#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d54 n LEU 3 N 0.00 0.73 0.00 -0.35 7.94 -1.26 -4.58 117.00 119.48 3d54 n LEU 3 Ca 0.00 -0.42 0.00 0.00 -1.11 0.00 0.00 56.01 54.48 3d54 n LEU 3 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3d54 n LEU 3 CO 0.00 0.18 0.00 -1.14 -1.11 0.00 0.00 177.39 175.32 3d54 n ARG 4 N -1.54 2.21 0.00 1.96 0.63 -1.26 -4.87 116.66 113.79 3d54 n ARG 4 Ca 0.02 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.09 3d54 n ARG 4 Cb 0.32 -0.18 0.80 0.00 0.45 0.00 0.00 32.46 33.84 3d54 n ARG 4 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3d54 n TYR 5 N 0.00 0.00 -0.05 -0.14 4.02 -1.26 -3.60 117.16 116.13 3d54 n TYR 5 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 3d54 n TYR 5 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.25 3d54 n TYR 5 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3d54 h LEU 6 N 0.00 0.71 -1.52 7.72 5.85 -1.89 -3.16 115.31 123.02 3d54 h LEU 6 Ca 0.00 -0.59 -0.05 0.00 0.84 0.00 0.00 57.88 58.08 3d54 h LEU 6 Cb 0.00 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 3d54 h LEU 6 CO 0.00 1.17 -0.23 0.78 -0.34 0.00 0.00 178.44 179.82 3d54 h ASN 7 N 0.28 0.00 1.80 1.25 2.35 -1.97 -2.21 115.58 117.08 3d54 h ASN 7 Ca -0.01 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 3d54 h ASN 7 Cb 1.10 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.46 3d54 h ASN 7 CO 0.10 0.23 -0.20 0.40 -1.65 0.00 0.00 177.43 176.31 3d54 h ILE 8 N 0.00 0.29 0.10 2.81 1.08 -1.76 -3.28 117.51 116.76 3d54 h ILE 8 Ca -0.00 -1.42 -0.31 0.00 -0.39 0.00 0.00 64.86 62.74 3d54 h ILE 8 Cb 0.53 2.13 -0.02 0.00 -3.07 0.00 0.00 36.82 36.40 3d54 h ILE 8 CO 0.03 0.17 -1.65 0.25 -0.69 0.00 0.00 178.15 176.25 3d54 h LEU 9 N 0.00 0.32 -1.18 1.44 5.85 -1.38 -3.35 115.31 117.02 3d54 h LEU 9 Ca -0.00 -0.53 -0.07 0.00 0.84 0.00 0.00 57.88 58.12 3d54 h LEU 9 Cb 1.13 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 3d54 h LEU 9 CO 0.02 1.45 -0.18 0.11 -0.34 0.00 0.00 178.44 179.50 3d54 h LYS 10 N 0.06 0.34 0.00 1.25 1.57 -1.51 -2.62 116.57 115.66 3d54 h LYS 10 Ca -0.29 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 3d54 h LYS 10 Cb 2.02 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.29 3d54 h LYS 10 CO 0.13 0.52 -0.15 -0.85 -0.57 0.00 0.00 179.45 178.54 3d54 n GLU 11 N -4.19 0.15 0.00 3.15 0.28 -1.24 -1.46 120.64 117.33 3d54 n GLU 11 Ca -0.00 0.10 0.11 0.00 -0.16 0.00 0.00 57.16 57.20 3d54 n GLU 11 Cb 0.33 -1.65 -0.13 0.00 1.43 0.00 0.00 31.44 31.43 3d54 n GLU 11 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3d54 n LYS 12 N -1.89 0.48 -0.10 3.44 4.76 -1.07 -4.36 118.16 119.42 3d54 n LYS 12 Ca 0.06 -0.12 -0.10 0.00 -2.87 0.00 0.00 58.31 55.28 3d54 n LYS 12 Cb 0.39 -1.55 -0.16 0.00 -1.84 0.00 0.00 35.03 31.88 3d54 n LYS 12 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3d54 n LEU 13 N -2.10 0.01 0.00 -0.35 4.77 -1.01 -5.02 117.00 113.29 3d54 n LEU 13 Ca -0.01 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3d54 n LEU 13 Cb 0.51 0.48 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 3d54 n LEU 13 CO 0.44 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 3d54 n GLY 14 N 1.78 0.53 0.00 -0.72 0.00 -0.53 -4.98 105.19 101.27 3d54 n GLY 14 Ca -0.32 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3d54 n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3d54 n ARG 15 N -2.89 0.00 -3.45 1.61 1.85 -1.23 -5.06 116.66 107.49 3d54 n ARG 15 Ca 0.00 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.47 3d54 n ARG 15 Cb 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.35 3d54 n ARG 15 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 3d54 s GLU 16 N -1.07 3.99 0.46 2.89 0.41 -1.26 -4.66 118.70 119.45 3d54 s GLU 16 Ca 0.00 0.48 -0.22 0.00 -0.41 0.00 0.00 54.97 54.82 3d54 s GLU 16 Cb 0.00 -3.23 -0.08 0.00 -1.78 0.00 0.00 34.13 29.04 3d54 s GLU 16 CO 0.00 0.67 1.08 -2.14 -0.49 0.00 0.00 175.26 174.38 3d54 s PRO 17 N -1.05 3.87 0.93 0.39 0.02 -1.26 -5.07 135.00 132.83 3d54 s PRO 17 Ca 0.25 1.52 -0.15 0.00 0.02 0.00 0.00 61.00 62.64 3d54 s PRO 17 Cb -0.17 -2.30 0.18 0.00 0.02 0.00 0.00 34.50 32.23 3d54 s PRO 17 CO 0.14 -0.40 1.29 0.95 -0.33 0.00 0.00 177.00 178.65 3d54 s THR 18 N -1.76 2.01 -0.07 0.99 -4.23 -1.26 -4.81 115.64 106.51 3d54 s THR 18 Ca 0.64 -0.03 0.31 0.00 -1.18 0.00 0.00 61.69 61.42 3d54 s THR 18 Cb -0.21 -2.98 0.36 0.00 1.34 0.00 0.00 72.50 71.01 3d54 s THR 18 CO 0.26 0.00 1.89 0.15 -0.54 0.00 0.00 174.62 176.38 3d54 h PHE 19 N -1.51 0.00 0.23 3.99 3.57 -1.97 -0.87 116.94 120.37 3d54 h PHE 19 Ca -0.44 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 60.73 3d54 h PHE 19 Cb 1.25 0.00 0.03 0.00 2.79 0.00 0.00 35.95 40.02 3d54 h PHE 19 CO -0.92 0.00 -1.43 0.28 -2.23 0.00 0.00 178.31 174.01 3d54 h VAL 20 N 0.00 1.31 0.09 1.41 2.07 -1.93 -3.23 116.25 115.97 3d54 h VAL 20 Ca 0.00 -2.73 -0.26 0.00 0.82 0.00 0.00 66.70 64.53 3d54 h VAL 20 Cb 0.57 3.00 0.01 0.00 -1.52 0.00 0.00 31.29 33.35 3d54 h VAL 20 CO 0.00 0.82 -1.14 -0.33 0.02 0.00 0.00 177.57 176.93 3d54 h GLU 21 N 0.15 0.34 -0.70 1.57 5.08 -1.83 -2.80 114.58 116.40 3d54 h GLU 21 Ca -0.24 -0.49 -0.07 0.00 -1.00 0.00 0.00 59.36 57.57 3d54 h GLU 21 Cb 2.13 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 31.52 3d54 h GLU 21 CO 0.27 1.19 0.18 1.25 -1.00 0.00 0.00 179.01 180.90 3d54 h LEU 22 N 0.14 1.04 0.00 1.33 6.46 -1.29 -1.66 115.31 121.33 3d54 h LEU 22 Ca -0.12 -0.21 -0.13 0.00 -0.12 0.00 0.00 57.88 57.30 3d54 h LEU 22 Cb 1.83 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 41.47 3d54 h LEU 22 CO 0.19 0.99 -0.64 1.56 -0.62 0.00 0.00 178.44 179.93 3d54 h GLN 23 N 1.05 0.00 -0.08 1.25 1.08 -1.63 -2.90 115.11 113.88 3d54 h GLN 23 Ca 0.22 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.35 3d54 h GLN 23 Cb 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 3d54 h GLN 23 CO -0.00 0.56 -0.21 0.00 -0.95 0.00 0.00 178.83 178.23 3d54 h ALA 24 N 1.42 0.13 -0.00 3.87 0.00 -1.20 -3.23 119.26 120.25 3d54 h ALA 24 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3d54 h ALA 24 Cb 1.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.23 3d54 h ALA 24 CO 0.07 0.09 -0.15 1.19 0.00 0.00 0.00 179.25 180.46 3d54 n PHE 25 N -4.53 0.00 0.44 0.00 3.01 -0.65 -1.76 117.46 113.97 3d54 n PHE 25 Ca -0.08 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.50 3d54 n PHE 25 Cb 0.43 -0.18 0.21 0.00 -0.01 0.00 0.00 39.48 39.93 3d54 n PHE 25 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3d54 h SER 26 N 0.68 0.00 0.00 4.37 0.87 -1.52 -2.80 113.55 115.15 3d54 h SER 26 Ca 0.00 -0.07 -0.20 0.00 -1.23 0.00 0.00 61.79 60.29 3d54 h SER 26 Cb 0.40 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 3d54 h SER 26 CO 0.00 0.03 -1.74 0.52 -0.53 0.00 0.00 176.83 175.11 3d54 n VAL 27 N -2.46 0.74 0.08 2.23 0.31 -1.20 -4.19 118.33 113.84 3d54 n VAL 27 Ca 0.04 -0.42 -0.08 0.00 -0.01 0.00 0.00 64.34 63.87 3d54 n VAL 27 Cb 0.47 -0.78 -0.07 0.00 -0.91 0.00 0.00 33.84 32.55 3d54 n VAL 27 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3d54 h MET 28 N 0.00 0.09 -0.65 5.55 2.07 -1.47 -3.26 114.93 117.26 3d54 h MET 28 Ca -0.29 -0.13 -0.36 0.00 -2.07 0.00 0.00 59.70 56.85 3d54 h MET 28 Cb 1.61 0.05 -0.21 0.00 -1.87 0.00 0.00 31.60 31.18 3d54 h MET 28 CO 0.00 0.99 0.22 0.91 1.07 0.00 0.00 176.91 180.10 3d54 n TRP 29 N -3.49 2.03 -2.13 -0.22 7.02 -1.05 -3.92 117.44 115.67 3d54 n TRP 29 Ca -0.02 -1.83 -0.18 0.00 -1.02 0.00 0.00 57.50 54.44 3d54 n TRP 29 Cb 0.90 -0.72 0.11 0.00 -2.42 0.00 0.00 31.31 29.17 3d54 n TRP 29 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 3d54 n SER 30 N -1.10 0.57 -0.27 -0.99 3.41 -1.23 -4.59 113.62 109.42 3d54 n SER 30 Ca 0.46 -1.60 0.13 0.00 -0.26 0.00 0.00 58.87 57.60 3d54 n SER 30 Cb 1.24 -0.56 0.42 0.00 -0.26 0.00 0.00 64.21 65.04 3d54 n SER 30 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3d54 n GLU 31 N -2.58 0.94 -0.05 4.33 4.07 -1.26 -2.69 120.64 123.40 3d54 n GLU 31 Ca 0.12 -0.53 -0.01 0.00 -0.06 0.00 0.00 57.16 56.67 3d54 n GLU 31 Cb 0.41 -1.49 -0.00 0.00 -0.06 0.00 0.00 31.44 30.30 3d54 n GLU 31 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 3d54 h HIS 32 N 1.31 0.00 -0.62 4.31 2.76 -1.90 -3.38 115.15 117.63 3d54 h HIS 32 Ca 0.00 0.00 -0.41 0.00 -2.20 0.00 0.00 60.37 57.76 3d54 h HIS 32 Cb 0.49 0.00 -0.26 0.00 1.55 0.00 0.00 27.41 29.19 3d54 h HIS 32 CO 0.00 0.00 -0.19 0.00 -1.30 0.00 0.00 177.93 176.44 3d54 n GLY 34 N -0.93 0.00 3.22 0.00 0.00 -1.09 -4.76 105.19 101.62 3d54 n GLY 34 Ca 0.43 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.36 3d54 n GLY 34 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d54 n TYR 35 N -2.57 -2.84 0.03 1.61 4.02 -1.25 -4.38 117.16 111.78 3d54 n TYR 35 Ca 0.00 1.11 -0.22 0.00 -0.01 0.00 0.00 57.90 58.78 3d54 n TYR 35 Cb 0.46 -3.68 -0.14 0.00 -0.02 0.00 0.00 39.34 35.96 3d54 n TYR 35 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3d54 h SER 36 N 0.62 0.49 -0.48 7.72 0.02 -1.83 -3.22 113.55 116.87 3d54 h SER 36 Ca -0.17 -0.95 0.00 0.00 -0.84 0.00 0.00 61.79 59.83 3d54 h SER 36 Cb 1.11 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.49 3d54 h SER 36 CO 0.30 1.83 0.00 1.41 -1.14 0.00 0.00 176.83 179.22 3d54 n HIS 37 N -3.55 1.03 0.00 3.45 8.25 -1.26 -1.87 115.22 121.26 3d54 n HIS 37 Ca -0.29 -0.42 0.00 0.00 -0.26 0.00 0.00 57.72 56.75 3d54 n HIS 37 Cb 1.05 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 32.00 3d54 n HIS 37 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3d54 n THR 38 N 0.80 0.00 -0.29 1.59 -2.24 -1.26 -4.89 114.28 107.99 3d54 n THR 38 Ca 0.19 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.05 3d54 n THR 38 Cb 0.64 0.01 0.24 0.00 -2.10 0.00 0.00 70.33 69.12 3d54 n THR 38 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3d54 h LYS 39 N 0.00 0.48 -0.07 -0.78 3.64 -1.75 -1.27 116.57 116.82 3d54 h LYS 39 Ca 0.00 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.17 3d54 h LYS 39 Cb 0.02 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3d54 h LYS 39 CO 0.00 0.32 -0.72 -0.22 -2.27 0.00 0.00 179.45 176.56 3d54 h LYS 40 N 0.50 0.34 -0.05 1.90 3.64 -1.86 -3.14 116.57 117.89 3d54 h LYS 40 Ca 0.48 -0.27 -0.17 0.00 -1.27 0.00 0.00 60.65 59.41 3d54 h LYS 40 Cb 0.78 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 3d54 h LYS 40 CO -0.43 0.92 -0.73 1.88 -2.27 0.00 0.00 179.45 178.82 3d54 h TYR 41 N 0.23 0.38 0.00 1.91 0.05 -1.71 -3.21 116.97 114.62 3d54 h TYR 41 Ca -0.03 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.58 3d54 h TYR 41 Cb 1.28 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.96 3d54 h TYR 41 CO 0.04 0.91 0.00 0.82 -1.05 0.00 0.00 178.16 178.87 3d54 h ILE 42 N 0.19 0.00 0.00 -2.88 2.04 -1.21 -2.59 117.51 113.05 3d54 h ILE 42 Ca -0.03 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 3d54 h ILE 42 Cb 1.29 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 3d54 h ILE 42 CO 0.12 0.00 -1.01 0.03 0.00 0.00 0.00 178.15 177.29 3d54 h ARG 43 N 0.00 0.00 0.00 2.37 3.08 -1.55 -3.31 114.38 114.97 3d54 h ARG 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d54 h ARG 43 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3d54 h ARG 43 CO 0.00 0.20 0.00 0.00 -1.07 0.00 0.00 179.97 179.10 3d54 h ARG 44 N 0.00 0.00 -6.32 0.04 3.08 -1.57 -3.45 114.38 106.16 3d54 h ARG 44 Ca -0.07 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.44 3d54 h ARG 44 Cb 1.31 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.32 3d54 h ARG 44 CO 0.03 0.00 0.22 -0.51 -1.07 0.00 0.00 179.97 178.64 3d54 s LEU 45 N -6.08 4.42 -0.09 3.04 1.43 -1.21 -5.00 118.68 115.19 3d54 s LEU 45 Ca 0.06 1.50 -0.29 0.00 -1.03 0.00 0.00 54.13 54.37 3d54 s LEU 45 Cb 0.06 -3.33 -0.05 0.00 0.03 0.00 0.00 46.19 42.90 3d54 s LEU 45 CO 0.63 -0.06 1.70 -2.16 0.23 0.00 0.00 176.35 176.69 3d54 s PRO 46 N 0.26 4.05 0.42 1.29 0.04 -1.26 -4.94 135.00 134.86 3d54 s PRO 46 Ca 0.42 2.12 0.05 0.00 0.04 0.00 0.00 61.00 63.63 3d54 s PRO 46 Cb -0.21 -4.03 0.07 0.00 0.04 0.00 0.00 34.50 30.38 3d54 s PRO 46 CO 0.24 -1.00 0.58 1.63 0.04 0.00 0.00 177.00 178.49 3d54 n LYS 47 N 7.35 0.58 0.00 4.56 5.02 -1.26 -0.82 118.16 133.59 3d54 n LYS 47 Ca 0.18 -2.06 0.00 0.00 -2.02 0.00 0.00 58.31 54.41 3d54 n LYS 47 Cb 0.43 -0.24 0.00 0.00 -0.02 0.00 0.00 35.03 35.21 3d54 n LYS 47 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3d54 n THR 48 N -1.99 0.00 -2.48 -0.18 -2.24 -1.25 -4.66 114.28 101.47 3d54 n THR 48 Ca 0.11 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.49 3d54 n THR 48 Cb 0.41 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.66 3d54 n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d54 n GLY 52 N 4.61 5.97 3.06 3.38 0.00 -1.26 -4.92 105.19 116.04 3d54 n GLY 52 Ca 0.00 -2.57 -0.24 0.00 0.00 0.00 0.00 46.02 43.21 3d54 n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3d54 s ASN 53 N -1.42 1.77 -0.48 1.61 0.02 -1.26 -5.04 114.94 110.14 3d54 s ASN 53 Ca 0.43 -0.29 -0.18 0.00 -1.02 0.00 0.00 52.86 51.80 3d54 s ASN 53 Cb 0.26 -0.60 0.05 0.00 0.02 0.00 0.00 41.25 40.98 3d54 s ASN 53 CO -0.20 0.09 0.53 0.00 0.02 0.00 0.00 177.10 177.53 3d54 s ALA 54 N 0.30 3.44 0.00 0.60 0.00 -1.26 -4.17 121.76 120.66 3d54 s ALA 54 Ca -0.07 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.12 3d54 s ALA 54 Cb -0.12 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.79 3d54 s ALA 54 CO 0.02 -1.84 0.00 0.41 0.00 0.00 0.00 175.76 174.36 3d54 n GLY 55 N 5.16 0.64 3.41 0.00 0.00 -1.25 -4.89 105.19 108.26 3d54 n GLY 55 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 3d54 n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d54 s VAL 56 N -0.22 2.53 -0.03 1.61 1.01 -1.26 -1.22 120.40 122.82 3d54 s VAL 56 Ca 0.00 -1.22 0.03 0.00 0.00 0.00 0.00 61.98 60.79 3d54 s VAL 56 Cb 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.36 3d54 s VAL 56 CO 0.00 0.39 -0.11 -0.69 0.00 0.00 0.00 175.10 174.69 3d54 s VAL 57 N -0.84 0.94 0.04 2.92 1.01 -0.54 -4.98 120.40 118.95 3d54 s VAL 57 Ca 0.13 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.37 3d54 s VAL 57 Cb -0.10 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.40 3d54 s VAL 57 CO 0.03 0.29 1.10 0.20 0.00 0.00 0.00 175.10 176.72 3d54 s ASN 58 N 0.20 7.21 -0.12 3.32 -0.87 -1.26 -1.72 114.94 121.71 3d54 s ASN 58 Ca -0.04 1.88 -0.08 0.00 -1.57 0.00 0.00 52.86 53.04 3d54 s ASN 58 Cb -0.10 -2.58 -0.05 0.00 -0.02 0.00 0.00 41.25 38.50 3d54 s ASN 58 CO 0.01 -0.37 -0.19 -0.11 -2.57 0.00 0.00 177.10 173.87 3d54 n LEU 59 N 3.81 1.22 -0.11 0.60 7.94 -0.97 -4.89 117.00 124.60 3d54 n LEU 59 Ca 0.07 0.20 0.02 0.00 -1.11 0.00 0.00 56.01 55.20 3d54 n LEU 59 Cb 0.48 -0.48 0.03 0.00 0.53 0.00 0.00 43.42 43.98 3d54 n LEU 59 CO 0.54 0.04 0.39 0.47 -1.11 0.00 0.00 177.39 177.73 3d54 n ASP 60 N -3.79 1.10 0.00 1.96 8.00 -0.95 -4.98 116.55 117.89 3d54 n ASP 60 Ca -0.22 -1.94 0.00 0.00 0.71 0.00 0.00 54.79 53.34 3d54 n ASP 60 Cb 0.57 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 3d54 n ASP 60 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3d54 n ASP 61 N -0.45 0.00 -0.13 -2.24 8.00 -1.26 -4.35 116.55 116.12 3d54 n ASP 61 Ca 0.03 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.27 3d54 n ASP 61 Cb 0.49 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.84 3d54 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d54 n TYR 62 N -1.67 0.00 -4.58 1.24 9.36 -1.26 -4.86 117.16 115.39 3d54 n TYR 62 Ca 0.00 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.95 3d54 n TYR 62 Cb 0.00 -0.96 -0.11 0.00 -0.63 0.00 0.00 39.34 37.64 3d54 n TYR 62 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3d54 s TYR 63 N -2.49 2.46 -0.20 2.98 2.02 -1.26 -2.82 117.35 118.03 3d54 s TYR 63 Ca -0.37 -0.58 -0.13 0.00 -0.37 0.00 0.00 57.07 55.62 3d54 s TYR 63 Cb 0.13 -1.58 0.06 0.00 -0.40 0.00 0.00 41.96 40.18 3d54 s TYR 63 CO 0.49 0.52 0.50 -1.54 -1.57 0.00 0.00 175.55 173.95 3d54 s SER 64 N -3.66 -0.63 -0.09 2.29 1.04 -0.06 -2.23 113.70 110.36 3d54 s SER 64 Ca 0.34 1.08 -0.17 0.00 0.48 0.00 0.00 55.95 57.68 3d54 s SER 64 Cb 0.06 0.99 -0.05 0.00 0.10 0.00 0.00 66.02 67.12 3d54 s SER 64 CO 0.17 -0.20 0.44 -0.69 0.98 0.00 0.00 173.24 173.93 3d54 s VAL 65 N 1.25 5.15 -0.19 5.02 1.01 -0.70 -1.65 120.40 130.29 3d54 s VAL 65 Ca -0.08 0.87 -0.04 0.00 0.00 0.00 0.00 61.98 62.74 3d54 s VAL 65 Cb -0.07 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 3d54 s VAL 65 CO -0.12 0.41 -0.04 0.00 0.00 0.00 0.00 175.10 175.34 3d54 s ALA 66 N 0.11 2.89 -0.00 5.51 0.00 0.21 -1.47 121.76 129.01 3d54 s ALA 66 Ca 0.24 -1.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 3d54 s ALA 66 Cb -0.15 -1.62 0.01 0.00 0.00 0.00 0.00 23.12 21.36 3d54 s ALA 66 CO 0.10 -0.10 0.23 -0.59 0.00 0.00 0.00 175.76 175.39 3d54 s PHE 67 N 0.93 -0.06 0.15 0.00 -0.71 -0.36 0.43 117.98 118.36 3d54 s PHE 67 Ca -0.00 0.04 -0.19 0.00 -1.04 0.00 0.00 56.93 55.75 3d54 s PHE 67 Cb -0.15 0.02 0.04 0.00 -1.21 0.00 0.00 43.02 41.73 3d54 s PHE 67 CO 0.01 -0.35 0.49 0.21 -1.34 0.00 0.00 175.22 174.24 3d54 s LYS 68 N -1.46 1.21 -0.04 1.99 2.20 -1.06 -4.69 119.74 117.89 3d54 s LYS 68 Ca -0.13 -0.67 0.02 0.00 -0.36 0.00 0.00 55.97 54.82 3d54 s LYS 68 Cb -0.06 0.52 0.01 0.00 -1.51 0.00 0.00 37.83 36.79 3d54 s LYS 68 CO 0.02 -0.50 -0.08 -1.50 -0.36 0.00 0.00 175.35 172.93 3d54 s ILE 69 N -3.80 0.74 0.28 5.43 2.07 -1.26 -2.27 121.20 122.38 3d54 s ILE 69 Ca 0.04 -0.30 0.09 0.00 -1.41 0.00 0.00 60.65 59.07 3d54 s ILE 69 Cb 0.00 -0.69 -0.05 0.00 0.13 0.00 0.00 42.46 41.85 3d54 s ILE 69 CO -0.10 0.25 -0.12 -0.70 -1.91 0.00 0.00 174.94 172.35 3d54 s GLU 70 N 0.47 1.59 -0.19 3.50 2.12 -0.84 -4.48 118.70 120.87 3d54 s GLU 70 Ca -0.07 -1.77 0.01 0.00 0.36 0.00 0.00 54.97 53.50 3d54 s GLU 70 Cb -0.11 -1.43 0.03 0.00 0.26 0.00 0.00 34.13 32.88 3d54 s GLU 70 CO 0.01 0.17 -0.16 -1.54 -0.54 0.00 0.00 175.26 173.21 3d54 s SER 71 N -3.47 3.27 -0.65 -1.70 1.04 -1.26 -2.29 113.70 108.64 3d54 s SER 71 Ca 0.29 -0.77 0.06 0.00 0.48 0.00 0.00 55.95 56.01 3d54 s SER 71 Cb 0.00 -1.38 0.21 0.00 0.10 0.00 0.00 66.02 64.96 3d54 s SER 71 CO 0.13 -0.07 0.61 1.41 0.98 0.00 0.00 173.24 176.30 3d54 n HIS 72 N 4.64 3.14 -0.04 5.02 8.25 -0.85 -4.85 115.22 130.53 3d54 n HIS 72 Ca -0.18 -4.17 -0.14 0.00 -0.26 0.00 0.00 57.72 52.97 3d54 n HIS 72 Cb 0.48 -0.55 -0.14 0.00 1.12 0.00 0.00 29.99 30.90 3d54 n HIS 72 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3d54 n ASN 73 N 1.43 1.27 0.10 0.41 3.02 -1.26 -4.12 115.26 116.11 3d54 n ASN 73 Ca 0.25 0.20 -0.13 0.00 -0.03 0.00 0.00 54.58 54.88 3d54 n ASN 73 Cb 0.39 -0.18 -0.08 0.00 -0.61 0.00 0.00 39.78 39.30 3d54 n ASN 73 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 3d54 h HIS 74 N 0.02 -0.27 0.00 3.10 3.86 -1.88 -2.12 115.15 117.86 3d54 h HIS 74 Ca -0.42 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 3d54 h HIS 74 Cb 2.05 0.09 0.00 0.00 1.06 0.00 0.00 27.41 30.61 3d54 h HIS 74 CO 0.03 0.10 0.00 -0.35 0.86 0.00 0.00 177.93 178.57 3d54 n PRO 75 N -5.04 0.21 0.17 2.45 -0.04 -1.26 -2.06 135.00 129.43 3d54 n PRO 75 Ca -0.09 0.39 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 3d54 n PRO 75 Cb 0.26 -1.87 0.21 0.00 -0.04 0.00 0.00 33.50 32.06 3d54 n PRO 75 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 3d54 h SER 76 N 0.00 0.00 0.12 3.54 0.02 -1.69 -2.73 113.55 112.81 3d54 h SER 76 Ca 0.00 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 3d54 h SER 76 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 3d54 h SER 76 CO 0.00 0.01 -0.06 0.00 -1.14 0.00 0.00 176.83 175.64 3d54 h ALA 77 N 2.16 -0.15 0.14 3.77 0.00 -0.79 -3.27 119.26 121.11 3d54 h ALA 77 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 3d54 h ALA 77 Cb 0.92 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3d54 h ALA 77 CO 0.00 -0.34 -0.07 -0.84 0.00 0.00 0.00 179.25 178.00 3d54 h ILE 78 N -0.65 1.01 -3.31 0.00 3.07 -1.64 -3.43 117.51 112.56 3d54 h ILE 78 Ca -0.02 -1.05 -0.52 0.00 1.55 0.00 0.00 64.86 64.82 3d54 h ILE 78 Cb 0.50 1.61 -0.38 0.00 -0.27 0.00 0.00 36.82 38.28 3d54 h ILE 78 CO 0.03 0.23 -0.78 -0.70 -1.05 0.00 0.00 178.15 175.88 3d54 s GLU 79 N -3.92 1.09 0.05 0.16 2.56 -1.03 -5.07 118.70 112.54 3d54 s GLU 79 Ca -0.14 -0.39 -0.30 0.00 0.00 0.00 0.00 54.97 54.13 3d54 s GLU 79 Cb 0.01 -1.86 -0.18 0.00 2.00 0.00 0.00 34.13 34.10 3d54 s GLU 79 CO 0.56 -0.47 1.44 -1.35 -0.56 0.00 0.00 175.26 174.89 3d54 h PRO 80 N 8.18 -0.79 0.25 4.30 0.11 -1.80 -2.51 132.00 139.74 3d54 h PRO 80 Ca -0.21 0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.94 3d54 h PRO 80 Cb 1.12 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3d54 h PRO 80 CO 0.36 -0.49 -0.12 -0.92 -0.21 0.00 0.00 178.00 176.62 3d54 h TYR 81 N -0.95 -0.31 0.00 0.65 3.20 -1.90 -2.05 116.97 115.61 3d54 h TYR 81 Ca -0.08 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.78 3d54 h TYR 81 Cb 0.67 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.04 3d54 h TYR 81 CO -0.01 -0.19 0.00 0.09 -1.64 0.00 0.00 178.16 176.41 3d54 n ASN 82 N -2.89 0.00 -0.12 -2.11 3.02 -1.26 -1.64 115.26 110.26 3d54 n ASN 82 Ca -0.04 -0.29 -0.25 0.00 -0.03 0.00 0.00 54.58 53.98 3d54 n ASN 82 Cb 0.13 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.20 3d54 n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d54 n GLY 83 N -0.46 -0.64 0.19 7.41 0.00 -0.94 -3.44 105.19 107.31 3d54 n GLY 83 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 3d54 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 h ALA 84 N -0.79 0.81 -0.14 4.61 0.00 -1.06 -1.68 119.26 121.01 3d54 h ALA 84 Ca -0.50 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 53.89 3d54 h ALA 84 Cb 1.