 h GLU 159 N 1.81 0.95 -0.68 5.44 9.09 -2.00 -1.88 114.58 127.31 3n58 h GLU 159 Ca -0.43 -0.06 0.02 0.00 0.05 0.00 0.00 59.36 58.95 3n58 h GLU 159 Cb 1.25 -0.21 -0.04 0.00 -1.65 0.00 0.00 28.75 28.10 3n58 h GLU 159 CO 0.64 0.63 0.45 0.93 0.05 0.00 0.00 179.01 181.72 3n58 h GLU 160 N 0.98 0.83 -0.33 1.06 3.07 -2.00 -2.11 114.58 116.08 3n58 h GLU 160 Ca 0.30 -0.05 -0.17 0.00 -0.50 0.00 0.00 59.36 58.94 3n58 h GLU 160 Cb -0.03 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 27.69 3n58 h GLU 160 CO -0.09 0.55 -0.45 1.49 -1.40 0.00 0.00 179.01 179.10 3n58 h GLU 161 N 0.86 0.89 -0.42 2.33 4.81 -1.84 -2.56 114.58 118.64 3n58 h GLU 161 Ca 0.27 -0.52 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 3n58 h GLU 161 Cb 0.01 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3n58 h GLU 161 CO -0.07 1.16 0.22 0.93 -0.73 0.00 0.00 179.01 180.52 3n58 h GLU 162 N 0.69 0.60 -0.31 1.92 5.08 -0.96 -1.39 114.58 120.20 3n58 h GLU 162 Ca 0.04 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 3n58 h GLU 162 Cb 1.06 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 3n58 h GLU 162 CO 0.11 0.49 -0.15 -0.24 -1.00 0.00 0.00 179.01 178.22 3n58 h VAL 163 N 0.55 1.24 -0.66 3.13 3.04 -1.39 -1.20 116.25 120.97 3n58 h VAL 163 Ca 0.15 -1.11 -0.04 0.00 -1.01 0.00 0.00 66.70 64.69 3n58 h VAL 163 Cb 0.08 1.18 -0.03 0.00 -2.01 0.00 0.00 31.29 30.50 3n58 h VAL 163 CO -0.02 0.36 0.25 0.25 -1.01 0.00 0.00 177.57 177.40 3n58 h LEU 164 N 0.50 0.90 -0.05 3.16 5.85 -1.27 -1.87 115.31 122.52 3n58 h LEU 164 Ca 0.09 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3n58 h LEU 164 Cb 0.55 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 3n58 h LEU 164 CO 0.04 0.81 -0.02 -0.26 -0.34 0.00 0.00 178.44 178.66 3n58 h PHE 165 N 0.96 0.12 -0.72 1.25 0.04 -0.82 -2.02 116.94 115.74 3n58 h PHE 165 Ca 0.22 -0.03 0.13 0.00 2.80 0.00 0.00 57.97 61.09 3n58 h PHE 165 Cb 0.20 -0.03 -0.09 0.00 2.20 0.00 0.00 35.95 38.23 3n58 h PHE 165 CO 0.02 0.49 0.28 0.00 -0.60 0.00 0.00 178.31 178.50 3n58 h ALA 166 N 0.61 0.99 -0.67 2.45 0.00 -1.20 -0.28 119.26 121.16 3n58 h ALA 166 Ca 0.01 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3n58 h ALA 166 Cb 0.46 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3n58 h ALA 166 CO 0.01 -0.20 0.11 0.37 0.00 0.00 0.00 179.25 179.54 3n58 h GLN 167 N 0.44 1.10 -0.08 0.00 5.75 -1.23 -0.00 115.11 121.08 3n58 h GLN 167 Ca 0.39 -0.29 -0.00 0.00 -0.15 0.00 0.00 58.65 58.60 3n58 h GLN 167 Cb 0.57 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 3n58 h GLN 167 CO -0.38 1.00 0.04 0.82 -2.65 0.00 0.00 178.83 177.66 3n58 h ILE 168 N 1.03 1.10 0.11 2.39 2.04 -0.60 -1.45 117.51 122.13 3n58 h ILE 168 Ca 0.20 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.78 3n58 h ILE 168 Cb 0.43 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 3n58 h ILE 168 CO 0.01 0.09 -0.28 0.11 0.00 0.00 0.00 178.15 178.08 3n58 h LYS 169 N 0.02 -0.47 -0.88 2.37 1.57 -0.85 -0.29 116.57 118.04 3n58 h LYS 169 Ca 0.03 0.03 0.21 0.00 -1.87 0.00 0.00 60.65 59.05 3n58 h LYS 169 Cb 0.11 0.11 -0.16 0.00 0.08 0.00 0.00 32.23 32.37 3n58 h LYS 169 CO -0.00 -0.31 -0.04 -0.22 -0.57 0.00 0.00 179.45 178.31 3n58 h LYS 170 N -0.49 0.05 -0.20 3.15 3.64 -0.92 -0.75 116.57 121.05 3n58 h LYS 170 Ca 0.03 -0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 3n58 h LYS 170 Cb 0.52 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 3n58 h LYS 170 CO -0.17 0.03 -0.51 -0.09 -2.27 0.00 0.00 179.45 176.44 3n58 h ARG 171 N 0.05 0.70 -0.82 1.90 9.65 -0.78 -2.49 114.38 122.59 3n58 h ARG 171 Ca 0.49 -0.49 0.12 0.00 -1.10 0.00 0.00 59.98 59.00 3n58 h ARG 171 Cb 0.89 0.07 -0.08 0.00 -1.39 0.00 0.00 29.97 29.46 3n58 h ARG 171 CO -0.82 1.11 0.44 0.52 2.80 0.00 0.00 179.97 184.02 3n58 h MET 172 N 0.41 0.67 -0.15 0.20 2.86 0.31 -1.30 114.93 117.93 3n58 h MET 172 Ca -0.01 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 3n58 h MET 172 Cb 1.12 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.63 3n58 h MET 172 CO 0.11 0.45 -0.13 0.00 1.06 0.00 0.00 176.91 178.39 3n58 h ALA 173 N 1.50 0.22 -0.30 6.32 0.00 -1.19 -2.90 119.26 122.90 3n58 h ALA 173 Ca 0.42 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3n58 h ALA 173 Cb 0.50 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3n58 h ALA 173 CO -0.30 0.09 0.09 0.00 0.00 0.00 0.00 179.25 179.12 3n58 h ALA 174 N 0.62 0.40 -2.53 0.00 0.00 -1.24 -3.39 119.26 113.12 3n58 h ALA 174 Ca 0.03 -0.16 -0.59 0.00 0.00 0.00 0.00 54.91 54.19 3n58 h ALA 174 Cb 0.65 -0.12 -0.39 0.00 0.00 0.00 0.00 17.79 17.94 3n58 h ALA 174 CO 0.03 0.04 -0.89 0.95 0.00 0.00 0.00 179.25 179.38 3n58 s THR 175 N -5.36 0.53 0.42 0.00 -4.23 -0.51 -5.11 115.64 101.38 3n58 s THR 175 Ca -0.13 -2.47 -0.26 0.00 -1.18 0.00 0.00 61.69 57.64 3n58 s THR 175 Cb 0.09 -1.38 -0.10 0.00 1.34 0.00 0.00 72.50 72.45 3n58 s THR 175 CO 0.74 -1.12 1.44 -0.81 -0.54 0.00 0.00 174.62 174.33 3n58 n PRO 176 N 3.20 2.40 0.00 3.99 -0.04 -1.09 -2.04 135.00 141.42 3n58 n PRO 176 Ca 0.22 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.53 3n58 n PRO 176 Cb 0.43 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.26 3n58 n PRO 176 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3n58 n GLY 177 N 0.55 2.72 0.28 0.55 0.00 -1.26 -4.95 105.19 103.07 3n58 n GLY 177 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 3n58 n GLY 177 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3n58 h PHE 178 N 0.00 -0.53 -0.37 1.61 3.57 -1.77 -0.43 116.94 119.02 3n58 h PHE 178 Ca 0.00 0.06 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 3n58 h PHE 178 Cb 0.00 0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 3n58 h PHE 178 CO 0.00 -0.32 -0.10 0.74 -2.23 0.00 0.00 178.31 176.40 3n58 h PHE 179 N -0.06 0.82 -0.31 0.41 0.04 -1.89 -0.79 116.94 115.16 3n58 h PHE 179 Ca 0.29 -0.18 -0.05 0.00 2.80 0.00 0.00 57.97 60.83 3n58 h PHE 179 Cb 0.51 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 3n58 h PHE 179 CO -0.57 0.87 -0.01 1.15 -0.60 0.00 0.00 178.31 179.16 3n58 h THR 180 N 0.52 1.26 -0.15 -1.55 2.02 -1.79 0.42 112.91 113.64 3n58 h THR 180 Ca 0.09 -0.98 -0.05 0.00 0.77 0.00 0.00 66.41 66.25 3n58 h THR 180 Cb 0.61 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 3n58 h THR 180 CO 0.04 0.32 -0.13 0.11 0.37 0.00 0.00 175.52 176.22 3n58 h LYS 181 N 0.35 0.24 0.20 6.66 6.56 -1.00 -2.49 116.57 127.09 3n58 h LYS 181 Ca 0.09 -0.06 -0.26 0.00 -1.06 0.00 0.00 60.65 59.36 3n58 h LYS 181 Cb 0.46 -0.03 0.03 0.00 -0.57 0.00 0.00 32.23 32.12 3n58 h LYS 181 CO 0.02 0.38 -1.14 0.37 -2.06 0.00 0.00 179.45 177.02 3n58 h GLN 182 N 0.23 0.42 -0.73 3.15 5.75 -0.77 -3.07 115.11 120.09 3n58 h GLN 182 Ca 0.05 -0.72 0.14 0.00 -0.15 0.00 0.00 58.65 57.96 3n58 h GLN 182 Cb 0.38 0.27 -0.10 0.00 1.07 0.00 0.00 27.48 29.11 3n58 h GLN 182 CO 0.02 1.35 0.26 -0.09 -2.65 0.00 0.00 178.83 177.71 3n58 h ARG 183 N -0.11 0.38 0.00 1.69 2.43 -0.10 -1.39 114.38 117.27 3n58 h ARG 183 Ca -0.20 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 58.88 3n58 h ARG 183 Cb 1.91 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 31.36 3n58 h ARG 183 CO 0.22 0.25 -0.31 0.00 -1.51 0.00 0.00 179.97 178.62 3n58 h ALA 184 N 1.54 1.10 -0.00 2.80 0.00 -1.51 -3.02 119.26 120.16 3n58 h ALA 184 Ca 0.40 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3n58 h ALA 184 Cb 0.61 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3n58 h ALA 184 CO -0.42 0.39 -0.31 0.00 0.00 0.00 0.00 179.25 178.91 3n58 n ALA 185 N -2.30 3.17 -2.57 0.00 0.00 -0.54 -4.82 120.51 113.45 3n58 n ALA 185 Ca -0.01 -0.35 -0.43 0.00 0.00 0.00 0.00 53.44 52.65 3n58 n ALA 185 Cb 0.44 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 3n58 n ALA 185 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3n58 s ILE 186 N -2.70 4.35 0.20 0.00 -1.09 -1.11 -4.27 121.20 116.58 3n58 s ILE 186 Ca 0.20 1.52 0.01 0.00 -2.23 0.00 0.00 60.65 60.15 3n58 s ILE 186 Cb 0.19 -4.37 -0.08 0.00 -1.58 0.00 0.00 42.46 36.62 3n58 s ILE 186 CO 0.58 -0.57 1.49 0.11 -1.23 0.00 0.00 174.94 175.32 3n58 h LYS 187 N 8.64 0.34 -1.59 2.79 1.57 -1.13 -3.47 116.57 123.72 3n58 h LYS 187 Ca -0.23 -0.25 0.25 0.00 -1.87 0.00 0.00 60.65 58.55 3n58 h LYS 187 Cb 1.07 0.05 -0.16 0.00 0.08 0.00 0.00 32.23 33.27 3n58 h LYS 187 CO 1.05 0.88 0.77 0.20 -0.57 0.00 0.00 179.45 181.78 3n58 s GLY 188 N -4.31 -0.34 -0.01 3.86 0.00 -1.25 -4.30 107.32 100.98 3n58 s GLY 188 Ca -0.05 1.24 0.06 0.00 0.00 0.00 0.00 44.72 45.98 3n58 s GLY 188 CO 0.82 0.38 -0.21 0.54 0.00 0.00 0.00 173.10 174.64 3n58 s VAL 189 N -2.53 1.63 -0.11 1.40 0.11 -0.75 -1.98 120.40 118.17 3n58 s VAL 189 Ca 0.10 -0.92 -0.01 0.00 -2.93 0.00 0.00 61.98 58.22 3n58 s VAL 189 Cb 0.00 -1.36 -0.03 0.00 -1.53 0.00 0.00 36.38 33.47 3n58 s VAL 189 CO -0.05 0.43 -0.07 0.42 -3.33 0.00 0.00 175.10 172.50 3n58 s THR 190 N -0.52 3.67 -0.12 5.04 -4.23 -0.49 -1.09 115.64 117.90 3n58 s THR 190 Ca 0.08 -0.47 0.03 0.00 -1.18 0.00 0.00 61.69 60.15 3n58 s THR 190 Cb -0.08 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.22 3n58 s THR 190 CO -0.00 0.55 -0.23 -0.70 -0.54 0.00 0.00 174.62 173.70 3n58 s GLU 191 N -0.23 3.03 0.02 3.99 2.56 -0.73 -0.56 118.70 126.77 3n58 s GLU 191 Ca 0.03 -0.87 -0.18 0.00 0.00 0.00 0.00 54.97 53.96 3n58 s GLU 191 Cb -0.13 -2.38 -0.29 0.00 2.00 0.00 0.00 34.13 33.34 3n58 s GLU 191 CO 0.03 0.07 1.04 1.49 -0.56 0.00 0.00 175.26 177.33 3n58 h GLU 192 N 7.05 0.49 -5.69 4.30 4.57 -1.42 -1.47 114.58 122.42 3n58 h GLU 192 Ca -0.27 -0.68 -0.48 0.00 -1.18 0.00 0.00 59.36 56.76 3n58 h GLU 192 Cb 1.21 0.23 -0.15 0.00 -0.16 0.00 0.00 28.75 29.88 3n58 h GLU 192 CO 0.52 1.29 -0.74 -0.08 -1.18 0.00 0.00 179.01 178.82 3n58 s THR 193 N -2.86 1.83 0.17 0.32 -1.32 -1.26 -3.18 115.64 109.33 3n58 s THR 193 Ca -0.11 -2.18 -0.24 0.00 -1.21 0.00 0.00 61.69 57.95 3n58 s THR 193 Cb 0.04 -2.03 0.05 0.00 -1.51 0.00 0.00 72.50 69.05 3n58 s THR 193 CO 0.89 -0.53 1.59 0.74 -2.21 0.00 0.00 174.62 175.09 3n58 h THR 194 N 2.65 0.18 -0.91 5.08 2.02 -1.94 0.01 112.91 119.99 3n58 h THR 194 Ca -0.39 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.82 3n58 h THR 194 Cb 1.22 0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 3n58 h THR 194 CO 0.60 0.00 0.60 0.74 0.37 0.00 0.00 175.52 177.83 3n58 h THR 195 N -0.26 1.19 -0.45 3.16 2.02 -1.95 0.17 112.91 116.78 3n58 h THR 195 Ca 0.17 -0.40 -0.08 0.00 0.77 0.00 0.00 66.41 66.88 3n58 h THR 195 Cb 0.56 -0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 3n58 h THR 195 CO -0.58 0.21 -0.01 1.23 0.37 0.00 0.00 175.52 176.74 3n58 h GLY 196 N 1.17 0.87 1.28 2.16 0.00 -1.48 -2.75 103.07 104.32 3n58 h GLY 196 Ca 0.35 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.99 3n58 h GLY 196 CO -0.09 0.60 0.25 -2.08 0.00 0.00 0.00 176.54 175.22 3n58 h VAL 197 N 0.65 1.22 -0.84 4.60 2.07 -0.08 -1.36 116.25 122.51 3n58 h VAL 197 Ca 0.13 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 3n58 h VAL 197 Cb 0.52 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 3n58 h VAL 197 CO 0.03 0.28 0.40 -1.13 0.02 0.00 0.00 177.57 177.17 3n58 h ASN 198 N 0.91 1.09 -0.73 0.57 -1.24 -0.93 -1.34 115.58 113.92 3n58 h ASN 198 Ca 0.22 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 57.09 3n58 h ASN 198 Cb 0.18 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 38.91 3n58 h ASN 198 CO -0.02 0.92 0.46 0.03 -1.29 0.00 0.00 177.43 177.53 3n58 h ARG 199 N 1.19 0.97 -0.49 6.67 3.08 -1.09 -1.62 114.38 123.09 3n58 h ARG 199 Ca 0.29 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.27 3n58 h ARG 199 Cb 0.12 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 3n58 h ARG 199 CO -0.04 0.67 0.32 -0.07 -1.07 0.00 0.00 179.97 179.79 3n58 h LEU 200 N 0.99 0.55 -0.94 3.04 3.38 -0.87 -1.63 115.31 119.83 3n58 h LEU 200 Ca 0.26 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.16 3n58 h LEU 200 Cb -0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3n58 h LEU 200 CO -0.05 0.40 0.06 1.88 0.09 0.00 0.00 178.44 180.82 3n58 h TYR 201 N 0.65 0.88 -0.15 1.13 0.05 -1.00 -0.97 116.97 117.56 3n58 h TYR 201 Ca 0.18 -0.11 0.04 0.00 0.05 0.00 0.00 58.73 58.89 3n58 h TYR 201 Cb -0.06 -0.25 -0.04 0.00 1.01 0.00 0.00 36.73 37.39 3n58 h TYR 201 CO -0.04 0.78 -0.07 1.96 -1.05 0.00 0.00 178.16 179.73 3n58 h GLN 202 N 0.79 -0.05 0.40 4.88 7.50 -1.00 -1.58 115.11 126.06 3n58 h GLN 202 Ca 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.31 3n58 h GLN 202 Cb 0.39 0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.90 3n58 h GLN 202 CO 0.01 -0.03 -0.43 -0.07 -1.50 0.00 0.00 178.83 176.81 3n58 h LEU 203 N -0.05 -1.18 -0.63 1.46 3.38 -0.82 -1.35 115.31 116.11 3n58 h LEU 203 Ca 0.08 0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.28 3n58 h LEU 203 Cb 0.18 0.40 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 3n58 h LEU 203 CO -0.19 -0.58 0.13 -0.61 0.09 0.00 0.00 178.44 177.28 3n58 h GLN 204 N -0.86 0.24 -0.78 1.13 4.15 -1.21 0.27 115.11 118.06 3n58 h GLN 204 Ca -0.04 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.39 3n58 h GLN 204 Cb 0.77 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.36 3n58 h GLN 204 CO -0.08 0.16 0.51 -0.22 -1.93 0.00 0.00 178.83 177.27 3n58 h LYS 205 N 0.25 0.97 -0.01 1.69 3.64 -1.06 -1.62 116.57 120.43 3n58 h LYS 205 Ca 0.34 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3n58 h LYS 205 Cb 0.52 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3n58 h LYS 205 CO -0.44 0.64 -0.06 1.63 -2.27 0.00 0.00 179.45 178.95 3n58 n LYS 206 N -4.44 1.00 -1.49 1.90 5.02 -0.09 -4.90 118.16 115.17 3n58 n LYS 206 Ca 0.09 -0.37 -0.07 0.00 -2.02 0.00 0.00 58.31 55.95 3n58 n LYS 206 Cb 0.08 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.57 3n58 n LYS 206 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3n58 n GLY 207 N 1.19 0.65 1.23 0.72 0.00 -0.53 -4.94 105.19 103.51 3n58 n GLY 207 Ca 0.18 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.58 3n58 n GLY 207 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n58 n LEU 208 N -0.84 4.52 -4.32 0.99 4.77 0.76 -4.84 117.00 118.04 3n58 n LEU 208 Ca -0.07 -2.99 -0.38 0.00 -0.03 0.00 0.00 56.01 52.54 3n58 n LEU 208 Cb 0.33 -0.59 -0.12 0.00 -2.33 0.00 0.00 43.42 40.71 3n58 n LEU 208 CO 0.10 0.66 -0.25 -0.22 -1.33 0.00 0.00 177.39 176.35 3n58 s LEU 209 N -2.80 4.15 -0.04 2.23 2.96 -1.24 -4.80 118.68 119.14 3n58 s LEU 209 Ca 0.46 -0.93 0.21 0.00 -0.22 0.00 0.00 54.13 53.66 3n58 s LEU 209 Cb 0.37 -1.89 0.68 0.00 0.50 0.00 0.00 46.19 45.85 3n58 s LEU 209 CO 0.11 -0.27 1.58 -0.81 -1.32 0.00 0.00 176.35 175.64 3n58 n PRO 210 N 4.85 3.08 -3.79 0.98 -0.04 -1.26 -4.80 135.00 134.02 3n58 n PRO 210 Ca -0.13 -2.76 -0.09 0.00 -0.04 0.00 0.00 63.50 60.48 3n58 n PRO 210 Cb 0.46 -1.69 -0.04 0.00 -0.04 0.00 0.00 33.50 32.20 3n58 n PRO 210 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3n58 s PHE 211 N -1.28 -0.05 0.37 0.54 -0.12 -1.26 -4.94 117.98 111.23 3n58 s PHE 211 Ca 0.50 -0.31 -0.27 0.00 -0.05 0.00 0.00 56.93 56.80 3n58 s PHE 211 Cb 0.28 0.39 -0.09 0.00 -0.63 0.00 0.00 43.02 42.97 3n58 s PHE 211 CO 0.31 -0.96 1.25 -1.25 -0.05 0.00 0.00 175.22 174.51 3n58 s PRO 212 N -3.90 4.19 -0.06 1.99 0.04 -1.24 -4.08 135.00 131.94 3n58 s PRO 212 Ca 0.11 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.26 3n58 s PRO 212 Cb -0.01 -2.89 -0.01 0.00 0.04 0.00 0.00 34.50 31.63 3n58 s PRO 212 CO 0.00 -0.27 -0.22 0.00 0.04 0.00 0.00 177.00 176.55 3n58 s ALA 213 N -1.25 1.96 -0.34 8.56 0.00 -0.53 -1.81 121.76 128.36 3n58 s ALA 213 Ca 0.53 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 51.42 3n58 s ALA 213 Cb -0.36 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3n58 s ALA 213 CO 0.47 0.34 0.36 0.42 0.00 0.00 0.00 175.76 177.35 3n58 s ILE 214 N 0.02 5.17 -0.89 0.00 -1.09 -0.25 -0.51 121.20 123.66 3n58 s ILE 214 Ca -0.07 0.09 -0.25 0.00 -2.23 0.00 0.00 60.65 58.20 3n58 s ILE 214 Cb -0.14 -3.81 0.03 0.00 -1.58 0.00 0.00 42.46 36.95 3n58 s ILE 214 CO 0.04 -0.07 1.49 0.21 -1.23 0.00 0.00 174.94 175.38 3n58 s ASN 215 N 1.73 6.13 0.23 3.58 2.47 0.20 -1.77 114.94 127.50 3n58 s ASN 215 Ca 0.12 -0.90 0.03 0.00 0.42 0.00 0.00 52.86 52.53 3n58 s ASN 215 Cb -0.16 -2.56 0.23 0.00 -1.45 0.00 0.00 41.25 37.30 3n58 s ASN 215 CO 0.12 -1.84 1.55 0.58 -3.72 0.00 0.00 177.10 173.79 3n58 h VAL 216 N 6.63 1.37 -1.00 -5.21 2.07 -1.55 -3.22 116.25 115.33 3n58 h VAL 216 Ca 0.00 -1.94 0.20 0.00 0.82 0.00 0.00 66.70 65.79 3n58 h VAL 216 Cb 1.03 1.95 -0.11 0.00 -1.52 0.00 0.00 31.29 32.65 3n58 h VAL 216 CO 1.34 0.58 0.61 -1.13 0.02 0.00 0.00 177.57 178.99 3n58 h ASN 217 N 0.22 0.75 -0.47 0.57 -1.24 -1.50 -2.18 115.58 111.74 3n58 h ASN 217 Ca -0.00 0.10 0.00 0.00 0.71 0.00 0.00 56.30 57.11 3n58 h ASN 217 Cb 1.10 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.12 3n58 h ASN 217 CO 0.10 0.24 0.00 0.47 -1.29 0.00 0.00 177.43 176.95 3n58 n ASP 218 N -4.77 2.73 -4.77 1.15 8.00 -1.22 -2.32 116.55 115.35 3n58 n ASP 218 Ca 0.24 -2.07 -0.41 0.00 0.71 0.00 0.00 54.79 53.27 3n58 n ASP 218 Cb 0.61 -0.35 -0.00 0.00 -0.02 0.00 0.00 41.12 41.35 3n58 n ASP 218 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3n58 s SER 219 N -0.94 6.31 0.20 -2.24 0.01 -0.82 -4.88 113.70 111.33 3n58 s SER 219 Ca 0.32 2.94 -0.08 0.00 1.31 0.00 0.00 55.95 60.44 3n58 s SER 219 Cb 0.18 -2.66 0.12 0.00 0.21 0.00 0.00 66.02 63.87 3n58 s SER 219 CO 0.21 -0.88 1.73 0.58 0.41 0.00 0.00 173.24 175.28 3n58 h VAL 220 N 2.80 1.26 0.00 3.43 2.07 -1.90 -1.16 116.25 122.76 3n58 h VAL 220 Ca -0.50 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.07 3n58 h VAL 220 Cb 1.24 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 3n58 h VAL 220 CO 0.64 0.37 0.00 0.35 0.02 0.00 0.00 177.57 178.94 3n58 n THR 221 N -4.24 0.00 -0.02 2.57 -2.24 -1.26 -2.08 114.28 107.01 3n58 n THR 221 Ca 0.06 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.82 3n58 n THR 221 Cb 0.25 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 67.96 3n58 n THR 221 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3n58 n LYS 222 N -0.88 0.12 -0.26 -0.78 0.00 -0.53 -4.08 118.16 111.75 3n58 n LYS 222 Ca 0.13 0.05 -0.04 0.00 0.00 0.00 0.00 58.31 58.45 3n58 n LYS 222 Cb 0.06 -0.64 0.07 0.00 0.00 0.00 0.00 35.03 34.53 3n58 n LYS 222 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 3n58 h SER 223 N -0.23 0.77 -0.27 3.14 4.64 -0.89 -0.46 113.55 120.26 3n58 h SER 223 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3n58 h SER 223 Cb 0.23 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3n58 h SER 223 CO 0.00 0.54 0.00 0.29 -0.87 0.00 0.00 176.83 176.79 3n58 n LYS 224 N -4.63 1.66 0.00 4.77 4.76 -0.88 -3.43 118.16 120.41 3n58 n LYS 224 Ca 0.07 -1.02 0.00 0.00 -2.87 0.00 0.00 58.31 54.49 3n58 n LYS 224 Cb 0.06 -1.25 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 3n58 n LYS 224 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3n58 n PHE 225 N 0.31 0.00 -0.09 2.13 3.72 -0.88 -4.63 117.46 118.02 3n58 n PHE 225 Ca 0.11 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.48 3n58 n PHE 225 Cb 0.25 0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.78 3n58 n PHE 225 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3n58 n ASP 226 N -1.06 -0.23 0.22 4.37 -0.08 -0.23 0.29 116.55 119.82 3n58 n ASP 226 Ca 0.00 0.80 0.05 0.00 -1.51 0.00 0.00 54.79 54.13 3n58 n ASP 226 Cb 0.00 -0.25 0.49 0.00 2.34 0.00 0.00 41.12 43.69 3n58 n ASP 226 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 3n58 h ASN 227 N 0.00 0.00 0.00 1.67 4.21 -1.57 -1.83 115.58 118.06 3n58 h ASN 227 Ca 0.04 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.55 3n58 h ASN 227 Cb 0.09 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 3n58 h ASN 227 CO -0.21 0.23 -0.28 1.17 -1.29 0.00 0.00 177.43 177.06 3n58 n LYS 228 N -4.16 0.17 -0.02 0.81 4.81 -1.02 -3.29 118.16 115.47 3n58 n LYS 228 Ca -0.02 0.17 -0.06 0.00 -0.87 0.00 0.00 58.31 57.53 3n58 n LYS 228 Cb 0.30 -0.90 0.14 0.00 0.02 0.00 0.00 35.03 34.58 3n58 n LYS 228 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 3n58 h TYR 229 N -0.34 0.68 -0.01 5.64 0.05 -0.30 -1.76 116.97 120.94 3n58 h TYR 229 Ca 0.00 -0.16 0.02 0.00 0.05 0.00 0.00 58.73 58.64 3n58 h TYR 229 Cb 0.28 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.83 3n58 h TYR 229 CO -0.12 0.82 -0.15 0.78 -1.05 0.00 0.00 178.16 178.44 3n58 h GLY 230 N 1.02 -0.18 1.96 3.88 0.00 -0.80 -0.78 103.07 108.17 3n58 h GLY 230 Ca 0.07 0.18 -0.08 0.00 0.00 0.00 0.00 47.33 47.49 3n58 h GLY 230 CO 0.06 -0.15 -0.37 0.00 0.00 0.00 0.00 176.54 176.08 3n58 h LYS 232 N 0.04 0.69 -0.50 0.00 3.64 -0.86 -0.74 116.57 118.84 3n58 h LYS 232 Ca 0.00 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.21 3n58 h LYS 232 Cb 0.68 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3n58 h LYS 232 CO 0.05 0.46 -0.19 0.93 -2.27 0.00 0.00 179.45 178.42 3n58 h GLU 233 N 0.71 1.01 0.00 1.90 4.39 -0.27 -3.38 114.58 118.94 3n58 h GLU 233 Ca 0.21 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.49 3n58 h GLU 233 Cb -0.05 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 3n58 h GLU 233 CO -0.06 1.10 -1.10 -1.13 -1.16 0.00 0.00 179.01 176.67 3n58 n SER 234 N -4.12 1.31 0.39 1.42 3.41 0.02 -4.17 113.62 111.89 3n58 n SER 234 Ca 0.00 -0.40 -0.16 0.00 -0.26 0.00 0.00 58.87 58.06 3n58 n SER 234 Cb 0.45 1.30 -0.07 0.00 -0.26 0.00 0.00 64.21 65.62 3n58 n SER 234 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3n58 h LEU 235 N 0.00 -0.86 -1.50 1.04 