#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ok4 h LEU 4 N 0.00 0.00 -0.60 1.20 3.38 -1.98 -2.86 115.31 114.46 1ok4 h LEU 4 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1ok4 h LEU 4 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1ok4 h LEU 4 CO 0.00 0.44 0.38 0.74 0.09 0.00 0.00 178.44 180.09 1ok4 h THR 5 N 0.00 1.11 -0.59 0.22 2.02 -1.96 -1.17 112.91 112.54 1ok4 h THR 5 Ca -0.01 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.82 1ok4 h THR 5 Cb 1.35 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1ok4 h THR 5 CO 0.06 0.14 0.03 -0.33 0.37 0.00 0.00 175.52 175.78 1ok4 h GLU 6 N 0.76 1.02 -0.49 6.66 5.08 -1.89 -0.88 114.58 124.84 1ok4 h GLU 6 Ca 0.23 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1ok4 h GLU 6 Cb -0.03 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1ok4 h GLU 6 CO -0.07 0.98 0.26 -0.22 -1.00 0.00 0.00 179.01 178.96 1ok4 h LYS 7 N 0.94 0.69 -0.33 2.33 3.64 -1.40 -1.52 116.57 120.91 1ok4 h LYS 7 Ca 0.17 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1ok4 h LYS 7 Cb 0.51 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1ok4 h LYS 7 CO 0.02 0.55 0.13 0.35 -2.27 0.00 0.00 179.45 178.24 1ok4 h PHE 8 N 0.65 0.24 -0.41 1.91 3.57 -0.74 -2.12 116.94 120.04 1ok4 h PHE 8 Ca 0.17 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 1ok4 h PHE 8 Cb 0.06 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1ok4 h PHE 8 CO -0.02 0.12 0.00 -0.07 -2.23 0.00 0.00 178.31 176.11 1ok4 h LEU 9 N 0.29 0.63 -0.74 0.59 3.38 -1.01 0.15 115.31 118.61 1ok4 h LEU 9 Ca 0.15 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1ok4 h LEU 9 Cb 0.10 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1ok4 h LEU 9 CO -0.13 0.70 0.07 -0.09 0.09 0.00 0.00 178.44 179.07 1ok4 h ARG 10 N 0.63 1.03 0.11 1.13 2.43 -0.93 -0.38 114.38 118.39 1ok4 h ARG 10 Ca 0.13 -0.28 -0.31 0.00 -0.81 0.00 0.00 59.98 58.71 1ok4 h ARG 10 Cb 0.39 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1ok4 h ARG 10 CO 0.01 0.97 -1.64 0.82 -1.51 0.00 0.00 179.97 178.62 1ok4 h ILE 11 N 0.96 0.85 -0.02 1.20 2.04 -1.11 -3.37 117.51 118.05 1ok4 h ILE 11 Ca 0.19 -2.35 0.00 0.00 1.00 0.00 0.00 64.86 63.70 1ok4 h ILE 11 Cb 0.46 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 39.10 1ok4 h ILE 11 CO 0.02 0.73 -0.12 0.49 0.00 0.00 0.00 178.15 179.27 1ok4 n PHE 12 N -3.81 0.00 -2.72 1.37 3.72 0.50 -4.61 117.46 111.91 1ok4 n PHE 12 Ca -0.29 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.06 1ok4 n PHE 12 Cb 0.93 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.55 1ok4 n PHE 12 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ok4 n ALA 13 N 0.55 2.65 0.26 4.37 0.00 -0.17 -4.49 120.51 123.69 1ok4 n ALA 13 Ca 0.08 -2.29 0.11 0.00 0.00 0.00 0.00 53.44 51.35 1ok4 n ALA 13 Cb 0.38 -0.91 0.71 0.00 0.00 0.00 0.00 19.45 19.62 1ok4 n ALA 13 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1ok4 h ARG 14 N 2.34 0.00 -0.10 0.00 0.11 -1.69 -0.31 114.38 114.72 1ok4 h ARG 14 Ca -0.21 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.87 1ok4 h ARG 14 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1ok4 h ARG 14 CO 0.17 0.12 0.00 0.54 0.10 0.00 0.00 179.97 180.90 1ok4 n ARG 15 N -3.83 1.62 0.00 0.08 1.74 -1.26 -4.92 116.66 110.09 1ok4 n ARG 15 Ca -0.02 -0.92 0.00 0.00 -0.77 0.00 0.00 57.85 56.14 1ok4 n ARG 15 Cb 0.21 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1ok4 n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ok4 