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 3d54 h ALA 84 CO -0.30 0.69 0.07 0.00 0.00 0.00 0.00 179.25 179.71 3d54 h ALA 85 N 1.11 0.18 -0.59 0.00 0.00 -1.44 -1.92 119.26 116.60 3d54 h ALA 85 Ca 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3d54 h ALA 85 Cb 1.06 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 3d54 h ALA 85 CO 0.09 -0.27 0.33 1.15 0.00 0.00 0.00 179.25 180.55 3d54 h THR 86 N 0.12 1.18 -0.53 0.00 2.02 -1.56 -2.86 112.91 111.28 3d54 h THR 86 Ca 0.05 -0.45 0.01 0.00 0.77 0.00 0.00 66.41 66.79 3d54 h THR 86 Cb 0.09 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 3d54 h THR 86 CO -0.01 0.20 0.35 1.23 0.37 0.00 0.00 175.52 177.66 3d54 h GLY 87 N 0.88 0.75 1.82 2.16 0.00 -0.55 -2.24 103.07 105.88 3d54 h GLY 87 Ca 0.21 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 47.19 3d54 h GLY 87 CO -0.03 0.27 -0.27 -2.08 0.00 0.00 0.00 176.54 174.43 3d54 h VAL 88 N 0.72 1.24 0.09 4.60 2.07 -1.18 -3.07 116.25 120.72 3d54 h VAL 88 Ca 0.19 -1.14 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 3d54 h VAL 88 Cb -0.08 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3d54 h VAL 88 CO -0.04 0.34 -0.04 1.23 0.02 0.00 0.00 177.57 179.08 3d54 h GLY 89 N 0.98 -0.13 2.00 2.17 0.00 -1.28 -1.96 103.07 104.86 3d54 h GLY 89 Ca 0.03 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 3d54 h GLY 89 CO 0.04 -0.05 -0.10 -1.33 0.00 0.00 0.00 176.54 175.11 3d54 h GLY 90 N -0.33 0.00 0.88 4.60 0.00 -1.44 -2.93 103.07 103.84 3d54 h GLY 90 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.01 3d54 h GLY 90 CO 0.02 0.00 -1.79 4.51 0.00 0.00 0.00 176.54 179.28 3d54 n ILE 91 N -3.32 1.64 -0.02 2.60 0.13 -1.16 -3.47 119.36 115.76 3d54 n ILE 91 Ca -0.00 -0.77 -0.03 0.00 -1.10 0.00 0.00 62.75 60.85 3d54 n ILE 91 Cb 0.31 -1.17 0.22 0.00 -0.84 0.00 0.00 39.64 38.15 3d54 n ILE 91 CO 0.00 0.00 0.00 0.40 2.80 0.00 0.00 176.55 179.75 3d54 h ILE 92 N 0.01 1.24 -0.02 9.51 1.08 -1.24 -2.81 117.51 125.29 3d54 h ILE 92 Ca -0.32 -1.07 -0.19 0.00 -0.39 0.00 0.00 64.86 62.88 3d54 h ILE 92 Cb 2.02 1.13 -0.01 0.00 -3.07 0.00 0.00 36.82 36.90 3d54 h ILE 92 CO 0.08 0.36 -0.82 0.03 -0.69 0.00 0.00 178.15 177.10 3d54 h ARG 93 N 0.52 0.27 0.00 2.37 3.08 -1.66 -2.39 114.38 116.58 3d54 h ARG 93 Ca 0.09 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3d54 h ARG 93 Cb 0.53 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.65 3d54 h ARG 93 CO 0.03 0.95 0.00 -3.47 -1.07 0.00 0.00 179.97 176.41 3d54 n ASP 94 N -3.73 0.61 -0.07 7.04 -0.08 -1.07 -1.52 116.55 117.72 3d54 n ASP 94 Ca -0.04 0.65 -0.15 0.00 -1.51 0.00 0.00 54.79 53.74 3d54 n ASP 94 Cb 0.76 -0.78 -0.14 0.00 2.34 0.00 0.00 41.12 43.31 3d54 n ASP 94 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3d54 n VAL 95 N -2.17 1.57 0.21 5.18 0.31 -1.13 -4.25 118.33 118.05 3d54 n VAL 95 Ca 0.02 -0.70 0.07 0.00 -0.01 0.00 0.00 64.34 63.72 3d54 n VAL 95 Cb 0.22 -1.23 0.45 0.00 -0.91 0.00 0.00 33.84 32.38 3d54 n VAL 95 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3d54 h LEU 96 N 0.02 0.00 -0.62 7.52 5.85 -0.87 -2.60 115.31 124.61 3d54 h LEU 96 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 3d54 h LEU 96 Cb 2.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.06 3d54 h LEU 96 CO 0.02 0.30 0.00 0.00 -0.34 0.00 0.00 178.44 178.41 3d54 n ALA 97 N -2.32 1.38 0.72 1.25 0.00 -0.58 -0.72 120.51 120.24 3d54 n ALA 97 Ca -0.01 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.62 3d54 n ALA 97 Cb 0.41 -1.27 0.18 0.00 0.00 0.00 0.00 19.45 18.78 3d54 n ALA 97 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3d54 n MET 98 N -1.95 2.36 -0.90 0.00 2.81 -0.98 -4.52 117.12 113.94 3d54 n MET 98 Ca 0.01 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 53.88 3d54 n MET 98 Cb 0.12 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 3d54 n MET 98 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d54 n GLY 99 N 1.41 0.47 3.90 3.03 0.00 0.11 -3.02 105.19 111.08 3d54 n GLY 99 Ca 0.17 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 3d54 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 100 N -2.00 3.92 -0.22 4.61 0.00 -1.25 -4.83 121.76 121.98 3d54 s ALA 100 Ca 0.00 -0.71 -0.25 0.00 0.00 0.00 0.00 51.96 51.01 3d54 s ALA 100 Cb 0.00 -1.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 3d54 s ALA 100 CO 0.00 0.73 0.83 0.50 0.00 0.00 0.00 175.76 177.82 3d54 s ARG 101 N -2.13 4.22 -0.20 0.00 3.52 -0.98 -4.28 118.95 119.10 3d54 s ARG 101 Ca 0.31 0.97 -0.31 0.00 -0.13 0.00 0.00 55.73 56.56 3d54 s ARG 101 Cb -0.13 -3.63 -0.08 0.00 -1.56 0.00 0.00 34.95 29.55 3d54 s ARG 101 CO 0.21 -0.47 2.12 -2.30 -0.81 0.00 0.00 175.30 174.06 3d54 n PRO 102 N 5.80 1.87 -0.00 5.12 -0.02 -1.26 -2.68 135.00 143.82 3d54 n PRO 102 Ca 0.05 0.58 0.05 0.00 -2.02 0.00 0.00 63.50 62.16 3d54 n PRO 102 Cb 0.48 -2.89 -0.06 0.00 -0.02 0.00 0.00 33.50 31.00 3d54 n PRO 102 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3d54 n THR 103 N 6.85 0.00 -3.64 3.45 -2.24 0.13 -4.75 114.28 114.07 3d54 n THR 103 Ca 0.30 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.75 3d54 n THR 103 Cb 0.36 0.87 -0.07 0.00 -2.10 0.00 0.00 70.33 69.38 3d54 n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d54 s ALA 104 N -2.11 -2.00 0.08 6.98 0.00 -0.96 -4.33 121.76 119.42 3d54 s ALA 104 Ca 0.03 2.15 0.09 0.00 0.00 0.00 0.00 51.96 54.22 3d54 s ALA 104 Cb 0.08 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.70 3d54 s ALA 104 CO 0.43 -0.33 -0.23 0.96 0.00 0.00 0.00 175.76 176.59 3d54 s ILE 105 N 0.96 1.89 0.07 0.00 -4.36 0.06 0.08 121.20 119.90 3d54 s ILE 105 Ca -0.04 -1.46 0.07 0.00 -0.26 0.00 0.00 60.65 58.96 3d54 s ILE 105 Cb -0.05 -1.67 -0.03 0.00 1.25 0.00 0.00 42.46 41.97 3d54 s ILE 105 CO -0.11 0.13 -0.20 -0.36 0.24 0.00 0.00 174.94 174.64 3d54 s PHE 106 N -0.97 1.72 -0.21 1.37 0.08 0.57 -2.63 117.98 117.92 3d54 s PHE 106 Ca 0.09 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.75 3d54 s PHE 106 Cb -0.10 -0.99 0.05 0.00 -0.57 0.00 0.00 43.02 41.42 3d54 s PHE 106 CO 0.03 0.13 -0.05 0.16 -0.10 0.00 0.00 175.22 175.39 3d54 s ASP 107 N -1.47 3.49 -0.71 1.36 -4.77 -1.12 -0.39 116.67 113.07 3d54 s ASP 107 Ca 0.06 -1.00 -0.15 0.00 -3.30 0.00 0.00 52.55 48.16 3d54 s ASP 107 Cb -0.09 -1.07 0.17 0.00 -1.09 0.00 0.00 42.92 40.84 3d54 s ASP 107 CO 0.03 -0.22 0.67 -0.55 0.70 0.00 0.00 175.17 175.80 3d54 s SER 108 N 1.49 6.50 -0.12 2.11 0.15 0.16 -0.74 113.70 123.26 3d54 s SER 108 Ca -0.03 -2.24 -0.10 0.00 0.70 0.00 0.00 55.95 54.27 3d54 s SER 108 Cb -0.18 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 61.87 3d54 s SER 108 CO -0.07 -0.73 0.22 -0.76 1.20 0.00 0.00 173.24 173.09 3d54 s LEU 109 N 0.96 4.36 -0.28 3.45 1.02 -0.90 -1.64 118.68 125.64 3d54 s LEU 109 Ca 0.12 0.53 -0.03 0.00 0.02 0.00 0.00 54.13 54.78 3d54 s LEU 109 Cb -0.19 -2.22 0.09 0.00 0.02 0.00 0.00 46.19 43.90 3d54 s LEU 109 CO -0.03 0.31 0.11 -1.00 0.02 0.00 0.00 176.35 175.75 3d54 s HIS 110 N -0.58 0.71 0.25 0.29 3.76 -0.79 -1.82 115.29 117.11 3d54 s HIS 110 Ca 0.16 -1.04 0.05 0.00 -0.15 0.00 0.00 55.06 54.07 3d54 s HIS 110 Cb -0.13 -1.10 -0.02 0.00 1.11 0.00 0.00 32.58 32.45 3d54 s HIS 110 CO 0.05 -0.80 0.17 -1.33 -0.85 0.00 0.00 174.74 171.98 3d54 n MET 111 N 5.14 0.41 0.01 1.40 2.81 -1.17 -2.08 117.12 123.64 3d54 n MET 111 Ca -0.05 -2.37 -0.13 0.00 -1.81 0.00 0.00 57.70 53.34 3d54 n MET 111 Cb 0.43 1.74 -0.14 0.00 -0.71 0.00 0.00 33.22 34.54 3d54 n MET 111 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3d54 h SER 112 N 1.35 0.17 -5.12 7.83 4.64 -1.81 -1.63 113.55 118.98 3d54 h SER 112 Ca -0.18 -0.31 -0.08 0.00 -0.47 0.00 0.00 61.79 60.74 3d54 h SER 112 Cb 0.85 -0.06 -0.15 0.00 -0.31 0.00 0.00 62.40 62.73 3d54 h SER 112 CO 0.27 1.27 -0.31 -0.60 -0.87 0.00 0.00 176.83 176.60 3d54 s ARG 113 N -2.60 0.85 -1.00 4.77 3.52 -1.26 -4.56 118.95 118.67 3d54 s ARG 113 Ca -0.09 -0.80 -0.25 0.00 -0.13 0.00 0.00 55.73 54.46 3d54 s ARG 113 Cb 0.08 0.36 -0.11 0.00 -1.56 0.00 0.00 34.95 33.72 3d54 s ARG 113 CO 0.82 -0.28 2.05 0.96 -0.81 0.00 0.00 175.30 178.04 3d54 s ILE 114 N -3.47 3.33 -0.35 4.11 -4.36 -1.26 -4.89 121.20 114.31 3d54 s ILE 114 Ca 0.02 -0.42 -0.28 0.00 -0.26 0.00 0.00 60.65 59.71 3d54 s ILE 114 Cb 0.03 -4.00 -0.03 0.00 1.25 0.00 0.00 42.46 39.71 3d54 s ILE 114 CO -0.09 -0.65 1.98 -0.63 0.24 0.00 0.00 174.94 175.79 3d54 s ILE 115 N 12.38 3.30 0.55 8.37 1.01 -1.26 -4.85 121.20 140.70 3d54 s ILE 115 Ca 0.75 0.28 0.29 0.00 0.00 0.00 0.00 60.65 61.97 3d54 s ILE 115 Cb -0.06 -3.46 0.42 0.00 0.01 0.00 0.00 42.46 39.38 3d54 s ILE 115 CO 0.08 -0.33 1.93 0.44 0.00 0.00 0.00 174.94 177.05 3d54 h ASP 116 N 14.39 0.00 -0.09 3.58 3.32 -2.00 -1.83 116.42 133.80 3d54 h ASP 116 Ca -0.33 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 3d54 h ASP 116 Cb 1.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 3d54 h ASP 116 CO 1.05 0.00 -0.00 1.23 -1.72 0.00 0.00 179.24 179.80 3d54 h GLY 117 N 0.00 0.16 1.33 2.75 0.00 -1.95 -1.45 103.07 103.91 3d54 h GLY 117 Ca 0.30 -0.12 -0.15 0.00 0.00 0.00 0.00 47.33 47.36 3d54 h GLY 117 CO -0.00 0.11 -0.42 -2.22 0.00 0.00 0.00 176.54 174.01 3d54 h ILE 118 N -0.13 1.29 0.52 2.60 2.04 -1.53 -2.55 117.51 119.75 3d54 h ILE 118 Ca 0.02 -1.59 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 3d54 h ILE 118 Cb 0.35 1.50 0.01 0.00 -0.74 0.00 0.00 36.82 37.94 3d54 h ILE 118 CO 0.00 0.52 -0.25 0.40 0.00 0.00 0.00 178.15 178.82 3d54 h ILE 119 N 0.60 0.45 0.00 -0.67 2.04 -1.52 -2.43 117.51 115.98 3d54 h ILE 119 Ca 0.05 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3d54 h ILE 119 Cb 0.96 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 3d54 h ILE 119 CO 0.09 0.03 0.00 -0.33 0.00 0.00 0.00 178.15 177.94 3d54 h GLU 120 N -0.84 0.00 0.11 2.37 5.08 -1.29 -2.39 114.58 117.62 3d54 h GLU 120 Ca -0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3d54 h GLU 120 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3d54 h GLU 120 CO 0.12 0.00 -0.05 0.78 -1.00 0.00 0.00 179.01 178.85 3d54 h GLY 121 N 0.11 -0.16 1.95 -3.84 0.00 -1.00 -1.82 103.07 98.32 3d54 h GLY 121 Ca 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 3d54 h GLY 121 CO 0.00 -0.06 -0.48 -2.22 0.00 0.00 0.00 176.54 173.79 3d54 h ILE 122 N -0.62 1.34 0.42 2.60 2.04 -1.25 -3.16 117.51 118.88 3d54 h ILE 122 Ca -0.02 -1.65 -0.02 0.00 1.00 0.00 0.00 64.86 64.18 3d54 h ILE 122 Cb 0.49 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 3d54 h ILE 122 CO 0.03 0.48 -0.20 0.00 0.00 0.00 0.00 178.15 178.45 3d54 h ALA 123 N 1.47 -0.77 0.00 1.87 0.00 -1.44 0.25 119.26 120.64 3d54 h ALA 123 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3d54 h ALA 123 Cb 0.86 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3d54 h ALA 123 CO 0.06 -0.73 0.00 -0.44 0.00 0.00 0.00 179.25 178.15 3d54 h ASP 124 N -0.81 0.00 0.00 0.00 5.19 -1.43 -1.44 116.42 117.94 3d54 h ASP 124 Ca -0.06 0.00 -0.43 0.00 -0.62 0.00 0.00 57.03 55.92 3d54 h ASP 124 Cb 0.43 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.87 3d54 h ASP 124 CO 0.09 0.00 -2.41 0.00 -3.12 0.00 0.00 179.24 173.80 3d54 n TYR 125 N -2.42 0.06 -0.32 4.55 4.19 -1.18 -3.92 117.16 118.11 3d54 n TYR 125 Ca -0.02 0.03 -0.03 0.00 3.31 0.00 0.00 57.90 61.19 3d54 n TYR 125 Cb 0.05 -0.98 0.11 0.00 0.49 0.00 0.00 39.34 39.01 3d54 n TYR 125 CO 0.00 0.00 0.00 0.78 0.91 0.00 0.00 176.86 178.55 3d54 h GLY 126 N -1.00 1.32 1.94 2.98 0.00 -0.27 -2.79 103.07 105.25 3d54 h GLY 126 Ca -0.66 -0.58 -0.14 0.00 0.00 0.00 0.00 47.33 45.95 3d54 h GLY 126 CO -0.40 0.56 -0.65 3.43 0.00 0.00 0.00 176.54 179.48 3d54 h ASN 127 N 1.24 0.07 1.41 0.19 2.35 -1.46 -3.00 115.58 116.38 3d54 h ASN 127 Ca 0.32 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3d54 h ASN 127 Cb -0.00 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.35 3d54 h ASN 127 CO -0.05 0.70 0.00 0.28 -1.65 0.00 0.00 177.43 176.70 3d54 h SER 128 N 0.04 0.00 -0.02 5.81 0.02 -1.62 -3.01 113.55 114.78 3d54 h SER 128 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3d54 h SER 128 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 3d54 h SER 128 CO 0.09 0.00 -0.11 2.30 -1.14 0.00 0.00 176.83 177.97 3d54 n ILE 129 N -2.79 0.00 -2.77 3.27 -5.35 -1.13 -4.77 119.36 105.82 3d54 n ILE 129 Ca 0.03 -0.44 -0.14 0.00 -0.27 0.00 0.00 62.75 61.93 3d54 n ILE 129 Cb 0.40 1.33 0.03 0.00 -1.74 0.00 0.00 39.64 39.65 3d54 n ILE 129 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d54 n GLY 130 N 1.08 -0.04 3.24 3.28 0.00 -1.14 -4.92 105.19 106.69 3d54 n GLY 130 Ca 0.10 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3d54 n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d54 s VAL 131 N -2.96 3.28 0.17 1.61 1.01 -1.14 -4.67 120.40 117.69 3d54 s VAL 131 Ca 0.20 -0.98 -0.31 0.00 0.00 0.00 0.00 61.98 60.89 3d54 s VAL 131 Cb -0.09 -2.71 -0.10 0.00 0.00 0.00 0.00 36.38 33.48 3d54 s VAL 131 CO 0.25 0.10 1.52 -2.16 0.00 0.00 0.00 175.10 174.81 3d54 s PRO 132 N 1.37 4.24 -1.02 2.72 0.04 -1.26 -4.56 135.00 136.54 3d54 s PRO 132 Ca -0.00 2.30 -0.16 0.00 0.04 0.00 0.00 61.00 63.18 3d54 s PRO 132 Cb -0.17 -3.16 0.16 0.00 0.04 0.00 0.00 34.50 31.36 3d54 s PRO 132 CO -0.01 -0.55 1.19 0.99 0.04 0.00 0.00 177.00 178.66 3d54 s THR 133 N 0.96 4.97 -0.28 1.26 2.01 -0.97 -0.76 115.64 122.83 3d54 s THR 133 Ca 0.67 -2.09 0.02 0.00 0.31 0.00 0.00 61.69 60.61 3d54 s THR 133 Cb -0.42 -4.78 0.28 0.00 0.01 0.00 0.00 72.50 67.59 3d54 s THR 133 CO 0.33 -1.48 1.31 1.33 -0.69 0.00 0.00 174.62 175.41 3d54 n VAL 134 N 4.93 1.76 0.00 3.82 0.24 -1.08 -4.42 118.33 123.59 3d54 n VAL 134 Ca 0.27 -0.74 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 3d54 n VAL 134 Cb 0.46 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 3d54 n VAL 134 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d54 n GLY 135 N -0.09 3.44 0.00 7.63 0.00 -1.26 -4.25 105.19 110.66 3d54 n GLY 135 Ca 0.22 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3d54 n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d54 n GLY 136 N -1.84 -0.74 3.85 -0.02 0.00 -1.26 -2.81 105.19 102.37 3d54 n GLY 136 Ca 0.00 -1.11 -0.22 0.00 0.00 0.00 0.00 46.02 44.70 3d54 n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d54 s GLU 137 N -2.00 3.02 -0.44 1.61 2.02 0.08 -4.92 118.70 118.07 3d54 s GLU 137 Ca 0.00 -1.00 0.07 0.00 0.02 0.00 0.00 54.97 54.07 3d54 s GLU 137 Cb 0.00 -2.62 0.27 0.00 0.10 0.00 0.00 34.13 31.88 3d54 s GLU 137 CO 0.00 0.41 0.79 -0.11 0.02 0.00 0.00 175.26 176.37 3d54 n LEU 138 N -1.19 -1.34 -4.48 1.80 7.94 -1.24 -2.12 117.00 116.37 3d54 n LEU 138 Ca -0.08 -4.04 -0.43 0.00 -1.11 0.00 0.00 56.01 50.35 3d54 n LEU 138 Cb 0.58 0.78 -0.03 0.00 0.53 0.00 0.00 43.42 45.27 3d54 n LEU 138 CO 0.43 2.07 0.92 -0.13 -1.11 0.00 0.00 177.39 179.58 3d54 s ARG 139 N -0.39 3.23 -0.31 1.96 1.81 -0.76 -4.89 118.95 119.61 3d54 s ARG 139 Ca 0.32 -0.89 -0.14 0.00 -1.72 0.00 0.00 55.73 53.31 3d54 s ARG 139 Cb 0.24 -4.41 -0.03 0.00 -0.45 0.00 0.00 34.95 30.30 3d54 s ARG 139 CO -0.15 -1.90 0.31 0.42 -0.68 0.00 0.00 175.30 173.30 3d54 s ILE 140 N 4.24 5.21 -0.08 1.52 -1.09 -1.26 -3.01 121.20 126.72 3d54 s ILE 140 Ca 0.28 0.18 -0.23 0.00 -2.23 0.00 0.00 60.65 58.64 3d54 s ILE 140 Cb -0.12 -3.71 0.05 0.00 -1.58 0.00 0.00 42.46 37.10 3d54 s ILE 140 CO 0.07 0.05 0.54 -0.55 -1.23 0.00 0.00 174.94 173.82 3d54 s SER 141 N 1.71 -0.51 0.00 3.58 0.15 -0.61 -1.64 113.70 116.39 3d54 s SER 141 Ca 0.11 0.64 0.11 0.00 0.70 0.00 0.00 55.95 57.51 3d54 s SER 141 Cb -0.16 0.63 0.66 0.00 -1.71 0.00 0.00 66.02 65.44 3d54 s SER 141 CO 0.11 -0.46 1.17 -1.54 1.20 0.00 0.00 173.24 173.73 3d54 n SER 142 N 1.49 0.00 0.18 5.45 3.41 -1.26 -2.25 113.62 120.64 3d54 n SER 142 Ca -0.18 -0.97 0.11 0.00 -0.26 0.00 0.00 58.87 57.56 3d54 n SER 142 Cb 0.56 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.63 3d54 n SER 142 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3d54 h LEU 143 N 0.00 0.00 -2.14 1.04 3.38 -1.96 -3.26 115.31 112.37 3d54 h LEU 143 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d54 h LEU 143 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3d54 h LEU 143 CO 0.00 0.06 0.00 -1.22 0.09 0.00 0.00 178.44 177.37 3d54 n TYR 144 N -3.01 0.61 -0.03 1.13 4.01 -0.95 -4.75 117.16 114.16 3d54 n TYR 144 Ca 0.03 -0.31 -0.09 0.00 -0.16 0.00 0.00 57.90 57.37 3d54 n TYR 144 Cb 0.56 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.56 3d54 n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3d54 h ALA 145 N 4.29 -0.25 -0.60 -0.72 0.00 -1.74 0.27 119.26 120.51 3d54 h ALA 145 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d54 h ALA 145 Cb 0.85 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3d54 h ALA 145 CO 0.00 -0.74 0.00 0.72 0.00 0.00 0.00 179.25 179.23 3d54 n HIS 146 N -5.40 1.25 -3.20 0.00 8.25 -1.26 -4.62 115.22 110.24 3d54 n HIS 146 Ca -0.02 -0.52 -0.13 0.00 -0.26 0.00 0.00 57.72 56.80 3d54 n HIS 146 Cb 0.31 -0.18 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 3d54 n HIS 146 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3d54 s ASN 147 N -0.88 0.12 0.36 0.41 3.04 0.96 -4.86 114.94 114.08 3d54 s ASN 147 Ca 0.46 -1.75 -0.13 0.00 0.04 0.00 0.00 52.86 51.48 3d54 s ASN 147 Cb 0.28 0.95 -0.08 0.00 -1.54 0.00 0.00 41.25 40.86 3d54 s ASN 147 CO 0.24 -0.18 0.75 -2.16 -3.04 0.00 0.00 177.10 172.71 3d54 s PRO 148 N 1.12 3.91 -0.07 0.43 0.04 -1.19 -4.66 135.00 134.58 3d54 s PRO 148 Ca 0.23 0.59 0.06 0.00 0.04 0.00 0.00 61.00 61.91 3d54 s PRO 148 Cb -0.07 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 32.06 3d54 s PRO 148 CO -0.07 0.07 -0.25 -0.51 0.04 0.00 0.00 177.00 176.29 3d54 s LEU 149 N -3.36 2.07 -0.29 -3.56 1.43 -0.88 -4.72 118.68 109.37 3d54 s LEU 149 Ca 0.53 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 53.10 3d54 s LEU 149 Cb -0.10 -1.37 0.09 0.00 0.03 0.00 0.00 46.19 44.84 3d54 s LEU 149 CO 0.23 0.22 0.08 -0.69 0.23 0.00 0.00 176.35 176.43 3d54 s VAL 150 N -0.05 0.84 -0.37 -1.59 1.01 -1.26 -1.89 120.40 117.10 3d54 s VAL 150 Ca -0.07 -1.27 -0.08 0.00 0.00 0.00 0.00 61.98 60.56 3d54 s VAL 150 Cb -0.15 -1.58 0.05 0.00 0.00 0.00 0.00 36.38 34.71 3d54 s VAL 150 CO 0.05 -0.59 0.18 0.20 0.00 0.00 0.00 175.10 174.94 3d54 s ASN 151 N 1.65 5.49 -0.17 3.32 -0.87 -0.65 -2.00 114.94 121.70 3d54 s ASN 151 Ca 0.08 -1.28 -0.11 0.00 -1.57 0.00 0.00 52.86 49.97 3d54 s ASN 151 Cb -0.17 -1.93 -0.05 0.00 -0.02 0.00 0.00 41.25 39.08 3d54 s ASN 151 CO -0.22 -0.42 0.21 0.68 -2.57 0.00 0.00 177.10 174.78 3d54 s VAL 152 N 1.42 5.36 -0.29 1.60 -7.23 -0.97 0.36 120.40 120.66 3d54 s VAL 152 Ca 0.01 0.36 0.00 0.00 -1.81 0.00 0.00 61.98 60.55 3d54 s VAL 152 Cb -0.21 -3.54 0.06 0.00 0.56 0.00 0.00 36.38 33.25 3d54 s VAL 152 CO 0.03 0.44 -0.04 -0.22 -0.31 0.00 0.00 175.10 175.00 3d54 s LEU 153 N 0.22 3.79 0.10 1.32 0.20 0.48 -1.98 118.68 122.81 3d54 s LEU 153 Ca 0.13 -1.39 -0.08 0.00 0.69 0.00 0.00 54.13 53.48 3d54 s LEU 153 Cb -0.12 -1.65 -0.06 0.00 -0.43 0.00 0.00 46.19 43.94 3d54 s LEU 153 CO 0.02 -0.25 0.39 0.00 -0.29 0.00 0.00 176.35 176.22 3d54 s ALA 154 N 1.17 3.74 0.03 5.97 0.00 -0.96 -0.31 121.76 131.40 3d54 s ALA 154 Ca -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.48 3d54 s ALA 154 Cb -0.20 -2.