5.85 -1.35 -2.42 115.31 116.07 3n58 h LEU 235 Ca 0.00 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3n58 h LEU 235 Cb 0.45 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 3n58 h LEU 235 CO 0.00 -0.52 -0.25 -0.37 -0.34 0.00 0.00 178.44 176.96 3n58 h VAL 236 N -1.21 1.14 -0.62 1.05 -1.51 -1.81 -1.22 116.25 112.07 3n58 h VAL 236 Ca -0.10 -0.88 0.12 0.00 -1.23 0.00 0.00 66.70 64.61 3n58 h VAL 236 Cb 0.78 1.48 -0.09 0.00 -2.13 0.00 0.00 31.29 31.32 3n58 h VAL 236 CO 0.17 0.25 0.09 -0.78 -1.23 0.00 0.00 177.57 176.07 3n58 h ASP 237 N 0.00 -0.09 -0.39 4.19 3.58 -1.72 0.42 116.42 122.40 3n58 h ASP 237 Ca -0.00 0.13 -0.12 0.00 0.42 0.00 0.00 57.03 57.46 3n58 h ASP 237 Cb 0.46 0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 3n58 h ASP 237 CO 0.03 -0.04 -0.23 1.23 -2.88 0.00 0.00 179.24 177.35 3n58 h GLY 238 N 0.21 0.93 0.89 -0.78 0.00 -0.72 -2.13 103.07 101.47 3n58 h GLY 238 Ca 0.33 -0.86 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 3n58 h GLY 238 CO -0.46 0.78 0.06 -2.22 0.00 0.00 0.00 176.54 174.70 3n58 h ILE 239 N 0.66 1.23 0.10 2.60 2.04 -0.63 -1.52 117.51 121.99 3n58 h ILE 239 Ca 0.08 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 3n58 h ILE 239 Cb 0.80 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3n58 h ILE 239 CO 0.07 0.26 -0.05 0.03 0.00 0.00 0.00 178.15 178.46 3n58 h ARG 240 N 0.33 -0.13 -0.57 2.37 3.08 -0.21 -0.87 114.38 118.37 3n58 h ARG 240 Ca 0.09 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 3n58 h ARG 240 Cb 0.33 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.38 3n58 h ARG 240 CO 0.00 -0.08 0.27 0.00 -1.07 0.00 0.00 179.97 179.09 3n58 h ARG 241 N -0.14 0.80 0.00 0.04 3.08 -1.35 0.56 114.38 117.38 3n58 h ARG 241 Ca -0.01 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 3n58 h ARG 241 Cb 0.11 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3n58 h ARG 241 CO 0.02 0.63 -0.39 0.78 -1.07 0.00 0.00 179.97 179.94 3n58 h GLY 242 N 0.90 0.00 0.00 0.04 0.00 -1.09 -3.41 103.07 99.51 3n58 h GLY 242 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3n58 h GLY 242 CO -0.03 0.00 -0.03 -1.30 0.00 0.00 0.00 176.54 175.18 3n58 n THR 243 N -3.48 0.00 -1.28 4.70 -2.24 -0.35 -4.93 114.28 106.69 3n58 n THR 243 Ca 0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 3n58 n THR 243 Cb 0.54 0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.73 3n58 n THR 243 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3n58 n ASP 244 N -0.12 -4.99 -4.75 3.42 8.00 0.19 -4.93 116.55 113.38 3n58 n ASP 244 Ca 0.00 0.28 -0.38 0.00 0.71 0.00 0.00 54.79 55.40 3n58 n ASP 244 Cb 0.00 -3.87 0.04 0.00 -0.02 0.00 0.00 41.12 37.27 3n58 n ASP 244 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3n58 s VAL 245 N -1.92 2.16 -0.04 2.53 0.11 -1.26 -4.98 120.40 117.00 3n58 s VAL 245 Ca 0.00 0.12 -0.30 0.00 -2.93 0.00 0.00 61.98 58.87 3n58 s VAL 245 Cb 0.00 -3.06 -0.05 0.00 -1.53 0.00 0.00 36.38 31.74 3n58 s VAL 245 CO 0.00 -0.00 1.40 -0.32 -3.33 0.00 0.00 175.10 172.84 3n58 s MET 246 N -2.94 4.27 -0.11 1.54 1.75 -1.26 -4.90 119.30 117.64 3n58 s MET 246 Ca 0.72 1.93 -0.16 0.00 -1.25 0.00 0.00 55.69 56.93 3n58 s MET 246 Cb -0.39 -3.65 -0.14 0.00 2.84 0.00 0.00 34.83 33.49 3n58 s MET 246 CO 0.46 -0.62 0.48 0.52 -0.65 0.00 0.00 175.02 175.21 3n58 h MET 247 N 8.08 -0.04 -6.26 4.11 2.86 -1.94 -3.42 114.93 118.32 3n58 h MET 247 Ca -0.36 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.60 3n58 h MET 247 Cb 1.17 0.01 0.05 0.00 0.06 0.00 0.00 31.60 32.88 3n58 h MET 247 CO 0.92 0.45 0.55 0.00 1.06 0.00 0.00 176.91 179.88 3n58 n ALA 248 N -2.67 -0.75 0.00 6.32 0.00 -1.25 -1.36 120.51 120.80 3n58 n ALA 248 Ca -0.06 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3n58 n ALA 248 Cb 0.25 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.58 3n58 n ALA 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n58 n GLY 249 N 2.84 0.96 3.90 0.00 0.00 -1.24 -4.97 105.19 106.68 3n58 n GLY 249 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3n58 n GLY 249 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n58 s LYS 250 N -1.00 3.36 -0.22 1.61 1.02 -0.47 -4.96 119.74 119.08 3n58 s LYS 250 Ca 0.00 -0.46 -0.09 0.00 0.02 0.00 0.00 55.97 55.44 3n58 s LYS 250 Cb 0.00 -3.00 -0.04 0.00 -0.52 0.00 0.00 37.83 34.26 3n58 s LYS 250 CO 0.00 0.61 0.11 0.08 -0.92 0.00 0.00 175.35 175.23 3n58 s VAL 251 N -1.47 4.96 -0.07 3.17 1.01 -1.26 -0.81 120.40 125.93 3n58 s VAL 251 Ca 0.33 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.36 3n58 s VAL 251 Cb -0.13 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 3n58 s VAL 251 CO 0.26 0.38 -0.09 0.00 0.00 0.00 0.00 175.10 175.65 3n58 s ALA 252 N 0.94 2.89 -0.28 5.51 0.00 -0.75 -0.61 121.76 129.46 3n58 s ALA 252 Ca 0.06 -0.90 -0.07 0.00 0.00 0.00 0.00 51.96 51.04 3n58 s ALA 252 Cb -0.13 -1.19 -0.00 0.00 0.00 0.00 0.00 23.12 21.79 3n58 s ALA 252 CO 0.03 0.52 0.08 0.08 0.00 0.00 0.00 175.76 176.47 3n58 s VAL 253 N -0.63 4.08 -0.33 0.00 1.01 0.28 -1.19 120.40 123.62 3n58 s VAL 253 Ca 0.09 -0.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.44 3n58 s VAL 253 Cb -0.11 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 3n58 s VAL 253 CO 0.02 0.17 0.21 -0.69 0.00 0.00 0.00 175.10 174.80 3n58 s VAL 254 N 1.54 4.99 -0.43 2.92 1.01 -0.17 -0.75 120.40 129.52 3n58 s VAL 254 Ca 0.04 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 3n58 s VAL 254 Cb -0.16 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.67 3n58 s VAL 254 CO 0.03 0.01 0.84 0.00 0.00 0.00 0.00 175.10 175.97 3n58 n GLY 256 N 4.81 2.22 2.79 0.00 0.00 0.17 -1.21 105.19 113.98 3n58 n GLY 256 Ca 0.04 -1.64 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 3n58 n GLY 256 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3n58 n TYR 257 N 1.87 1.29 -0.25 1.61 9.36 -1.25 -4.31 117.16 125.48 3n58 n TYR 257 Ca 0.00 -2.23 0.00 0.00 3.32 0.00 0.00 57.90 58.99 3n58 n TYR 257 Cb 0.00 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.46 3n58 n TYR 257 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3n58 n GLY 258 N -0.53 0.18 0.33 2.98 0.00 -1.26 -4.44 105.19 102.44 3n58 n GLY 258 Ca 0.08 -1.64 -0.02 0.00 0.00 0.00 0.00 46.02 44.44 3n58 n GLY 258 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n58 h ASP 259 N 0.00 0.96 -0.15 1.61 3.32 -1.93 0.31 116.42 120.55 3n58 h ASP 259 Ca 0.00 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 3n58 h ASP 259 Cb 0.00 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.33 3n58 h ASP 259 CO 0.00 0.68 -0.36 0.58 -1.72 0.00 0.00 179.24 178.42 3n58 h VAL 260 N 1.13 1.36 -0.73 -1.35 2.07 -1.85 -2.59 116.25 114.30 3n58 h VAL 260 Ca 0.34 -1.64 -0.05 0.00 0.82 0.00 0.00 66.70 66.17 3n58 h VAL 260 Cb -0.05 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 3n58 h VAL 260 CO -0.10 0.49 0.26 1.23 0.02 0.00 0.00 177.57 179.47 3n58 h GLY 261 N 0.12 1.19 0.70 2.17 0.00 -1.68 0.32 103.07 105.89 3n58 h GLY 261 Ca -0.00 -0.67 0.02 0.00 0.00 0.00 0.00 47.33 46.68 3n58 h GLY 261 CO 0.08 0.63 -0.08 0.50 0.00 0.00 0.00 176.54 177.66 3n58 h LYS 262 N 1.07 -0.11 -0.50 4.80 1.57 -0.42 0.05 116.57 123.03 3n58 h LYS 262 Ca 0.24 0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.93 3n58 h LYS 262 Cb 0.25 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3n58 h LYS 262 CO -0.01 -0.07 -0.08 0.78 -0.57 0.00 0.00 179.45 179.49 3n58 h GLY 263 N -0.12 0.97 1.00 3.86 0.00 -1.06 -2.39 103.07 105.33 3n58 h GLY 263 Ca 0.06 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.64 3n58 h GLY 263 CO -0.13 0.68 0.42 1.76 0.00 0.00 0.00 176.54 179.26 3n58 h SER 264 N 0.81 0.84 -0.32 0.19 0.02 -0.22 -0.25 113.55 114.63 3n58 h SER 264 Ca 0.14 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 3n58 h SER 264 Cb 0.60 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 3n58 h SER 264 CO 0.04 0.66 0.12 0.00 -1.14 0.00 0.00 176.83 176.51 3n58 h ALA 265 N 1.22 0.41 -0.97 3.77 0.00 -0.83 -2.23 119.26 120.63 3n58 h ALA 265 Ca 0.25 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3n58 h ALA 265 Cb -0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3n58 h ALA 265 CO -0.05 0.02 0.61 1.96 0.00 0.00 0.00 179.25 181.79 3n58 h GLN 266 N 0.36 1.30 -0.35 0.00 1.08 -1.21 -0.49 115.11 115.80 3n58 h GLN 266 Ca 0.11 -0.10 0.07 0.00 -1.45 0.00 0.00 58.65 57.27 3n58 h GLN 266 Cb 0.19 -0.28 -0.06 0.00 -0.05 0.00 0.00 27.48 27.28 3n58 h GLN 266 CO -0.01 0.89 -0.04 1.03 -0.95 0.00 0.00 178.83 179.75 3n58 h SER 267 N 1.33 -0.22 -0.04 1.46 0.87 -0.70 0.11 113.55 116.35 3n58 h SER 267 Ca 0.35 0.09 -0.08 0.00 -1.23 0.00 0.00 61.79 60.92 3n58 h SER 267 Cb -0.10 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 3n58 h SER 267 CO -0.07 -0.07 -0.29 -0.07 -0.53 0.00 0.00 176.83 175.79 3n58 h LEU 268 N 0.05 0.33 -0.52 2.23 3.38 -1.07 -3.02 115.31 116.70 3n58 h LEU 268 Ca 0.17 -0.68 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 3n58 h LEU 268 Cb 0.25 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3n58 h LEU 268 CO -0.32 0.96 0.33 0.00 0.09 0.00 0.00 178.44 179.50 3n58 h ALA 269 N 0.38 0.66 0.00 1.53 0.00 -1.04 -1.46 119.26 119.33 3n58 h ALA 269 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3n58 h ALA 269 Cb 0.97 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3n58 h ALA 269 CO 0.06 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.85 3n58 n GLY 270 N -1.16 -1.10 0.12 0.00 0.00 0.36 -1.16 105.19 102.25 3n58 n GLY 270 Ca 0.03 0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.25 3n58 n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n58 n ALA 271 N -1.73 4.29 0.00 4.61 0.00 -0.74 -4.98 120.51 121.96 3n58 n ALA 271 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3n58 n ALA 271 Cb 0.16 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3n58 n ALA 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n58 n GLY 272 N 1.48 0.85 3.86 0.00 0.00 -0.31 -3.96 105.19 107.11 3n58 n GLY 272 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3n58 n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n58 s ALA 273 N -2.00 3.12 -0.33 4.61 0.00 -0.63 -3.72 121.76 122.82 3n58 s ALA 273 Ca 0.00 0.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.85 3n58 s ALA 273 Cb 0.00 -3.