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.68 3d54 s ALA 154 CO -0.03 0.60 -0.06 0.00 0.00 0.00 0.00 175.76 176.27 3d54 s ALA 155 N -1.49 0.40 0.01 0.00 0.00 0.11 -2.55 121.76 118.25 3d54 s ALA 155 Ca 0.36 -0.60 -0.12 0.00 0.00 0.00 0.00 51.96 51.59 3d54 s ALA 155 Cb -0.13 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.05 3d54 s ALA 155 CO 0.20 -0.04 0.26 0.20 0.00 0.00 0.00 175.76 176.38 3d54 s GLY 156 N -1.27 -0.08 0.01 0.00 0.00 0.17 0.17 107.32 106.32 3d54 s GLY 156 Ca -0.09 0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.70 3d54 s GLY 156 CO -0.00 -0.12 0.07 0.54 0.00 0.00 0.00 173.10 173.59 3d54 s VAL 157 N -1.83 4.64 0.01 1.40 0.11 -1.09 0.67 120.40 124.30 3d54 s VAL 157 Ca -0.10 -0.48 -0.23 0.00 -2.93 0.00 0.00 61.98 58.23 3d54 s VAL 157 Cb -0.04 -3.13 0.05 0.00 -1.53 0.00 0.00 36.38 31.73 3d54 s VAL 157 CO 0.01 0.32 0.53 0.54 -3.33 0.00 0.00 175.10 173.17 3d54 s VAL 158 N -1.21 0.03 0.48 2.04 0.11 -0.66 -2.31 120.40 118.88 3d54 s VAL 158 Ca 0.23 -0.22 -0.19 0.00 -2.93 0.00 0.00 61.98 58.88 3d54 s VAL 158 Cb -0.12 -0.91 -0.09 0.00 -1.53 0.00 0.00 36.38 33.72 3d54 s VAL 158 CO 0.15 -0.12 0.97 -0.13 -3.33 0.00 0.00 175.10 172.64 3d54 s ARG 159 N -1.85 4.06 0.42 1.54 0.52 -1.26 -0.88 118.95 121.50 3d54 s ARG 159 Ca -0.09 1.06 0.24 0.00 -0.52 0.00 0.00 55.73 56.42 3d54 s ARG 159 Cb -0.01 -2.15 0.43 0.00 0.52 0.00 0.00 34.95 33.74 3d54 s ARG 159 CO 0.03 -0.18 1.64 -0.91 0.02 0.00 0.00 175.30 175.91 3d54 h ASN 160 N 1.40 0.00 -0.31 0.23 2.35 -1.84 -3.08 115.58 114.33 3d54 h ASN 160 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 3d54 h ASN 160 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 3d54 h ASN 160 CO 0.61 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.49 3d54 n ASP 161 N -3.02 1.97 0.00 5.81 5.75 -1.26 -3.56 116.55 122.24 3d54 n ASP 161 Ca 0.04 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 3d54 n ASP 161 Cb 0.51 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 3d54 n ASP 161 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 3d54 n MET 162 N 0.55 1.01 -2.09 0.11 2.81 -1.17 -5.10 117.12 113.24 3d54 n MET 162 Ca 0.14 -0.82 -0.39 0.00 -1.81 0.00 0.00 57.70 54.83 3d54 n MET 162 Cb 0.33 -0.70 -0.00 0.00 -0.71 0.00 0.00 33.22 32.14 3d54 n MET 162 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3d54 s LEU 163 N -0.35 4.13 -0.01 4.03 0.20 -1.18 -4.86 118.68 120.64 3d54 s LEU 163 Ca 0.00 2.56 0.03 0.00 0.69 0.00 0.00 54.13 57.41 3d54 s LEU 163 Cb 0.00 -4.02 -0.03 0.00 -0.43 0.00 0.00 46.19 41.70 3d54 s LEU 163 CO 0.00 -0.92 -0.08 -0.69 -0.29 0.00 0.00 176.35 174.37 3d54 s VAL 164 N -1.34 3.55 0.81 1.68 1.01 -1.17 -5.03 120.40 119.92 3d54 s VAL 164 Ca 0.60 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 3d54 s VAL 164 Cb -0.36 -2.51 0.19 0.00 0.00 0.00 0.00 36.38 33.70 3d54 s VAL 164 CO 0.45 0.45 1.02 -0.67 0.00 0.00 0.00 175.10 176.34 3d54 n ASP 165 N 1.75 -0.29 -2.18 3.32 4.64 -1.26 -4.67 116.55 117.86 3d54 n ASP 165 Ca -0.16 -1.31 0.01 0.00 -1.38 0.00 0.00 54.79 51.94 3d54 n ASP 165 Cb 0.53 -0.80 0.04 0.00 -1.04 0.00 0.00 41.12 39.84 3d54 n ASP 165 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 3d54 n SER 166 N -3.83 1.49 -3.51 1.67 3.41 -1.26 -2.89 113.62 108.69 3d54 n SER 166 Ca 0.13 -2.15 -0.14 0.00 -0.26 0.00 0.00 58.87 56.45 3d54 n SER 166 Cb 0.46 -0.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 3d54 n SER 166 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3d54 s LYS 167 N -2.22 1.13 -0.28 4.33 -2.85 -1.26 -4.72 119.74 113.87 3d54 s LYS 167 Ca 0.31 -0.25 -0.23 0.00 -1.00 0.00 0.00 55.97 54.80 3d54 s LYS 167 Cb 0.35 0.52 -0.00 0.00 -2.06 0.00 0.00 37.83 36.64 3d54 s LYS 167 CO -0.09 -0.44 0.77 0.00 0.10 0.00 0.00 175.35 175.70 3d54 s ALA 168 N -2.76 3.58 -0.10 0.59 0.00 0.22 -4.53 121.76 118.76 3d54 s ALA 168 Ca -0.04 -0.34 -0.16 0.00 0.00 0.00 0.00 51.96 51.43 3d54 s ALA 168 Cb -0.00 -3.25 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 3d54 s ALA 168 CO -0.04 -1.05 0.48 0.66 0.00 0.00 0.00 175.76 175.81 3d54 h SER 169 N 7.95 -0.05 -3.24 0.00 4.64 -1.88 -3.41 113.55 117.57 3d54 h SER 169 Ca -0.24 -0.46 -0.52 0.00 -0.47 0.00 0.00 61.79 60.10 3d54 h SER 169 Cb 1.10 0.01 -0.16 0.00 -0.31 0.00 0.00 62.40 63.04 3d54 h SER 169 CO 0.86 0.66 -0.77 0.00 -0.87 0.00 0.00 176.83 176.71 3d54 s ARG 170 N -2.22 1.36 0.55 4.77 1.70 -1.26 -5.03 118.95 118.82 3d54 s ARG 170 Ca -0.10 -1.52 -0.16 0.00 -0.47 0.00 0.00 55.73 53.48 3d54 s ARG 170 Cb -0.01 -1.35 -0.06 0.00 -0.57 0.00 0.00 34.95 32.95 3d54 s ARG 170 CO 0.37 0.26 1.01 -2.14 -1.08 0.00 0.00 175.30 173.71 3d54 s PRO 171 N -3.15 3.75 0.00 3.89 0.02 -1.26 -4.05 135.00 134.20 3d54 s PRO 171 Ca 0.20 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.20 3d54 s PRO 171 Cb -0.04 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.37 3d54 s PRO 171 CO 0.08 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.72 3d54 n GLY 172 N -1.63 0.66 3.93 0.52 0.00 -0.72 -5.03 105.19 102.93 3d54 n GLY 172 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3d54 n GLY 172 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d54 s GLN 173 N -0.96 3.52 0.06 1.61 -0.21 -1.26 -4.52 119.66 117.90 3d54 s GLN 173 Ca 0.00 -0.26 0.08 0.00 0.02 0.00 0.00 55.36 55.20 3d54 s GLN 173 Cb 0.00 -2.67 -0.03 0.00 1.00 0.00 0.00 33.01 31.31 3d54 s GLN 173 CO 0.00 0.18 -0.22 0.14 -2.12 0.00 0.00 175.29 173.27 3d54 s VAL 174 N -2.24 1.79 -0.24 1.09 -7.23 0.31 -0.66 120.40 113.23 3d54 s VAL 174 Ca 0.41 -1.33 -0.08 0.00 -1.81 0.00 0.00 61.98 59.16 3d54 s VAL 174 Cb -0.10 -1.57 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 3d54 s VAL 174 CO 0.34 0.17 0.10 -0.63 -0.31 0.00 0.00 175.10 174.77 3d54 s ILE 175 N -0.89 4.66 -0.15 -0.62 1.01 -0.48 -1.25 121.20 123.48 3d54 s ILE 175 Ca 0.08 -0.06 -0.05 0.00 0.00 0.00 0.00 60.65 60.62 3d54 s ILE 175 Cb -0.09 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 3d54 s ILE 175 CO 0.03 0.35 0.03 -0.69 0.00 0.00 0.00 174.94 174.65 3d54 s VAL 176 N 1.33 4.49 -0.18 2.92 1.01 0.99 -1.98 120.40 128.98 3d54 s VAL 176 Ca 0.06 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 3d54 s VAL 176 Cb -0.15 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 3d54 s VAL 176 CO 0.05 0.50 -0.00 -0.63 0.00 0.00 0.00 175.10 175.01 3d54 s ILE 177 N 0.08 4.08 0.28 2.22 -1.09 -1.04 -0.96 121.20 124.78 3d54 s ILE 177 Ca 0.03 -0.28 -0.02 0.00 -2.23 0.00 0.00 60.65 58.16 3d54 s ILE 177 Cb -0.13 -2.82 -0.02 0.00 -1.58 0.00 0.00 42.46 37.91 3d54 s ILE 177 CO 0.01 0.46 0.33 0.72 -1.23 0.00 0.00 174.94 175.23 3d54 s PHE 178 N 0.63 1.14 -0.06 3.97 -0.71 -1.01 -2.50 117.98 119.43 3d54 s PHE 178 Ca -0.01 -1.31 0.00 0.00 -1.04 0.00 0.00 56.93 54.57 3d54 s PHE 178 Cb -0.14 -0.32 0.00 0.00 -1.21 0.00 0.00 43.02 41.35 3d54 s PHE 178 CO 0.02 -0.91 0.00 0.41 -1.34 0.00 0.00 175.22 173.40 3d54 n GLY 179 N -0.46 0.09 2.29 1.99 0.00 -0.88 -1.41 105.19 106.81 3d54 n GLY 179 Ca 0.02 -1.88 -0.19 0.00 0.00 0.00 0.00 46.02 43.97 3d54 n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d54 n GLY 180 N 0.00 -2.57 3.80 -0.02 0.00 -0.81 -2.28 105.19 103.31 3d54 n GLY 180 Ca 0.00 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.18 3d54 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 181 N -3.08 3.06 -0.48 4.61 0.00 -1.26 -4.80 121.76 119.82 3d54 s ALA 181 Ca 0.46 0.56 -0.14 0.00 0.00 0.00 0.00 51.96 52.84 3d54 s ALA 181 Cb -0.04 -3.21 0.09 0.00 0.00 0.00 0.00 23.12 19.95 3d54 s ALA 181 CO 0.35 -0.05 0.39 0.99 0.00 0.00 0.00 175.76 177.44 3d54 s THR 182 N -1.86 4.95 0.00 0.00 2.01 -0.17 -4.84 115.64 115.72 3d54 s THR 182 Ca 0.59 -1.28 0.00 0.00 0.31 0.00 0.00 61.69 61.32 3d54 s THR 182 Cb -0.16 -4.04 0.00 0.00 0.01 0.00 0.00 72.50 68.31 3d54 s THR 182 CO 0.21 -0.64 0.00 0.61 -0.69 0.00 0.00 174.62 174.11 3d54 n GLY 183 N 5.13 6.11 3.43 4.40 0.00 -1.26 -3.11 105.19 119.90 3d54 n GLY 183 Ca -0.12 -1.85 -0.44 0.00 0.00 0.00 0.00 46.02 43.60 3d54 n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d54 s ARG 184 N 1.60 3.70 0.00 1.61 0.52 -1.26 -4.65 118.95 120.47 3d54 s ARG 184 Ca 0.00 -2.03 0.00 0.00 -0.52 0.00 0.00 55.73 53.18 3d54 s ARG 184 Cb 0.00 -4.87 0.00 0.00 0.52 0.00 0.00 34.95 30.60 3d54 s ARG 184 CO 0.00 -1.69 0.40 -0.25 0.02 0.00 0.00 175.30 173.77 3d54 n ASP 185 N 5.95 0.77 -3.17 0.23 8.00 -1.26 -5.01 116.55 122.06 3d54 n ASP 185 Ca 0.25 -1.05 0.05 0.00 0.71 0.00 0.00 54.79 54.74 3d54 n ASP 185 Cb 0.47 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 3d54 n ASP 185 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3d54 s GLY 186 N -0.05 0.01 0.00 0.44 0.00 -1.26 -4.25 107.32 102.21 3d54 s GLY 186 Ca 0.00 3.28 0.00 0.00 0.00 0.00 0.00 44.72 48.00 3d54 s GLY 186 CO 0.00 3.76 0.00 2.41 0.00 0.00 0.00 173.10 179.27 3d54 n THR 203 N 5.18 0.00 0.10 0.90 -1.04 -1.26 -4.84 114.28 113.32 3d54 n THR 203 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3d54 n THR 203 Cb 0.55 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.06 3d54 n THR 203 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3d54 n LYS 204 N 0.00 0.00 -1.47 -2.82 5.02 -1.26 -4.97 118.16 112.67 3d54 n LYS 204 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 3d54 n LYS 204 Cb 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.09 3d54 n LYS 204 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3d54 n LEU 205 N -3.13 6.50 0.00 -0.35 7.94 -1.26 -4.28 117.00 122.42 3d54 n LEU 205 Ca 0.00 -4.31 0.00 0.00 -1.11 0.00 0.00 56.01 50.59 3d54 n LEU 205 Cb 0.00 -0.75 0.00 0.00 0.53 0.00 0.00 43.42 43.20 3d54 n LEU 205 CO 0.00 1.60 0.00 -1.54 -1.11 0.00 0.00 177.39 176.34 3d54 n SER 206 N -0.90 0.00 -4.64 1.96 3.41 -1.26 -3.99 113.62 108.19 3d54 n SER 206 Ca 0.55 -0.04 -0.35 0.00 -0.26 0.00 0.00 58.87 58.76 3d54 n SER 206 Cb 0.87 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.72 3d54 n SER 206 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3d54 s ILE 207 N 0.00 5.05 -0.04 -1.33 -4.36 -1.26 -4.96 121.20 114.30 3d54 s ILE 207 Ca 0.00 0.07 -0.09 0.00 -0.26 0.00 0.00 60.65 60.37 3d54 s ILE 207 Cb 0.00 -3.32 0.01 0.00 1.25 0.00 0.00 42.46 40.41 3d54 s ILE 207 CO 0.00 0.40 0.20 0.00 0.24 0.00 0.00 174.94 175.79 3d54 s GLN 208 N 0.73 0.40 -0.08 0.37 -2.07 -1.26 -5.01 119.66 112.74 3d54 s GLN 208 Ca 0.06 -0.01 -0.06 0.00 -1.82 0.00 0.00 55.36 53.53 3d54 s GLN 208 Cb -0.13 0.18 -0.04 0.00 -1.09 0.00 0.00 33.01 31.93 3d54 s GLN 208 CO 0.02 -0.08 0.17 0.08 -1.32 0.00 0.00 175.29 174.16 3d54 s VAL 209 N -0.61 5.45 0.27 3.63 1.01 -1.26 -4.86 120.40 124.04 3d54 s VAL 209 Ca -0.07 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 3d54 s VAL 209 Cb -0.04 -3.46 -0.08 0.00 0.00 0.00 0.00 36.38 32.79 3d54 s VAL 209 CO 0.01 0.52 0.71 -0.83 0.00 0.00 0.00 175.10 175.51 3d54 s GLY 210 N -1.31 2.44 -0.86 4.51 0.00 -1.26 -4.98 107.32 105.85 3d54 s GLY 210 Ca 0.19 0.05 -0.03 0.00 0.00 0.00 0.00 44.72 44.94 3d54 s GLY 210 CO 0.09 0.31 0.74 -0.35 0.00 0.00 0.00 173.10 173.89 3d54 s ASP 211 N -2.02 5.98 0.66 1.64 3.68 -1.26 -4.95 116.67 120.41 3d54 s ASP 211 Ca 0.49 -3.52 0.41 0.00 2.13 0.00 0.00 52.55 52.06 3d54 s ASP 211 Cb -0.13 -1.93 2.22 0.00 -1.45 0.00 0.00 42.92 41.63 3d54 s ASP 211 CO 0.19 -0.24 2.26 1.55 0.13 0.00 0.00 175.17 179.06 3d54 h PRO 212 N 6.31 0.00 -0.11 4.34 0.13 -1.92 -1.60 132.00 139.15 3d54 h PRO 212 Ca 0.13 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 3d54 h PRO 212 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3d54 h PRO 212 CO 0.83 0.00 -0.35 0.35 -0.23 0.00 0.00 178.00 178.60 3d54 h PHE 213 N 0.00 0.58 0.00 1.56 3.57 -1.92 -2.49 116.94 118.23 3d54 h PHE 213 Ca 0.00 -0.23 -0.06 0.00 3.53 0.00 0.00 57.97 61.21 3d54 h PHE 213 Cb 0.17 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 3d54 h PHE 213 CO 0.00 0.96 -0.29 0.00 -2.23 0.00 0.00 178.31 176.75 3d54 h ALA 214 N 0.50 1.42 -0.34 2.41 0.00 -1.73 -2.19 119.26 119.33 3d54 h ALA 214 Ca -0.01 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 3d54 h ALA 214 Cb 0.97 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3d54 h ALA 214 CO 0.08 0.37 -0.26 1.49 0.00 0.00 0.00 179.25 180.93 3d54 h GLU 215 N 0.00 0.69 -0.27 0.00 4.57 -1.30 0.13 114.58 118.41 3d54 h GLU 215 Ca -0.00 -0.29 -0.17 0.00 -1.18 0.00 0.00 59.36 57.72 3d54 h GLU 215 Cb 0.55 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.11 3d54 h GLU 215 CO 0.04 0.88 -0.53 -0.22 -1.18 0.00 0.00 179.01 178.00 3d54 h LYS 216 N 0.60 0.78 0.00 1.92 1.63 -0.97 -1.09 116.57 119.44 3d54 h LYS 216 Ca 0.08 -0.48 -0.00 0.00 -0.85 0.00 0.00 60.65 59.40 3d54 h LYS 216 Cb 0.75 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.43 3d54 h LYS 216 CO 0.06 1.11 -0.02 0.52 -3.45 0.00 0.00 179.45 177.67 3d54 h MET 217 N 0.60 0.00 0.16 1.90 2.86 -0.90 -1.81 114.93 117.74 3d54 h MET 217 Ca 0.02 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.36 3d54 h MET 217 Cb 1.11 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.79 3d54 h MET 217 CO 0.11 0.02 -1.36 1.25 1.06 0.00 0.00 176.91 177.99 3d54 h LEU 218 N 0.00 0.52 0.12 1.22 5.85 -0.38 -2.56 115.31 120.07 3d54 h LEU 218 Ca -0.00 -0.59 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 3d54 h LEU 218 Cb 0.59 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3d54 h LEU 218 CO 0.00 1.47 -0.06 0.40 -0.34 0.00 0.00 178.44 179.91 3d54 h ILE 219 N 0.09 1.08 0.00 4.05 2.04 -0.64 -1.72 117.51 122.40 3d54 h ILE 219 Ca -0.19 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 64.74 3d54 h ILE 219 Cb 2.03 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 3d54 h ILE 219 CO 0.21 0.22 0.00 -0.33 0.00 0.00 0.00 178.15 178.25 3d54 h GLU 220 N -0.61 0.00 0.00 2.37 4.39 -1.48 -1.27 114.58 117.99 3d54 h GLU 220 Ca -0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3d54 h GLU 220 Cb 0.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 3d54 h GLU 220 CO 0.03 0.00 -0.04 0.00 -1.16 0.00 0.00 179.01 177.84 3d54 h ALA 221 N 2.02 -0.00 -0.32 3.43 0.00 -1.40 -3.25 119.26 119.73 3d54 h ALA 221 Ca 0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 3d54 h ALA 221 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3d54 h ALA 221 CO 0.00 -0.02 0.14 0.35 0.00 0.00 0.00 179.25 179.71 3d54 h PHE 222 N -0.88 0.48 0.00 0.00 3.57 -1.11 -2.57 116.94 116.43 3d54 h PHE 222 Ca -0.01 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.46 3d54 h PHE 222 Cb 0.95 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.54 3d54 h PHE 222 CO 0.25 0.45 0.00 1.28 -2.23 0.00 0.00 178.31 178.06 3d54 n LEU 223 N -4.73 0.17 -0.00 0.59 4.77 -0.50 -1.64 117.00 115.67 3d54 n LEU 223 Ca -0.02 0.55 -0.01 0.00 -0.03 0.00 0.00 56.01 56.50 3d54 n LEU 223 Cb 0.13 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.57 3d54 n LEU 223 CO 0.36 -0.38 -0.54 1.21 -1.33 0.00 0.00 177.39 176.71 3d54 n GLU 224 N -1.70 0.64 0.11 3.23 2.13 -0.99 -3.43 120.64 120.64 3d54 n GLU 224 Ca 0.03 0.13 -0.03 0.00 0.66 0.00 0.00 57.16 57.94 3d54 n GLU 224 Cb 0.16 -1.71 0.09 0.00 0.27 0.00 0.00 31.44 30.25 3d54 n GLU 224 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 3d54 h MET 225 N 0.00 0.03 0.04 5.31 2.86 -1.07 -2.15 114.93 119.95 3d54 h MET 225 Ca -0.23 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.38 3d54 h MET 225 Cb 1.66 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.33 3d54 h MET 225 CO 0.04 0.73 -0.02 0.28 1.06 0.00 0.00 176.91 179.00 3d54 h VAL 226 N 0.02 1.32 0.00 -2.22 2.07 -1.44 -1.41 116.25 114.59 3d54 h VAL 226 Ca -0.01 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.28 3d54 h VAL 226 Cb 1.27 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.15 3d54 h VAL 226 CO 0.10 0.31 0.00 -0.33 0.02 0.00 0.00 177.57 177.66 3d54 h GLU 227 N -0.60 0.00 -0.00 1.57 5.08 -1.58 0.17 114.58 119.22 3d54 h GLU 227 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3d54 h GLU 227 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3d54 h GLU 227 CO 0.01 0.00 -0.24 -1.91 -1.00 0.00 0.00 179.01 175.87 3d54 n GLU 228 N -3.00 0.30 -2.81 2.33 4.07 -0.81 -4.94 120.64 115.78 3d54 n GLU 228 Ca 0.00 -0.12 -0.15 0.00 -0.06 0.00 0.00 57.16 56.83 3d54 n GLU 228 Cb 0.26 -1.50 0.03 0.00 -0.06 0.00 0.00 31.44 30.17 3d54 n GLU 228 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3d54 n GLY 229 N 1.42 -0.12 0.59 8.31 0.00 0.05 -4.93 105.19 110.50 3d54 n GLY 229 Ca 0.09 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.05 3d54 n GLY 229 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d54 n LEU 230 N -2.86 2.19 -4.51 0.99 4.77 -0.55 -4.89 117.00 112.14 3d54 n LEU 230 Ca -0.07 -0.89 -0.41 0.00 -0.03 0.00 0.00 56.01 54.62 3d54 n LEU 230 Cb 0.58 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.56 3d54 n LEU 230 CO 0.33 0.39 -0.12 -0.69 -1.33 0.00 0.00 177.39 175.97 3d54 s VAL 231 N -1.82 5.20 -1.16 4.08 1.01 -1.23 -4.58 120.40 121.90 3d54 s VAL 231 Ca 0.19 -0.32 0.13 0.00 0.00 0.00 0.00 61.98 61.98 3d54 s VAL 231 Cb 0.15 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 3d54 s VAL 231 CO 0.34 -0.06 0.73 -0.62 0.00 0.00 0.00 175.10 175.50 3d54 n GLU 232 N 5.10 1.96 0.00 2.72 1.02 -0.85 -4.86 120.64 125.74 3d54 n GLU 232 Ca -0.12 -0.63 0.00 0.00 -0.02 0.00 0.00 57.16 56.39 3d54 n GLU 232 Cb 0.49 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 3d54 n GLU 232 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d54 n GLY 233 N 1.08 1.74 3.47 0.62 0.00 -1.16 -4.40 105.19 106.53 3d54 n GLY 233 Ca 0.05 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 3d54 n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 234 N -2.00 -1.71 -0.07 4.61 0.00 -1.14 0.37 121.76 121.82 3d54 s ALA 234 Ca 0.00 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 3d54 s ALA 234 Cb 0.00 0.44 0.03 0.00 0.00 0.00 0.00 23.12 23.60 3d54 s ALA 234 CO 0.00 -0.61 0.38 -1.14 0.00 0.00 0.00 175.76 174.39 3d54 s GLN 235 N -2.73 0.63 0.61 0.00 2.00 -0.85 -4.34 119.66 114.98 3d54 s GLN 235 Ca -0.02 0.15 -0.13 0.00 -2.00 0.00 0.00 55.36 53.36 3d54 s GLN 235 Cb -0.01 0.29 -0.04 0.00 0.80 0.00 0.00 33.01 34.06 3d54 s GLN 235 CO -0.05 -0.15 1.03 0.16 -0.50 0.00 0.00 175.29 175.78 3d54 s ASP 236 N -0.72 6.10 -0.57 6.67 -4.77 -1.26 -1.53 116.67 120.60 3d54 s ASP 236 Ca -0.08 1.53 0.00 0.00 -3.30 0.00 0.00 52.55 50.70 3d54 s ASP 236 Cb -0.04 -2.49 0.15 0.00 -1.09 0.00 0.00 42.92 39.45 3d54 s ASP 236 CO 0.03 -0.95 0.35 -0.76 0.70 0.00 0.00 175.17 174.54 3d54 s LEU 237 N -4.95 4.82 0.00 2.11 1.02 -1.22 -4.75 118.68 115.71 3d54 s LEU 237 Ca 0.57 -2.90 0.00 0.00 0.02 0.00 0.00 54.13 51.82 3d54 s LEU 237 Cb -0.12 -1.75 0.00 0.00 0.02 0.00 0.00 46.19 44.34 3d54 s LEU 237 CO 0.48 -0.31 0.00 0.61 0.02 0.00 0.00 176.35 177.15 3d54 n GLY 238 N 3.35 0.73 3.75 -3.19 0.00 -1.26 -4.59 105.19 103.97 3d54 n GLY 238 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3d54 n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 239 N -2.87 3.53 0.00 4.61 0.00 -1.26 -3.06 121.76 122.70 3d54 s ALA 239 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.14 3d54 s ALA 239 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 3d54 s ALA 239 CO 0.00 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.59 3d54 n GLY 240 N 1.83 2.11 7.00 0.00 0.00 -1.26 -4.67 105.19 110.20 3d54 n GLY 240 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3d54 n GLY 240 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d54 n GLY 241 N 0.00 1.23 0.37 -0.02 0.00 -1.17 -3.60 105.19 101.99 3d54 n GLY 241 Ca 0.00 -0.69 0.14 0.00 0.00 0.00 0.00 46.02 45.48 3d54 n GLY 241 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d54 h VAL 242 N 0.00 0.84 0.46 1.61 2.07 -1.71 -1.18 116.25 118.33 3d54 h VAL 242 Ca 0.00 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 3d54 h VAL 242 Cb 0.00 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3d54 h VAL 242 CO 0.00 0.06 -0.22 0.25 0.02 0.00 0.00 177.57 177.69 3d54 h LEU 243 N 0.35 -0.52 0.00 2.57 5.85 -1.60 -2.25 115.31 119.71 3d54 h LEU 243 Ca 0.31 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3d54 h LEU 243 Cb 0.71 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.88 3d54 h LEU 243 CO -0.08 -0.11 0.00 -0.24 -0.34 0.00 0.00 178.44 177.67 3d54 n SER 244 N -5.20 0.00 -0.10 1.25 2.88 -0.95 -2.15 113.62 109.35 3d54 n SER 244 Ca -0.09 -0.58 -0.20 0.00 -1.33 0.00 0.00 58.87 56.66 3d54 n SER 244 Cb 0.29 -0.06 -0.07 0.00 -0.75 0.00 0.00 64.21 63.62 3d54 n SER 244 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3d54 n ALA 245 N -1.06 1.42 0.20 -1.46 0.00 -0.49 -3.99 120.51 115.13 3d54 n ALA 245 Ca 0.16 -0.86 0.07 0.00 0.00 0.00 0.00 53.44 52.81 3d54 n ALA 245 Cb 0.10 0.16 0.38 0.00 0.00 0.00 0.00 19.45 20.09 3d54 n ALA 245 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3d54 h THR 246 N -0.84 0.75 0.18 0.00 1.35 -1.45 -2.57 112.91 110.34 3d54 h THR 246 Ca -0.42 -1.36 -0.31 0.00 -0.55 0.00 0.00 66.41 63.76 3d54 h THR 246 Cb 1.32 1.87 0.03 0.00 -1.73 0.00 0.00 68.15 69.63 3d54 h THR 246 CO -0.26 0.31 -1.35 0.77 -0.25 0.00 0.00 175.52 174.74 3d54 h SER 247 N 0.00 0.75 0.86 5.36 4.64 -1.64 -3.25 113.55 120.27 3d54 h SER 247 Ca -0.00 -0.77 0.00 0.00 -0.47 0.00 0.00 61.79 60.55 3d54 h SER 247 Cb 0.84 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3d54 h SER 247 CO 0.04 1.59 -0.03 -0.62 -0.87 0.00 0.00 176.83 176.94 3d54 n GLU 248 N -3.70 0.11 0.14 4.77 1.02 -1.19 -1.95 120.64 119.84 3d54 n GLU 248 Ca -0.14 -0.01 0.11 0.00 -0.02 0.00 0.00 57.16 57.11 3d54 n GLU 248 Cb 1.05 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 31.02 3d54 n GLU 248 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3d54 h LEU 249 N 0.02 0.00 -0.76 -4.62 3.38 -1.49 -3.33 115.31 108.50 3d54 h LEU 249 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d54 h LEU 249 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3d54 h LEU 249 CO 0.00 0.02 -0.06 1.33 0.09 0.00 0.00 178.44 179.82 3d54 n VAL 250 N -2.84 0.00 0.03 1.22 0.24 -1.19 0.73 118.33 116.52 3d54 n VAL 250 Ca 0.01 -0.47 -0.06 0.00 -2.04 0.00 0.00 64.34 61.78 3d54 n VAL 250 Cb 0.55 1.06 -0.11 0.00 -1.47 0.00 0.00 33.84 33.87 3d54 n VAL 250 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d54 h ALA 251 N 0.71 0.61 -0.18 2.33 0.00 -1.51 -1.43 119.26 119.79 3d54 h ALA 251 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.81 3d54 h ALA 251 Cb 0.14 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3d54 h ALA 251 CO 0.00 1.29 0.00 1.63 0.00 0.00 0.00 179.25 182.17 3d54 n LYS 252 N -3.14 1.91 0.00 0.00 5.02 -1.25 -3.74 118.16 116.96 3d54 n LYS 252 Ca -0.08 -1.36 0.02 0.00 -2.02 0.00 0.00 58.31 54.86 3d54 n LYS 252 Cb 0.96 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 34.52 3d54 n LYS 252 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d54 n GLY 253 N 1.22 0.36 2.59 0.72 0.00 -1.21 -4.93 105.19 103.95 3d54 n GLY 253 Ca 0.17 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 3d54 n GLY 253 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d54 n ASN 254 N -0.84 -5.02 -1.97 1.61 3.02 -0.89 -4.98 115.26 106.19 3d54 n ASN 254 Ca 0.01 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 3d54 n ASN 254 Cb 0.06 -3.22 0.00 0.00 -0.61 0.00 0.00 39.78 36.01 3d54 n ASN 254 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3d54 n LEU 255 N -0.90 0.00 0.00 3.41 4.77 -0.59 -4.55 117.00 119.14 3d54 n LEU 255 Ca -0.08 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.86 3d54 n LEU 255 Cb 0.44 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 3d54 n LEU 255 CO 0.12 -0.40 -0.03 0.61 -1.33 0.00 0.00 177.39 176.37 3d54 n GLY 256 N 5.00 3.99 3.58 -0.72 0.00 -1.10 -4.53 105.19 111.41 3d54 n GLY 256 Ca 0.00 -2.00 -0.15 0.00 0.00 0.00 0.00 46.02 43.87 3d54 n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 257 N -2.17 -1.81 -0.34 4.61 0.00 -1.04 -2.47 121.76 118.54 3d54 s ALA 257 Ca 0.03 1.67 -0.05 0.00 0.00 0.00 0.00 51.96 53.60 3d54 s ALA 257 Cb 0.00 -0.66 0.05 0.00 0.00 0.00 0.00 23.12 22.51 3d54 s ALA 257 CO 0.02 -0.34 0.10 0.42 0.00 0.00 0.00 175.76 175.96 3d54 s ILE 258 N -0.45 3.61 -0.23 0.00 1.01 -0.47 -1.01 121.20 123.66 3d54 s ILE 258 Ca -0.04 -1.28 -0.12 0.00 0.00 0.00 0.00 60.65 59.20 3d54 s ILE 258 Cb -0.02 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.30 3d54 s ILE 258 CO 0.04 -0.23 0.23 -0.69 0.00 0.00 0.00 174.94 174.29 3d54 s VAL 259 N 1.35 5.31 -0.44 2.92 1.01 0.15 -2.19 120.40 128.51 3d54 s VAL 259 Ca -0.01 0.33 -0.15 0.00 0.00 0.00 0.00 61.98 62.15 3d54 s VAL 259 Cb -0.20 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.66 3d54 s VAL 259 CO 0.01 0.31 0.34 -1.00 0.00 0.00 0.00 175.10 174.76 3d54 s HIS 260 N 1.21 3.25 -1.68 5.22 3.76 0.21 -1.26 115.29 126.01 3d54 s HIS 260 Ca 0.11 -0.83 0.30 0.00 -0.15 0.00 0.00 55.06 54.49 3d54 s HIS 260 Cb -0.14 -2.88 1.42 0.00 1.11 0.00 0.00 32.58 32.09 3d54 s HIS 260 CO 0.06 -0.71 1.97 1.28 -0.85 0.00 0.00 174.74 176.50 3d54 n LEU 261 N 5.16 0.30 0.10 0.89 4.77 -0.74 -3.40 117.00 124.07 3d54 n LEU 261 Ca -0.12 0.07 0.13 0.00 -0.03 0.00 0.00 56.01 56.06 3d54 n LEU 261 Cb 0.45 -0.17 0.37 0.00 -2.33 0.00 0.00 43.42 41.73 3d54 n LEU 261 CO 0.44 0.05 0.81 -0.90 -1.33 0.00 0.00 177.39 176.46 3d54 n ASP 262 N -1.01 0.81 -0.73 -1.43 5.75 -1.26 -3.25 116.55 115.43 3d54 n ASP 262 Ca 0.16 0.51 0.13 0.00 -0.01 0.00 0.00 54.79 55.58 3d54 n ASP 262 Cb 0.24 -0.66 0.27 0.00 -1.03 0.00 0.00 41.12 39.94 3d54 n ASP 262 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3d54 n ARG 263 N -2.25 1.98 -2.72 0.11 5.12 -1.22 -4.93 116.66 112.74 3d54 n ARG 263 Ca 0.05 -1.47 -0.42 0.00 -1.93 0.00 0.00 57.85 54.09 3d54 n ARG 263 Cb 0.43 -1.47 -0.03 0.00 -1.16 0.00 0.00 32.46 30.23 3d54 n ARG 263 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3d54 s VAL 264 N -2.03 4.82 -0.54 1.55 1.01 -1.20 -4.54 120.40 119.46 3d54 s VAL 264 Ca 0.31 2.04 -0.26 0.00 0.00 0.00 0.00 61.98 64.08 3d54 s VAL 264 Cb 0.20 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 3d54 s VAL 264 CO 0.33 0.19 2.36 -2.84 0.00 0.00 0.00 175.10 175.14 3d54 s PRO 265 N 0.85 2.08 0.26 2.72 0.02 -1.26 -4.95 135.00 134.72 3d54 s PRO 265 Ca 0.51 1.22 -0.16 0.00 0.02 0.00 0.00 61.00 62.59 3d54 s PRO 265 Cb -0.21 -4.60 -0.08 0.00 0.02 0.00 0.00 34.50 29.62 3d54 s PRO 265 CO 0.28 -3.38 0.70 -0.51 -0.33 0.00 0.00 177.00 173.75 3d54 s LEU 266 N 12.27 4.19 -0.21 -5.54 1.02 -1.26 -1.00 118.68 128.15 3d54 s LEU 266 Ca 0.94 1.27 -0.08 0.00 0.02 0.00 0.00 54.13 56.29 3d54 s LEU 266 Cb -0.16 -3.81 -0.19 0.00 0.02 0.00 0.00 46.19 42.05 3d54 s LEU 266 CO 0.23 -0.09 -0.00 -1.14 0.02 0.00 0.00 176.35 175.37 3d54 n ARG 267 N 0.12 0.66 -3.87 1.70 0.63 -1.18 -4.76 116.66 109.95 3d54 n ARG 267 Ca 0.01 0.28 -0.34 0.00 -0.92 0.00 0.00 57.85 56.87 3d54 n ARG 267 Cb 0.52 -1.61 -0.13 0.00 0.45 0.00 0.00 32.46 31.69 3d54 n ARG 267 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 3d54 s GLU 268 N -2.50 1.85 0.13 -0.14 2.02 -1.26 -5.01 118.70 113.79 3d54 s GLU 268 Ca -0.31 -1.81 0.08 0.00 0.02 0.00 0.00 54.97 52.95 3d54 s GLU 268 Cb 0.09 -3.43 0.45 0.00 0.10 0.00 0.00 34.13 31.34 3d54 s GLU 268 CO 0.63 -1.00 1.22 -0.35 0.02 0.00 0.00 175.26 175.78 3d54 n PRO 269 N 4.48 0.05 -0.57 0.39 -0.04 -1.26 -3.06 135.00 134.99 3d54 n PRO 269 Ca -0.01 0.53 -0.11 0.00 -0.04 0.00 0.00 63.50 63.87 3d54 n PRO 269 Cb 0.42 -1.73 0.07 0.00 -0.04 0.00 0.00 33.50 32.22 3d54 n PRO 269 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3d54 n ASP 270 N -1.77 3.93 -4.85 3.54 5.75 -1.26 -4.91 116.55 116.97 3d54 n ASP 270 Ca -0.01 -2.72 -0.37 0.00 -0.01 0.00 0.00 54.79 51.68 3d54 n ASP 270 Cb 0.06 -0.73 -0.06 0.00 -1.03 0.00 0.00 41.12 39.36 3d54 n ASP 270 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 3d54 s MET 271 N -1.40 3.80 0.21 0.11 -1.94 -1.17 -5.08 119.30 113.83 3d54 s MET 271 Ca 0.24 0.27 -0.28 0.00 -1.71 0.00 0.00 55.69 54.21 3d54 s MET 271 Cb 0.20 -3.19 -0.09 0.00 2.01 0.00 0.00 34.83 33.76 3d54 s MET 271 CO 0.03 0.70 0.87 -1.21 -0.01 0.00 0.00 175.02 175.40 3d54 s GLU 272 N -1.16 4.73 0.42 2.03 2.02 -1.26 -4.96 118.70 120.52 3d54 s GLU 272 Ca 0.23 1.34 0.34 0.00 0.02 0.00 0.00 54.97 56.90 3d54 s GLU 272 Cb -0.15 -3.27 1.40 0.00 0.10 0.00 0.00 34.13 32.20 3d54 s GLU 272 CO 0.12 0.54 1.39 -2.30 0.02 0.00 0.00 175.26 175.04 3d54 n PRO 273 N 1.54 -0.02 0.09 0.39 -0.02 -1.26 -1.04 135.00 134.68 3d54 n PRO 273 Ca -0.04 1.07 -0.05 0.00 -2.02 0.00 0.00 63.50 62.47 3d54 n PRO 273 Cb 0.48 -2.21 0.01 0.00 -0.02 0.00 0.00 33.50 31.75 3d54 n PRO 273 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3d54 h TRP 274 N 0.00 0.00 0.00 6.00 5.08 -1.97 -3.14 115.95 121.92 3d54 h TRP 274 Ca 0.80 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.73 3d54 h TRP 274 Cb 2.79 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 28.95 3d54 h TRP 274 CO -0.00 0.83 -0.23 0.93 -1.28 0.00 0.00 178.44 178.70 3d54 h GLU 275 N 0.00 0.00 0.02 0.12 5.08 -1.48 -1.37 114.58 116.95 3d54 h GLU 275 Ca -0.01 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.15 3d54 h GLU 275 Cb 1.48 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.71 3d54 h GLU 275 CO 0.11 0.23 -0.95 0.82 -1.00 0.00 0.00 179.01 178.21 3d54 h ILE 276 N 0.00 1.60 0.00 3.13 2.04 -1.53 -2.59 117.51 120.16 3d54 h ILE 276 Ca -0.00 -3.00 -0.00 0.00 1.00 0.00 0.00 64.86 62.86 3d54 h ILE 276 Cb 0.86 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.61 3d54 h ILE 276 CO 0.03 0.86 -0.00 0.25 0.00 0.00 0.00 178.15 179.29 3d54 h LEU 277 N 0.04 -0.00 0.00 1.44 5.85 -1.50 -3.34 115.31 117.80 3d54 h LEU 277 Ca -0.03 -0.82 0.00 0.00 0.84 0.00 0.00 57.88 57.86 3d54 h LEU 277 Cb 1.64 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.67 3d54 h LEU 277 CO 0.13 0.90 0.00 0.00 -0.34 0.00 0.00 178.44 179.14 3d54 n ILE 278 N -4.65 0.01 -1.64 4.05 0.13 -0.53 -3.11 119.36 113.62 3d54 n ILE 278 Ca -0.08 0.00 -0.44 0.00 -1.10 0.00 0.00 62.75 61.13 3d54 n ILE 278 Cb 0.40 -0.52 -0.03 0.00 -0.84 0.00 0.00 39.64 38.64 3d54 n ILE 278 CO 0.00 0.00 0.00 -0.24 2.80 0.00 0.00 176.55 179.11 3d54 n SER 279 N -1.12 3.75 -2.27 9.51 2.88 -0.97 -4.71 113.62 120.69 3d54 n SER 279 Ca 0.19 0.72 -0.32 0.00 -1.33 0.00 0.00 58.87 58.13 3d54 n SER 279 Cb 0.16 -1.50 0.09 0.00 -0.75 0.00 0.00 64.21 62.21 3d54 n SER 279 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3d54 n GLU 280 N 7.73 2.69 -2.28 -1.46 1.02 -1.26 -4.10 120.64 122.98 3d54 n GLU 280 Ca 0.24 -3.32 -0.40 0.00 -0.02 0.00 0.00 57.16 53.65 3d54 n GLU 280 Cb 0.39 -2.27 -0.03 0.00 -0.02 0.00 0.00 31.44 29.52 3d54 n GLU 280 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3d54 s SER 281 N -1.92 6.95 0.79 1.62 0.01 -1.26 -4.89 113.70 114.99 3d54 s SER 281 Ca 0.62 2.48 -0.07 0.00 1.31 0.00 0.00 55.95 60.29 3d54 s SER 281 Cb 0.50 -2.64 0.13 0.00 0.21 0.00 0.00 66.02 64.22 3d54 s SER 281 CO 0.01 -0.39 1.10 -1.10 0.41 0.00 0.00 173.24 173.27 3d54 s GLN 282 N -1.71 1.51 -1.42 12.44 -0.21 -1.26 -4.46 119.66 124.54 3d54 s GLN 282 Ca 0.48 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 55.21 3d54 s GLN 282 Cb -0.36 -2.14 0.00 0.00 1.00 0.00 0.00 33.01 31.52 3d54 s GLN 282 CO 0.47 -1.68 0.00 0.39 -2.12 0.00 0.00 175.29 172.34 3d54 n GLU 283 N -3.14 -1.03 -4.14 2.91 4.71 -1.26 -4.55 120.64 114.13 3d54 n GLU 283 Ca 0.13 0.91 -0.27 0.00 -0.01 0.00 0.00 57.16 57.92 3d54 n GLU 283 Cb 0.60 -5.07 -0.07 0.00 -1.01 0.00 0.00 31.44 25.90 3d54 n GLU 283 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 3d54 s ARG 284 N -3.65 2.65 0.04 3.49 0.52 -1.26 -1.93 118.95 118.81 3d54 s ARG 284 Ca 0.00 -0.98 -0.02 0.00 -0.52 0.00 0.00 55.73 54.21 3d54 s ARG 284 Cb 0.00 -2.50 -0.03 0.00 0.52 0.00 0.00 34.95 32.94 3d54 s ARG 284 CO 0.00 0.47 -0.00 -1.64 0.02 0.00 0.00 175.30 174.15 3d54 s MET 285 N -2.98 0.53 -0.08 3.54 -1.94 -0.50 -3.42 119.30 114.45 3d54 s MET 285 Ca 0.29 -0.96 0.04 0.00 -1.71 0.00 0.00 55.69 53.35 3d54 s MET 285 Cb -0.10 0.19 0.00 0.00 2.01 0.00 0.00 34.83 36.94 3d54 s MET 285 CO 0.21 -0.11 -0.21 0.00 -0.01 0.00 0.00 175.02 174.90 3d54 s ALA 286 N -3.02 1.92 -0.03 3.03 0.00 -0.58 -2.40 121.76 120.68 3d54 s ALA 286 Ca -0.01 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3d54 s ALA 286 Cb 0.01 -0.72 -0.00 0.00 0.00 0.00 0.00 23.12 22.41 3d54 s ALA 286 CO -0.07 0.26 -0.12 0.08 0.00 0.00 0.00 175.76 175.91 3d54 s VAL 287 N 0.35 1.01 -0.27 0.00 1.01 -0.14 -2.01 120.40 120.35 3d54 s VAL 287 Ca -0.16 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 3d54 s VAL 287 Cb -0.17 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 3d54 s VAL 287 CO 0.07 0.30 0.11 -0.69 0.00 0.00 0.00 175.10 174.89 3d54 s VAL 288 N 0.08 4.49 0.29 2.92 1.01 0.16 -0.01 120.40 129.34 3d54 s VAL 288 Ca -0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 3d54 s VAL 288 Cb -0.09 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 3d54 s VAL 288 CO 0.01 0.23 0.34 0.28 0.00 0.00 0.00 175.10 175.96 3d54 s THR 289 N 1.62 0.00 0.20 3.92 -1.32 -0.38 -2.00 115.64 117.69 3d54 s THR 289 Ca 0.06 -1.78 -0.15 0.00 -1.21 0.00 0.00 61.69 58.61 3d54 s THR 289 Cb -0.16 -2.51 -0.08 0.00 -1.51 0.00 0.00 72.50 68.25 3d54 s THR 289 CO 0.05 0.00 0.62 -0.44 -2.21 0.00 0.00 174.62 172.64 3d54 s SER 290 N -3.22 6.84 0.00 8.08 0.01 -1.26 -0.53 113.70 123.61 3d54 s SER 290 Ca 0.34 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.76 3d54 s SER 290 Cb 0.02 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.93 3d54 s SER 290 CO 0.19 0.02 0.86 -0.81 0.41 0.00 0.00 173.24 173.90 3d54 n PRO 291 N 0.47 0.00 0.02 12.44 -0.04 -1.26 -1.63 135.00 145.00 3d54 n PRO 291 Ca -0.02 0.37 0.04 0.00 -0.04 0.00 0.00 63.50 63.85 3d54 n PRO 291 Cb 0.52 -1.53 -0.10 0.00 -0.04 0.00 0.00 33.50 32.35 3d54 n PRO 291 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3d54 n GLN 292 N -1.36 0.64 -0.29 0.54 6.02 -1.26 -4.04 117.38 117.63 3d54 n GLN 292 Ca 0.00 0.05 0.11 0.00 -0.01 0.00 0.00 57.00 57.15 3d54 n GLN 292 Cb 0.03 -1.69 0.28 0.00 1.02 0.00 0.00 30.24 29.88 3d54 n GLN 292 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3d54 n LYS 293 N -2.64 2.50 0.09 -1.09 5.02 -0.64 -4.29 118.16 117.11 3d54 n LYS 293 Ca -0.09 -2.31 0.08 0.00 -2.02 0.00 0.00 58.31 53.96 3d54 n LYS 293 Cb 0.75 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 34.23 3d54 n LYS 293 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d54 h ALA 294 N 4.30 0.57 0.00 7.82 0.00 -1.68 -3.24 119.26 127.04 3d54 h ALA 294 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3d54 h ALA 294 Cb 0.90 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3d54 h ALA 294 CO 0.00 0.26 0.00 0.66 0.00 0.00 0.00 179.25 180.17 3d54 h SER 295 N 0.00 0.00 0.29 0.00 4.64 -1.82 -2.99 113.55 113.67 3d54 h SER 295 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3d54 h SER 295 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3d54 h SER 295 CO 0.01 0.00 -1.62 -1.14 -0.87 0.00 0.00 176.83 173.21 3d54 n ARG 296 N -3.09 0.59 0.07 4.77 0.00 -1.25 -4.05 116.66 113.69 3d54 n ARG 296 Ca 0.02 -0.09 -0.13 0.00 -0.00 0.00 0.00 57.85 57.65 3d54 n ARG 296 Cb 0.41 -1.60 -0.14 0.00 0.00 0.00 0.00 32.46 31.13 3d54 n ARG 296 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 3d54 h ILE 297 N 0.00 1.40 0.00 5.15 2.10 -1.55 -3.24 117.51 121.37 3d54 h ILE 297 Ca 0.00 -3.05 -0.13 0.00 1.08 0.00 0.00 64.86 62.76 3d54 h ILE 297 Cb 0.96 2.83 -0.02 0.00 -1.09 0.00 0.00 36.82 39.49 3d54 h ILE 297 CO 0.00 0.86 -0.60 -0.07 -1.08 0.00 0.00 178.15 177.26 3d54 h LEU 298 N 0.05 0.00 -0.88 2.19 3.38 -1.72 -3.01 115.31 115.31 3d54 h LEU 298 Ca -0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 3d54 h LEU 298 Cb 1.94 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.68 3d54 h LEU 298 CO 0.16 0.60 -0.35 -0.33 0.09 0.00 0.00 178.44 178.62 3d54 h GLU 299 N 0.00 0.00 0.04 1.13 5.08 -1.70 -2.01 114.58 117.12 3d54 h GLU 299 Ca -0.01 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.13 3d54 h GLU 299 Cb 1.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 3d54 h GLU 299 CO 0.08 0.35 -1.00 0.82 -1.00 0.00 0.00 179.01 178.25 3d54 h ILE 300 N 0.00 1.56 -0.06 3.13 2.04 -1.56 -2.72 117.51 119.90 3d54 h ILE 300 Ca -0.00 -2.95 -0.04 0.00 1.00 0.00 0.00 64.86 62.86 3d54 h ILE 300 Cb 0.91 2.70 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 3d54 h ILE 300 CO 0.05 0.86 -0.14 0.00 0.00 0.00 0.00 178.15 178.92 3d54 h ALA 301 N 0.88 0.10 0.00 1.87 0.00 -1.39 -2.70 119.26 118.01 3d54 h ALA 301 Ca -0.06 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3d54 h ALA 301 Cb 1.70 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 3d54 h ALA 301 CO 0.15 -0.00 -0.10 -0.09 0.00 0.00 0.00 179.25 179.21 3d54 h ARG 302 N -0.30 0.00 0.02 0.00 2.43 -1.39 0.52 114.38 115.66 3d54 h ARG 302 Ca 0.00 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.97 3d54 h ARG 302 Cb 0.73 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 3d54 h ARG 302 CO 0.03 0.10 -0.94 -0.22 -1.51 0.00 0.00 179.97 177.43 3d54 h LYS 303 N 0.00 0.11 -0.80 0.20 3.64 -1.44 -3.23 116.57 115.04 3d54 h LYS 303 Ca -0.00 -0.14 -0.25 0.00 -1.27 0.00 0.00 60.65 58.99 3d54 h LYS 303 Cb 0.38 0.05 -0.15 0.00 -0.41 0.00 0.00 32.23 32.09 3d54 h LYS 303 CO 0.01 0.96 0.32 0.72 -2.27 0.00 0.00 179.45 179.19 3d54 n HIS 304 N -3.55 2.47 -1.24 1.91 8.25 -0.36 -4.91 115.22 117.81 3d54 n HIS 304 Ca -0.03 -1.25 -0.08 0.00 -0.26 0.00 0.00 57.72 56.11 3d54 n HIS 304 Cb 0.86 -0.71 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 3d54 n HIS 304 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3d54 n LEU 305 N -0.25 -0.11 -4.96 2.41 4.32 -1.05 -4.85 117.00 112.52 3d54 n LEU 305 Ca 0.42 0.20 -0.22 0.00 -0.02 0.00 0.00 56.01 56.39 3d54 n LEU 305 Cb 1.39 -2.39 -0.01 0.00 -1.62 0.00 0.00 43.42 40.79 3d54 n LEU 305 CO 0.45 -0.91 0.05 -0.76 -1.22 0.00 0.00 177.39 174.99 3d54 s LEU 306 N -1.85 4.16 -0.07 2.23 1.43 0.03 -4.98 118.68 119.64 3d54 s LEU 306 Ca 0.00 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 3d54 s LEU 306 Cb 0.00 -2.99 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 3d54 s LEU 306 CO 0.00 -0.20 -0.09 -0.36 0.23 0.00 0.00 176.35 175.92 3d54 s PHE 307 N -2.12 2.87 0.00 0.29 0.40 -0.96 -3.45 117.98 115.01 3d54 s PHE 307 Ca 0.38 -0.09 -0.28 0.00 -0.60 0.00 0.00 56.93 56.33 3d54 s PHE 307 Cb -0.09 -1.71 0.09 0.00 0.51 0.00 0.00 43.02 41.82 3d54 s PHE 307 CO 0.32 0.23 0.81 0.20 0.70 0.00 0.00 175.22 177.48 3d54 s GLY 308 N -0.63 -0.49 0.28 4.36 0.00 -1.26 -2.07 107.32 107.51 3d54 s GLY 308 Ca 0.09 1.08 -0.21 0.00 0.00 0.00 0.00 44.72 45.69 3d54 s GLY 308 CO 0.02 0.48 0.73 -0.35 0.00 0.00 0.00 173.10 173.97 3d54 s ASP 309 N -2.17 -0.25 -0.12 1.64 2.15 -1.04 -4.99 116.67 111.88 3d54 s ASP 309 Ca 0.01 -0.61 -0.27 0.00 0.43 0.00 0.00 52.55 52.11 3d54 s ASP 309 Cb -0.01 0.72 -0.02 0.00 -0.30 0.00 0.00 42.92 43.32 3d54 s ASP 309 CO -0.06 -1.34 0.91 -0.69 -0.17 0.00 0.00 175.17 173.83 3d54 s VAL 310 N -3.87 4.85 -0.08 1.11 1.01 -1.26 -2.48 120.40 119.67 3d54 s VAL 310 Ca 0.11 1.84 -0.01 0.00 0.00 0.00 0.00 61.98 63.92 3d54 s VAL 310 Cb -0.06 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 3d54 s VAL 310 CO 0.07 0.04 -0.09 1.33 0.00 0.00 0.00 175.10 176.45 3d54 n VAL 311 N 4.53 0.46 -4.43 2.92 0.24 -0.84 -4.81 118.33 116.40 3d54 n VAL 311 Ca 0.06 -0.15 -0.22 0.00 -2.04 0.00 0.00 64.34 61.99 3d54 n VAL 311 Cb 0.49 -1.11 -0.10 0.00 -1.47 0.00 0.00 33.84 31.65 3d54 n VAL 311 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d54 s ALA 312 N -2.16 2.52 -0.09 2.33 0.00 -1.10 -0.62 121.76 122.65 3d54 s ALA 312 Ca -0.11 -1.80 0.03 0.00 0.00 0.00 0.00 51.96 50.07 3d54 s ALA 312 Cb 0.03 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 22.95 3d54 s ALA 312 CO 0.17 0.22 -0.17 -1.21 0.00 0.00 0.00 175.76 174.77 3d54 s GLU 313 N -3.51 2.33 -0.28 0.00 2.02 -0.93 -1.38 118.70 116.95 3d54 s GLU 313 Ca 0.27 -0.62 -0.24 0.00 0.02 0.00 0.00 54.97 54.40 3d54 s GLU 313 Cb -0.04 -1.86 -0.00 0.00 0.10 0.00 0.00 34.13 