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 3n58 s ALA 273 CO 0.00 -0.36 0.26 0.50 0.00 0.00 0.00 175.76 176.16 3n58 s ARG 274 N -4.43 3.60 -0.23 0.00 3.52 0.01 -4.04 118.95 117.37 3n58 s ARG 274 Ca 0.56 -0.53 -0.09 0.00 -0.13 0.00 0.00 55.73 55.54 3n58 s ARG 274 Cb -0.10 -3.78 -0.04 0.00 -1.56 0.00 0.00 34.95 29.47 3n58 s ARG 274 CO 0.39 -0.41 0.10 0.08 -0.81 0.00 0.00 175.30 174.66 3n58 s VAL 275 N 1.79 4.80 0.08 7.11 1.01 -1.26 -1.82 120.40 132.11 3n58 s VAL 275 Ca 0.07 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.07 3n58 s VAL 275 Cb -0.17 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 3n58 s VAL 275 CO 0.11 0.36 0.07 -0.54 0.00 0.00 0.00 175.10 175.10 3n58 s LYS 276 N 1.19 2.85 0.01 2.72 1.02 -0.33 -3.78 119.74 123.41 3n58 s LYS 276 Ca 0.05 -0.70 0.05 0.00 0.02 0.00 0.00 55.97 55.39 3n58 s LYS 276 Cb -0.14 -2.71 -0.01 0.00 -0.52 0.00 0.00 37.83 34.44 3n58 s LYS 276 CO 0.04 0.56 -0.15 0.08 -0.92 0.00 0.00 175.35 174.97 3n58 s VAL 277 N -1.38 1.18 0.23 3.17 1.01 -0.32 -1.00 120.40 123.29 3n58 s VAL 277 Ca 0.29 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.60 3n58 s VAL 277 Cb -0.12 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3n58 s VAL 277 CO 0.21 0.24 0.02 0.42 0.00 0.00 0.00 175.10 175.99 3n58 s THR 278 N -0.50 3.66 -0.01 3.92 -4.23 0.04 -1.10 115.64 117.43 3n58 s THR 278 Ca 0.05 -1.67 -0.28 0.00 -1.18 0.00 0.00 61.69 58.61 3n58 s THR 278 Cb -0.06 -2.91 0.09 0.00 1.34 0.00 0.00 72.50 70.95 3n58 s THR 278 CO 0.00 -0.27 0.75 -1.61 -0.54 0.00 0.00 174.62 172.96 3n58 s GLU 279 N -3.40 0.99 -0.02 3.99 0.41 -1.26 -0.65 118.70 118.75 3n58 s GLU 279 Ca 0.30 -0.05 0.17 0.00 -0.41 0.00 0.00 54.97 54.97 3n58 s GLU 279 Cb -0.08 0.46 -0.26 0.00 -1.78 0.00 0.00 34.13 32.48 3n58 s GLU 279 CO 0.20 -0.37 0.36 1.33 -0.49 0.00 0.00 175.26 176.29 3n58 n VAL 280 N 0.34 0.02 -3.19 2.63 0.24 -1.26 -4.94 118.33 112.16 3n58 n VAL 280 Ca -0.15 -0.38 -0.40 0.00 -2.04 0.00 0.00 64.34 61.36 3n58 n VAL 280 Cb 0.60 0.11 -0.07 0.00 -1.47 0.00 0.00 33.84 33.01 3n58 n VAL 280 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3n58 s ASP 281 N -3.93 6.48 0.35 -1.34 -1.08 -1.26 -4.97 116.67 110.92 3n58 s ASP 281 Ca -0.06 0.58 0.08 0.00 -0.52 0.00 0.00 52.55 52.63 3n58 s ASP 281 Cb 0.11 -2.30 0.64 0.00 -1.46 0.00 0.00 42.92 39.91 3n58 s ASP 281 CO 0.69 -0.32 1.83 1.55 0.52 0.00 0.00 175.17 179.44 3n58 h PRO 282 N 7.98 0.26 -0.32 4.34 0.13 -1.99 -0.26 132.00 142.14 3n58 h PRO 282 Ca -0.28 -0.08 -0.05 0.00 -0.87 0.00 0.00 66.00 64.72 3n58 h PRO 282 Cb 1.13 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3n58 h PRO 282 CO 0.74 0.48 0.00 0.82 -0.23 0.00 0.00 178.00 179.81 3n58 h ILE 283 N 0.23 1.26 -0.44 -3.56 2.04 -1.99 -0.88 117.51 114.17 3n58 h ILE 283 Ca 0.04 -0.95 -0.07 0.00 1.00 0.00 0.00 64.86 64.88 3n58 h ILE 283 Cb 0.54 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 3n58 h ILE 283 CO 0.04 0.31 -0.03 0.00 0.00 0.00 0.00 178.15 178.47 3n58 h ALA 285 N 1.29 0.37 -0.38 0.00 0.00 -0.98 -1.99 119.26 117.57 3n58 h ALA 285 Ca 0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3n58 h ALA 285 Cb 0.46 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3n58 h ALA 285 CO 0.02 0.02 0.12 1.25 0.00 0.00 0.00 179.25 180.66 3n58 h LEU 286 N 0.29 0.49 -0.52 0.00 5.85 -1.02 -0.48 115.31 119.92 3n58 h LEU 286 Ca 0.09 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3n58 h LEU 286 Cb 0.27 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 3n58 h LEU 286 CO -0.00 0.48 0.30 1.56 -0.34 0.00 0.00 178.44 180.44 3n58 h GLN 287 N 0.54 0.73 -0.54 1.25 4.20 -1.11 -0.42 115.11 119.76 3n58 h GLN 287 Ca 0.13 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 3n58 h GLN 287 Cb 0.17 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3n58 h GLN 287 CO -0.01 0.55 0.13 0.00 -0.67 0.00 0.00 178.83 178.83 3n58 h ALA 288 N 1.13 0.71 -0.37 3.87 0.00 -0.57 -0.30 119.26 123.73 3n58 h ALA 288 Ca 0.19 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3n58 h ALA 288 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3n58 h ALA 288 CO -0.03 0.41 0.13 0.00 0.00 0.00 0.00 179.25 179.76 3n58 h ALA 289 N 1.01 0.48 -0.06 0.00 0.00 -1.04 -1.27 119.26 118.38 3n58 h ALA 289 Ca 0.17 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3n58 h ALA 289 Cb 0.34 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3n58 h ALA 289 CO 0.00 0.11 0.05 1.98 0.00 0.00 0.00 179.25 181.39 3n58 h MET 290 N 0.45 0.00 -0.00 0.00 -1.53 -0.93 -0.98 114.93 111.93 3n58 h MET 290 Ca 0.12 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.38 3n58 h MET 290 Cb 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.28 3n58 h MET 290 CO -0.01 0.00 -0.02 -0.25 0.14 0.00 0.00 176.91 176.77 3n58 n ASP 291 N -4.49 0.36 0.00 1.39 8.00 -0.14 -4.88 116.55 116.79 3n58 n ASP 291 Ca -0.01 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.57 3n58 n ASP 291 Cb 0.15 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 3n58 n ASP 291 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3n58 n GLY 292 N 1.12 0.95 3.88 0.44 0.00 -0.37 -5.06 105.19 106.14 3n58 n GLY 292 Ca 0.20 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3n58 n GLY 292 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n58 s PHE 293 N -2.00 3.60 -0.05 1.61 0.08 -0.52 -5.01 117.98 115.69 3n58 s PHE 293 Ca 0.00 0.55 -0.30 0.00 0.12 0.00 0.00 56.93 57.30 3n58 s PHE 293 Cb 0.00 -1.96 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 3n58 s PHE 293 CO 0.00 0.70 1.41 -2.00 -0.10 0.00 0.00 175.22 175.23 3n58 s GLU 294 N -1.25 4.26 -0.33 0.44 2.12 -1.25 -3.84 118.70 118.85 3n58 s GLU 294 Ca 0.19 1.92 -0.16 0.00 0.36 0.00 0.00 54.97 57.29 3n58 s GLU 294 Cb -0.13 -3.69 -0.02 0.00 0.26 0.00 0.00 34.13 30.55 3n58 s GLU 294 CO 0.08 -0.65 0.41 0.08 -0.54 0.00 0.00 175.26 174.64 3n58 s VAL 295 N 2.95 5.13 0.30 3.70 1.01 -1.26 -1.18 120.40 131.05 3n58 s VAL 295 Ca 0.63 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.88 3n58 s VAL 295 Cb -0.29 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 3n58 s VAL 295 CO 0.24 -0.07 0.10 0.68 0.00 0.00 0.00 175.10 176.05 3n58 s VAL 296 N 2.13 0.70 -0.02 2.92 -7.23 -0.26 -4.94 120.40 113.70 3n58 s VAL 296 Ca 0.14 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.25 3n58 s VAL 296 Cb -0.16 -2.64 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 3n58 s VAL 296 CO 0.12 0.00 0.24 0.42 -0.31 0.00 0.00 175.10 175.57 3n58 s THR 297 N -3.56 5.34 0.40 5.32 -4.23 -1.26 -3.98 115.64 113.68 3n58 s THR 297 Ca 0.36 0.19 0.11 0.00 -1.18 0.00 0.00 61.69 61.16 3n58 s THR 297 Cb 0.07 -3.54 0.31 0.00 1.34 0.00 0.00 72.50 70.69 3n58 s THR 297 CO 0.15 0.43 1.97 0.25 -0.54 0.00 0.00 174.62 176.87 3n58 h LEU 298 N 4.22 0.49 -0.71 4.79 5.85 -1.96 -0.97 115.31 127.02 3n58 h LEU 298 Ca -0.51 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.36 3n58 h LEU 298 Cb 1.20 -0.10 -0.10 0.00 0.37 0.00 0.00 40.66 42.04 3n58 h LEU 298 CO 0.64 0.30 0.21 0.44 -0.34 0.00 0.00 178.44 179.70 3n58 h ASP 299 N 0.55 0.12 0.78 1.25 3.32 -1.97 0.19 116.42 120.66 3n58 h ASP 299 Ca 0.30 0.12 -0.24 0.00 0.02 0.00 0.00 57.03 57.23 3n58 h ASP 299 Cb 0.44 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3n58 h ASP 299 CO -0.09 0.03 -1.09 0.44 -1.72 0.00 0.00 179.24 176.81 3n58 h ASP 300 N 0.34 0.22 0.13 6.45 3.32 -1.63 -3.37 116.42 121.87 3n58 h ASP 300 Ca 0.39 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3n58 h ASP 300 Cb 0.62 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3n58 h ASP 300 CO -0.44 1.16 -1.53 0.00 -1.72 0.00 0.00 179.24 176.71 3n58 n ALA 301 N -2.45 3.39 -0.21 3.45 0.00 -0.61 -4.51 120.51 119.58 3n58 n ALA 301 Ca -0.04 -0.51 -0.00 0.00 0.00 0.00 0.00 53.44 52.89 3n58 n ALA 301 Cb 0.96 -0.81 0.11 0.00 0.00 0.00 0.00 19.45 19.71 3n58 n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n58 h ALA 302 N 2.35 0.84 0.00 0.00 0.00 -0.81 -2.92 119.26 118.71 3n58 h ALA 302 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3n58 h ALA 302 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3n58 h ALA 302 CO 0.00 -0.12 0.00 0.66 0.00 0.00 0.00 179.25 179.79 3n58 h SER 303 N 0.50 0.00 0.00 0.00 4.64 -1.79 -2.98 113.55 113.92 3n58 h SER 303 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3n58 h SER 303 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3n58 h SER 303 CO -0.27 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.04 3n58 n THR 304 N -2.32 0.08 -2.38 2.95 -2.24 -1.11 -3.92 114.28 105.33 3n58 n THR 304 Ca 0.01 -0.51 -0.36 0.00 -2.27 0.00 0.00 64.05 60.92 3n58 n THR 304 Cb 0.18 1.01 -0.02 0.00 -2.10 0.00 0.00 70.33 69.40 3n58 n THR 304 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n58 s ALA 305 N -0.08 2.88 -0.12 6.98 0.00 -1.13 -4.88 121.76 125.42 3n58 s ALA 305 Ca 0.00 0.78 0.14 0.00 0.00 0.00 0.00 51.96 52.87 3n58 s ALA 305 Cb 0.00 -3.32 -0.24 0.00 0.00 0.00 0.00 23.12 19.56 3n58 s ALA 305 CO 0.00 -0.52 0.39 -0.25 0.00 0.00 0.00 175.76 175.38 3n58 n ASP 306 N -0.78 0.59 -3.90 0.00 8.00 0.22 -4.62 116.55 116.07 3n58 n ASP 306 Ca 0.09 0.23 -0.16 0.00 0.71 0.00 0.00 54.79 55.65 3n58 n ASP 306 Cb 0.50 0.33 -0.15 0.00 -0.02 0.00 0.00 41.12 41.78 3n58 n ASP 306 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3n58 s ILE 307 N -2.55 0.31 -0.07 0.53 1.01 -0.98 -1.36 121.20 118.09 3n58 s ILE 307 Ca -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.48 3n58 s ILE 307 Cb 0.07 -0.32 0.02 0.00 0.01 0.00 0.00 42.46 42.25 3n58 s ILE 307 CO 0.82 0.13 -0.05 -0.69 0.00 0.00 0.00 174.94 175.14 3n58 s VAL 308 N 0.36 0.72 -0.01 2.92 1.01 0.53 -0.56 120.40 125.38 3n58 s VAL 308 Ca -0.04 -0.16 0.03 0.00 0.00 0.00 0.00 61.98 61.82 3n58 s VAL 308 Cb -0.07 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 3n58 s VAL 308 CO -0.01 0.29 -0.11 -0.69 0.00 0.00 0.00 175.10 174.59 3n58 s VAL 309 N 1.37 0.91 -0.08 2.92 1.01 0.07 -1.56 120.40 125.05 3n58 s VAL 309 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.47 3n58 s VAL 309 Cb -0.13 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 3n58 s VAL 309 CO -0.03 0.26 -0.07 0.28 0.00 0.00 0.00 175.10 175.54 3n58 s THR 310 N -0.22 3.68 -0.03 3.92 -1.32 -0.91 -0.46 115.64 120.29 3n58 s THR 310 Ca 0.03 -0.48 0.09 0.00 -1.21 0.00 0.00 61.69 60.13 3n58 s THR 310 Cb -0.05 -2.52 0.16 0.00 -1.51 0.00 0.00 72.50 68.58 3n58 s THR 310 CO -0.00 0.58 1.07 0.35 -2.21 0.00 0.00 174.62 174.41 3n58 n THR 311 N 2.46 0.39 0.02 5.08 -2.24 -0.35 -1.11 114.28 118.53 3n58 n THR 311 Ca -0.18 -0.72 -0.16 0.00 -2.27 0.00 0.00 64.05 60.72 3n58 n THR 311 Cb 0.53 0.46 -0.14 0.00 -2.10 0.00 0.00 70.33 69.08 3n58 n THR 311 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3n58 h THR 312 N 5.68 0.90 0.00 4.28 1.35 -1.93 -3.40 112.91 119.79 3n58 h THR 312 Ca -0.05 -2.62 0.00 0.00 -0.55 0.00 0.00 66.41 63.19 3n58 h THR 312 Cb 1.43 2.59 0.00 0.00 -1.73 0.00 0.00 68.15 70.44 3n58 h THR 312 CO 0.02 0.76 0.00 0.61 -0.25 0.00 0.00 175.52 176.66 3n58 n GLY 313 N 1.75 0.40 0.00 5.82 0.00 -1.26 -5.02 105.19 106.88 3n58 n GLY 313 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3n58 n GLY 313 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3n58 n ASN 314 N -0.20 0.00 -4.16 1.61 2.85 -1.26 -4.98 115.26 109.11 3n58 n ASN 314 Ca 0.00 -0.58 -0.15 0.00 -0.11 0.00 0.00 54.58 53.74 3n58 n ASN 314 Cb 0.10 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.01 3n58 n ASN 314 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 3n58 s LYS 315 N -0.03 0.80 -1.31 1.20 -2.85 -1.26 -4.15 119.74 112.14 3n58 s LYS 315 Ca 0.00 -1.08 -0.05 0.00 -1.00 0.00 0.00 55.97 53.84 3n58 s LYS 315 Cb 0.00 -0.55 0.01 0.00 -2.06 0.00 0.00 37.83 35.23 3n58 s LYS 315 CO 0.00 0.09 1.07 -0.25 0.10 0.00 0.00 175.35 176.36 3n58 n ASP 316 N 0.79 -4.28 0.01 0.03 8.00 -0.55 -4.92 116.55 115.63 3n58 n ASP 316 Ca -0.18 -0.61 -0.22 0.00 0.71 0.00 0.00 54.79 54.50 3n58 n ASP 316 Cb 0.57 -4.90 -0.14 0.00 -0.02 0.00 0.00 41.12 36.63 3n58 n ASP 316 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3n58 h VAL 317 N -2.30 0.96 -3.55 2.53 2.07 -0.98 -3.42 116.25 111.56 3n58 h VAL 317 Ca -0.58 -2.39 -0.71 0.00 0.82 0.00 0.00 66.70 63.85 3n58 h VAL 317 Cb 1.36 2.66 -0.28 0.00 -1.52 0.00 0.00 31.29 33.50 3n58 h VAL 317 CO 0.55 0.72 -0.53 -0.63 0.02 0.00 0.00 177.57 177.70 3n58 s ILE 318 N -2.49 4.05 0.52 4.57 1.01 -0.80 -5.03 121.20 123.03 3n58 s ILE 318 Ca -0.20 -1.29 0.07 0.00 0.00 0.00 0.00 60.65 59.23 3n58 s ILE 318 Cb 0.05 -3.41 0.05 0.00 0.01 0.00 0.00 42.46 39.16 3n58 s ILE 318 CO 0.76 -0.38 0.71 0.42 0.00 0.00 0.00 174.94 176.46 3n58 s THR 319 N 1.41 2.55 0.45 2.92 -4.23 -1.26 -1.33 115.64 116.15 3n58 s THR 319 Ca 0.02 -0.94 0.14 0.00 -1.18 0.00 0.00 61.69 59.73 3n58 s THR 319 Cb -0.21 -2.61 0.19 0.00 1.34 0.00 0.00 72.50 71.20 3n58 s THR 319 CO 0.02 0.00 2.00 -0.29 -0.54 0.00 0.00 174.62 175.81 3n58 h ILE 320 N 0.30 1.12 -0.30 2.99 6.09 -1.97 -1.23 117.51 124.52 3n58 h ILE 320 Ca -0.36 -0.61 -0.13 0.00 -1.37 0.00 0.00 64.86 62.39 3n58 h ILE 320 Cb 1.28 1.33 -0.01 0.00 0.47 0.00 0.00 36.82 39.89 3n58 h ILE 320 CO 0.43 0.17 -0.36 0.44 -3.07 0.00 0.00 178.15 175.76 3n58 h ASP 321 N 0.00 0.71 -0.15 2.19 3.32 -2.00 -1.38 116.42 119.12 3n58 h ASP 321 Ca -0.00 -0.31 -0.05 0.00 0.02 0.00 0.00 57.03 56.69 3n58 h ASP 321 Cb 0.31 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 3n58 h ASP 321 CO 0.02 1.01 -0.11 0.45 -1.72 0.00 0.00 179.24 178.89 3n58 h HIS 322 N 0.57 0.40 -0.05 4.55 3.86 -1.77 -3.05 115.15 119.66 3n58 h HIS 322 Ca 0.05 -0.11 -0.06 0.00 -1.16 0.00 0.00 60.37 59.09 3n58 h HIS 322 Cb 0.88 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 3n58 h HIS 322 CO 0.04 0.69 -0.26 0.52 0.86 0.00 0.00 177.93 179.79 3n58 h MET 323 N -0.02 0.08 -0.52 2.45 2.86 -1.16 -1.63 114.93 117.00 3n58 h MET 323 Ca 0.03 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3n58 h MET 323 Cb 0.61 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 3n58 h MET 323 CO 0.03 0.34 0.34 0.00 1.06 0.00 0.00 176.91 178.68 3n58 h ARG 324 N 0.08 0.67 0.00 1.72 3.08 -1.25 -2.98 114.38 115.70 3n58 h ARG 324 Ca 0.01 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 3n58 h ARG 324 Cb 0.51 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3n58 h ARG 324 CO 0.04 0.44 -0.25 0.87 -1.07 0.00 0.00 179.97 180.00 3n58 h LYS 325 N 0.69 0.00 -6.96 0.04 1.57 -1.20 -3.46 116.57 107.26 3n58 h LYS 325 Ca 0.19 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.43 3n58 h LYS 325 Cb -0.07 0.00 0.19 0.00 0.08 0.00 0.00 32.23 32.43 3n58 h LYS 325 CO -0.05 0.25 -0.04 -1.33 -0.57 0.00 0.00 179.45 177.71 3n58 n MET 326 N -3.54 0.16 -2.95 3.15 2.81 -0.91 -4.23 117.12 111.61 3n58 n MET 326 Ca -0.01 0.12 -0.29 0.00 -1.81 0.00 0.00 57.70 55.71 3n58 n MET 326 Cb 0.40 -2.15 -0.02 0.00 -0.71 0.00 0.00 33.22 30.74 3n58 n MET 326 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 3n58 s LYS 327 N -3.59 3.66 0.13 0.03 -2.85 -1.25 -4.97 119.74 110.90 3n58 s LYS 327 Ca 0.68 0.23 -0.35 0.00 -1.00 0.00 0.00 55.97 55.53 3n58 s LYS 327 Cb -0.30 -2.47 -0.16 0.00 -2.06 0.00 0.00 37.83 32.84 3n58 s LYS 327 CO 0.56 -0.01 1.27 -3.47 0.10 0.00 0.00 175.35 173.80 3n58 n ASP 328 N -1.49 1.55 0.00 0.03 2.03 -1.26 -1.50 116.55 115.91 3n58 n ASP 328 Ca 0.00 1.13 0.00 0.00 0.52 0.00 0.00 54.79 56.44 3n58 n ASP 328 Cb 0.54 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 3n58 n ASP 328 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 3n58 n MET 329 N 2.19 -0.34 -1.68 -0.67 2.81 0.29 -4.91 117.12 114.81 3n58 n MET 329 Ca 0.17 0.08 -0.44 0.00 -1.81 0.00 0.00 57.70 55.70 3n58 n MET 329 Cb 0.22 -3.34 -0.03 0.00 -0.71 0.00 0.00 33.22 29.36 3n58 n MET 329 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3n58 s ILE 331 N 0.09 5.08 -0.08 0.00 1.01 -0.47 -1.70 121.20 125.13 3n58 s ILE 331 Ca 0.69 1.00 0.02 0.00 0.00 0.00 0.00 60.65 62.36 3n58 s ILE 331 Cb -0.63 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.03 3n58 s ILE 331 CO 0.48 0.41 -0.14 -0.69 0.00 0.00 0.00 174.94 174.99 3n58 s VAL 332 N 0.03 1.33 0.11 2.92 1.01 0.05 -0.34 120.40 125.52 3n58 s VAL 332 Ca 0.27 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 3n58 s VAL 332 Cb -0.16 -1.21 -0.00 0.00 0.00 0.00 0.00 36.38 35.01 3n58 s VAL 332 CO 0.13 0.40 0.22 -0.83 0.00 0.00 0.00 175.10 175.02 3n58 s GLY 333 N 0.70 0.19 -0.05 4.51 0.00 -0.60 -1.79 107.32 110.28 3n58 s GLY 333 Ca -0.13 -0.67 0.05 0.00 0.00 0.00 0.00 44.72 43.96 3n58 s GLY 333 CO 0.03 -0.80 -0.18 0.21 0.00 0.00 0.00 173.10 172.36 3n58 s ASN 334 N -2.89 2.30 -0.00 1.64 2.47 -1.26 -2.15 114.94 115.05 3n58 s ASN 334 Ca 0.08 -0.38 0.00 0.00 0.42 0.00 0.00 52.86 52.99 3n58 s ASN 334 Cb 0.04 -0.64 0.01 0.00 -1.45 0.00 0.00 41.25 39.21 3n58 s ASN 334 CO -0.08 0.17 0.93 0.00 -3.72 0.00 0.00 177.10 174.40 3n58 n ILE 335 N 3.11 0.87 -2.04 -5.21 3.06 -0.27 -0.69 119.36 118.19 3n58 n ILE 335 Ca -0.18 -0.88 -0.28 0.00 -2.50 0.00 0.00 62.75 58.92 3n58 n ILE 335 Cb 0.53 0.56 0.07 0.00 0.54 0.00 0.00 39.64 41.34 3n58 n ILE 335 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3n58 s GLY 336 N -0.89 1.63 0.47 4.50 0.00 -1.22 -4.91 107.32 106.90 3n58 s GLY 336 Ca 0.01 -0.73 0.20 0.00 0.00 0.00 0.00 44.72 44.20 3n58 s GLY 336 CO 0.00 -0.30 1.99 0.84 0.00 0.00 0.00 173.10 175.63 3n58 h HIS 337 N -0.80 0.00 -3.97 1.90 2.76 -1.95 -3.37 115.15 109.73 3n58 h HIS 337 Ca -0.45 0.00 -0.47 0.00 -2.20 0.00 0.00 60.37 57.24 3n58 h HIS 337 Cb 1.31 0.00 -0.22 0.00 1.55 0.00 0.00 27.41 30.05 3n58 h HIS 337 CO 0.35 0.19 -0.80 -0.06 -1.30 0.00 0.00 177.93 176.31 3n58 s PHE 338 N -4.33 1.44 -2.00 5.26 0.08 -1.26 -4.73 117.98 112.43 3n58 s PHE 338 Ca -0.03 -0.43 0.05 0.00 0.12 0.00 0.00 56.93 56.64 3n58 s PHE 338 Cb 0.14 -0.81 0.31 0.00 -0.57 0.00 0.00 43.02 42.09 3n58 s PHE 338 CO 0.65 0.11 0.93 -0.40 -0.10 0.00 0.00 175.22 176.41 3n58 n ASP 339 N 1.33 0.00 -0.63 1.36 5.75 -1.26 -3.53 116.55 119.57 3n58 n ASP 339 Ca -0.20 -1.23 0.13 0.00 -0.01 0.00 0.00 54.79 53.48 3n58 n ASP 339 Cb 0.54 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 41.03 3n58 n ASP 339 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3n58 n ASN 340 N -0.62 1.95 -0.22 -1.12 6.94 -1.26 -4.11 115.26 116.82 3n58 n ASN 340 Ca 0.04 -1.66 -0.08 0.00 -0.02 0.00 0.00 54.58 52.86 3n58 n ASN 340 Cb 0.02 -0.02 0.03 0.00 -2.36 0.00 0.00 39.78 37.45 3n58 n ASN 340 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 3n58 h GLU 341 N 2.98 1.04 -5.99 -3.83 5.08 -1.72 -1.46 114.58 110.68 3n58 h GLU 341 Ca 0.00 -0.28 -0.61 0.00 -1.00 0.00 0.00 59.36 57.47 3n58 h GLU 341 Cb 0.64 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 3n58 h GLU 341 CO 0.00 0.97 -0.33 0.42 -1.00 0.00 0.00 179.01 179.07 3n58 s ILE 342 N -5.19 5.22 -1.44 3.13 1.01 -1.26 -0.41 121.20 122.27 3n58 s ILE 342 Ca -0.12 0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.68 3n58 s ILE 342 Cb 0.13 -3.60 0.05 0.00 0.01 0.00 0.00 42.46 39.05 3n58 s ILE 342 CO 0.84 0.31 2.36 0.00 0.00 0.00 0.00 174.94 178.45 3n58 n GLN 343 N 0.96 3.55 -0.21 2.79 6.02 -0.44 -4.68 117.38 125.38 3n58 n GLN 343 Ca -0.09 -2.87 -0.08 0.00 -0.01 0.00 0.00 57.00 53.95 3n58 n GLN 343 Cb 0.52 -2.97 0.03 0.00 1.02 0.00 0.00 30.24 28.85 3n58 n GLN 343 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3n58 h VAL 344 N 3.45 1.23 -0.98 5.09 2.07 -1.89 -2.27 116.25 122.95 3n58 h VAL 344 Ca 0.63 -0.74 0.22 0.00 0.82 0.00 0.00 66.70 67.63 3n58 h VAL 344 Cb 0.49 0.62 -0.09 0.00 -1.52 0.00 0.00 31.29 30.80 3n58 h VAL 344 CO 1.73 0.29 0.63 0.00 0.02 0.00 0.00 177.57 180.24 3n58 h ALA 345 N 1.07 2.06 0.00 1.67 0.00 -1.93 0.45 119.26 122.59 3n58 h ALA 345 Ca 0.19 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3n58 h ALA 345 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3n58 h ALA 345 CO -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 178.82 3n58 n ALA 346 N -2.45 1.89 0.21 0.00 0.00 -0.86 -2.37 120.51 116.94 3n58 n ALA 346 Ca 0.23 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.74 3n58 n ALA 346 Cb 0.73 -1.34 -0.04 0.00 0.00 0.00 0.00 19.45 18.79 3n58 n ALA 346 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3n58 n LEU 347 N -1.69 0.54 0.33 0.00 4.77 0.15 -4.15 117.00 116.95 3n58 n LEU 347 Ca 0.04 0.13 0.15 0.00 -0.03 0.00 0.00 56.01 56.31 3n58 n LEU 347 Cb 0.25 -0.05 0.82 0.00 -2.33 0.00 0.00 43.42 42.11 3n58 n LEU 347 CO 0.19 -0.07 1.11 0.03 -1.33 0.00 0.00 177.39 177.33 3n58 h ARG 348 N 0.00 0.00 0.00 3.23 2.47 -1.13 -0.28 114.38 118.67 3n58 h ARG 348 Ca 0.00 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 3n58 h ARG 348 Cb 0.92 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.23 3n58 h ARG 348 CO 0.00 0.00 -0.35 -0.91 0.56 0.00 0.00 179.97 179.27 3n58 h ASN 349 N 0.00 0.00 -0.90 7.04 4.21 -1.76 -3.47 115.58 120.70 3n58 h ASN 349 Ca 0.00 0.00 -0.48 0.00 1.21 0.00 0.00 56.30 57.03 3n58 h ASN 349 Cb 0.61 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 37.84 3n58 h ASN 349 CO 0.00 0.35 -0.11 -0.76 -1.29 0.00 0.00 177.43 175.62 3n58 s LEU 350 N -7.07 3.17 -0.57 1.61 1.43 -0.12 -5.04 118.68 112.10 3n58 s LEU 350 Ca -0.00 -0.78 -0.28 0.00 -1.03 0.00 0.00 54.13 52.04 3n58 s LEU 350 Cb 0.11 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.58 3n58 s LEU 350 CO 0.68 -1.28 1.36 -1.59 0.23 0.00 0.00 176.35 175.75 3n58 s LYS 351 N -4.64 3.35 0.17 1.70 0.00 -1.21 -4.90 119.74 114.22 3n58 s LYS 351 Ca 0.61 0.40 -0.15 0.00 0.00 0.00 0.00 55.97 56.83 3n58 s LYS 351 Cb -0.06 -4.10 -0.07 0.00 0.00 0.00 0.00 37.83 33.60 3n58 s LYS 351 CO 0.38 -1.88 0.59 -1.58 0.00 0.00 0.00 175.35 172.86 3n58 s TRP 352 N 5.79 3.59 -0.11 1.78 0.52 -1.26 -1.16 118.94 128.10 3n58 s TRP 352 Ca 0.50 1.11 -0.01 0.00 0.02 0.00 0.00 56.10 57.71 3n58 s TRP 352 Cb -0.10 -2.41 0.03 0.00 -1.15 0.00 0.00 33.47 29.84 3n58 s TRP 352 CO 0.25 0.38 -0.01 0.99 0.02 0.00 0.00 176.95 178.58 3n58 s THR 353 N -1.53 0.59 0.26 2.01 2.01 0.20 -4.98 115.64 