32.33 3d54 s GLU 313 CO 0.12 0.06 0.81 0.08 0.02 0.00 0.00 175.26 176.35 3d54 s VAL 314 N 0.63 4.81 0.57 2.63 1.01 0.16 -1.36 120.40 128.85 3d54 s VAL 314 Ca -0.14 1.36 0.07 0.00 0.00 0.00 0.00 61.98 63.28 3d54 s VAL 314 Cb -0.16 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.15 3d54 s VAL 314 CO 0.04 -0.17 0.60 0.27 0.00 0.00 0.00 175.10 175.84 3d54 s ILE 315 N 2.91 1.79 -0.08 2.22 -4.36 -1.03 -1.75 121.20 120.91 3d54 s ILE 315 Ca 0.34 -1.26 -0.11 0.00 -0.26 0.00 0.00 60.65 59.36 3d54 s ILE 315 Cb -0.15 -2.06 -0.29 0.00 1.25 0.00 0.00 42.46 41.22 3d54 s ILE 315 CO 0.10 0.00 0.57 -0.08 0.24 0.00 0.00 174.94 175.77 3d54 h GLU 316 N 0.44 0.34 -6.37 0.37 4.81 -1.97 -2.92 114.58 109.29 3d54 h GLU 316 Ca -0.33 -0.59 -0.54 0.00 -0.13 0.00 0.00 59.36 57.78 3d54 h GLU 316 Cb 1.30 0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.90 3d54 h GLU 316 CO 0.49 1.28 0.96 -2.00 -0.73 0.00 0.00 179.01 179.01 3d54 s GLU 317 N -2.56 4.23 -0.71 1.92 2.12 -1.26 -4.47 118.70 117.96 3d54 s GLU 317 Ca -0.18 2.15 -0.05 0.00 0.36 0.00 0.00 54.97 57.25 3d54 s GLU 317 Cb 0.06 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.72 3d54 s GLU 317 CO 0.82 -0.70 1.93 -0.35 -0.54 0.00 0.00 175.26 176.42 3d54 n PRO 318 N 5.87 1.68 -4.24 4.30 -0.04 -1.26 -3.57 135.00 137.74 3d54 n PRO 318 Ca 0.15 -1.24 -0.18 0.00 -0.04 0.00 0.00 63.50 62.19 3d54 n PRO 318 Cb 0.42 -2.33 -0.11 0.00 -0.04 0.00 0.00 33.50 31.44 3d54 n PRO 318 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3d54 s VAL 319 N 3.55 1.36 -0.34 0.52 0.11 -1.26 -2.73 120.40 121.60 3d54 s VAL 319 Ca 0.33 -1.69 -0.03 0.00 -2.93 0.00 0.00 61.98 57.65 3d54 s VAL 319 Cb 0.09 -1.52 0.07 0.00 -1.53 0.00 0.00 36.38 33.49 3d54 s VAL 319 CO -0.03 -0.38 0.09 -0.47 -3.33 0.00 0.00 175.10 170.98 3d54 s TYR 320 N -2.04 3.36 -0.20 1.54 5.04 -0.61 -2.49 117.35 121.97 3d54 s TYR 320 Ca 0.08 -1.95 -0.07 0.00 -2.44 0.00 0.00 57.07 52.70 3d54 s TYR 320 Cb -0.05 -2.49 -0.04 0.00 0.35 0.00 0.00 41.96 39.73 3d54 s TYR 320 CO 0.03 -0.84 0.05 0.50 -1.34 0.00 0.00 175.55 173.95 3d54 s ARG 321 N 1.25 3.84 -0.13 4.97 3.52 -0.18 -2.80 118.95 129.43 3d54 s ARG 321 Ca -0.00 -0.41 0.02 0.00 -0.13 0.00 0.00 55.73 55.20 3d54 s ARG 321 Cb -0.21 -3.21 0.02 0.00 -1.56 0.00 0.00 34.95 29.99 3d54 s ARG 321 CO -0.01 0.13 -0.17 0.08 -0.81 0.00 0.00 175.30 174.52 3d54 s VAL 322 N 0.74 1.65 0.15 7.11 1.01 -0.46 0.32 120.40 130.92 3d54 s VAL 322 Ca 0.03 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 3d54 s VAL 322 Cb -0.14 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3d54 s VAL 322 CO 0.02 0.47 0.18 0.00 0.00 0.00 0.00 175.10 175.77 3d54 s MET 323 N 1.05 1.04 -0.61 2.72 0.23 -0.39 -2.55 119.30 120.81 3d54 s MET 323 Ca -0.04 -1.28 0.05 0.00 -1.03 0.00 0.00 55.69 53.39 3d54 s MET 323 Cb -0.15 0.32 0.17 0.00 -1.53 0.00 0.00 34.83 33.64 3d54 s MET 323 CO -0.04 -0.35 0.43 -0.47 -2.03 0.00 0.00 175.02 172.57 3d54 s TYR 324 N -4.00 2.79 0.00 3.16 6.14 -0.60 -1.80 117.35 123.04 3d54 s TYR 324 Ca 0.20 -3.01 0.00 0.00 0.64 0.00 0.00 57.07 54.90 3d54 s TYR 324 Cb 0.05 -2.17 0.00 0.00 0.42 0.00 0.00 41.96 40.27 3d54 s TYR 324 CO 0.00 -0.64 0.00 -2.13 0.64 0.00 0.00 175.55 173.42 3d54 n ARG 325 N 2.32 0.00 -0.08 4.97 0.63 -1.26 -4.11 116.66 119.13 3d54 n ARG 325 Ca 0.22 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 57.05 3d54 n ARG 325 Cb 0.39 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 33.14 3d54 n ARG 325 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3d54 n ASN 326 N 10.74 0.40 -4.86 6.15 3.02 -1.26 -4.93 115.26 124.50 3d54 n ASN 326 Ca 0.00 0.12 -0.35 0.00 -0.03 0.00 0.00 54.58 54.32 3d54 n ASN 326 Cb 0.00 0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 39.69 3d54 n ASN 326 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3d54 s ASP 327 N -5.75 6.65 0.49 6.41 -0.00 -1.26 -5.09 116.67 118.13 3d54 s ASP 327 Ca -0.10 0.80 -0.03 0.00 -0.00 0.00 0.00 52.55 53.22 3d54 s ASP 327 Cb 0.07 -2.18 -0.01 0.00 -0.00 0.00 0.00 42.92 40.79 3d54 s ASP 327 CO 0.82 0.19 0.77 -0.22 -0.00 0.00 0.00 175.17 176.73 3d54 s LEU 328 N -1.81 3.55 0.00 1.23 2.96 -1.26 -1.56 118.68 121.78 3d54 s LEU 328 Ca 0.32 0.66 0.00 0.00 -0.22 0.00 0.00 54.13 54.88 3d54 s LEU 328 Cb -0.14 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.01 3d54 s LEU 328 CO 0.17 -0.73 0.00 1.33 -1.32 0.00 0.00 176.35 175.80 3d54 n VAL 329 N -2.27 0.00 -3.64 1.68 0.24 -1.06 -4.89 118.33 108.39 3d54 n VAL 329 Ca 0.01 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.17 3d54 n VAL 329 Cb 0.57 -0.14 -0.08 0.00 -1.47 0.00 0.00 33.84 32.72 3d54 n VAL 329 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3d54 s MET 330 N -1.18 0.79 -0.22 7.34 -2.45 -1.15 -4.78 119.30 117.64 3d54 s MET 330 Ca 0.00 0.78 -0.05 0.00 -1.25 0.00 0.00 55.69 55.17 3d54 s MET 330 Cb 0.00 0.38 0.11 0.00 1.25 0.00 0.00 34.83 36.57 3d54 s MET 330 CO 0.00 -0.12 0.42 -2.00 1.05 0.00 0.00 175.02 174.37 3d54 s GLU 331 N 0.10 0.35 0.05 4.11 2.12 -1.26 -1.36 118.70 122.80 3d54 s GLU 331 Ca -0.02 0.89 -0.08 0.00 0.36 0.00 0.00 54.97 56.13 3d54 s GLU 331 Cb -0.04 0.11 -0.00 0.00 0.26 0.00 0.00 34.13 34.46 3d54 s GLU 331 CO 0.02 -0.39 0.16 0.14 -0.54 0.00 0.00 175.26 174.65 3d54 s VAL 332 N 2.61 0.13 0.41 3.70 -7.23 -1.12 -5.03 120.40 113.88 3d54 s VAL 332 Ca 0.04 -1.05 -0.27 0.00 -1.81 0.00 0.00 61.98 58.89 3d54 s VAL 332 Cb -0.13 -1.03 -0.09 0.00 0.56 0.00 0.00 36.38 35.69 3d54 s VAL 332 CO -0.14 -0.58 1.43 -2.84 -0.31 0.00 0.00 175.10 172.66 3d54 s PRO 333 N -2.91 3.91 0.17 4.82 0.02 -1.26 -1.57 135.00 138.18 3d54 s PRO 333 Ca -0.02 2.45 -0.13 0.00 0.02 0.00 0.00 61.00 63.31 3d54 s PRO 333 Cb 0.01 -2.81 0.07 0.00 0.02 0.00 0.00 34.50 31.79 3d54 s PRO 333 CO -0.06 -0.65 1.80 -0.24 -0.33 0.00 0.00 177.00 177.53 3d54 h VAL 334 N 2.61 1.17 0.00 3.83 3.04 -1.79 -2.78 116.25 122.33 3d54 h VAL 334 Ca -0.51 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.79 3d54 h VAL 334 Cb 1.25 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 30.95 3d54 h VAL 334 CO 0.63 0.18 0.00 0.00 -1.01 0.00 0.00 177.57 177.36 3d54 n GLN 335 N -4.64 0.11 0.03 4.17 1.13 -1.26 -2.16 117.38 114.76 3d54 n GLN 335 Ca 0.03 0.31 0.14 0.00 -1.94 0.00 0.00 57.00 55.54 3d54 n GLN 335 Cb 0.06 -1.70 0.56 0.00 0.11 0.00 0.00 30.24 29.27 3d54 n GLN 335 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 3d54 n LEU 336 N -1.91 0.20 -0.14 1.08 7.94 -1.05 -3.14 117.00 119.98 3d54 n LEU 336 Ca 0.03 0.52 -0.29 0.00 -1.11 0.00 0.00 56.01 55.17 3d54 n LEU 336 Cb 0.23 -0.46 -0.10 0.00 0.53 0.00 0.00 43.42 43.62 3d54 n LEU 336 CO 0.19 -0.05 -1.35 0.18 -1.11 0.00 0.00 177.39 175.24 3d54 n LEU 337 N -1.69 1.99 0.16 -1.96 4.77 -0.92 -4.55 117.00 114.80 3d54 n LEU 337 Ca 0.07 0.33 0.01 0.00 -0.03 0.00 0.00 56.01 56.38 3d54 n LEU 337 Cb 0.36 -0.84 0.24 0.00 -2.33 0.00 0.00 43.42 40.85 3d54 n LEU 337 CO 0.27 0.56 0.57 0.00 -1.33 0.00 0.00 177.39 177.47 3d54 h ALA 338 N -0.90 1.08 -2.65 -1.18 0.00 -1.69 -3.41 119.26 110.51 3d54 h ALA 338 Ca -0.67 -0.48 -0.72 0.00 0.00 0.00 0.00 54.91 53.05 3d54 h ALA 338 Cb 1.60 -0.08 -0.25 0.00 0.00 0.00 0.00 17.79 19.06 3d54 h ALA 338 CO -0.39 0.66 -0.45 -0.80 0.00 0.00 0.00 179.25 178.27 3d54 s ASN 339 N -6.81 5.84 0.56 0.00 0.01 -1.19 -5.02 114.94 108.34 3d54 s ASN 339 Ca -0.01 -1.22 -0.08 0.00 -0.71 0.00 0.00 52.86 50.83 3d54 s ASN 339 Cb 0.13 -2.06 -0.03 0.00 0.41 0.00 0.00 41.25 39.69 3d54 s ASN 339 CO 0.74 -0.50 0.92 0.00 -1.51 0.00 0.00 177.10 176.76 3d54 s ALA 340 N 1.55 3.23 -0.26 0.60 0.00 -1.26 -4.78 121.76 120.83 3d54 s ALA 340 Ca 0.03 -0.30 -0.28 0.00 0.00 0.00 0.00 51.96 51.41 3d54 s ALA 340 Cb -0.21 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 3d54 s ALA 340 CO 0.06 -0.57 1.91 -2.14 0.00 0.00 0.00 175.76 175.02 3d54 s PRO 341 N -5.00 3.38 -0.22 0.00 0.02 -1.26 -4.92 135.00 127.00 3d54 s PRO 341 Ca 0.52 1.70 -0.29 0.00 0.02 0.00 0.00 61.00 62.94 3d54 s PRO 341 Cb -0.11 -4.22 -0.02 0.00 0.02 0.00 0.00 34.50 30.17 3d54 s PRO 341 CO 0.50 -1.81 1.42 -2.00 -0.33 0.00 0.00 177.00 174.78 3d54 s GLU 342 N 5.67 3.99 0.65 5.54 2.12 -1.26 -4.65 118.70 130.75 3d54 s GLU 342 Ca 0.85 1.57 -0.11 0.00 0.36 0.00 0.00 54.97 57.65 3d54 s GLU 342 Cb -0.27 -3.91 -0.02 0.00 0.26 0.00 0.00 34.13 30.19 3d54 s GLU 342 CO 0.34 -1.04 1.05 -1.21 -0.54 0.00 0.00 175.26 173.86 3d54 s GLU 343 N 4.13 3.34 0.09 4.30 0.41 -0.78 -5.04 118.70 125.15 3d54 s GLU 343 Ca 0.62 0.69 -0.21 0.00 -0.41 0.00 0.00 54.97 55.66 3d54 s GLU 343 Cb -0.22 -2.06 -0.07 0.00 -1.78 0.00 0.00 34.13 30.00 3d54 s GLU 343 CO 0.23 -0.74 0.64 -0.51 -0.49 0.00 0.00 175.26 174.39 3d54 s ASP 344 N -4.19 7.16 0.45 -0.19 1.01 -1.26 -4.76 116.67 114.89 3d54 s ASP 344 Ca 0.56 1.37 -0.21 0.00 0.71 0.00 0.00 52.55 54.98 3d54 s ASP 344 Cb -0.11 -2.40 -0.10 0.00 1.01 0.00 0.00 42.92 41.32 3d54 s ASP 344 CO 0.54 0.24 1.00 0.27 0.21 0.00 0.00 175.17 177.43 3d54 s ILE 345 N -1.03 4.02 -0.59 0.77 -4.36 -1.26 -5.03 121.20 113.71 3d54 s ILE 345 Ca 0.31 1.30 0.06 0.00 -0.26 0.00 0.00 60.65 62.06 3d54 s ILE 345 Cb -0.20 -3.54 0.23 0.00 1.25 0.00 0.00 42.46 40.19 3d54 s ILE 345 CO 0.21 -0.23 0.63 0.52 0.24 0.00 0.00 174.94 176.31 3d54 n VAL 346 N -0.71 1.43 -1.43 8.37 0.31 -1.26 -5.10 118.33 119.93 3d54 n VAL 346 Ca 0.08 -4.81 -0.56 0.00 -0.01 0.00 0.00 64.34 59.04 3d54 n VAL 346 Cb 0.53 -2.06 -0.07 0.00 -0.91 0.00 0.00 33.84 31.32 3d54 n VAL 346 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3d54 n GLU 347 N 1.31 0.00 -5.25 5.55 1.02 -1.26 -4.84 120.64 117.17 3d54 n GLU 347 Ca 0.26 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 57.09 3d54 n GLU 347 Cb 0.42 -1.40 -0.16 0.00 -0.02 0.00 0.00 31.44 30.28 3d54 n GLU 347 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3d54 s TYR 348 N -0.08 2.43 0.06 -0.32 5.04 -1.26 -5.09 117.35 118.13 3d54 s TYR 348 Ca 0.85 -0.63 0.07 0.00 -2.44 0.00 0.00 57.07 54.93 3d54 s TYR 348 Cb -1.19 -1.58 -0.03 0.00 0.35 0.00 0.00 41.96 39.50 3d54 s TYR 348 CO 0.55 -0.15 -0.18 0.95 -1.34 0.00 0.00 175.55 175.37 3d54 s THR 349 N -0.29 2.81 0.28 4.34 -4.23 -1.26 -4.94 115.64 112.35 3d54 s THR 349 Ca 0.00 -1.25 -0.27 0.00 -1.18 0.00 0.00 61.69 58.99 3d54 s THR 349 Cb -0.13 -2.21 -0.09 0.00 1.34 0.00 0.00 72.50 71.41 3d54 s THR 349 CO 0.02 0.28 0.91 -2.84 -0.54 0.00 0.00 174.62 172.46 3d54 s PRO 350 N -1.60 4.64 0.35 3.99 0.02 -1.26 -5.06 135.00 136.08 3d54 s PRO 350 Ca 0.15 1.32 0.02 0.00 0.02 0.00 0.00 61.00 62.52 3d54 s PRO 350 Cb -0.11 -2.99 0.02 0.00 0.02 0.00 0.00 34.50 31.45 3d54 s PRO 350 CO 0.06 0.38 0.19 0.41 -0.33 0.00 0.00 177.00 177.71 3d54 n GLY 351 N 0.93 3.14 3.78 0.52 0.00 -1.26 -5.10 105.19 107.20 3d54 n GLY 351 Ca -0.00 -2.27 -0.36 0.00 0.00 0.00 0.00 46.02 43.38 3d54 n GLY 351 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d54 s LYS 352 N -3.40 3.86 -0.43 1.61 1.02 -1.26 -4.89 119.74 116.24 3d54 s LYS 352 Ca 0.14 1.59 -0.27 0.00 0.02 0.00 0.00 55.97 57.45 3d54 s LYS 352 Cb -0.01 -2.35 -0.04 0.00 -0.52 0.00 0.00 37.83 34.91 3d54 s LYS 352 CO 0.09 -0.42 2.03 0.42 -0.92 0.00 0.00 175.35 176.54 3d54 s ILE 353 N -1.69 3.25 0.96 2.17 1.01 -1.26 -4.95 121.20 120.70 3d54 s ILE 353 Ca 0.63 0.21 -0.12 0.00 0.00 0.00 0.00 60.65 61.38 3d54 s ILE 353 Cb -0.24 -3.48 0.17 0.00 0.01 0.00 0.00 42.46 38.92 3d54 s ILE 353 CO 0.29 -0.40 1.09 -2.16 0.00 0.00 0.00 174.94 173.76 3d54 s PRO 354 N 6.80 0.70 -0.48 2.79 0.04 -1.26 -4.98 135.00 138.61 3d54 s PRO 354 Ca 0.84 0.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.32 3d54 s PRO 354 Cb -0.20 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.62 3d54 s PRO 354 CO 0.28 -2.59 0.90 -2.00 0.04 0.00 0.00 177.00 173.63 3d54 s GLU 355 N -4.91 3.46 -0.06 4.56 2.12 -1.26 -5.04 118.70 117.57 3d54 s GLU 355 Ca 0.65 0.01 -0.22 0.00 0.36 0.00 0.00 54.97 55.76 3d54 s GLU 355 Cb -0.19 -3.96 -0.04 0.00 0.26 0.00 0.00 34.13 30.20 3d54 s GLU 355 CO 0.58 -1.26 0.65 -0.06 -0.54 0.00 0.00 175.26 174.63 3d54 s PHE 356 N 3.71 3.59 0.07 5.30 0.08 -1.26 -5.08 117.98 124.39 3d54 s PHE 356 Ca 0.34 1.20 -0.03 0.00 0.12 0.00 0.00 56.93 58.55 3d54 s PHE 356 Cb -0.11 -2.74 -0.05 0.00 -0.57 0.00 0.00 43.02 39.56 3d54 s PHE 356 CO 0.24 0.15 0.28 0.15 -0.10 0.00 0.00 175.22 175.94 3d54 s LYS 357 N 0.57 3.54 -0.12 0.44 3.01 -1.26 -4.62 119.74 121.30 3d54 s LYS 357 Ca 0.35 -0.22 -0.30 0.00 -1.01 0.00 0.00 55.97 54.79 3d54 s LYS 357 Cb -0.18 -2.99 -0.03 0.00 -1.01 0.00 0.00 37.83 33.63 3d54 s LYS 357 CO 0.17 0.57 1.30 -0.98 0.51 0.00 0.00 175.35 176.92 3d54 s ARG 358 N -2.34 4.26 -0.31 1.68 1.70 -1.26 -4.99 118.95 117.69 3d54 s ARG 358 Ca 0.35 1.74 -0.15 0.00 -0.47 0.00 0.00 55.73 57.20 3d54 s ARG 358 Cb -0.13 -3.72 -0.02 0.00 -0.57 0.00 0.00 34.95 30.51 3d54 s ARG 358 CO 0.23 -0.65 0.39 0.08 -1.08 0.00 0.00 175.30 174.27 3d54 s VAL 359 N 3.17 5.15 -0.26 4.99 1.01 -1.26 -5.04 120.40 128.16 3d54 s VAL 359 Ca 0.58 0.35 -0.29 0.00 0.00 0.00 0.00 61.98 62.62 3d54 s VAL 359 Cb -0.24 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 3d54 s VAL 359 CO 0.19 0.02 1.51 -1.61 0.00 0.00 0.00 175.10 175.20 3d54 s GLU 360 N 2.10 3.80 -0.22 2.72 0.41 -1.26 -4.97 118.70 121.28 3d54 s GLU 360 Ca 0.14 1.47 -0.03 0.00 -0.41 0.00 0.00 54.97 56.15 3d54 s GLU 360 Cb -0.16 -3.99 0.01 0.00 -1.78 0.00 0.00 34.13 28.21 3d54 s GLU 360 CO 0.11 -1.27 -0.07 -0.06 -0.49 0.00 0.00 175.26 173.48 3d54 s PHE 361 N 5.00 2.96 -0.24 1.61 0.40 -1.26 -4.92 117.98 121.54 3d54 s PHE 361 Ca 0.66 -1.21 -0.36 0.00 -0.60 0.00 0.00 56.93 55.42 3d54 s PHE 361 Cb -0.21 -2.07 -0.12 0.00 0.51 0.00 0.00 43.02 41.12 3d54 s PHE 361 CO 0.28 -0.64 1.98 0.39 0.70 0.00 0.00 175.22 177.93 3d54 n GLU 362 N 4.74 1.49 -2.30 0.44 1.02 -0.65 -4.88 120.64 120.50 3d54 n GLU 362 Ca -0.18 0.50 -0.41 0.00 -0.02 0.00 0.00 57.16 57.05 3d54 n GLU 362 Cb 0.50 -2.47 -0.03 0.00 -0.02 0.00 0.00 31.44 29.42 3d54 n GLU 362 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3d54 s GLU 363 N 4.88 3.19 0.34 3.49 2.02 -1.26 -4.51 118.70 126.85 3d54 s GLU 363 Ca 1.01 0.56 0.09 0.00 0.02 0.00 0.00 54.97 56.65 3d54 s GLU 363 Cb -0.83 -4.18 -0.05 0.00 0.10 0.00 0.00 34.13 29.17 3d54 s GLU 363 CO 0.54 -2.07 0.06 0.14 0.02 0.00 0.00 175.26 173.94 3d54 s VAL 364 N 6.65 2.80 -0.35 2.63 -7.23 -1.26 -4.95 120.40 118.68 3d54 s VAL 364 Ca 0.57 -1.87 -0.21 0.00 -1.81 0.00 0.00 61.98 58.65 3d54 s VAL 364 Cb -0.12 -2.86 0.00 0.00 0.56 0.00 0.00 36.38 33.96 3d54 s VAL 364 CO 0.25 -0.20 0.69 0.21 -0.31 0.00 0.00 175.10 175.74 3d54 s ASN 365 N -3.76 6.49 0.46 4.85 3.04 -1.26 -4.27 114.94 120.49 3d54 s ASN 365 Ca 0.36 0.28 0.26 0.00 0.04 0.00 0.00 52.86 53.80 3d54 s ASN 365 Cb -0.01 -2.35 0.68 0.00 -1.54 0.00 0.00 41.25 38.02 3d54 s ASN 365 CO 0.20 -0.62 1.73 0.00 -3.04 0.00 0.00 177.10 175.37 3d54 h ALA 366 N 8.41 1.00 -0.61 1.71 0.00 -1.93 -3.29 119.26 124.55 3d54 h ALA 366 Ca -0.26 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.73 3d54 h ALA 366 Cb 1.11 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 3d54 h ALA 366 CO 0.86 0.00 0.27 0.00 0.00 0.00 0.00 179.25 180.38 3d54 h ARG 367 N 0.00 0.48 -0.04 0.00 2.47 -1.93 -0.03 114.38 115.34 3d54 h ARG 367 Ca 0.00 -0.03 0.01 0.00 -1.26 0.00 0.00 59.98 58.70 3d54 h ARG 367 Cb 0.83 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 29.04 3d54 h ARG 367 CO 0.00 0.32 0.07 0.93 0.56 0.00 0.00 179.97 181.85 3d54 h GLU 368 N 0.49 0.00 0.02 0.04 5.08 -1.98 0.13 114.58 118.36 3d54 h GLU 368 Ca 0.30 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.28 3d54 h GLU 368 Cb 0.31 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.50 3d54 h GLU 368 CO -0.26 0.00 -2.36 0.28 -1.00 0.00 0.00 179.01 175.68 3d54 n VAL 369 N -3.50 1.52 0.77 3.13 0.31 -0.19 -4.50 118.33 115.87 3d54 n VAL 369 Ca -0.02 -0.64 0.12 0.00 -0.01 0.00 0.00 64.34 63.78 3d54 n VAL 369 Cb 0.16 -1.28 0.17 0.00 -0.91 0.00 0.00 33.84 31.98 3d54 n VAL 369 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 3d54 n PHE 370 N -3.19 0.24 1.61 3.52 -1.74 -0.22 -3.43 117.46 114.25 3d54 n PHE 370 Ca -0.40 0.07 0.07 0.00 -0.56 0.00 0.00 57.45 56.63 3d54 n PHE 370 Cb 1.03 -0.42 0.41 0.00 1.52 0.00 0.00 39.48 42.02 3d54 n PHE 370 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 3d54 n GLU 371 N -1.80 0.80 0.00 3.97 1.02 0.42 -0.96 120.64 124.09 3d54 n GLU 371 Ca 0.04 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.26 3d54 n GLU 371 Cb 0.39 -1.27 -0.02 0.00 -0.02 0.00 0.00 31.44 30.53 3d54 n GLU 371 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3d54 n GLN 372 N -0.77 1.68 -4.89 3.49 6.02 -1.22 -4.96 117.38 116.73 3d54 n GLN 372 Ca 0.10 -0.69 -0.32 0.00 -0.01 0.00 0.00 57.00 56.08 3d54 n GLN 372 Cb 0.05 -1.28 -0.13 0.00 1.02 0.00 0.00 30.24 29.90 3d54 n GLN 372 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3d54 s TYR 373 N -2.02 2.67 -0.74 1.08 4.12 -0.14 -4.81 117.35 117.52 3d54 s TYR 373 Ca 0.12 -0.18 -0.27 0.00 0.02 0.00 0.00 57.07 56.76 3d54 s TYR 373 Cb 0.13 -1.61 0.03 0.00 -1.52 0.00 0.00 41.96 39.00 3d54 s TYR 373 CO 0.45 0.18 1.27 0.34 0.02 0.00 0.00 175.55 177.81 3d54 s ASP 374 N -0.80 6.17 -0.28 2.29 -1.08 -1.26 -4.84 116.67 116.86 3d54 s ASP 374 Ca 0.12 -0.49 0.11 0.00 -0.52 0.00 0.00 52.55 51.78 3d54 s ASP 374 Cb -0.11 -2.55 0.67 0.00 -1.46 0.00 0.00 42.92 39.47 3d54 s ASP 374 CO 0.01 -1.82 1.68 0.00 0.52 0.00 0.00 175.17 175.56 3d54 n HIS 375 N 9.30 1.92 0.00 -5.34 1.44 -1.26 -2.29 115.22 118.99 3d54 n HIS 375 Ca 0.03 -1.17 0.00 0.00 -2.01 0.00 0.00 57.72 54.57 3d54 n HIS 375 Cb 0.49 -0.57 0.00 0.00 0.12 0.00 0.00 29.99 30.03 3d54 n HIS 375 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3d54 n MET 376 N -0.34 2.78 -1.69 -1.40 2.81 -1.26 -4.82 117.12 113.19 3d54 n MET 376 Ca 0.35 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.86 3d54 n MET 376 Cb 1.22 -0.30 0.06 0.00 -0.71 0.00 0.00 33.22 33.49 3d54 n MET 376 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 3d54 n VAL 377 N -0.38 4.22 0.00 2.03 3.14 -1.26 -2.28 118.33 123.81 3d54 n VAL 377 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 3d54 n VAL 377 Cb 0.00 -1.41 0.00 0.00 -1.06 0.00 0.00 33.84 31.37 3d54 n VAL 377 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3d54 n GLY 378 N 1.01 2.89 2.85 7.55 0.00 -1.26 -4.26 105.19 113.97 3d54 n GLY 378 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.13 3d54 n GLY 378 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3d54 n THR 379 N -2.00 0.00 0.77 2.61 5.66 -0.96 -4.85 114.28 115.51 3d54 n THR 379 Ca 0.00 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.11 3d54 n THR 379 Cb 0.00 -1.05 0.27 0.00 -1.55 0.00 0.00 70.33 68.00 3d54 n THR 379 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3d54 n ASP 380 N -0.93 2.67 -4.54 1.09 9.92 -1.26 -4.86 116.55 118.63 3d54 n ASP 380 Ca -0.03 -1.87 -0.42 0.00 -0.53 0.00 0.00 54.79 51.94 3d54 n ASP 380 Cb 0.48 -0.16 -0.07 0.00 -0.64 0.00 0.00 41.12 40.73 3d54 n ASP 380 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3d54 s THR 381 N -1.68 4.89 -0.15 -3.53 -4.23 -1.26 -2.25 115.64 107.42 3d54 s THR 381 Ca 0.35 0.31 -0.25 0.00 -1.18 0.00 0.00 61.69 60.92 3d54 s THR 381 Cb 0.20 -4.12 -0.24 0.00 1.34 0.00 0.00 72.50 69.69 3d54 s THR 381 CO 0.30 -0.43 0.58 0.58 -0.54 0.00 0.00 174.62 175.11 3d54 h VAL 382 N 5.76 1.45 -3.72 2.29 2.07 -1.57 -3.44 116.25 119.09 3d54 h VAL 382 Ca -0.26 -2.31 -0.69 0.00 0.82 0.00 0.00 66.70 64.26 3d54 h VAL 382 Cb 1.11 2.96 -0.32 0.00 -1.52 0.00 0.00 31.29 33.52 3d54 h VAL 382 CO 0.85 0.53 -0.66 -0.69 0.02 0.00 0.00 177.57 177.61 3d54 s VAL 383 N -2.29 3.23 0.61 2.57 1.01 -0.25 -4.96 120.40 120.32 3d54 s VAL 383 Ca -0.22 -1.37 -0.15 0.00 0.00 0.00 0.00 61.98 60.24 3d54 s VAL 383 Cb 0.01 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 3d54 s VAL 383 CO 0.67 -0.17 1.06 -2.16 0.00 0.00 0.00 175.10 174.50 3d54 s PRO 384 N 1.29 3.21 0.86 2.72 0.04 -1.26 -3.53 135.00 138.32 3d54 s PRO 384 Ca -0.03 1.19 -0.10 0.00 0.04 0.00 0.00 61.00 62.09 3d54 s PRO 384 Cb -0.20 -2.02 0.11 0.00 0.04 0.00 0.00 34.50 32.43 3d54 s PRO 384 CO -0.00 -0.90 1.12 -1.25 0.04 0.00 0.00 177.00 176.01 3d54 s PRO 385 N -4.21 1.50 0.00 0.56 0.04 -1.26 -4.56 135.00 127.07 3d54 s PRO 385 Ca 0.63 