114.20 3n58 s THR 353 Ca 0.40 -0.12 -0.29 0.00 0.31 0.00 0.00 61.69 61.99 3n58 s THR 353 Cb -0.15 -0.77 -0.09 0.00 0.01 0.00 0.00 72.50 71.50 3n58 s THR 353 CO 0.20 0.20 1.20 0.21 -0.69 0.00 0.00 174.62 175.74 3n58 s ASN 354 N 1.88 7.06 -0.22 3.53 3.84 -1.26 -0.62 114.94 129.14 3n58 s ASN 354 Ca 0.04 2.38 0.02 0.00 0.21 0.00 0.00 52.86 55.51 3n58 s ASN 354 Cb -0.13 -2.63 -0.15 0.00 -0.55 0.00 0.00 41.25 37.79 3n58 s ASN 354 CO -0.06 -0.34 -0.18 0.52 -2.79 0.00 0.00 177.10 174.25 3n58 n VAL 355 N 1.57 1.27 -3.99 -5.21 0.31 -0.00 -4.90 118.33 107.37 3n58 n VAL 355 Ca 0.01 -0.50 0.04 0.00 -0.01 0.00 0.00 64.34 63.88 3n58 n VAL 355 Cb 0.44 -1.25 0.01 0.00 -0.91 0.00 0.00 33.84 32.13 3n58 n VAL 355 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3n58 s LYS 356 N -2.44 0.12 0.15 5.55 -2.85 -1.12 -5.02 119.74 114.13 3n58 s LYS 356 Ca -0.29 -0.08 -0.33 0.00 -1.00 0.00 0.00 55.97 54.27 3n58 s LYS 356 Cb 0.08 0.03 -0.13 0.00 -2.06 0.00 0.00 37.83 35.75 3n58 s LYS 356 CO 0.52 -0.05 1.64 -2.30 0.10 0.00 0.00 175.35 175.26 3n58 n PRO 357 N -0.93 2.31 -1.51 1.78 -0.02 -1.26 -1.30 135.00 134.06 3n58 n PRO 357 Ca 0.05 0.83 -0.15 0.00 -2.02 0.00 0.00 63.50 62.21 3n58 n PRO 357 Cb 0.59 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.38 3n58 n PRO 357 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3n58 n GLN 358 N 3.82 -1.08 -3.72 -0.52 3.00 -1.26 -4.96 117.38 112.67 3n58 n GLN 358 Ca 0.17 1.02 -0.25 0.00 -0.01 0.00 0.00 57.00 57.92 3n58 n GLN 358 Cb 0.30 -5.18 -0.17 0.00 0.00 0.00 0.00 30.24 25.19 3n58 n GLN 358 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3n58 s VAL 359 N -2.58 0.31 0.04 5.09 1.01 -0.42 -0.49 120.40 123.35 3n58 s VAL 359 Ca 0.00 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.85 3n58 s VAL 359 Cb 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 3n58 s VAL 359 CO 0.00 -0.06 -0.23 -1.81 0.00 0.00 0.00 175.10 173.00 3n58 s ASP 360 N 1.97 2.71 -0.31 3.32 1.01 -0.85 -0.82 116.67 123.69 3n58 s ASP 360 Ca 0.02 -0.53 -0.09 0.00 0.71 0.00 0.00 52.55 52.66 3n58 s ASP 360 Cb -0.15 -0.24 -0.00 0.00 1.01 0.00 0.00 42.92 43.53 3n58 s ASP 360 CO -0.07 0.21 0.15 -0.22 0.21 0.00 0.00 175.17 175.44 3n58 s LEU 361 N -1.11 4.11 -0.18 1.23 2.96 0.21 -0.50 118.68 125.39 3n58 s LEU 361 Ca 0.09 -0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 53.38 3n58 s LEU 361 Cb -0.09 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 3n58 s LEU 361 CO 0.02 -0.20 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.20 3n58 s ILE 362 N 1.60 3.98 -0.21 6.68 1.01 -0.51 -0.63 121.20 133.12 3n58 s ILE 362 Ca 0.04 -0.31 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 3n58 s ILE 362 Cb -0.17 -2.78 -0.02 0.00 0.01 0.00 0.00 42.46 39.51 3n58 s ILE 362 CO 0.06 0.46 -0.03 -0.70 0.00 0.00 0.00 174.94 174.72 3n58 s GLU 363 N 0.69 3.48 0.73 2.79 2.12 -0.31 -0.99 118.70 127.21 3n58 s GLU 363 Ca -0.01 -0.59 -0.12 0.00 0.36 0.00 0.00 54.97 54.62 3n58 s GLU 363 Cb -0.14 -3.01 0.03 0.00 0.26 0.00 0.00 34.13 31.27 3n58 s GLU 363 CO 0.02 -0.08 1.12 -0.06 -0.54 0.00 0.00 175.26 175.71 3n58 s PHE 364 N 1.21 3.22 0.25 5.30 0.08 0.60 -3.34 117.98 125.29 3n58 s PHE 364 Ca 0.03 0.98 -0.04 0.00 0.12 0.00 0.00 56.93 58.02 3n58 s PHE 364 Cb -0.14 -3.17 0.43 0.00 -0.57 0.00 0.00 43.02 39.56 3n58 s PHE 364 CO -0.00 -1.34 1.79 -1.35 -0.10 0.00 0.00 175.22 174.21 3n58 h PRO 365 N -0.76 0.68 0.00 0.24 0.11 -1.99 -0.43 132.00 129.84 3n58 h PRO 365 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3n58 h PRO 365 Cb 1.27 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3n58 h PRO 365 CO 0.64 0.45 0.00 -0.40 -0.21 0.00 0.00 178.00 178.48 3n58 n ASP 366 N -4.81 0.00 0.00 -2.05 5.75 -1.26 -4.81 116.55 109.37 3n58 n ASP 366 Ca 0.14 -0.64 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 3n58 n ASP 366 Cb 0.33 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 3n58 n ASP 366 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3n58 n GLY 367 N 0.14 0.86 3.72 6.12 0.00 -0.17 -5.03 105.19 110.83 3n58 n GLY 367 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3n58 n GLY 367 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n58 s LYS 368 N -0.44 4.40 0.08 1.61 2.36 -1.25 -4.71 119.74 121.78 3n58 s LYS 368 Ca 0.00 1.96 0.04 0.00 -2.55 0.00 0.00 55.97 55.42 3n58 s LYS 368 Cb 0.00 -3.26 -0.04 0.00 -1.05 0.00 0.00 37.83 33.48 3n58 s LYS 368 CO 0.00 -0.28 0.00 1.03 1.55 0.00 0.00 175.35 177.65 3n58 s ARG 369 N 0.53 2.59 0.18 4.03 0.52 -1.26 -0.29 118.95 125.25 3n58 s ARG 369 Ca 0.59 -0.81 0.10 0.00 -0.52 0.00 0.00 55.73 55.09 3n58 s ARG 369 Cb -0.34 -2.56 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 3n58 s ARG 369 CO 0.33 0.55 -0.21 -0.51 0.02 0.00 0.00 175.30 175.49 3n58 s LEU 370 N -2.22 2.45 -0.29 2.53 1.43 -0.16 0.11 118.68 122.52 3n58 s LEU 370 Ca 0.25 -0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 52.41 3n58 s LEU 370 Cb -0.12 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.13 3n58 s LEU 370 CO 0.17 0.03 0.07 -0.63 0.23 0.00 0.00 176.35 176.23 3n58 s ILE 371 N -1.92 3.92 -0.14 -0.59 1.01 -0.69 -1.43 121.20 121.36 3n58 s ILE 371 Ca 0.19 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 60.06 3n58 s ILE 371 Cb -0.07 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 3n58 s ILE 371 CO 0.08 0.08 0.11 -0.22 0.00 0.00 0.00 174.94 175.00 3n58 s LEU 372 N 1.49 4.15 -0.15 2.97 2.96 0.34 -0.77 118.68 129.67 3n58 s LEU 372 Ca 0.02 0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 54.19 3n58 s LEU 372 Cb -0.17 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 3n58 s LEU 372 CO 0.02 0.32 0.03 -0.76 -1.32 0.00 0.00 176.35 174.64 3n58 s LEU 373 N -0.50 3.64 -1.19 -0.68 1.43 -0.74 -2.01 118.68 118.62 3n58 s LEU 373 Ca 0.11 0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.16 3n58 s LEU 373 Cb -0.12 -1.89 0.10 0.00 0.03 0.00 0.00 46.19 44.31 3n58 s LEU 373 CO 0.02 0.22 0.43 -1.20 0.23 0.00 0.00 176.35 176.05 3n58 n SER 374 N 3.20 -2.80 -3.48 2.29 7.64 0.36 -0.73 113.62 120.10 3n58 n SER 374 Ca -0.17 -0.43 -0.25 0.00 1.01 0.00 0.00 58.87 59.02 3n58 n SER 374 Cb 0.53 -2.37 0.01 0.00 -1.01 0.00 0.00 64.21 61.36 3n58 n SER 374 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3n58 n GLU 375 N -3.58 -4.00 -1.06 1.43 1.02 -1.26 -1.17 120.64 112.00 3n58 n GLU 375 Ca 0.02 0.55 -0.02 0.00 -0.02 0.00 0.00 57.16 57.69 3n58 n GLU 375 Cb 0.51 -5.32 -0.01 0.00 -0.02 0.00 0.00 31.44 26.60 3n58 n GLU 375 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3n58 n GLY 376 N -1.34 0.53 3.98 0.62 0.00 0.09 -4.98 105.19 104.09 3n58 n GLY 376 Ca -0.01 -0.28 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 3n58 n GLY 376 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n58 s ARG 377 N -1.27 2.91 -0.52 1.61 0.52 -0.32 -4.20 118.95 117.68 3n58 s ARG 377 Ca 0.00 -1.18 -0.36 0.00 -0.52 0.00 0.00 55.73 53.67 3n58 s ARG 377 Cb 0.00 -2.73 -0.17 0.00 0.52 0.00 0.00 34.95 32.57 3n58 s ARG 377 CO 0.00 -0.11 1.95 1.28 0.02 0.00 0.00 175.30 178.44 3n58 n LEU 378 N -1.71 0.57 0.09 2.53 4.32 -1.22 -4.45 117.00 117.13 3n58 n LEU 378 Ca 0.04 0.50 -0.04 0.00 -0.02 0.00 0.00 56.01 56.49 3n58 n LEU 378 Cb 0.59 -0.78 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 3n58 n LEU 378 CO 0.41 -0.66 0.29 0.17 -1.22 0.00 0.00 177.39 176.38 3n58 h LEU 379 N 8.33 0.00 -0.68 2.23 8.10 -1.23 -0.75 115.31 131.31 3n58 h LEU 379 Ca -0.08 0.00 0.06 0.00 0.11 0.00 0.00 57.88 57.98 3n58 h LEU 379 Cb 1.21 0.00 -0.06 0.00 -0.44 0.00 0.00 40.66 41.37 3n58 h LEU 379 CO 1.00 0.83 0.37 -0.55 -4.11 0.00 0.00 178.44 175.98 3n58 h ASN 380 N 0.00 0.54 0.62 0.17 -1.07 -1.83 0.07 115.58 114.08 3n58 h ASN 380 Ca -0.01 0.03 -0.27 0.00 0.07 0.00 0.00 56.30 56.12 3n58 h ASN 380 Cb 1.49 -0.07 -0.02 0.00 -2.07 0.00 0.00 38.32 37.65 3n58 h ASN 380 CO 0.11 0.34 -1.40 -0.07 0.07 0.00 0.00 177.43 176.48 3n58 h LEU 381 N 0.67 0.20 -0.00 6.14 3.38 -1.83 -0.67 115.31 123.20 3n58 h LEU 381 Ca 0.31 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3n58 h LEU 381 Cb 0.21 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3n58 h LEU 381 CO -0.20 1.23 -0.00 1.23 0.09 0.00 0.00 178.44 180.79 3n58 h GLY 382 N 2.42 0.00 0.69 0.83 0.00 -0.96 -3.37 103.07 102.69 3n58 h GLY 382 Ca -0.18 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3n58 h GLY 382 CO 0.14 0.00 -0.98 0.70 0.00 0.00 0.00 176.54 176.41 3n58 n ASN 383 N -4.83 0.62 0.00 0.19 4.13 -0.01 -4.90 115.26 110.46 3n58 n ASN 383 Ca -0.09 -0.14 0.00 0.00 1.68 0.00 0.00 54.58 56.04 3n58 n ASN 383 Cb 0.27 0.70 0.00 0.00 -1.54 0.00 0.00 39.78 39.21 3n58 n ASN 383 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3n58 n ALA 384 N -1.84 0.00 -1.93 5.41 0.00 -1.07 -4.51 120.51 116.57 3n58 n ALA 384 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.49 3n58 n ALA 384 Cb 0.44 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.93 3n58 n ALA 384 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3n58 n THR 385 N 0.00 0.47 -4.73 0.00 -2.24 -1.05 -4.73 114.28 102.01 3n58 n THR 385 Ca 0.00 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 3n58 n THR 385 Cb 0.00 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 3n58 n THR 385 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n58 n GLY 386 N -0.21 0.96 3.80 3.38 0.00 -0.28 -4.83 105.19 108.01 3n58 n GLY 386 Ca 0.05 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 3n58 n GLY 386 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n58 s HIS 387 N 0.00 3.04 0.99 1.61 3.76 -1.26 -4.78 115.29 118.65 3n58 s HIS 387 Ca 0.00 1.58 -0.12 0.00 -0.15 0.00 0.00 55.06 56.37 3n58 s HIS 387 Cb 0.00 -3.04 0.19 0.00 1.11 0.00 0.00 32.58 30.83 3n58 s HIS 387 CO 0.00 -0.74 1.08 -2.14 -0.85 0.00 0.00 174.74 172.09 3n58 s PRO 388 N -3.20 0.47 0.11 8.40 0.02 -1.26 -4.81 135.00 134.73 3n58 s PRO 388 Ca 0.66 0.79 -0.20 0.00 0.02 0.00 0.00 61.00 62.27 3n58 s PRO 388 Cb -0.16 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.56 3n58 s PRO 388 CO 0.19 -2.78 1.75 0.77 -0.33 0.00 0.00 177.00 176.60 3n58 h SER 389 N -1.94 0.19 -0.70 2.53 0.02 -1.94 -2.62 113.55 109.09 3n58 h SER 389 Ca -0.53 -0.03 0.12 0.00 -0.84 0.00 0.00 61.79 60.51 3n58 h SER 389 Cb 1.31 -0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.71 3n58 h SER 389 CO 0.53 0.16 0.26 0.15 -1.14 0.00 0.00 176.83 176.80 3n58 h PHE 390 N 0.19 0.45 -0.17 3.45 3.04 -1.90 0.15 116.94 122.15 3n58 h PHE 390 Ca 0.06 0.03 -0.20 0.00 3.98 0.00 0.00 57.97 61.84 3n58 h PHE 390 Cb 0.01 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.43 3n58 h PHE 390 CO -0.06 0.07 -0.70 -0.24 -2.02 0.00 0.00 178.31 175.36 3n58 h VAL 391 N 0.42 1.30 0.00 1.41 3.04 -1.80 -2.73 116.25 117.88 3n58 h VAL 391 Ca 0.37 -1.93 -0.04 0.00 -1.01 0.00 0.00 66.70 64.09 3n58 h VAL 391 Cb 0.53 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.71 3n58 h VAL 391 CO -0.37 0.61 -0.20 0.24 -1.01 0.00 0.00 177.57 176.84 3n58 h MET 392 N 0.51 0.00 -0.79 4.17 2.86 -0.97 -2.26 114.93 118.45 3n58 h MET 392 Ca -0.03 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3n58 h MET 392 Cb 1.30 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.92 3n58 h MET 392 CO 0.14 0.20 0.48 1.03 1.06 0.00 0.00 176.91 179.81 3n58 h SER 393 N 0.00 0.94 -0.49 1.22 0.87 -0.42 0.45 113.55 116.12 3n58 h SER 393 Ca -0.00 -0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.42 3n58 h SER 393 Cb 0.38 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 3n58 h SER 393 CO 0.03 0.73 0.02 0.00 -0.53 0.00 0.00 176.83 177.07 3n58 h ALA 394 N 1.26 0.66 -0.01 6.23 0.00 -1.37 -1.10 119.26 124.93 3n58 h ALA 394 Ca 0.28 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3n58 h ALA 394 Cb -0.04 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3n58 h ALA 394 CO -0.05 0.46 0.00 1.03 0.00 0.00 0.00 179.25 180.68 3n58 h SER 395 N 0.72 0.01 1.42 0.00 0.87 -1.25 -3.25 113.55 112.08 3n58 h SER 395 Ca 0.14 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.41 3n58 h SER 395 Cb 0.49 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.45 3n58 h SER 395 CO 0.02 0.28 -0.10 -0.26 -0.53 0.00 0.00 176.83 176.25 3n58 h PHE 396 N -0.26 0.00 0.00 2.24 0.04 -0.06 -2.80 116.94 116.11 3n58 h PHE 396 Ca 0.00 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 3n58 h PHE 396 Cb 0.27 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 3n58 h PHE 396 CO 0.02 0.10 -0.47 1.15 -0.60 0.00 0.00 178.31 178.51 3n58 h THR 397 N 0.00 1.17 -0.12 -1.55 2.02 -1.23 -1.83 112.91 111.37 3n58 h THR 397 Ca -0.00 -1.69 -0.02 0.00 0.77 0.00 0.00 66.41 65.48 3n58 h THR 397 Cb 0.83 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.19 3n58 h THR 397 CO 0.01 0.46 0.01 0.78 0.37 0.00 0.00 175.52 177.15 3n58 h ASN 398 N 0.00 0.20 -0.66 4.18 2.35 -1.53 -2.64 115.58 117.48 3n58 h ASN 398 Ca -0.00 -0.28 0.14 0.00 -0.55 0.00 0.00 56.30 55.60 3n58 h ASN 398 Cb 0.91 -0.05 -0.11 0.00 0.05 0.00 0.00 38.32 39.12 3n58 h ASN 398 CO 0.06 0.44 0.01 1.56 -1.65 0.00 0.00 177.43 177.84 3n58 h GLN 399 N -0.04 0.12 -0.64 0.81 1.08 -1.36 0.32 115.11 115.40 3n58 h GLN 399 Ca 0.04 -0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.17 3n58 h GLN 399 Cb 0.33 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.70 3n58 h GLN 399 CO 0.00 0.08 0.16 0.28 -0.95 0.00 0.00 178.83 178.40 3n58 h VAL 400 N 0.12 1.25 -0.36 -0.54 2.07 -1.29 -0.29 116.25 117.21 3n58 h VAL 400 Ca 0.35 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 3n58 h VAL 400 Cb 0.58 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 3n58 h VAL 400 CO -0.57 0.35 -0.12 -0.07 0.02 0.00 0.00 177.57 177.18 3n58 h LEU 401 N 0.94 0.62 -0.50 2.57 3.38 -0.98 -1.52 115.31 119.82 3n58 h LEU 401 Ca 0.20 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3n58 h LEU 401 Cb 0.35 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3n58 h LEU 401 CO 0.00 0.77 0.16 1.23 0.09 0.00 0.00 178.44 180.69 3n58 h GLY 402 N 0.96 0.84 0.79 0.83 0.00 0.16 -1.39 103.07 105.27 3n58 h GLY 402 Ca 0.10 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3n58 h GLY 402 CO 0.03 0.47 -0.05 1.46 0.00 0.00 0.00 176.54 178.45 3n58 h GLN 403 N 0.69 -0.13 -0.67 4.80 1.08 -0.87 -2.03 115.11 117.97 3n58 h GLN 403 Ca 0.16 0.01 0.13 0.00 -1.45 0.00 0.00 58.65 57.50 3n58 h GLN 403 Cb 0.27 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.64 3n58 h GLN 403 CO -0.01 0.10 0.18 0.82 -0.95 0.00 0.00 178.83 178.97 3n58 h ILE 404 N -0.34 0.61 0.28 2.54 2.04 -1.21 0.14 117.51 121.57 3n58 h ILE 404 Ca -0.01 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3n58 h ILE 404 Cb 0.29 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3n58 h ILE 404 CO 0.02 0.05 -0.24 -0.33 0.00 0.00 0.00 178.15 177.65 3n58 h GLU 405 N 0.30 -0.50 0.00 2.37 4.39 -1.15 -0.48 114.58 119.52 3n58 h GLU 405 Ca 0.36 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.06 3n58 h GLU 405 Cb 0.56 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.32 3n58 h GLU 405 CO -0.43 -0.33 -0.15 -0.07 -1.16 0.00 0.00 179.01 176.87 3n58 h LEU 406 N -0.52 0.00 0.17 1.33 3.38 -1.04 0.31 115.31 118.95 3n58 h LEU 406 Ca -0.04 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.59 3n58 h LEU 406 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3n58 h LEU 406 CO -0.01 0.15 -1.74 0.15 0.09 0.00 0.00 178.44 177.07 3n58 h PHE 407 N 0.00 0.65 0.00 1.13 3.57 -0.73 -3.28 116.94 118.28 3n58 h PHE 407 Ca -0.00 -0.48 0.00 0.00 3.53 0.00 0.00 57.97 61.02 3n58 h PHE 407 Cb 0.44 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3n58 h PHE 407 CO 0.00 1.64 -1.00 0.25 -2.23 0.00 0.00 178.31 176.96 3n58 n THR 408 N -3.55 0.09 -2.75 4.41 -2.24 -0.19 -4.47 114.28 105.57 3n58 n THR 408 Ca -0.24 -0.16 -0.02 0.00 -2.27 0.00 0.00 64.05 61.36 3n58 n THR 408 Cb 1.07 0.42 0.05 0.00 -2.10 0.00 0.00 70.33 69.76 3n58 n THR 408 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3n58 n ARG 409 N -1.78 1.88 -0.02 -0.78 1.74 0.11 -4.92 116.66 112.88 3n58 n ARG 409 Ca 0.03 -3.54 0.09 0.00 -0.77 0.00 0.00 57.85 53.65 3n58 n ARG 409 Cb 0.40 -1.64 0.49 0.00 -1.02 0.00 0.00 32.46 30.69 3n58 n ARG 409 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3n58 h THR 410 N 5.29 0.97 0.00 0.55 2.02 -1.66 -1.78 112.91 118.31 3n58 h THR 410 Ca -0.09 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3n58 h THR 410 Cb 1.31 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 3n58 h THR 410 CO 0.24 0.08 0.00 0.47 0.37 0.00 0.00 175.52 176.67 3n58 n ASP 411 N -4.47 0.37 -0.28 4.18 8.00 -1.26 -2.36 116.55 120.72 3n58 n ASP 411 Ca 0.06 0.58 0.15 0.00 0.71 0.00 0.00 54.79 56.29 3n58 n ASP 411 Cb 0.24 -0.66 0.69 0.00 -0.02 0.00 0.00 41.12 41.38 3n58 n ASP 411 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n58 n ALA 412 N -1.65 2.62 -2.53 2.24 0.00 -0.67 -4.89 120.51 115.65 3n58 n ALA 412 Ca 0.04 -0.35 -0.24 0.00 0.00 0.00 0.00 53.44 52.89 3n58 n ALA 412 Cb 0.24 -1.31 -0.15 0.00 0.00 0.00 0.00 19.45 18.24 3n58 n ALA 412 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3n58 s TYR 413 N -2.01 1.48 0.56 0.00 1.51 -0.99 -5.14 117.35 112.75 3n58 s TYR 413 Ca 0.42 -0.29 0.07 0.00 -1.01 0.00 0.00 57.07 56.26 3n58 s TYR 413 Cb 0.21 -0.94 0.07 0.00 -0.11 0.00 0.00 41.96 41.20 3n58 s TYR 413 CO 0.35 -0.01 0.77 -1.59 -1.11 0.00 0.00 175.55 173.96 3n58 s LYS 414 N -0.53 2.35 -0.88 -0.62 0.00 -1.26 -4.83 119.74 113.97 3n58 s LYS 414 Ca 0.06 -1.40 -0.20 0.00 0.00 0.00 0.00 55.97 54.43 3n58 s LYS 414 Cb -0.07 -2.61 -0.12 0.00 0.00 0.00 0.00 37.83 35.03 3n58 s LYS 414 CO -0.00 -0.80 1.99 0.09 0.00 0.00 0.00 175.35 176.62 3n58 n ASN 415 N -2.25 2.88 -4.18 0.03 3.02 -1.26 -3.70 115.26 109.81 3n58 n ASN 415 Ca 0.13 -2.68 -0.11 0.00 -0.03 0.00 0.00 54.58 51.89 3n58 n ASN 415 Cb 0.61 -1.19 -0.10 0.00 -0.61 0.00 0.00 39.78 38.49 3n58 n ASN 415 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3n58 s GLU 416 N 4.64 1.18 -0.27 3.52 2.02 -1.26 -4.84 118.70 123.69 3n58 s GLU 416 Ca 0.55 -1.57 -0.19 0.00 0.02 0.00 0.00 54.97 53.78 3n58 s GLU 416 Cb 0.14 0.28 -0.02 0.00 0.10 0.00 0.00 34.13 34.63 3n58 s GLU 416 CO 0.08 -0.39 0.57 0.08 0.02 0.00 0.00 175.26 175.62 3n58 s VAL 417 N -4.13 5.01 0.28 2.63 1.01 -1.26 -1.45 120.40 122.48 3n58 s VAL 417 Ca 0.35 0.91 0.08 0.00 0.00 0.00 0.00 61.98 63.32 3n58 s VAL 417 Cb 0.06 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3n58 s VAL 417 CO 0.10 0.00 0.15 -0.31 0.00 0.00 0.00 175.10 175.04 3n58 s TYR 418 N 2.43 2.93 0.18 5.22 2.02 0.34 -4.91 117.35 125.56 3n58 s TYR 418 Ca 0.23 -0.20 0.10 0.00 -0.37 0.00 0.00 57.07 56.84 3n58 s TYR 418 Cb -0.15 -1.42 -0.04 0.00 -0.40 0.00 0.00 41.96 39.94 3n58 s TYR 418 CO 0.10 0.48 -0.19 0.14 -1.57 0.00 0.00 175.55 174.51 3n58 s VAL 419 N -2.24 2.67 0.78 0.71 -7.23 -1.26 0.60 120.40 114.42 3n58 s VAL 419 Ca 0.34 -1.84 -0.13 0.00 -1.81 0.00 0.00 61.98 58.54 3n58 s VAL 419 Cb -0.07 -2.28 0.07 0.00 0.56 0.00 0.00 36.38 34.66 3n58 s VAL 419 CO 0.24 -0.08 1.16 -0.76 -0.31 0.00 0.00 175.10 175.35 3n58 s LEU 420 N -2.63 3.15 0.70 1.32 1.43 -1.26 -4.98 118.68 116.40 3n58 s LEU 420 Ca 0.21 2.19 -0.13 0.00 -1.03 0.00 0.00 54.13 55.37 3n58 s LEU 420 Cb -0.09 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.59 3n58 s LEU 420 CO 0.11 -2.40 1.10 -2.16 0.23 0.00 0.00 176.35 173.23 3n58 s PRO 421 N -4.30 2.64 0.22 1.29 0.04 -1.26 -4.90 135.00 128.73 3n58 s PRO 421 Ca 0.69 1.27 -0.08 0.00 0.04 0.00 0.00 61.00 62.92 3n58 s PRO 421 Cb -0.24 -1.94 0.28 0.00 0.04 0.00 0.00 34.50 32.64 3n58 s PRO 421 CO 0.50 -1.36 1.82 -0.22 0.04 0.00 0.00 177.00 177.77 3n58 h LYS 422 N -0.43 0.73 -0.60 4.56 3.64 -1.96 -2.26 116.57 120.25 3n58 h LYS 422 Ca -0.45 -0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.02 3n58 h LYS 422 Cb 1.24 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 3n58 h LYS 422 CO 0.53 0.48 0.41 1.12 -2.27 0.00 0.00 179.45 179.73 3n58 h HIS 423 N 0.75 0.21 -0.04 1.91 2.07 -1.97 0.13 115.15 118.22 3n58 h HIS 423 Ca 0.33 0.01 -0.25 0.00 -2.85 0.00 0.00 60.37 57.60 3n58 h HIS 423 Cb 0.21 -0.07 0.02 0.00 2.57 0.00 0.00 27.41 30.14 3n58 h HIS 423 CO -0.07 0.09 -0.96 -0.07 -3.07 0.00 0.00 177.93 173.84 3n58 h LEU 424 N 0.19 0.85 -0.39 6.12 3.38 -1.79 -1.17 115.31 122.49 3n58 h LEU 424 Ca 0.29 -0.65 0.03 0.00 0.09 0.00 0.00 57.88 57.63 3n58 h LEU 424 Cb 0.87 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 3n58 h LEU 424 CO -0.05 1.45 0.20 -0.78 0.09 0.00 0.00 178.44 179.35 3n58 h ASP 425 N 0.40 0.30 -0.57 -0.43 1.82 -0.92 -0.81 116.42 116.21 3n58 h ASP 425 Ca -0.10 0.02 -0.08 0.00 -0.39 0.00 0.00 57.03 56.47 3n58 h ASP 425 Cb 1.61 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 41.55 3n58 h ASP 425 CO 0.19 0.22 0.05 -0.33 -1.61 0.00 0.00 179.24 177.76 3n58 h GLU 426 N 0.41 0.99 0.09 0.28 5.08 -0.81 -2.60 114.58 118.02 3n58 h GLU 426 Ca 0.16 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3n58 h GLU 426 Cb 0.06 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 3n58 h GLU 426 CO -0.11 0.94 -0.19 -0.22 -1.00 0.00 0.00 179.01 178.44 3n58 h LYS 427 N 0.93 -0.34 -0.56 2.33 3.64 -0.72 -0.14 116.57 121.70 3n58 h LYS 427 Ca 0.18 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.70 3n58 h LYS 427 Cb 0.46 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 32.27 3n58 h LYS 427 CO 0.02 -0.23 -0.01 0.28 -2.27 0.00 0.00 179.45 177.24 3n58 h VAL 428 N -0.35 0.54 -0.81 2.00 2.07 -0.98 0.16 116.25 118.87 3n58 h VAL 428 Ca 0.03 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3n58 