1.33 0.00 0.00 0.04 0.00 0.00 61.00 63.00 3d54 s PRO 385 Cb -0.16 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.58 3d54 s PRO 385 CO 0.40 -2.22 0.00 0.41 0.04 0.00 0.00 177.00 175.62 3d54 n GLY 386 N -0.45 2.80 2.82 0.56 0.00 -1.26 -4.98 105.19 104.68 3d54 n GLY 386 Ca 0.10 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 3d54 n GLY 386 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d54 n PHE 387 N 0.00 2.66 0.00 1.61 0.99 -1.26 -4.54 117.46 116.91 3d54 n PHE 387 Ca 0.00 -2.71 0.00 0.00 -0.00 0.00 0.00 57.45 54.74 3d54 n PHE 387 Cb 0.00 -1.68 0.00 0.00 -1.00 0.00 0.00 39.48 36.80 3d54 n PHE 387 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3d54 n GLY 388 N 2.01 1.31 3.72 1.37 0.00 -1.26 -4.78 105.19 107.56 3d54 n GLY 388 Ca 0.40 0.48 -0.38 0.00 0.00 0.00 0.00 46.02 46.52 3d54 n GLY 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 n ALA 389 N 9.35 1.12 -2.96 4.61 0.00 -1.26 -4.90 120.51 126.47 3d54 n ALA 389 Ca 0.00 0.03 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 3d54 n ALA 389 Cb 0.00 -2.30 -0.17 0.00 0.00 0.00 0.00 19.45 16.98 3d54 n ALA 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d54 s ALA 390 N -1.38 2.18 -0.08 0.00 0.00 -0.65 -4.88 121.76 116.95 3d54 s ALA 390 Ca 0.79 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.75 3d54 s ALA 390 Cb -0.40 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 3d54 s ALA 390 CO 0.43 0.36 -0.09 0.08 0.00 0.00 0.00 175.76 176.54 3d54 s VAL 391 N 0.07 3.50 0.31 0.00 1.01 -1.23 -1.32 120.40 122.73 3d54 s VAL 391 Ca -0.10 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.34 3d54 s VAL 391 Cb -0.16 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.78 3d54 s VAL 391 CO 0.06 0.57 0.02 0.23 0.00 0.00 0.00 175.10 175.99 3d54 n MET 392 N 2.58 1.11 -4.05 2.72 2.81 0.08 -1.09 117.12 121.28 3d54 n MET 392 Ca -0.18 -2.30 -0.13 0.00 -1.81 0.00 0.00 57.70 53.28 3d54 n MET 392 Cb 0.53 0.75 -0.04 0.00 -0.71 0.00 0.00 33.22 33.75 3d54 n MET 392 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 3d54 s ARG 393 N -3.11 1.88 -0.10 0.03 1.70 -0.95 -3.25 118.95 115.14 3d54 s ARG 393 Ca 0.03 -1.66 0.14 0.00 -0.47 0.00 0.00 55.73 53.77 3d54 s ARG 393 Cb 0.00 0.46 0.26 0.00 -0.57 0.00 0.00 34.95 35.10 3d54 s ARG 393 CO 0.02 -0.79 1.13 -0.89 -1.08 0.00 0.00 175.30 173.69 3d54 n ILE 394 N -0.53 1.34 -0.08 4.99 5.41 -0.84 -4.91 119.36 124.74 3d54 n ILE 394 Ca -0.00 -1.81 0.00 0.00 1.00 0.00 0.00 62.75 61.94 3d54 n ILE 394 Cb 0.62 0.04 0.00 0.00 -0.71 0.00 0.00 39.64 39.59 3d54 n ILE 394 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3d54 n LYS 395 N -0.87 0.00 0.00 0.38 5.02 -1.26 -4.23 118.16 117.20 3d54 n LYS 395 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 3d54 n LYS 395 Cb 0.71 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 3d54 n LYS 395 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3d54 n ARG 396 N -2.00 0.00 -0.12 1.97 3.00 -1.26 -5.05 116.66 113.19 3d54 n ARG 396 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 57.85 57.58 3d54 n ARG 396 Cb 0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 32.46 32.06 3d54 n ARG 396 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 3d54 n ASP 397 N -1.00 1.92 0.00 0.55 4.64 -1.26 -5.11 116.55 116.29 3d54 n ASP 397 Ca 0.00 0.38 0.00 0.00 -1.38 0.00 0.00 54.79 53.79 3d54 n ASP 397 Cb 0.00 -0.87 0.00 0.00 -1.04 0.00 0.00 41.12 39.21 3d54 n ASP 397 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3d54 n GLY 398 N 1.33 3.65 1.82 0.27 0.00 -1.26 -5.05 105.19 105.95 3d54 n GLY 398 Ca -0.44 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 43.81 3d54 n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d54 n GLY 399 N -1.90 2.92 2.99 -0.02 0.00 -0.57 -1.99 105.19 106.61 3d54 n GLY 399 Ca 0.00 -1.62 -0.09 0.00 0.00 0.00 0.00 46.02 44.30 3d54 n GLY 399 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3d54 s TYR 400 N -3.39 0.30 -0.12 1.61 1.13 -1.20 -2.74 117.35 112.94 3d54 s TYR 400 Ca 0.18 -0.52 0.02 0.00 -1.41 0.00 0.00 57.07 55.34 3d54 s TYR 400 Cb 0.00 -0.21 0.01 0.00 -1.10 0.00 0.00 41.96 40.66 3d54 s TYR 400 CO 0.13 -0.18 -0.17 -1.54 -2.51 0.00 0.00 175.55 171.28 3d54 s SER 401 N -1.46 2.63 -0.02 -0.18 1.04 -0.56 -0.74 113.70 114.41 3d54 s SER 401 Ca -0.15 -0.48 0.07 0.00 0.48 0.00 0.00 55.95 55.87 3d54 s SER 401 Cb -0.10 -1.19 -0.02 0.00 0.10 0.00 0.00 66.02 64.81 3d54 s SER 401 CO -0.01 0.04 -0.23 -0.76 0.98 0.00 0.00 173.24 173.26 3d54 s LEU 402 N 0.92 2.25 0.02 2.42 1.43 -0.44 -1.10 118.68 124.19 3d54 s LEU 402 Ca -0.07 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3d54 s LEU 402 Cb -0.15 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 3d54 s LEU 402 CO -0.01 0.32 -0.04 -0.69 0.23 0.00 0.00 176.35 176.15 3d54 s VAL 403 N -0.68 0.24 -0.10 -1.59 1.01 -1.15 -1.64 120.40 116.50 3d54 s VAL 403 Ca 0.11 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3d54 s VAL 403 Cb -0.10 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.95 3d54 s VAL 403 CO 0.00 -0.39 -0.12 -0.89 0.00 0.00 0.00 175.10 173.70 3d54 s THR 404 N -1.25 1.22 0.00 3.92 2.01 -1.26 -0.78 115.64 119.50 3d54 s THR 404 Ca -0.12 -0.47 -0.08 0.00 0.31 0.00 0.00 61.69 61.33 3d54 s THR 404 Cb -0.09 -1.15 0.00 0.00 0.01 0.00 0.00 72.50 71.27 3d54 s THR 404 CO -0.00 0.39 0.14 -2.28 -0.69 0.00 0.00 174.62 172.18 3d54 s HIS 405 N 1.13 0.04 -0.28 4.92 2.46 -0.65 -4.79 115.29 118.12 3d54 s HIS 405 Ca -0.05 -0.13 -0.03 0.00 0.47 0.00 0.00 55.06 55.31 3d54 s HIS 405 Cb -0.14 -0.05 0.16 0.00 -0.13 0.00 0.00 32.58 32.42 3d54 s HIS 405 CO -0.02 -0.30 0.54 -1.54 -2.47 0.00 0.00 174.74 170.95 3d54 s SER 406 N -1.42 -0.89 -1.08 9.88 1.04 -1.26 -0.69 113.70 119.28 3d54 s SER 406 Ca -0.14 0.84 -0.17 0.00 0.48 0.00 0.00 55.95 56.96 3d54 s SER 406 Cb -0.07 1.88 0.14 0.00 0.10 0.00 0.00 66.02 68.08 3d54 s SER 406 CO 0.01 -0.26 1.30 -0.13 0.98 0.00 0.00 173.24 175.15 3d54 s ARG 407 N 2.77 3.84 0.11 4.02 1.81 -1.26 -4.78 118.95 125.47 3d54 s ARG 407 Ca 0.13 -2.13 -0.07 0.00 -1.72 0.00 0.00 55.73 51.94 3d54 s ARG 407 Cb -0.14 -5.02 -0.13 0.00 -0.45 0.00 0.00 34.95 29.20 3d54 s ARG 407 CO -0.19 -1.80 1.27 0.00 -0.68 0.00 0.00 175.30 173.90 3d54 h ALA 408 N 8.03 0.30 -0.01 2.13 0.00 -1.90 -3.04 119.26 124.78 3d54 h ALA 408 Ca 0.24 -0.71 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 3d54 h ALA 408 Cb 0.95 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3d54 h ALA 408 CO 1.19 0.79 -0.35 0.38 0.00 0.00 0.00 179.25 181.26 3d54 h ASP 409 N 0.27 0.02 0.42 0.00 2.03 -1.93 -2.94 116.42 114.29 3d54 h ASP 409 Ca -0.09 -0.01 -0.31 0.00 -0.73 0.00 0.00 57.03 55.89 3d54 h ASP 409 Cb 1.62 -0.01 -0.02 0.00 -0.83 0.00 0.00 39.33 40.09 3d54 h ASP 409 CO 0.17 0.37 -1.65 -0.07 -1.03 0.00 0.00 179.24 177.03 3d54 h LEU 410 N 0.02 0.26 -2.71 0.15 3.38 -1.90 -3.34 115.31 111.16 3d54 h LEU 410 Ca -0.00 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3d54 h LEU 410 Cb 0.62 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3d54 h LEU 410 CO 0.05 1.39 0.00 0.00 0.09 0.00 0.00 178.44 179.96 3d54 h ALA 411 N 0.58 1.00 -0.05 1.53 0.00 -1.39 -1.54 119.26 119.39 3d54 h ALA 411 Ca -0.28 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3d54 h ALA 411 Cb 2.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.80 3d54 h ALA 411 CO 0.12 0.00 -0.09 1.25 0.00 0.00 0.00 179.25 180.53 3d54 h LEU 412 N 0.00 0.17 -0.13 0.00 6.46 -1.66 -3.10 115.31 117.06 3d54 h LEU 412 Ca 0.00 -0.56 -0.18 0.00 -0.12 0.00 0.00 57.88 57.01 3d54 h LEU 412 Cb 0.09 -0.05 0.01 0.00 -0.73 0.00 0.00 40.66 39.98 3d54 h LEU 412 CO 0.00 0.70 -0.63 1.56 -0.62 0.00 0.00 178.44 179.45 3d54 h GLN 413 N -0.36 0.65 -3.20 1.25 4.20 -1.63 -3.43 115.11 112.60 3d54 h GLN 413 Ca 0.00 -0.53 -0.43 0.00 0.06 0.00 0.00 58.65 57.74 3d54 h GLN 413 Cb 0.67 0.11 -0.40 0.00 0.30 0.00 0.00 27.48 28.16 3d54 h GLN 413 CO 0.02 1.15 -0.75 0.34 -0.67 0.00 0.00 178.83 178.92 3d54 s ASP 414 N -6.88 1.96 0.43 1.46 2.15 -0.63 -5.01 116.67 110.15 3d54 s ASP 414 Ca -0.12 -0.38 0.30 0.00 0.43 0.00 0.00 52.55 52.78 3d54 s ASP 414 Cb 0.07 -0.24 1.46 0.00 -0.30 0.00 0.00 42.92 43.90 3d54 s ASP 414 CO 0.86 -0.31 1.90 0.74 -0.17 0.00 0.00 175.17 178.20 3d54 h THR 415 N 6.43 0.00 0.00 1.71 2.02 -1.81 -1.67 112.91 119.59 3d54 h THR 415 Ca -0.14 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3d54 h THR 415 Cb 1.14 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 3d54 h THR 415 CO 0.25 0.00 -0.11 0.00 0.37 0.00 0.00 175.52 176.03 3d54 n TYR 416 N -2.59 0.00 0.28 3.16 9.36 -1.26 -3.85 117.16 122.27 3d54 n TYR 416 Ca -0.01 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.34 3d54 n TYR 416 Cb 0.14 -0.06 0.79 0.00 -0.63 0.00 0.00 39.34 39.58 3d54 n TYR 416 CO 0.00 0.00 0.00 -1.49 0.22 0.00 0.00 176.86 175.59 3d54 h TRP 417 N -0.11 0.00 -0.30 2.98 4.06 -1.88 0.13 115.95 120.83 3d54 h TRP 417 Ca 0.00 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.79 3d54 h TRP 417 Cb 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.27 3d54 h TRP 417 CO -0.05 0.03 -0.45 0.78 -3.56 0.00 0.00 178.44 175.20 3d54 h GLY 418 N 0.17 0.91 1.91 1.49 0.00 -1.51 -1.69 103.07 104.35 3d54 h GLY 418 Ca -0.00 -1.01 -0.18 0.00 0.00 0.00 0.00 47.33 46.13 3d54 h GLY 418 CO 0.00 0.91 -0.85 -0.84 0.00 0.00 0.00 176.54 175.76 3d54 h THR 419 N 0.61 1.55 -0.09 4.70 2.02 -1.57 -2.93 112.91 117.20 3d54 h THR 419 Ca 0.03 -2.75 -0.17 0.00 0.77 0.00 0.00 66.41 64.29 3d54 h THR 419 Cb 1.05 2.51 0.01 0.00 -1.74 0.00 0.00 68.15 69.97 3d54 h THR 419 CO 0.10 0.79 -0.61 0.25 0.37 0.00 0.00 175.52 176.43 3d54 h LEU 420 N 0.04 0.69 -1.89 2.58 5.85 -0.73 -3.07 115.31 118.78 3d54 h LEU 420 Ca -0.02 -0.66 -0.03 0.00 0.84 0.00 0.00 57.88 58.01 3d54 h LEU 420 Cb 1.48 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 3d54 h LEU 420 CO 0.12 1.25 -0.13 0.40 -0.34 0.00 0.00 178.44 179.74 3d54 h ILE 421 N 0.19 0.73 -0.55 4.05 2.04 -1.34 -2.16 117.51 120.45 3d54 h ILE 421 Ca -0.05 -0.51 -0.09 0.00 1.00 0.00 0.00 64.86 65.21 3d54 h ILE 421 Cb 1.26 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 3d54 h ILE 421 CO 0.12 0.13 -0.00 0.00 0.00 0.00 0.00 178.15 178.40 3d54 h ALA 422 N 1.87 0.75 -0.04 1.87 0.00 -1.42 0.32 119.26 122.60 3d54 h ALA 422 Ca -0.00 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.44 3d54 h ALA 422 Cb 0.30 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3d54 h ALA 422 CO 0.02 0.58 -0.72 0.28 0.00 0.00 0.00 179.25 179.41 3d54 h VAL 423 N 0.86 1.43 0.13 0.00 2.07 -1.35 -2.50 116.25 116.90 3d54 h VAL 423 Ca 0.16 -2.23 -0.21 0.00 0.82 0.00 0.00 66.70 65.23 3d54 h VAL 423 Cb 0.55 2.19 0.02 0.00 -1.52 0.00 0.00 31.29 32.52 3d54 h VAL 423 CO 0.03 0.66 -0.90 -0.07 0.02 0.00 0.00 177.57 177.31 3d54 h LEU 424 N 0.16 0.56 -0.44 2.57 3.38 -1.27 -3.12 115.31 117.16 3d54 h LEU 424 Ca -0.02 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.04 3d54 h LEU 424 Cb 1.27 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3d54 h LEU 424 CO 0.11 1.42 0.00 1.21 0.09 0.00 0.00 178.44 181.27 3d54 n GLU 425 N -4.06 0.13 -0.01 1.13 2.13 0.11 -1.79 120.64 118.27 3d54 n GLU 425 Ca -0.14 0.35 -0.16 0.00 0.66 0.00 0.00 57.16 57.88 3d54 n GLU 425 Cb 0.85 -1.74 -0.12 0.00 0.27 0.00 0.00 31.44 30.70 3d54 n GLU 425 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 3d54 h SER 426 N 0.00 0.30 0.44 4.31 0.02 -1.46 -2.87 113.55 114.28 3d54 h SER 426 Ca 0.00 -0.82 -0.03 0.00 -0.84 0.00 0.00 61.79 60.10 3d54 h SER 426 Cb 0.34 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 3d54 h SER 426 CO 0.00 1.08 -0.14 0.58 -1.14 0.00 0.00 176.83 177.21 3d54 h VAL 427 N -0.46 0.58 -0.12 2.27 2.07 -1.35 -1.97 116.25 117.27 3d54 h VAL 427 Ca -0.05 -0.62 -0.20 0.00 0.82 0.00 0.00 66.70 66.65 3d54 h VAL 427 Cb 1.16 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 3d54 h VAL 427 CO 0.07 0.14 -0.73 -0.09 0.02 0.00 0.00 177.57 176.98 3d54 h ARG 428 N 0.00 0.57 0.00 1.57 2.43 -1.33 -2.90 114.38 114.72 3d54 h ARG 428 Ca -0.00 -0.45 -0.10 0.00 -0.81 0.00 0.00 59.98 58.62 3d54 h ARG 428 Cb 0.39 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 3d54 h ARG 428 CO 0.02 1.08 -0.48 0.87 -1.51 0.00 0.00 179.97 179.95 3d54 h LYS 429 N 0.39 0.00 0.00 0.20 1.57 -1.14 -3.06 116.57 114.53 3d54 h LYS 429 Ca -0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 3d54 h LYS 429 Cb 1.32 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 3d54 h LYS 429 CO 0.14 0.48 -0.52 1.15 -0.57 0.00 0.00 179.45 180.12 3d54 h THR 430 N 0.00 0.96 0.00 -0.16 2.02 -1.34 -3.06 112.91 111.33 3d54 h THR 430 Ca -0.00 -2.13 0.00 0.00 0.77 0.00 0.00 66.41 65.04 3d54 h THR 430 Cb 1.22 2.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.95 3d54 h THR 430 CO 0.06 0.51 -0.64 0.18 0.37 0.00 0.00 175.52 176.00 3d54 n LEU 431 N -3.33 0.60 0.20 2.58 4.77 -1.10 -2.74 117.00 117.98 3d54 n LEU 431 Ca 0.01 0.09 0.06 0.00 -0.03 0.00 0.00 56.01 56.14 3d54 n LEU 431 Cb 0.69 -0.20 0.43 0.00 -2.33 0.00 0.00 43.42 42.01 3d54 n LEU 431 CO 0.40 0.04 0.76 0.28 -1.33 0.00 0.00 177.39 177.53 3d54 h SER 432 N 0.00 0.00 0.33 -1.43 0.02 -1.43 -2.99 113.55 108.05 3d54 h SER 432 Ca 0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 3d54 h SER 432 Cb 0.64 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 3d54 h SER 432 CO 0.00 0.32 -1.79 -0.37 -1.14 0.00 0.00 176.83 173.86 3d54 h VAL 433 N 0.00 0.83 0.00 2.27 -1.51 -1.71 -3.31 116.25 112.82 3d54 h VAL 433 Ca -0.00 -2.57 0.00 0.00 -1.23 0.00 0.00 66.70 62.90 3d54 h VAL 433 Cb 0.69 2.54 0.00 0.00 -2.13 0.00 0.00 31.29 32.39 3d54 h VAL 433 CO 0.04 0.75 0.00 0.61 -1.23 0.00 0.00 177.57 177.74 3d54 n GLY 434 N 1.77 1.19 3.33 5.19 0.00 -1.13 -4.03 105.19 111.52 3d54 n GLY 434 Ca -0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 3d54 n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 435 N -1.61 2.33 -0.33 4.61 0.00 -1.11 -4.74 121.76 120.91 3d54 s ALA 435 Ca 0.00 -1.03 -0.20 0.00 0.00 0.00 0.00 51.96 50.73 3d54 s ALA 435 Cb 0.00 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.34 3d54 s ALA 435 CO 0.00 0.45 0.63 -1.83 0.00 0.00 0.00 175.76 175.01 3d54 s GLU 436 N -0.31 3.79 0.48 0.00 -1.05 -0.95 -3.89 118.70 116.77 3d54 s GLU 436 Ca 0.01 0.18 -0.20 0.00 -0.15 0.00 0.00 54.97 54.81 3d54 s GLU 436 Cb -0.13 -3.77 -0.12 0.00 -0.44 0.00 0.00 34.13 29.67 3d54 s GLU 436 CO 0.02 -0.65 0.35 -2.30 0.95 0.00 0.00 175.26 173.63 3d54 n PRO 437 N 5.97 0.37 0.00 -4.83 -0.02 -1.26 -1.77 135.00 133.45 3d54 n PRO 437 Ca -0.01 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3d54 n PRO 437 Cb 0.49 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 3d54 n PRO 437 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3d54 n LEU 438 N 1.43 0.26 -4.02 2.45 4.77 0.43 -4.78 117.00 117.55 3d54 n LEU 438 Ca 0.11 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.99 3d54 n LEU 438 Cb 0.43 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 3d54 n LEU 438 CO 0.53 -0.14 0.13 0.00 -1.33 0.00 0.00 177.39 176.59 3d54 s ALA 439 N -1.94 -0.07 0.14 -1.18 0.00 -1.17 -4.36 121.76 113.18 3d54 s ALA 439 Ca 0.00 -0.98 0.06 0.00 0.00 0.00 0.00 51.96 51.04 3d54 s ALA 439 Cb 0.00 1.11 -0.04 0.00 0.00 0.00 0.00 23.12 24.19 3d54 s ALA 439 CO 0.00 -0.82 -0.13 0.42 0.00 0.00 0.00 175.76 175.22 3d54 s ILE 440 N -4.02 1.38 -0.10 0.00 1.01 -0.70 -2.09 121.20 116.67 3d54 s ILE 440 Ca 0.24 -1.89 -0.03 0.00 0.00 0.00 0.00 60.65 58.97 3d54 s ILE 440 Cb 0.00 -1.71 0.05 0.00 0.01 0.00 0.00 42.46 40.81 3d54 s ILE 440 CO 0.09 -0.52 0.10 0.28 0.00 0.00 0.00 174.94 174.89 3d54 s THR 441 N -2.56 -0.15 0.48 2.92 -1.32 -0.44 -1.76 115.64 112.81 3d54 s THR 441 Ca 0.13 0.19 -0.04 0.00 -1.21 0.00 0.00 61.69 60.76 3d54 s THR 441 Cb -0.02 -0.35 -0.02 0.00 -1.51 0.00 0.00 72.50 70.59 3d54 s THR 441 CO 0.03 -0.00 0.76 0.54 -2.21 0.00 0.00 174.62 173.74 3d54 s ASN 442 N 2.20 6.05 -0.29 8.08 2.20 -1.18 -1.37 114.94 130.62 3d54 s ASN 442 Ca 0.04 0.71 0.00 0.00 -0.94 0.00 0.00 52.86 52.67 3d54 s ASN 442 Cb -0.14 -1.98 0.18 0.00 -2.00 0.00 0.00 41.25 37.32 3d54 s ASN 442 CO -0.06 -0.67 0.56 0.00 -2.94 0.00 0.00 177.10 173.99 3d54 s VAL 444 N 2.79 5.09 -0.59 0.00 1.01 -0.52 -1.82 120.40 126.37 3d54 s VAL 444 Ca 0.17 0.94 0.05 0.00 0.00 0.00 0.00 61.98 63.15 3d54 s VAL 444 Cb -0.14 -3.84 0.32 0.00 0.00 0.00 0.00 36.38 32.72 3d54 s VAL 444 CO -0.22 0.14 0.90 0.59 0.00 0.00 0.00 175.10 176.51 3d54 n ASN 445 N 5.07 4.23 -4.91 3.32 3.02 -0.85 -1.16 115.26 123.98 3d54 n ASN 445 Ca -0.04 -3.62 -0.27 0.00 -0.03 0.00 0.00 54.58 50.62 3d54 n ASN 445 Cb 0.50 -0.58 0.02 0.00 -0.61 0.00 0.00 39.78 39.10 3d54 n ASN 445 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3d54 s TYR 446 N -3.23 3.38 0.00 3.10 5.04 -1.24 -3.65 117.35 120.75 3d54 s TYR 446 Ca 0.47 0.70 0.00 0.00 -2.44 0.00 0.00 57.07 55.80 3d54 s TYR 446 Cb 0.25 -2.54 0.00 0.00 0.35 0.00 0.00 41.96 40.03 3d54 s TYR 446 CO -0.11 -0.57 0.00 0.41 -1.34 0.00 0.00 175.55 173.94 3d54 n GLY 447 N -2.43 0.41 3.60 8.97 0.00 -1.26 -3.77 105.19 110.71 3d54 n GLY 447 Ca 0.03 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3d54 n GLY 447 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d54 s ASP 448 N -1.12 6.56 0.00 1.61 -1.08 -1.26 -1.23 116.67 120.15 3d54 s ASP 448 Ca 0.00 0.48 0.08 0.00 -0.52 0.00 0.00 52.55 52.59 3d54 s ASP 448 Cb 0.00 -2.36 0.37 0.00 -1.46 0.00 0.00 42.92 39.46 3d54 s ASP 448 CO 0.00 -0.56 1.25 -0.81 0.52 0.00 0.00 175.17 175.57 3d54 n PRO 449 N 6.05 1.20 -0.04 4.34 -0.04 -1.26 -3.07 135.00 142.18 3d54 n PRO 449 Ca 0.01 -0.31 -0.04 0.00 -0.04 0.00 0.00 63.50 63.12 3d54 n PRO 449 Cb 0.48 -1.15 -0.07 0.00 -0.04 0.00 0.00 33.50 32.73 3d54 n PRO 449 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3d54 n ASP 450 N -0.32 2.96 0.11 3.54 8.00 -1.26 -3.79 116.55 125.80 3d54 n ASP 450 Ca 0.07 -0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.55 3d54 n ASP 450 Cb 0.09 0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 41.86 3d54 n ASP 450 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3d54 h VAL 451 N 0.00 1.15 -1.27 2.53 2.07 -2.00 -3.39 116.25 115.35 3d54 h VAL 451 Ca -0.22 -2.64 -0.43 0.00 0.82 0.00 0.00 66.70 64.22 3d54 h VAL 451 Cb 1.51 2.56 -0.30 0.00 -1.52 0.00 0.00 31.29 33.54 3d54 h VAL 451 CO 0.01 0.66 -0.89 -0.67 0.02 0.00 0.00 177.57 176.70 3d54 n ASP 452 N -3.26 -0.90 0.00 0.57 -0.08 -1.18 -4.96 116.55 106.75 3d54 n ASP 452 Ca 0.01 -2.95 0.09 0.00 -1.51 0.00 0.00 54.79 50.42 3d54 n ASP 452 Cb 0.81 0.28 0.52 0.00 2.34 0.00 0.00 41.12 45.07 3d54 n ASP 452 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3d54 n PRO 453 N 1.38 0.64 -0.03 -0.67 -0.02 -1.25 -3.02 135.00 132.03 3d54 n PRO 453 Ca 0.17 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.48 3d54 n PRO 453 Cb 0.58 -1.43 -0.14 0.00 -0.02 0.00 0.00 33.50 32.50 3d54 n PRO 453 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3d54 h VAL 454 N 0.00 1.67 -0.04 -1.45 2.07 -1.90 -3.32 116.25 113.28 3d54 h VAL 454 Ca 0.00 -2.41 -0.07 0.00 0.82 0.00 0.00 66.70 65.04 3d54 h VAL 454 Cb 0.00 3.30 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 3d54 h VAL 454 CO 0.00 0.64 -0.28 1.23 0.02 0.00 0.00 177.57 179.18 3d54 h GLY 455 N -0.77 0.08 1.27 2.17 0.00 -1.95 -2.81 103.07 101.06 3d54 h GLY 455 Ca -0.06 -0.06 -0.09 0.00 0.00 0.00 0.00 47.33 47.12 3d54 h GLY 455 CO 0.05 0.05 -0.06 -2.00 0.00 0.00 0.00 176.54 174.58 3d54 h LEU 456 N 0.07 0.85 -0.45 3.11 5.85 -1.71 -2.84 115.31 120.19 3d54 h LEU 456 Ca 0.01 -0.24 -0.17 0.00 0.84 0.00 0.00 57.88 58.32 3d54 h LEU 456 Cb 0.54 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 3d54 h LEU 456 CO 0.04 0.95 -0.55 0.28 -0.34 0.00 0.00 178.44 178.81 3d54 h SER 457 N 0.79 0.71 0.69 1.25 0.02 -1.61 -1.28 113.55 114.13 3d54 h SER 457 Ca 0.14 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 3d54 h SER 457 Cb 0.56 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 3d54 h SER 457 CO 0.03 1.12 -0.03 0.00 -1.14 0.00 0.00 176.83 176.82 3d54 h ALA 458 N 0.89 1.03 0.00 3.77 0.00 -1.33 -0.23 119.26 123.39 3d54 h ALA 458 Ca 0.01 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 3d54 h ALA 458 Cb 1.12 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 3d54 h ALA 458 CO 0.11 0.03 -1.20 1.98 0.00 0.00 0.00 179.25 180.17 3d54 h MET 459 N 0.00 0.00 -0.11 0.00 -1.53 -1.29 -3.07 114.93 108.93 3d54 h MET 459 Ca -0.00 0.00 -0.08 0.00 -3.44 0.00 0.00 59.70 56.18 3d54 h MET 459 Cb 0.38 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.42 3d54 h MET 459 CO 0.00 1.00 -0.30 0.52 0.14 0.00 0.00 176.91 178.27 3d54 h MET 460 N -1.00 0.20 0.00 0.39 2.86 -1.12 -1.64 114.93 114.62 3d54 h MET 460 Ca -0.33 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.21 3d54 h MET 460 Cb 1.29 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.93 3d54 h MET 460 CO -0.20 0.48 -0.40 1.15 1.06 0.00 0.00 176.91 179.00 3d54 h THR 461 N 0.18 0.20 0.00 2.22 2.02 -1.22 -2.09 112.91 114.21 3d54 h THR 461 Ca 0.03 -1.30 -0.07 0.00 0.77 0.00 0.00 66.41 65.83 3d54 h THR 461 Cb 0.62 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 3d54 h THR 461 CO 0.04 0.11 -0.34 0.00 0.37 0.00 0.00 175.52 175.70 3d54 h ALA 462 N 1.87 0.84 0.00 6.16 0.00 -1.24 -2.07 119.26 124.83 3d54 h ALA 462 Ca -0.01 -0.31 -0.26 0.00 0.00 0.00 0.00 54.91 54.33 3d54 h ALA 462 Cb 1.11 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 3d54 h ALA 462 CO 0.02 0.43 -1.65 -0.11 0.00 0.00 0.00 179.25 177.93 3d54 n LEU 463 N -3.28 0.84 -0.04 0.00 -0.00 -0.70 -3.08 117.00 110.75 3d54 n LEU 463 Ca 0.02 0.39 -0.14 0.00 -0.00 0.00 0.00 56.01 56.28 3d54 n LEU 463 Cb 0.60 0.15 -0.09 0.00 -0.00 0.00 0.00 43.42 44.08 3d54 n LEU 463 CO 0.37 0.33 0.56 0.50 -0.00 0.00 0.00 177.39 179.14 3d54 h LYS 464 N 0.00 0.21 -0.18 1.96 3.64 -1.27 -3.07 116.57 117.86 3d54 h LYS 464 Ca -0.26 -0.13 -0.15 0.00 -1.27 0.00 0.00 60.65 58.83 3d54 h LYS 464 Cb 1.91 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.74 3d54 h LYS 464 CO 0.07 0.72 -0.52 -0.91 -2.27 0.00 0.00 179.45 176.53 3d54 h ASN 465 N -0.28 0.56 0.95 4.20 -0.26 -1.55 -2.96 115.58 116.24 3d54 h ASN 465 Ca 0.00 -0.29 0.00 0.00 -0.56 0.00 0.00 56.30 55.45 3d54 h ASN 465 Cb 0.71 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 3d54 h ASN 465 CO 0.03 0.98 0.00 0.00 -1.06 0.00 0.00 177.43 177.38 3d54 h ALA 466 N 1.03 1.00 0.00 -0.83 0.00 -1.62 -1.68 119.26 117.17 3d54 h ALA 466 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d54 h ALA 466 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3d54 h ALA 466 CO 0.10 0.00 -1.11 0.00 0.00 0.00 0.00 179.25 178.23 3d54 n GLU 468 N -2.29 0.64 -0.04 0.00 1.02 -0.95 -2.41 120.64 116.62 3d54 n GLU 468 Ca 0.00 0.22 -0.16 0.00 -0.02 0.00 0.00 57.16 57.21 3d54 n GLU 468 Cb 0.50 -1.75 -0.07 0.00 -0.02 0.00 0.00 31.44 30.10 3d54 n GLU 468 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3d54 h PHE 469 N 0.00 0.80 0.00 -0.32 3.04 -1.45 -3.23 116.94 115.79 3d54 h PHE 469 Ca -0.30 -0.33 0.00 0.00 3.98 0.00 0.00 57.97 61.32 3d54 h PHE 469 Cb 1.94 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 40.32 3d54 h PHE 469 CO 0.00 1.12 -0.98 -1.13 -2.02 0.00 0.00 178.31 175.30 3d54 n SER 470 N -4.18 0.62 -0.70 0.41 3.41 -1.20 -4.97 113.62 107.01 3d54 n SER 470 Ca -0.07 -0.17 -0.09 0.00 -0.26 0.00 0.00 58.87 58.28 3d54 n SER 470 Cb 0.61 0.72 -0.04 0.00 -0.26 0.00 0.00 64.21 65.23 3d54 n SER 470 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d54 n GLY 471 N 1.37 1.06 3.51 5.00 0.00 -1.01 -4.99 105.19 110.12 3d54 n GLY 471 Ca 0.02 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 3d54 n GLY 471 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d54 s VAL 472 N -2.24 5.13 0.82 1.61 1.01 -1.01 -4.98 120.40 120.74 3d54 s VAL 472 Ca 0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 3d54 s VAL 472 Cb 0.00 -3.93 0.08 0.00 0.00 0.00 0.00 36.38 32.53 3d54 s VAL 472 CO 0.00 -0.25 1.09 -2.16 0.00 0.00 0.00 175.10 173.78 3d54 s PRO 473 N 2.07 1.90 -0.25 2.72 0.04 -1.26 -4.60 135.00 135.62 3d54 s PRO 473 Ca 0.12 0.75 -0.08 0.00 0.04 0.00 0.00 61.00 61.83 3d54 s PRO 473 Cb -0.17 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3d54 s PRO 473 CO 0.12 -1.78 0.10 0.08 0.04 0.00 0.00 177.00 175.56 3d54 s VAL 474 N -3.06 4.54 -0.07 -0.36 1.01 0.00 -1.73 120.40 120.74 3d54 s VAL 474 Ca 0.61 -0.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.40 3d54 s VAL 474 Cb -0.16 -3.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.02 3d54 s VAL 474 CO 0.55 0.33 0.40 0.00 0.00 0.00 0.00 175.10 176.38 3d54 h ALA 475 N 8.20 -0.24 -2.49 5.51 0.00 -1.66 -3.33 119.26 125.24 3d54 h ALA 475 Ca -0.38 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.31 3d54 h ALA 475 Cb 1.18 0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.92 3d54 h ALA 475 CO 0.58 -0.24 -0.48 -1.54 0.00 0.00 0.00 179.25 177.57 3d54 s SER 476 N -5.34 0.20 0.08 0.00 1.04 -1.26 -3.76 113.70 104.66 3d54 s SER 476 Ca -0.06 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.44 3d54 s SER 476 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 3d54 s SER 476 CO 0.19 -0.77 0.10 0.61 0.98 0.00 0.00 173.24 174.36 3d54 n GLY 477 N -0.10 3.10 3.56 7.32 0.00 -1.26 -3.11 105.19 114.70 3d54 n GLY 477 Ca -0.10 -1.49 -0.08 0.00 0.00 0.00 0.00 46.02 44.35 3d54 n GLY 477 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3d54 s ASN 478 N -1.50 -0.36 -0.27 1.61 2.47 -1.07 -4.84 114.94 110.99 3d54 s ASN 478 Ca 0.07 -0.12 -0.08 0.00 0.42 0.00 0.00 52.86 53.16 3d54 s ASN 478 Cb -0.00 0.47 0.12 0.00 -1.45 0.00 0.00 41.25 40.39 3d54 s ASN 478 CO 0.05 -0.79 0.56 0.00 -3.72 0.00 0.00 177.10 173.20 3d54 s ALA 479 N -3.32 -1.74 -0.34 1.71 0.00 -1.26 -1.44 121.76 115.37 3d54 s ALA 479 Ca 0.06 1.96 0.02 0.00 0.00 0.00 0.00 51.96 54.00 3d54 s ALA 479 Cb -0.01 -1.67 0.09 0.00 0.00 0.00 0.00 23.12 21.52 3d54 s ALA 479 CO -0.07 -0.93 0.05 -1.12 0.00 0.00 0.00 175.76 173.69 3d54 s SER 480 N 2.79 4.84 0.58 0.00 0.01 -0.31 -4.84 113.70 116.77 3d54 s SER 480 Ca -0.01 -1.89 0.10 0.00 1.31 0.00 0.00 55.95 55.46 3d54 s SER 480 Cb -0.12 -1.67 0.09 0.00 0.21 0.00 0.00 66.02 64.52 3d54 s SER 480 CO -0.17 -0.37 0.78 -0.76 0.41 0.00 0.00 173.24 173.13 3d54 s LEU 481 N 1.03 3.06 -0.91 2.44 1.43 -1.26 -3.67 118.68 120.80 3d54 s LEU 481 Ca 0.05 -0.88 -0.06 0.00 -1.03 0.00 0.00 54.13 52.21 3d54 s LEU 481 Cb -0.20 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.45 3d54 s LEU 481 CO -0.06 -1.35 0.80 -1.22 0.23 0.00 0.00 176.35 174.75 3d54 n TYR 482 N -2.24 -1.93 -3.09 0.29 4.01 -0.36 -4.99 117.16 108.84 3d54 n TYR 482 Ca 0.15 0.68 -0.45 0.00 -0.16 0.00 0.00 57.90 58.13 3d54 n TYR 482 Cb 0.62 -3.74 -0.03 0.00 -0.31 0.00 0.00 39.34 35.88 3d54 n TYR 482 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3d54 s ASN 483 N -3.24 6.53 0.03 7.72 0.01 -1.24 -4.92 114.94 119.82 3d54 s ASN 483 Ca 0.38 -2.04 0.00 0.00 -0.71 0.00 0.00 52.86 50.50 3d54 s ASN 483 Cb -0.17 -2.32 -0.02 0.00 0.41 0.00 0.00 41.25 39.15 3d54 s ASN 483 CO 0.49 -0.94 -0.04 0.42 -1.51 0.00 0.00 177.10 175.52 3d54 s THR 484 N 1.98 0.21 -0.03 1.60 -4.23 -1.26 -2.95 115.64 110.97 3d54 s THR 484 Ca 0.22 -0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 59.74 3d54 s THR 484 Cb -0.12 -0.40 0.03 0.00 1.34 0.00 0.00 72.50 73.35 3d54 s THR 484 CO -0.04 -0.50 0.02 -0.47 -0.54 0.00 0.00 174.62 173.09 3d54 s TYR 485 N -1.56 0.13 0.00 3.99 5.04 -1.16 -4.74 117.35 119.05 3d54 s TYR 485 Ca -0.14 0.10 0.00 0.00 -2.44 0.00 0.00 57.07 54.60 3d54 s TYR 485 Cb -0.09 -0.33 0.00 0.00 0.35 0.00 0.00 41.96 41.89 3d54 s TYR 485 CO -0.01 -0.12 0.00 1.04 -1.34 0.00 0.00 175.55 175.12 3d54 n GLN 486 N 4.32 -0.31 0.00 4.97 1.13 -1.26 -2.20 117.38 124.03 3d54 n GLN 486 Ca -0.24 0.08 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 3d54 n GLN 486 Cb 0.50 -3.60 0.00 0.00 0.11 0.00 0.00 30.24 27.25 3d54 n GLN 486 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d54 n GLY 487 N -1.71 2.29 3.67 1.08 0.00 -1.26 -5.06 105.19 104.20 3d54 n GLY 487 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3d54 n GLY 487 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d54 s LYS 488 N -0.91 4.25 0.81 1.61 2.20 -0.93 -4.96 119.74 121.80 3d54 s LYS 488 Ca 0.00 1.74 -0.11 0.00 -0.36 0.00 0.00 55.97 57.24 3d54 s LYS 488 Cb 0.00 -3.74 0.08 0.00 -1.51 0.00 0.00 37.83 32.66 3d54 s LYS 488 CO 0.00 -0.67 1.09 -1.25 -0.36 0.00 0.00 175.35 174.16 3d54 s PRO 489 N 3.27 1.93 0.32 4.03 0.04 -1.26 -3.00 135.00 140.33 3d54 s PRO 489 Ca 0.57 1.07 -0.18 0.00 0.04 0.00 0.00 61.00 62.49 3d54 s PRO 489 Cb -0.24 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 3d54 s PRO 489 CO 0.18 -1.84 0.80 -1.50 0.04 0.00 0.00 177.00 174.67 3d54 s ILE 490 N -2.91 4.55 0.07 0.56 2.07 -1.15 -4.98 121.20 119.40 3d54 s ILE 490 Ca 0.62 1.23 -0.30 0.00 -1.41 0.00 0.00 60.65 60.79 3d54 s ILE 490 Cb -0.17 -3.71 -0.09 0.00 0.13 0.00 0.00 42.46 38.61 3d54 s ILE 490 CO 0.56 -0.08 1.92 -2.84 -1.91 0.00 0.00 174.94 172.60 3d54 s PRO 491 N -2.68 4.14 -0.70 3.50 0.02 -1.26 -4.30 135.00 133.72 3d54 s PRO 491 Ca 0.53 2.62 -0.26 0.00 0.02 0.00 0.00 61.00 63.91 3d54 s PRO 491 Cb -0.12 -3.96 -0.14 0.00 0.02 0.00 0.00 34.50 30.30 3d54 s PRO 491 CO 0.18 -0.92 2.45 -0.35 -0.33 0.00 0.00 177.00 178.03 3d54 n PRO 492 N 6.88 0.64 -3.88 5.54 -0.04 -1.26 -4.90 135.00 137.98 3d54 n PRO 492 Ca 0.19 -0.19 -0.36 0.00 -0.04 0.00 0.00 63.50 63.10 3d54 n PRO 492 Cb 0.40 -2.91 -0.13 0.00 -0.04 0.00 0.00 33.50 30.82 3d54 n PRO 492 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3d54 s THR 493 N 11.14 4.03 -0.21 0.52 2.01 -1.24 -4.75 115.64 127.13 3d54 s THR 493 Ca 1.07 -0.27 -0.05 0.00 0.31 0.00 0.00 61.69 62.75 3d54 s THR 493 Cb -0.44 -2.86 -0.02 0.00 0.01 0.00 0.00 72.50 69.20 3d54 s THR 493 CO 0.29 0.38 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.37 3d54 s LEU 494 N 1.39 3.09 -0.29 4.42 2.96 -1.26 -2.00 118.68 126.99 3d54 s LEU 494 Ca 0.05 -0.29 -0.11 0.00 -0.22 0.00 0.00 54.13 53.55 3d54 s LEU 494 Cb -0.15 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 3d54 s LEU 494 CO 0.02 0.02 0.20 -0.69 -1.32 0.00 0.00 176.35 174.57 3d54 s VAL 495 N 1.26 5.30 -0.03 1.68 1.01 -0.76 -4.36 120.40 124.51 3d54 s VAL 495 Ca 0.03 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 3d54 s VAL 495 Cb -0.14 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3d54 s VAL 495 CO -0.00 0.20 0.18 -0.69 0.00 0.00 0.00 175.10 174.79 3d54 s VAL 496 N 1.75 5.45 -0.21 2.92 1.01 0.14 -2.26 120.40 129.20 3d54 s VAL 496 Ca 0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 3d54 s VAL 496 Cb -0.16 -3.51 0.06 0.00 0.00 0.00 0.00 36.38 32.77 3d54 s VAL 496 CO 0.11 0.39 0.02 -0.83 0.00 0.00 0.00 175.10 174.79 3d54 s GLY 497 N -1.75 0.82 0.45 4.51 0.00 -0.47 -1.64 107.32 109.25 3d54 s GLY 497 Ca 0.25 -0.86 -0.05 0.00 0.00 0.00 0.00 44.72 44.06 3d54 s GLY 497 CO 0.16 1.35 0.75 1.06 0.00 0.00 0.00 173.10 176.42 3d54 s MET 498 N 1.77 3.56 -0.06 2.90 -1.94 0.03 -1.33 119.30 124.24 3d54 s MET 498 Ca -0.01 0.16 -0.03 0.00 -1.71 0.00 0.00 55.69 54.10 3d54 s MET 498 Cb -0.17 -2.42 0.03 0.00 2.01 0.00 0.00 34.83 34.28 3d54 s MET 498 CO -0.09 -0.14 0.13 -1.17 -0.01 0.00 0.00 175.02 173.74 3d54 s LEU 499 N -4.58 1.04 0.03 -0.03 0.20 -0.89 -2.94 118.68 111.51 3d54 s LEU 499 Ca 0.47 0.26 -0.03 0.00 0.69 0.00 0.00 54.13 55.52 3d54 s LEU 499 Cb -0.10 0.36 -0.02 0.00 -0.43 0.00 0.00 46.19 45.99 3d54 s LEU 499 CO 0.42 -0.11 0.03 -0.83 -0.29 0.00 0.00 176.35 175.57 3d54 s GLY 500 N 0.77 0.26 -0.08 7.98 0.00 -0.26 -0.43 107.32 115.56 3d54 s GLY 500 Ca -0.06 -0.69 -0.17 0.00 0.00 0.00 0.00 44.72 43.80 3d54 s GLY 500 CO -0.04 -0.80 0.43 1.25 0.00 0.00 0.00 173.10 173.95 3d54 s LYS 501 N -2.47 4.20 0.11 2.90 2.20 -0.73 -1.49 119.74 124.45 3d54 s LYS 501 Ca -0.06 0.40 -0.16 0.00 -0.36 0.00 0.00 55.97 55.79 3d54 s LYS 501 Cb -0.02 -3.36 0.03 0.00 -1.51 0.00 0.00 37.83 32.97 3d54 s LYS 501 CO -0.04 0.34 0.39 0.54 -0.36 0.00 0.00 175.35 176.22 3d54 s VAL 502 N 0.03 0.07 -0.30 4.02 0.11 -1.11 -2.23 120.40 120.99 3d54 s VAL 502 Ca 0.24 -0.59 -0.13 0.00 -2.93 0.00 0.00 61.98 58.57 3d54 s VAL 502 Cb -0.15 -1.14 -0.03 0.00 -1.53 0.00 0.00 36.38 33.52 3d54 s VAL 502 CO 0.11 -0.33 0.29 0.21 -3.33 0.00 0.00 175.10 172.05 3d54 s ASN 503 N -2.69 6.12 0.05 3.54 3.04 -1.26 -1.52 114.94 122.22 3d54 s ASN 503 Ca 0.02 -0.06 0.03 0.00 0.04 0.00 0.00 52.86 52.89 3d54 s ASN 503 Cb 0.02 -2.16 0.16 0.00 -1.54 0.00 0.00 41.25 37.72 3d54 s ASN 503 CO -0.11 -0.19 1.01 -0.81 -3.04 0.00 0.00 177.10 173.97 3d54 n PRO 504 N 5.22 0.02 -0.02 0.43 -0.04 -1.26 -1.63 135.00 137.72 3d54 n PRO 504 Ca -0.11 0.45 -0.16 0.00 -0.04 0.00 0.00 63.50 63.64 3d54 n PRO 504 Cb 0.51 -1.65 -0.14 0.00 -0.04 0.00 0.00 33.50 32.18 3d54 n PRO 504 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3d54 n GLN 505 N -1.54 0.71 -1.85 0.54 3.00 -1.26 -4.40 117.38 112.58 3d54 n GLN 505 Ca -0.00 0.26 -0.38 0.00 -0.01 0.00 0.00 57.00 56.87 3d54 n GLN 505 Cb 0.09 -1.72 -0.02 0.00 0.00 0.00 0.00 30.24 28.59 3d54 n GLN 505 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3d54 n LYS 506 N -3.28 4.22 -4.53 -1.09 5.02 -0.65 -4.92 118.16 112.93 3d54 n LYS 506 Ca -0.27 -3.17 -0.29 0.00 -2.02 0.00 0.00 58.31 52.56 3d54 n LYS 506 Cb 1.05 -2.58 -0.13 0.00 -0.02 0.00 0.00 35.03 33.35 3d54 n LYS 506 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3d54 s VAL 507 N -0.91 2.30 -0.40 -0.18 -7.23 -1.26 -4.79 120.40 107.93 3d54 s VAL 507 Ca 0.56 -1.62 -0.27 0.00 -1.81 0.00 0.00 61.98 58.85 3d54 s VAL 507 Cb 0.21 -1.99 0.02 0.00 0.56 0.00 0.00 36.38 35.18 3d54 s VAL 507 CO -0.10 0.17 1.00 0.00 -0.31 0.00 0.00 175.10 175.85 3d54 s ALA 508 N -1.00 3.33 -0.16 1.32 0.00 -1.26 -5.03 121.76 118.97 3d54 s ALA 508 Ca 0.14 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.62 3d54 s ALA 508 Cb -0.10 -3.66 -0.01 0.00 0.00 0.00 0.00 23.12 19.35 3d54 s ALA 508 CO 0.05 -1.83 -0.09 0.15 0.00 0.00 0.00 175.76 174.04 3d54 s LYS 509 N 3.78 3.41 -0.54 0.00 -0.14 -1.26 -5.00 119.74 119.99 3d54 s LYS 509 Ca 0.41 -0.65 -0.30 0.00 -1.36 0.00 0.00 55.97 54.07 3d54 s LYS 509 Cb -0.10 -2.78 -0.12 0.00 -1.68 0.00 0.00 37.83 33.15 3d54 s LYS 509 CO 0.23 0.08 2.40 -0.35 -0.76 0.00 0.00 175.35 176.95 3d54 n PRO 510 N 3.93 0.88 -4.06 -1.68 -0.04 -1.26 -4.97 135.00 127.81 3d54 n PRO 510 Ca -0.18 0.12 -0.25 0.00 -0.04 0.00 0.00 63.50 63.15 3d54 n PRO 510 Cb 0.52 -2.69 -0.04 0.00 -0.04 0.00 0.00 33.50 31.25 3d54 n PRO 510 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 3d54 s LYS 511 N 7.68 3.05 -0.28 0.54 -2.85 -1.26 -5.05 119.74 121.56 3d54 s LYS 511 Ca 1.10 -0.85 -0.29 0.00 -1.00 0.00 0.00 55.97 54.94 3d54 s LYS 511 Cb -0.64 -2.71 -0.02 0.00 -2.06 0.00 0.00 37.83 32.40 3d54 s LYS 511 CO 0.39 0.47 1.76 -2.14 0.10 0.00 0.00 175.35 175.93 3d54 s PRO 512 N -3.36 3.50 0.18 1.78 0.02 -1.26 -4.94 135.00 130.91 3d54 s PRO 512 Ca 0.32 1.55 -0.00 0.00 0.02 0.00 0.00 61.00 62.89 3d54 s PRO 512 Cb -0.10 -4.15 0.00 0.00 0.02 0.00 0.00 34.50 30.27 3d54 s PRO 512 CO 0.25 -1.66 0.23 -1.13 -0.33 0.00 0.00 177.00 174.36 3d54 n SER 513 N 9.68 -0.64 -4.86 2.53 3.41 -1.22 -5.00 113.62 117.52 3d54 n SER 513 Ca 0.22 -1.98 -0.37 0.00 -0.26 0.00 0.00 58.87 56.47 3d54 n SER 513 Cb 0.46 1.22 -0.06 0.00 -0.26 0.00 0.00 64.21 65.57 3d54 n SER 513 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3d54 s LYS 514 N -2.45 3.67 -0.15 4.33 1.02 -1.21 -0.99 119.74 123.96 3d54 s LYS 514 Ca 0.16 0.11 -0.13 0.00 0.02 0.00 0.00 55.97 56.12 3d54 s LYS 514 Cb -0.00 -3.18 -0.05 0.00 -0.52 0.00 0.00 37.83 34.08 3d54 s LYS 514 CO 0.11 0.72 0.29 0.08 -0.92 0.00 0.00 175.35 175.63 3d54 s VAL 515 N -1.10 5.30 -0.06 3.17 1.01 -0.55 -3.50 120.40 124.67 3d54 s VAL 515 Ca 0.21 0.55 0.04 0.00 0.00 0.00 0.00 61.98 62.78 3d54 s VAL 515 Cb -0.14 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 3d54 s VAL 515 CO 0.10 0.42 -0.20 -0.36 0.00 0.00 0.00 175.10 175.06 3d54 s PHE 516 N 0.26 2.03 -0.47 5.22 0.40 0.25 -0.82 117.98 124.83 3d54 s PHE 516 Ca 0.17 -0.67 -0.18 0.00 -0.60 0.00 0.00 56.93 55.65 3d54 s PHE 516 Cb -0.13 -1.36 0.05 0.00 0.51 0.00 0.00 43.02 42.08 3d54 s PHE 516 CO 0.04 -0.25 0.54 0.00 0.70 0.00 0.00 175.22 176.26 3d54 s ALA 517 N 0.14 3.42 -0.10 5.36 0.00 0.15 0.19 121.76 130.93 3d54 s ALA 517 Ca -0.09 -1.72 -0.03 0.00 0.00 0.00 0.00 51.96 50.13 3d54 s ALA 517 Cb -0.14 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3d54 s ALA 517 CO 0.04 -1.84 0.00 0.14 0.00 0.00 0.00 175.76 174.11 3d54 s VAL 518 N 2.35 4.33 -0.05 0.00 -7.23 -0.17 -2.04 120.40 117.58 3d54 s VAL 518 Ca 0.13 -0.23 0.00 0.00 -1.81 0.00 0.00 61.98 60.07 3d54 s VAL 518 Cb -0.19 -2.84 0.00 0.00 0.56 0.00 0.00 36.38 33.91 3d54 s VAL 518 CO 0.12 0.58 0.00 0.61 -0.31 0.00 0.00 175.10 176.10 3d54 n GLY 519 N 2.43 0.36 3.42 2.32 0.00 -0.42 -1.27 105.19 112.02 3d54 n GLY 519 Ca -0.18 -2.31 -0.28 0.00 0.00 0.00 0.00 46.02 43.25 3d54 n GLY 519 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3d54 s TRP 520 N -0.22 2.32 0.44 1.61 1.48 -0.88 -4.32 118.94 119.36 3d54 s TRP 520 Ca 0.00 -0.36 0.11 0.00 -1.06 0.00 0.00 56.10 54.79 3d54 s TRP 520 Cb 0.00 -1.19 0.96 0.00 -1.16 0.00 0.00 33.47 32.09 3d54 s TRP 520 CO 0.00 0.44 2.03 -0.91 -4.06 0.00 0.00 176.95 174.45 3d54 h ASN 521 N 3.44 0.21 -1.74 -2.66 4.21 -1.94 -3.16 115.58 113.94 3d54 h ASN 521 Ca -0.48 -0.02 -0.43 0.00 1.21 0.00 0.00 56.30 56.58 3d54 h ASN 521 Cb 1.19 -0.05 0.02 0.00 -1.12 0.00 0.00 38.32 38.36 3d54 h ASN 521 CO 0.45 0.24 -0.23 -1.81 -1.29 0.00 0.00 177.43 174.79 3d54 s ASP 522 N -6.89 5.66 -0.04 5.81 1.11 -1.26 -2.90 116.67 118.14 3d54 s ASP 522 Ca -0.06 -0.28 0.05 0.00 0.18 0.00 0.00 52.55 52.44 3d54 s ASP 522 Cb 0.16 -0.83 -0.02 0.00 1.07 0.00 0.00 42.92 43.30 3d54 s ASP 522 CO 0.71 -0.77 -0.19 0.12 1.18 0.00 0.00 175.17 176.23 3d54 s PHE 523 N -2.40 2.56 -0.30 4.23 2.19 -1.22 -3.77 117.98 119.28 3d54 s PHE 523 Ca 0.53 -0.31 -0.02 0.00 0.33 0.00 0.00 56.93 57.46 3d54 s PHE 523 Cb -0.10 -1.59 0.19 0.00 -1.31 0.00 0.00 43.02 40.20 3d54 s PHE 523 CO 0.34 0.07 0.63 -2.00 1.83 0.00 0.00 175.22 176.08 3d54 s GLU 524 N -0.61 0.55 0.48 10.12 2.56 -1.26 -5.05 118.70 125.49 3d54 s GLU 524 Ca 0.09 1.00 0.16 0.00 0.00 0.00 0.00 54.97 56.23 3d54 s GLU 524 Cb -0.11 0.56 1.16 0.00 2.00 0.00 0.00 34.13 37.75 3d54 s GLU 524 CO 0.00 -0.57 2.04 1.25 -0.56 0.00 0.00 175.26 177.42 3d54 h LEU 525 N 8.00 0.19 -1.38 2.70 5.85 -2.00 -2.70 115.31 125.96 3d54 h LEU 525 Ca -0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3d54 h LEU 525 Cb 1.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3d54 h LEU 525 CO 0.23 0.12 0.20 -0.33 -0.34 0.00 0.00 178.44 178.32 3d54 h GLU 526 N 0.22 0.00 -0.48 1.25 3.07 -2.05 -2.52 114.58 114.06 3d54 h GLU 526 Ca 0.18 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.75 3d54 h GLU 526 Cb 0.42 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 28.06 3d54 h GLU 526 CO -0.03 0.00 -0.77 -2.13 -1.40 0.00 0.00 179.01 174.68 3d54 n ARG 527 N -2.33 1.20 -0.03 2.33 3.00 -1.02 -4.92 116.66 114.88 3d54 n ARG 527 Ca -0.01 -2.53 -0.22 0.00 -0.00 0.00 0.00 57.85 55.09 3d54 n ARG 527 Cb 0.23 -0.64 -0.13 0.00 0.00 0.00 0.00 32.46 31.92 3d54 n ARG 527 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 3d54 n GLU 528 N -0.38 0.70 0.32 -0.14 4.07 -0.95 -4.09 120.64 120.17 3d54 n GLU 528 Ca 0.02 0.35 0.20 0.00 -0.06 0.00 0.00 57.16 57.67 3d54 n GLU 528 Cb 0.84 -1.71 1.06 0.00 -0.06 0.00 0.00 31.44 31.56 3d54 n GLU 528 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 3d54 h LYS 529 N -0.25 0.00 0.00 5.31 1.57 -1.91 0.74 116.57 122.02 3d54 h LYS 529 Ca -0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3d54 h LYS 529 Cb 1.