h VAL 428 Cb 0.38 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 3n58 h VAL 428 CO -0.11 0.02 0.48 0.00 0.02 0.00 0.00 177.57 177.98 3n58 h ALA 429 N 1.51 1.03 -0.61 1.67 0.00 -1.24 -2.59 119.26 119.03 3n58 h ALA 429 Ca 0.29 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3n58 h ALA 429 Cb 0.45 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3n58 h ALA 429 CO -0.48 0.50 0.31 -0.09 0.00 0.00 0.00 179.25 179.49 3n58 h ARG 430 N 1.11 0.85 0.00 0.00 2.43 0.11 -1.33 114.38 117.56 3n58 h ARG 430 Ca 0.29 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3n58 h ARG 430 Cb -0.03 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 3n58 h ARG 430 CO -0.05 0.64 0.00 1.28 -1.51 0.00 0.00 179.97 180.33 3n58 n LEU 431 N -4.37 0.00 -0.27 3.80 4.77 -0.19 -2.89 117.00 117.86 3n58 n LEU 431 Ca 0.06 0.45 0.07 0.00 -0.03 0.00 0.00 56.01 56.55 3n58 n LEU 431 Cb 0.11 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 3n58 n LEU 431 CO 0.38 -0.16 0.21 1.41 -1.33 0.00 0.00 177.39 177.89 3n58 n HIS 432 N -1.45 0.00 -0.08 -1.77 8.25 -0.51 -4.33 115.22 115.34 3n58 n HIS 432 Ca 0.06 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 3n58 n HIS 432 Cb 0.20 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.26 3n58 n HIS 432 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3n58 h LEU 433 N 1.35 0.46 -0.60 2.41 3.38 -1.41 -3.29 115.31 117.60 3n58 h LEU 433 Ca 0.00 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.61 3n58 h LEU 433 Cb 0.46 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 3n58 h LEU 433 CO 0.00 0.73 0.38 0.44 0.09 0.00 0.00 178.44 180.07 3n58 h ASP 434 N 0.18 0.62 -1.05 -0.43 3.32 -1.79 -1.31 116.42 115.97 3n58 h ASP 434 Ca 0.06 -0.00 0.30 0.00 0.02 0.00 0.00 57.03 57.41 3n58 h ASP 434 Cb 0.53 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 3n58 h ASP 434 CO 0.03 0.44 0.81 0.50 -1.72 0.00 0.00 179.24 179.30 3n58 h LYS 435 N 0.75 0.00 -0.32 3.56 1.63 -1.87 0.42 116.57 120.74 3n58 h LYS 435 Ca 0.23 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 3n58 h LYS 435 Cb -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 3n58 h LYS 435 CO -0.09 0.00 0.00 1.28 -3.45 0.00 0.00 179.45 177.19 3n58 n LEU 436 N -4.04 2.94 -1.77 5.20 4.77 -0.55 -4.96 117.00 118.60 3n58 n LEU 436 Ca 0.22 -1.65 -0.17 0.00 -0.03 0.00 0.00 56.01 54.39 3n58 n LEU 436 Cb 1.16 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 42.02 3n58 n LEU 436 CO 0.37 0.68 -0.20 0.61 -1.33 0.00 0.00 177.39 177.52 3n58 n GLY 437 N 0.91 0.30 3.49 -0.72 0.00 0.14 -4.95 105.19 104.35 3n58 n GLY 437 Ca 0.14 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3n58 n GLY 437 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n58 s ALA 438 N -2.79 3.39 -0.24 4.61 0.00 -0.84 -5.02 121.76 120.86 3n58 s ALA 438 Ca 0.00 -1.41 -0.13 0.00 0.00 0.00 0.00 51.96 50.42 3n58 s ALA 438 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 3n58 s ALA 438 CO 0.00 -1.69 0.28 0.21 0.00 0.00 0.00 175.76 174.56 3n58 s LYS 439 N 2.42 4.07 0.14 0.00 2.20 -1.26 -4.44 119.74 122.86 3n58 s LYS 439 Ca 0.16 -0.07 -0.23 0.00 -0.36 0.00 0.00 55.97 55.48 3n58 s LYS 439 Cb -0.16 -3.59 -0.08 0.00 -1.51 0.00 0.00 37.83 32.50 3n58 s LYS 439 CO 0.16 -0.09 0.70 -1.17 -0.36 0.00 0.00 175.35 174.58 3n58 s LEU 440 N 1.50 4.55 0.33 5.43 2.96 -1.26 -5.06 118.68 127.13 3n58 s LEU 440 Ca 0.12 1.49 -0.20 0.00 -0.22 0.00 0.00 54.13 55.32 3n58 s LEU 440 Cb -0.15 -3.17 -0.10 0.00 0.50 0.00 0.00 46.19 43.28 3n58 s LEU 440 CO 0.08 0.22 0.84 -0.89 -1.32 0.00 0.00 176.35 175.28 3n58 s THR 441 N -1.16 4.47 -0.20 3.68 2.01 -1.26 -5.08 115.64 118.09 3n58 s THR 441 Ca 0.34 1.36 -0.06 0.00 0.31 0.00 0.00 61.69 63.64 3n58 s THR 441 Cb -0.21 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 3n58 s THR 441 CO 0.23 -0.06 0.03 -0.69 -0.69 0.00 0.00 174.62 173.44 3n58 s VAL 442 N -1.85 4.19 0.29 3.82 1.01 -1.26 -5.09 120.40 121.52 3n58 s VAL 442 Ca 0.53 -0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 3n58 s VAL 442 Cb -0.13 -2.91 -0.12 0.00 0.00 0.00 0.00 36.38 33.23 3n58 s VAL 442 CO 0.18 0.42 1.61 0.18 0.00 0.00 0.00 175.10 177.49 3n58 n LEU 443 N 4.21 4.42 -4.64 3.92 4.77 -1.26 -5.01 117.00 123.41 3n58 n LEU 443 Ca -0.17 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 56.66 3n58 n LEU 443 Cb 0.52 -1.60 0.18 0.00 -2.33 0.00 0.00 43.42 40.19 3n58 n LEU 443 CO 0.32 0.18 0.62 -0.94 -1.33 0.00 0.00 177.39 176.25 3n58 s SER 444 N 0.52 2.58 0.14 -1.43 1.04 -1.26 -4.82 113.70 110.47 3n58 s SER 444 Ca 0.64 1.56 -0.13 0.00 0.48 0.00 0.00 55.95 58.49 3n58 s SER 444 Cb -0.49 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.41 3n58 s SER 444 CO 0.48 -3.21 1.59 -0.08 0.98 0.00 0.00 173.24 173.01 3n58 h GLU 445 N -1.94 0.81 -0.52 4.02 4.57 -2.00 -2.34 114.58 117.17 3n58 h GLU 445 Ca -0.53 -0.25 0.01 0.00 -1.18 0.00 0.00 59.36 57.41 3n58 h GLU 445 Cb 1.30 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.79 3n58 h GLU 445 CO 0.52 0.86 0.35 0.93 -1.18 0.00 0.00 179.01 180.48 3n58 h GLU 446 N 0.66 0.69 -0.27 1.92 3.07 -1.99 -2.04 114.58 116.61 3n58 h GLU 446 Ca 0.13 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3n58 h GLU 446 Cb 0.49 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 3n58 h GLU 446 CO 0.02 0.46 0.18 1.96 -1.40 0.00 0.00 179.01 180.23 3n58 h GLN 447 N 0.71 0.36 -0.14 2.33 4.20 -1.88 0.35 115.11 121.04 3n58 h GLN 447 Ca 0.19 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 3n58 h GLN 447 Cb -0.08 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 3n58 h GLN 447 CO -0.04 0.24 0.08 0.00 -0.67 0.00 0.00 178.83 178.44 3n58 h ALA 448 N 1.10 0.17 -0.60 3.87 0.00 -1.33 -1.83 119.26 120.63 3n58 h ALA 448 Ca 0.10 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.09 3n58 h ALA 448 Cb -0.04 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 3n58 h ALA 448 CO -0.02 -0.31 0.15 0.00 0.00 0.00 0.00 179.25 179.06 3n58 h ALA 449 N 1.01 0.73 -0.62 0.00 0.00 -1.24 -0.56 119.26 118.58 3n58 h ALA 449 Ca 0.05 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.17 3n58 h ALA 449 Cb 0.03 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3n58 h ALA 449 CO -0.01 -0.29 0.41 -0.92 0.00 0.00 0.00 179.25 178.45 3n58 h TYR 450 N 0.29 0.50 -0.02 0.00 3.20 -0.07 -1.86 116.97 119.01 3n58 h TYR 450 Ca 0.32 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.20 3n58 h TYR 450 Cb 0.46 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.57 3n58 h TYR 450 CO -0.23 0.24 -0.12 0.44 -1.64 0.00 0.00 178.16 176.85 3n58 n ILE 451 N -4.48 0.00 -1.34 1.81 -5.35 -0.97 -5.00 119.36 104.04 3n58 n ILE 451 Ca 0.10 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 3n58 n ILE 451 Cb 0.34 1.27 0.00 0.00 -1.74 0.00 0.00 39.64 39.51 3n58 n ILE 451 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3n58 n GLY 452 N 0.96 0.97 2.50 3.28 0.00 -0.33 -5.09 105.19 107.49 3n58 n GLY 452 Ca 0.08 -0.53 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 3n58 n GLY 452 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3n58 n VAL 453 N -2.61 0.00 -4.20 1.61 0.24 -0.56 -5.02 118.33 107.79 3n58 n VAL 453 Ca 0.00 -1.80 -0.27 0.00 -2.04 0.00 0.00 64.34 60.23 3n58 n VAL 453 Cb 0.32 0.71 -0.08 0.00 -1.47 0.00 0.00 33.84 33.32 3n58 n VAL 453 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3n58 s THR 454 N -2.78 3.76 0.10 3.34 -4.23 -1.26 -3.83 115.64 110.75 3n58 s THR 454 Ca 0.19 -1.40 0.24 0.00 -1.18 0.00 0.00 61.69 59.54 3n58 s THR 454 Cb 0.01 -2.89 0.24 0.00 1.34 0.00 0.00 72.50 71.19 3n58 s THR 454 CO 0.14 -0.11 1.70 -0.65 -0.54 0.00 0.00 174.62 175.16 3n58 h PRO 455 N 2.70 0.00 -0.01 3.99 0.11 -1.88 -0.72 132.00 136.18 3n58 h PRO 455 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3n58 h PRO 455 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3n58 h PRO 455 CO 0.58 0.00 -0.64 1.04 -0.21 0.00 0.00 178.00 178.77 3n58 n GLN 456 N -2.40 0.79 0.00 1.05 3.00 -1.26 -4.67 117.38 113.88 3n58 n GLN 456 Ca -0.02 -0.65 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 3n58 n GLN 456 Cb 0.16 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.92 3n58 n GLN 456 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3n58 n GLY 457 N 1.45 -2.28 3.70 1.08 0.00 -0.28 -4.93 105.19 103.92 3n58 n GLY 457 Ca 0.08 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.22 3n58 n GLY 457 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3n58 s PRO 458 N -0.81 1.77 0.00 1.61 0.02 -1.26 -4.70 135.00 131.63 3n58 s PRO 458 Ca 0.00 1.81 0.16 0.00 0.02 0.00 0.00 61.00 62.99 3n58 s PRO 458 Cb 0.00 -1.78 -0.14 0.00 0.02 0.00 0.00 34.50 32.60 3n58 s PRO 458 CO 0.00 -2.13 0.72 1.19 -0.33 0.00 0.00 177.00 176.45 3n58 n PHE 459 N -3.08 0.00 -4.24 6.54 3.72 -1.26 -4.52 117.46 114.62 3n58 n PHE 459 Ca 0.14 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.36 3n58 n PHE 459 Cb 0.50 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.93 3n58 n PHE 459 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3n58 s LYS 460 N -2.38 1.01 0.97 -1.08 -0.14 -1.26 -5.01 119.74 111.85 3n58 s LYS 460 Ca 0.08 -1.21 -0.11 0.00 -1.36 0.00 0.00 55.97 53.36 3n58 s LYS 460 Cb 0.12 -0.93 0.17 0.00 -1.68 0.00 0.00 37.83 35.52 3n58 s LYS 460 CO 0.60 0.18 1.09 -1.54 -0.76 0.00 0.00 175.35 174.93 3n58 s SER 461 N -2.37 2.67 0.30 2.83 1.04 -1.26 -4.90 113.70 112.02 3n58 s SER 461 Ca 0.08 1.76 0.02 0.00 0.48 0.00 0.00 55.95 58.28 3n58 s SER 461 Cb -0.06 -2.37 0.57 0.00 0.10 0.00 0.00 66.02 64.27 3n58 s SER 461 CO 0.03 -3.18 1.88 -0.08 0.98 0.00 0.00 173.24 172.87 3n58 h GLU 462 N -1.92 0.95 -0.41 4.02 4.81 -2.02 -2.73 114.58 117.27 3n58 h GLU 462 Ca -0.50 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 3n58 h GLU 462 Cb 1.29 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.45 3n58 h GLU 462 CO 0.49 0.63 0.00 0.72 -0.73 0.00 0.00 179.01 180.12 3n58 n HIS 463 N -4.54 1.19 -1.60 0.92 8.25 -1.26 -5.00 115.22 113.18 3n58 n HIS 463 Ca 0.16 -0.74 -0.47 0.00 -0.26 0.00 0.00 57.72 56.41 3n58 n HIS 463 Cb 0.29 -0.30 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 3n58 n HIS 463 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 3n58 n TYR 464 N 0.18 1.46 0.39 4.41 9.36 -1.03 -4.90 117.16 127.03 3n58 n TYR 464 Ca 0.22 0.63 0.12 0.00 3.32 0.00 0.00 57.90 62.19 3n58 n TYR 464 Cb 0.88 -2.31 0.07 0.00 -0.63 0.00 0.00 39.34 37.35 3n58 n TYR 464 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3n58 n ARG 465 N 1.67 0.41 -0.49 2.98 1.74 -1.26 -5.03 116.66 116.67 3n58 n ARG 465 Ca 0.14 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 3n58 n ARG 465 Cb 0.27 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 3n58 n ARG 465 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77