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.13 3d54 h LYS 529 CO -0.01 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.80 3d54 h GLU 530 N 0.00 0.00 0.14 3.15 4.39 -1.96 -2.35 114.58 117.95 3d54 h GLU 530 Ca 0.01 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.38 3d54 h GLU 530 Cb 0.24 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 3d54 h GLU 530 CO -0.00 0.00 -1.71 1.25 -1.16 0.00 0.00 179.01 177.39 3d54 h LEU 531 N 0.00 0.45 -0.21 1.33 5.85 -1.05 -3.25 115.31 118.44 3d54 h LEU 531 Ca 0.00 -0.72 -0.02 0.00 0.84 0.00 0.00 57.88 57.99 3d54 h LEU 531 Cb 0.78 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 3d54 h LEU 531 CO 0.00 1.61 0.07 -0.50 -0.34 0.00 0.00 178.44 179.28 3d54 h TRP 532 N 0.08 0.34 0.00 1.25 6.55 -1.48 -0.60 115.95 122.09 3d54 h TRP 532 Ca -0.31 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.49 3d54 h TRP 532 Cb 2.05 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 30.25 3d54 h TRP 532 CO 0.08 0.41 0.00 0.54 -1.05 0.00 0.00 178.44 178.41 3d54 n ARG 533 N -4.79 0.87 -0.09 0.49 1.74 -0.89 -1.85 116.66 112.14 3d54 n ARG 533 Ca -0.04 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.94 3d54 n ARG 533 Cb 0.15 -1.39 -0.13 0.00 -1.02 0.00 0.00 32.46 30.07 3d54 n ARG 533 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d54 n ALA 534 N -0.89 1.55 0.02 7.54 0.00 -0.77 -3.88 120.51 124.08 3d54 n ALA 534 Ca 0.16 -1.14 -0.15 0.00 0.00 0.00 0.00 53.44 52.31 3d54 n ALA 534 Cb 0.07 -0.11 -0.05 0.00 0.00 0.00 0.00 19.45 19.37 3d54 n ALA 534 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3d54 h ILE 535 N 0.00 1.32 -0.48 0.00 2.04 -0.80 -3.14 117.51 116.45 3d54 h ILE 535 Ca -0.49 -2.13 -0.03 0.00 1.00 0.00 0.00 64.86 63.22 3d54 h ILE 535 Cb 2.04 2.14 -0.02 0.00 -0.74 0.00 0.00 36.82 40.24 3d54 h ILE 535 CO 0.01 0.66 0.20 0.03 0.00 0.00 0.00 178.15 179.04 3d54 h ARG 536 N 0.40 0.72 0.00 2.37 3.08 -1.57 -0.28 114.38 119.10 3d54 h ARG 536 Ca -0.06 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3d54 h ARG 536 Cb 1.45 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.39 3d54 h ARG 536 CO 0.16 0.64 0.00 1.17 -1.07 0.00 0.00 179.97 180.87 3d54 n LYS 537 N -4.58 0.11 -0.01 0.04 4.81 -1.23 -2.49 118.16 114.81 3d54 n LYS 537 Ca 0.01 0.19 0.05 0.00 -0.87 0.00 0.00 58.31 57.69 3d54 n LYS 537 Cb 0.15 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 33.60 3d54 n LYS 537 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3d54 n LEU 538 N -1.39 0.00 -0.08 3.14 4.77 -0.66 -4.46 117.00 118.31 3d54 n LEU 538 Ca 0.06 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.87 3d54 n LEU 538 Cb 0.15 0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 3d54 n LEU 538 CO 0.13 0.03 0.11 -1.28 -1.33 0.00 0.00 177.39 175.05 3d54 h SER 539 N 0.00 0.00 0.00 -1.43 0.87 -0.77 -2.92 113.55 109.30 3d54 h SER 539 Ca -0.03 -0.83 0.00 0.00 -1.23 0.00 0.00 61.79 59.70 3d54 h SER 539 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 3d54 h SER 539 CO 0.00 1.14 0.00 -1.84 -0.53 0.00 0.00 176.83 175.60 3d54 n GLU 540 N -4.56 0.60 0.01 2.24 0.00 -1.19 -0.83 120.64 116.92 3d54 n GLU 540 Ca -0.16 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.11 3d54 n GLU 540 Cb 0.53 -1.36 0.05 0.00 0.00 0.00 0.00 31.44 30.66 3d54 n GLU 540 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3d54 n GLU 541 N -0.86 0.13 -0.45 3.44 2.13 -1.23 -4.99 120.64 118.79 3d54 n GLU 541 Ca 0.11 -0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 3d54 n GLU 541 Cb 0.05 -1.54 0.00 0.00 0.27 0.00 0.00 31.44 30.22 3d54 n GLU 541 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3d54 n GLY 542 N 1.44 1.56 3.77 8.31 0.00 -0.01 -5.09 105.19 115.17 3d54 n GLY 542 Ca 0.04 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 3d54 n GLY 542 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d54 s ALA 543 N -2.03 3.48 -0.33 4.61 0.00 -1.10 -4.98 121.76 121.41 3d54 s ALA 543 Ca 0.00 -1.54 -0.12 0.00 0.00 0.00 0.00 51.96 50.30 3d54 s ALA 543 Cb 0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.02 3d54 s ALA 543 CO 0.00 0.22 0.21 0.12 0.00 0.00 0.00 175.76 176.31 3d54 s PHE 544 N -2.23 3.21 0.12 0.00 5.36 -1.24 -4.72 117.98 118.49 3d54 s PHE 544 Ca 0.33 -0.36 0.05 0.00 -0.96 0.00 0.00 56.93 55.99 3d54 s PHE 544 Cb -0.07 -2.43 -0.04 0.00 -0.34 0.00 0.00 43.02 40.14 3d54 s PHE 544 CO 0.23 -0.40 0.07 0.42 -1.46 0.00 0.00 175.22 174.08 3d54 s ILE 545 N 1.68 4.28 -0.21 3.12 1.09 -1.25 -0.73 121.20 129.18 3d54 s ILE 545 Ca 0.05 -1.00 -0.04 0.00 -1.10 0.00 0.00 60.65 58.56 3d54 s ILE 545 Cb -0.17 -3.11 0.08 0.00 -1.06 0.00 0.00 42.46 38.20 3d54 s ILE 545 CO 0.09 0.02 0.16 -0.76 -0.10 0.00 0.00 174.94 174.35 3d54 s LEU 546 N -2.65 0.19 -0.38 2.97 1.43 -0.59 -4.79 118.68 114.86 3d54 s LEU 546 Ca 0.29 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.65 3d54 s LEU 546 Cb -0.11 -0.00 0.03 0.00 0.03 0.00 0.00 46.19 46.13 3d54 s LEU 546 CO 0.21 -0.36 0.22 -0.55 0.23 0.00 0.00 176.35 176.09 3d54 s SER 547 N 2.21 5.77 0.03 2.29 0.15 -1.26 -1.88 113.70 121.00 3d54 s SER 547 Ca 0.05 -0.97 -0.02 0.00 0.70 0.00 0.00 55.95 55.72 3d54 s SER 547 Cb -0.16 -2.04 -0.02 0.00 -1.71 0.00 0.00 66.02 62.09 3d54 s SER 547 CO -0.17 -0.39 0.00 -0.55 1.20 0.00 0.00 173.24 173.33 3d54 s SER 548 N 1.57 0.27 0.28 5.45 0.15 -1.26 -4.82 113.70 115.34 3d54 s SER 548 Ca 0.02 -0.60 -0.01 0.00 0.70 0.00 0.00 55.95 56.06 3d54 s SER 548 Cb -0.19 0.15 0.48 0.00 -1.71 0.00 0.00 66.02 64.75 3d54 s SER 548 CO 0.07 -0.41 1.87 0.28 1.20 0.00 0.00 173.24 176.25 3d54 h SER 549 N 4.11 0.99 -0.39 5.45 0.02 -1.95 -1.93 113.55 119.85 3d54 h SER 549 Ca -0.32 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.53 3d54 h SER 549 Cb 1.19 -0.18 -0.07 0.00 0.14 0.00 0.00 62.40 63.47 3d54 h SER 549 CO 0.48 0.59 0.04 0.00 -1.14 0.00 0.00 176.83 176.80 3d54 n GLN 550 N -4.54 2.55 0.00 3.45 6.02 -1.26 -4.95 117.38 118.65 3d54 n GLN 550 Ca 0.17 -3.01 0.00 0.00 -0.01 0.00 0.00 57.00 54.15 3d54 n GLN 550 Cb 0.25 -1.89 0.00 0.00 1.02 0.00 0.00 30.24 29.62 3d54 n GLN 550 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3d54 n LEU 551 N -0.75 0.00 -3.74 1.08 4.77 -0.73 -4.58 117.00 113.06 3d54 n LEU 551 Ca 0.30 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 56.09 3d54 n LEU 551 Cb 1.04 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.96 3d54 n LEU 551 CO 0.22 0.00 -0.36 -0.22 -1.33 0.00 0.00 177.39 175.71 3d54 s LEU 552 N 0.00 0.65 0.46 2.23 2.96 -1.26 -4.34 118.68 119.37 3d54 s LEU 552 Ca 0.00 0.02 0.07 0.00 -0.22 0.00 0.00 54.13 54.01 3d54 s LEU 552 Cb 0.00 -0.19 -0.00 0.00 0.50 0.00 0.00 46.19 46.50 3d54 s LEU 552 CO 0.00 -0.18 0.41 0.42 -1.32 0.00 0.00 176.35 175.68 3d54 s THR 553 N 1.63 2.39 0.41 3.68 -4.23 -1.26 -5.00 115.64 113.26 3d54 s THR 553 Ca -0.02 -1.36 0.11 0.00 -1.18 0.00 0.00 61.69 59.25 3d54 s THR 553 Cb -0.13 -2.75 0.32 0.00 1.34 0.00 0.00 72.50 71.28 3d54 s THR 553 CO -0.03 0.00 1.97 -0.09 -0.54 0.00 0.00 174.62 175.93 3d54 h ARG 554 N 0.92 0.50 -0.42 3.99 9.65 -1.93 -1.48 114.38 125.61 3d54 h ARG 554 Ca -0.40 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.38 3d54 h ARG 554 Cb 1.28 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.73 3d54 h ARG 554 CO 0.56 0.33 -0.03 1.15 2.80 0.00 0.00 179.97 184.78 3d54 h THR 555 N 0.51 1.27 -0.69 0.20 2.02 -1.94 -2.67 112.91 111.60 3d54 h THR 555 Ca 0.30 -1.09 -0.05 0.00 0.77 0.00 0.00 66.41 66.33 3d54 h THR 555 Cb 0.48 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 3d54 h THR 555 CO -0.09 0.37 0.22 0.45 0.37 0.00 0.00 175.52 176.84 3d54 h HIS 556 N 0.59 1.11 0.00 3.16 3.86 -1.51 -1.62 115.15 120.75 3d54 h HIS 556 Ca 0.11 -0.11 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 3d54 h HIS 556 Cb 0.54 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 3d54 h HIS 556 CO 0.04 0.89 -0.53 0.28 0.86 0.00 0.00 177.93 179.47 3d54 h VAL 557 N 1.01 1.30 0.02 2.45 2.07 -1.38 -2.00 116.25 119.72 3d54 h VAL 557 Ca 0.22 -1.88 -0.23 0.00 0.82 0.00 0.00 66.70 65.63 3d54 h VAL 557 Cb 0.30 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3d54 h VAL 557 CO -0.01 0.52 -1.16 -0.08 0.02 0.00 0.00 177.57 176.86 3d54 h GLU 558 N 0.00 0.04 0.00 1.57 4.57 -1.27 -2.48 114.58 117.02 3d54 h GLU 558 Ca -0.01 -0.08 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 3d54 h GLU 558 Cb 0.99 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.61 3d54 h GLU 558 CO 0.07 0.96 -0.17 1.15 -1.18 0.00 0.00 179.01 179.84 3d54 h THR 559 N 0.01 0.22 0.05 0.32 2.02 -1.19 -3.06 112.91 111.28 3d54 h THR 559 Ca -0.08 -1.31 -0.25 0.00 0.77 0.00 0.00 66.41 65.54 3d54 h THR 559 Cb 1.84 2.09 0.01 0.00 -1.74 0.00 0.00 68.15 70.35 3d54 h THR 559 CO 0.13 0.13 -1.06 -0.26 0.37 0.00 0.00 175.52 174.83 3d54 h PHE 560 N 0.00 0.65 0.00 3.16 0.04 -1.36 -3.23 116.94 116.20 3d54 h PHE 560 Ca -0.00 -0.39 -0.07 0.00 2.80 0.00 0.00 57.97 60.31 3d54 h PHE 560 Cb 1.10 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.18 3d54 h PHE 560 CO 0.00 1.23 -0.35 -0.09 -0.60 0.00 0.00 178.31 178.50 3d54 h ARG 561 N 0.20 0.00 0.00 1.51 2.43 -1.34 -0.72 114.38 116.47 3d54 h ARG 561 Ca -0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3d54 h ARG 561 Cb 1.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.27 3d54 h ARG 561 CO 0.18 0.35 0.00 1.49 -1.51 0.00 0.00 179.97 180.49 3d54 h GLU 562 N 0.00 0.00 -0.41 0.20 4.57 -1.55 -0.58 114.58 116.82 3d54 h GLU 562 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3d54 h GLU 562 Cb 0.73 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 3d54 h GLU 562 CO 0.05 0.00 0.00 0.66 -1.18 0.00 0.00 179.01 178.54 3d54 n TYR 563 N -3.01 0.53 -3.04 0.92 4.02 -0.84 -4.96 117.16 110.78 3d54 n TYR 563 Ca 0.02 -0.26 -0.12 0.00 -0.01 0.00 0.00 57.90 57.52 3d54 n TYR 563 Cb 0.35 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.72 3d54 n TYR 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d54 n GLY 564 N 1.46 0.19 3.13 2.72 0.00 -0.22 -5.06 105.19 107.41 3d54 n GLY 564 Ca 0.19 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 3d54 n GLY 564 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d54 s LEU 565 N -4.19 2.11 -0.02 0.99 1.43 -0.33 -4.76 118.68 113.90 3d54 s LEU 565 Ca 0.29 -0.37 0.07 0.00 -1.03 0.00 0.00 54.13 53.09 3d54 s LEU 565 Cb -0.13 -0.66 -0.02 0.00 0.03 0.00 0.00 46.19 45.42 3d54 s LEU 565 CO 0.37 0.10 -0.23 -1.59 0.23 0.00 0.00 176.35 175.22 3d54 s LYS 566 N -0.78 2.17 -0.10 1.70 -2.85 -1.21 -2.99 119.74 115.67 3d54 s LYS 566 Ca 0.03 -0.90 0.03 0.00 -1.00 0.00 0.00 55.97 54.14 3d54 s LYS 566 Cb -0.07 -2.11 -0.00 0.00 -2.06 0.00 0.00 37.83 33.59 3d54 s LYS 566 CO 0.00 0.57 -0.22 -1.50 0.10 0.00 0.00 175.35 174.31 3d54 s ILE 567 N -0.66 2.29 -0.27 3.79 2.07 -1.26 -3.42 121.20 123.74 3d54 s ILE 567 Ca 0.11 -0.94 -0.01 0.00 -1.41 0.00 0.00 60.65 58.39 3d54 s ILE 567 Cb -0.10 -1.89 0.09 0.00 0.13 0.00 0.00 42.46 40.68 3d54 s ILE 567 CO -0.00 0.55 0.07 -1.83 -1.91 0.00 0.00 174.94 171.82 3d54 s GLU 568 N 0.28 0.75 0.15 3.50 -1.05 -1.18 -5.07 118.70 116.09 3d54 s GLU 568 Ca -0.16 -0.88 0.00 0.00 -0.15 0.00 0.00 54.97 53.78 3d54 s GLU 568 Cb -0.17 -2.04 -0.04 0.00 -0.44 0.00 0.00 34.13 31.43 3d54 s GLU 568 CO 0.08 -0.87 0.04 0.14 0.95 0.00 0.00 175.26 175.60 3d54 s VAL 569 N 1.68 0.31 -0.76 1.83 -7.23 -1.26 -3.23 120.40 111.72 3d54 s VAL 569 Ca 0.06 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.28 3d54 s VAL 569 Cb -0.17 -2.11 0.19 0.00 0.56 0.00 0.00 36.38 34.84 3d54 s VAL 569 CO -0.20 -0.43 0.61 -0.75 -0.31 0.00 0.00 175.10 174.02 3d54 s LYS 570 N -4.01 2.89 -0.09 4.82 2.20 -1.01 -5.04 119.74 119.51 3d54 s LYS 570 Ca 0.25 -3.01 -0.29 0.00 -0.36 0.00 0.00 55.97 52.56 3d54 s LYS 570 Cb 0.07 -3.79 -0.07 0.00 -1.51 0.00 0.00 37.83 32.53 3d54 s LYS 570 CO 0.03 -1.23 2.06 -0.51 -0.36 0.00 0.00 175.35 175.34 3d54 s LEU 571 N -0.88 3.98 -0.06 5.43 1.43 -1.26 -4.88 118.68 122.44 3d54 s LEU 571 Ca 0.23 2.28 -0.30 0.00 -1.03 0.00 0.00 54.13 55.31 3d54 s LEU 571 Cb -0.12 -3.52 -0.05 0.00 0.03 0.00 0.00 46.19 42.53 3d54 s LEU 571 CO -0.09 -1.46 1.54 -2.84 0.23 0.00 0.00 176.35 173.73 3d54 s PRO 572 N 5.29 4.21 0.04 1.29 0.02 -1.26 -4.90 135.00 139.68 3d54 s PRO 572 Ca 0.93 2.07 -0.30 0.00 0.02 0.00 0.00 61.00 63.71 3d54 s PRO 572 Cb -0.37 -3.86 -0.09 0.00 0.02 0.00 0.00 34.50 30.20 3d54 s PRO 572 CO 0.38 -0.78 1.92 -2.00 -0.33 0.00 0.00 177.00 176.20 3d54 s GLU 573 N 3.62 4.15 0.25 5.54 2.12 -1.26 -4.99 118.70 128.13 3d54 s GLU 573 Ca 0.69 2.57 0.09 0.00 0.36 0.00 0.00 54.97 58.67 3d54 s GLU 573 Cb -0.31 -4.09 -0.04 0.00 0.26 0.00 0.00 34.13 29.95 3d54 s GLU 573 CO 0.26 -0.93 0.01 0.14 -0.54 0.00 0.00 175.26 174.20 3d54 s VAL 574 N 4.24 3.54 0.46 3.70 -7.23 -1.26 -4.99 120.40 118.86 3d54 s VAL 574 Ca 0.86 -1.81 -0.21 0.00 -1.81 0.00 0.00 61.98 59.01 3d54 s VAL 574 Cb -0.42 -2.87 -0.09 0.00 0.56 0.00 0.00 36.38 33.56 3d54 s VAL 574 CO 0.40 -0.33 1.04 -0.13 -0.31 0.00 0.00 175.10 175.77 3d54 s ARG 575 N -3.56 3.94 0.31 4.82 0.52 -1.14 -4.96 118.95 118.87 3d54 s ARG 575 Ca 0.31 1.40 0.06 0.00 -0.52 0.00 0.00 55.73 56.97 3d54 s ARG 575 Cb -0.07 -2.24 0.84 0.00 0.52 0.00 0.00 34.95 34.00 3d54 s ARG 575 CO 0.20 -0.32 1.62 -1.35 0.02 0.00 0.00 175.30 175.47 3d54 h PRO 576 N 1.87 0.14 -4.60 3.54 0.11 -1.90 -3.24 132.00 127.92 3d54 h PRO 576 Ca -0.49 -0.01 -0.71 0.00 0.11 0.00 0.00 66.00 64.90 3d54 h PRO 576 Cb 1.22 -0.03 -0.20 0.00 0.11 0.00 0.00 31.00 32.09 3d54 h PRO 576 CO 0.60 0.09 0.01 0.00 -0.21 0.00 0.00 178.00 178.49 3d54 s ALA 577 N -5.87 3.46 0.32 -0.75 0.00 -1.26 -5.03 121.76 112.63 3d54 s ALA 577 Ca -0.12 -2.19 0.03 0.00 0.00 0.00 0.00 51.96 49.68 3d54 s ALA 577 Cb 0.28 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 3d54 s ALA 577 CO 0.78 -2.18 0.11 -3.38 0.00 0.00 0.00 175.76 171.08 3d54 s HIS 578 N 2.40 1.71 -0.49 0.00 -3.43 -1.23 -3.42 115.29 110.84 3d54 s HIS 578 Ca 0.10 -1.19 0.08 0.00 -0.80 0.00 0.00 55.06 53.25 3d54 s HIS 578 Cb -0.24 -1.04 0.32 0.00 -1.43 0.00 0.00 32.58 30.18 3d54 s HIS 578 CO 0.07 -0.28 0.78 1.04 -2.00 0.00 0.00 174.74 174.34 3d54 n GLN 579 N -0.64 1.97 -4.03 -0.38 6.02 -1.19 -4.90 117.38 114.23 3d54 n GLN 579 Ca -0.02 -4.08 -0.13 0.00 -0.01 0.00 0.00 57.00 52.77 3d54 n GLN 579 Cb 0.66 -1.91 -0.12 0.00 1.02 0.00 0.00 30.24 29.89 3d54 n GLN 579 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 3d54 s MET 580 N -2.63 0.36 0.05 -1.09 1.75 -1.26 -2.07 119.30 114.41 3d54 s MET 580 Ca 0.42 -0.46 0.00 0.00 -1.25 0.00 0.00 55.69 54.41 3d54 s MET 580 Cb 0.27 -0.17 -0.03 0.00 2.84 0.00 0.00 34.83 37.74 3d54 s MET 580 CO -0.10 0.03 -0.05 0.14 -0.65 0.00 0.00 175.02 174.40 3d54 s VAL 581 N -0.87 0.38 -0.25 10.11 -7.23 -0.40 -4.57 120.40 117.57 3d54 s VAL 581 Ca -0.07 -1.51 -0.08 0.00 -1.81 0.00 0.00 61.98 58.51 3d54 s VAL 581 Cb -0.06 -1.12 -0.03 0.00 0.56 0.00 0.00 36.38 35.72 3d54 s VAL 581 CO -0.00 -0.75 0.09 -0.76 -0.31 0.00 0.00 175.10 173.37 3d54 s LEU 582 N -2.39 3.56 -0.17 1.32 1.43 -0.79 -1.00 118.68 120.65 3d54 s LEU 582 Ca 0.00 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 3d54 s LEU 582 Cb 0.00 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 3d54 s LEU 582 CO -0.05 -0.02 -0.01 -0.69 0.23 0.00 0.00 176.35 175.81 3d54 s VAL 583 N 1.56 4.11 -0.87 -1.59 1.01 0.13 -1.55 120.40 123.20 3d54 s VAL 583 Ca 0.06 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.76 3d54 s VAL 583 Cb -0.15 -2.82 0.24 0.00 0.00 0.00 0.00 36.38 33.64 3d54 s VAL 583 CO 0.05 0.48 0.88 0.49 0.00 0.00 0.00 175.10 176.99 3d54 n PHE 584 N 3.64 3.79 -3.40 5.22 3.01 0.09 -0.59 117.46 129.21 3d54 n PHE 584 Ca -0.17 -3.91 -0.14 0.00 1.01 0.00 0.00 57.45 54.23 3d54 n PHE 584 Cb 0.52 -1.03 0.02 0.00 -0.01 0.00 0.00 39.48 38.99 3d54 n PHE 584 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3d54 n SER 585 N 1.86 1.73 -0.08 4.37 3.41 -1.23 -3.59 113.62 120.09 3d54 n SER 585 Ca 0.24 -2.08 -0.13 0.00 -0.26 0.00 0.00 58.87 56.63 3d54 n SER 585 Cb 0.37 -0.14 -0.09 0.00 -0.26 0.00 0.00 64.21 64.10 3d54 n SER 585 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3d54 h GLU 586 N 0.00 0.00 -6.02 4.33 4.39 -1.93 -3.20 114.58 112.14 3d54 h GLU 586 Ca -0.20 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 58.93 3d54 h GLU 586 Cb 0.79 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.34 3d54 h GLU 586 CO 0.30 0.68 -0.58 0.50 -1.16 0.00 0.00 179.01 178.75 3d54 s ARG 587 N -2.18 2.19 -0.20 2.33 3.52 -1.26 -4.79 118.95 118.56 3d54 s ARG 587 Ca -0.19 -1.70 -0.36 0.00 -0.13 0.00 0.00 55.73 53.34 3d54 s ARG 587 Cb 0.02 -2.01 -0.13 0.00 -1.56 0.00 0.00 34.95 31.27 3d54 s ARG 587 CO 0.47 0.09 1.91 2.41 -0.81 0.00 0.00 175.30 179.37 3d54 n THR 588 N -1.05 0.43 -1.65 4.11 -1.04 -1.26 -4.88 114.28 108.93 3d54 n THR 588 Ca -0.03 -0.13 -0.47 0.00 -2.04 0.00 0.00 64.05 61.37 3d54 n THR 588 Cb 0.62 -1.67 -0.04 0.00 -1.82 0.00 0.00 70.33 67.42 3d54 n THR 588 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3d54 n PRO 589 N 6.63 1.91 -3.27 -2.82 -0.02 -1.26 -4.97 135.00 131.20 3d54 n PRO 589 Ca 0.27 0.69 -0.47 0.00 -2.02 0.00 0.00 63.50 61.98 3d54 n PRO 589 Cb 0.24 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.28 3d54 n PRO 589 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3d54 s VAL 590 N 0.75 5.51 0.15 -1.45 -7.23 -1.26 -4.98 120.40 111.89 3d54 s VAL 590 Ca 0.79 -2.39 -0.03 0.00 -1.81 0.00 0.00 61.98 58.55 3d54 s VAL 590 Cb -0.74 -4.52 -0.03 0.00 0.56 0.00 0.00 36.38 31.65 3d54 s VAL 590 CO 0.41 -1.10 0.13 0.68 -0.31 0.00 0.00 175.10 174.90 3d54 s VAL 591 N 0.45 0.08 -1.04 1.32 -7.23 -1.26 -4.96 120.40 107.76 3d54 s VAL 591 Ca 0.20 -1.78 -0.02 0.00 -1.81 0.00 0.00 61.98 58.58 3d54 s VAL 591 Cb -0.09 -2.03 0.27 0.00 0.56 0.00 0.00 36.38 35.09 3d54 s VAL 591 CO -0.09 -0.38 2.01 0.47 -0.31 0.00 0.00 175.10 176.80 3d54 n ASP 592 N -0.14 7.49 -3.58 4.85 8.00 -1.26 -4.87 116.55 127.04 3d54 n ASP 592 Ca -0.05 -3.58 -0.12 0.00 0.71 0.00 0.00 54.79 51.75 3d54 n ASP 592 Cb 0.64 -1.20 -0.06 0.00 -0.02 0.00 0.00 41.12 40.48 3d54 n ASP 592 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3d54 s VAL 593 N -3.70 0.00 -0.33 2.53 0.11 -1.26 -5.00 120.40 112.76 3d54 s VAL 593 Ca 0.45 0.00 -0.40 0.00 -2.93 0.00 0.00 61.98 59.09 3d54 s VAL 593 Cb 0.23 -1.00 -0.16 0.00 -1.53 0.00 0.00 36.38 33.92 3d54 s VAL 593 CO -0.16 0.00 1.84 -2.65 -3.33 0.00 0.00 175.10 170.79 3d54 n PRO 594 N 1.16 0.95 -3.94 1.54 -0.02 -1.26 -4.74 135.00 128.69 3d54 n PRO 594 Ca -0.13 0.33 -0.34 0.00 -2.02 0.00 0.00 63.50 61.35 3d54 n PRO 594 Cb 0.57 -2.06 -0.14 0.00 -0.02 0.00 0.00 33.50 31.85 3d54 n PRO 594 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3d54 s VAL 595 N 4.31 2.69 -0.10 -1.45 1.01 -1.26 -1.30 120.40 124.30 3d54 s VAL 595 Ca 1.03 -1.84 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3d54 s VAL 595 Cb -1.11 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 3d54 s VAL 595 CO 0.65 -0.34 -0.15 -0.54 0.00 0.00 0.00 175.10 174.71 3d54 s LYS 596 N 1.10 3.01 -0.29 2.72 1.02 -0.87 -4.98 119.74 121.46 3d54 s LYS 596 Ca 0.01 -0.72 -0.28 0.00 0.02 0.00 0.00 55.97 55.00 3d54 s LYS 596 Cb -0.20 -2.49 0.01 0.00 -0.52 0.00 0.00 37.83 34.63 3d54 s LYS 596 CO -0.04 0.36 1.01 -2.00 -0.92 0.00 0.00 175.35 173.75 3d54 s GLU 597 N -0.04 4.11 0.00 1.68 2.12 -1.26 0.34 118.70 125.65 3d54 s GLU 597 Ca -0.04 1.07 0.10 0.00 0.36 0.00 0.00 54.97 56.46 3d54 s GLU 597 Cb -0.14 -3.70 -0.10 0.00 0.26 0.00 0.00 34.13 30.44 3d54 s GLU 597 CO 0.04 -0.77 0.41 0.44 -0.54 0.00 0.00 175.26 174.84 3d54 n ILE 598 N 5.62 0.00 -0.13 -3.70 -5.35 -0.00 -4.94 119.36 110.86 3d54 n ILE 598 Ca 0.10 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 3d54 n ILE 598 Cb 0.47 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.37 3d54 n ILE 598 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d54 n GLY 599 N 1.23 -0.59 3.32 3.28 0.00 -1.04 -2.40 105.19 108.98 3d54 n GLY 599 Ca 0.02 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 3d54 n GLY 599 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d54 s THR 600 N -3.96 0.00 -0.40 2.61 -4.23 -1.20 -1.49 115.64 106.97 3d54 s THR 600 Ca 0.00 -1.83 0.08 0.00 -1.18 0.00 0.00 61.69 58.76 3d54 s THR 600 Cb 0.00 -2.44 0.25 0.00 1.34 0.00 0.00 72.50 71.65 3d54 s THR 600 CO 0.00 0.00 0.56 -0.11 -0.54 0.00 0.00 174.62 174.53 3d54 n LEU 601 N -0.34 -0.07 -4.85 4.79 7.94 -0.16 -3.09 117.00 121.22 3d54 n LEU 601 Ca 0.02 -4.59 -0.29 0.00 -1.11 0.00 0.00 56.01 50.04 3d54 n LEU 601 Cb 0.64 0.66 0.10 0.00 0.53 0.00 0.00 43.42 45.35 3d54 n LEU 601 CO 0.30 2.07 0.75 -0.94 -1.11 0.00 0.00 177.39 178.46 3d54 s SER 602 N -1.25 4.33 0.00 1.96 1.04 -1.22 -3.37 113.70 115.19 3d54 s SER 602 Ca 0.35 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.73 3d54 s SER 602 Cb 0.18 -1.55 0.00 0.00 0.10 0.00 0.00 66.02 64.75 3d54 s SER 602 CO -0.12 -2.03 0.00 0.54 0.98 0.00 0.00 173.24 172.61