n GLY 16 N 1.11 3.41 3.31 -0.13 0.00 -0.13 -5.00 105.19 107.76 1ok4 n GLY 16 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 1ok4 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ok4 s LYS 17 N -0.92 1.35 -0.01 1.61 -0.14 -1.26 -4.97 119.74 115.41 1ok4 s LYS 17 Ca 0.00 -1.71 0.01 0.00 -1.36 0.00 0.00 55.97 52.91 1ok4 s LYS 17 Cb 0.00 -0.35 0.00 0.00 -1.68 0.00 0.00 37.83 35.80 1ok4 s LYS 17 CO 0.00 -0.22 -0.03 0.45 -0.76 0.00 0.00 175.35 174.79 1ok4 s SER 18 N -3.29 0.38 -0.12 2.83 0.15 -0.40 -4.52 113.70 108.73 1ok4 s SER 18 Ca 0.33 -0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.94 1ok4 s SER 18 Cb 0.07 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.33 1ok4 s SER 18 CO 0.11 0.02 -0.13 -0.63 1.20 0.00 0.00 173.24 173.81 1ok4 s ILE 19 N 0.09 1.43 -0.14 6.45 1.01 -1.26 -1.65 121.20 127.13 1ok4 s ILE 19 Ca -0.01 -0.57 -0.01 0.00 0.00 0.00 0.00 60.65 60.07 1ok4 s ILE 19 Cb -0.03 -1.34 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1ok4 s ILE 19 CO -0.00 0.43 -0.12 -0.63 0.00 0.00 0.00 174.94 174.62 1ok4 s ILE 20 N 1.31 3.08 -0.46 2.92 -1.09 -0.39 -0.92 121.20 125.65 1ok4 s ILE 20 Ca -0.00 -0.64 -0.22 0.00 -2.23 0.00 0.00 60.65 57.56 1ok4 s ILE 20 Cb -0.14 -2.31 0.03 0.00 -1.58 0.00 0.00 42.46 38.47 1ok4 s ILE 20 CO -0.06 0.51 0.73 -0.22 -1.23 0.00 0.00 174.94 174.67 1ok4 s LEU 21 N 0.48 4.40 0.09 2.97 2.96 0.03 -1.03 118.68 128.58 1ok4 s LEU 21 Ca -0.09 -0.29 -0.22 0.00 -0.22 0.00 0.00 54.13 53.32 1ok4 s LEU 21 Cb -0.16 -2.82 -0.07 0.00 0.50 0.00 0.00 46.19 43.65 1ok4 s LEU 21 CO 0.04 -0.88 0.66 0.00 -1.32 0.00 0.00 176.35 174.85 1ok4 s ALA 22 N 3.10 3.51 -0.32 5.97 0.00 0.00 -1.55 121.76 132.48 1ok4 s ALA 22 Ca 0.26 0.17 0.16 0.00 0.00 0.00 0.00 51.96 52.55 1ok4 s ALA 22 Cb -0.13 -2.80 0.45 0.00 0.00 0.00 0.00 23.12 20.64 1ok4 s ALA 22 CO 0.20 0.30 1.35 0.98 0.00 0.00 0.00 175.76 178.59 1ok4 n TYR 23 N 1.93 -0.78 0.48 0.00 9.36 -0.69 -4.20 117.16 123.27 1ok4 n TYR 23 Ca -0.07 -1.93 0.10 0.00 3.32 0.00 0.00 57.90 59.31 1ok4 n TYR 23 Cb 0.50 0.85 0.26 0.00 -0.63 0.00 0.00 39.34 40.31 1ok4 n TYR 23 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1ok4 n ASP 24 N -1.08 2.74 0.22 2.98 5.75 -1.24 -4.52 116.55 121.40 1ok4 n ASP 24 Ca -0.07 -1.94 0.08 0.00 -0.01 0.00 0.00 54.79 52.85 1ok4 n ASP 24 Cb 0.85 -0.29 0.52 0.00 -1.03 0.00 0.00 41.12 41.17 1ok4 n ASP 24 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 1ok4 h HIS 25 N 3.20 0.00 -0.12 2.11 3.86 -1.92 -2.78 115.15 119.50 1ok4 h HIS 25 Ca 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1ok4 h HIS 25 Cb 0.72 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.19 1ok4 h HIS 25 CO 0.29 0.25 0.09 0.78 0.86 0.00 0.00 177.93 180.20 1ok4 h GLY 26 N 1.35 0.00 0.11 2.45 0.00 -1.82 0.30 103.07 105.46 1ok4 h GLY 26 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1ok4 h GLY 26 CO 0.03 0.00 -2.11 4.51 0.00 0.00 0.00 176.54 178.97 1ok4 n ILE 27 N -4.33 1.57 -0.29 2.60 3.06 -1.07 -3.01 119.36 117.89 1ok4 n ILE 27 Ca -0.00 -0.39 -0.03 0.00 -2.50 0.00 0.00 62.75 59.83 1ok4 n ILE 27 Cb 0.21 -1.79 0.09 0.00 0.54 0.00 0.00 39.64 38.69 1ok4 n ILE 27 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 1ok4 h GLU 28 N -0.57 1.00 0.00 9.51 4.39 -1.40 -3.36 114.58 124.15 1ok4 h GLU 28 Ca -0.54 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.10 1ok4 h GLU 28 Cb 1.68 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 30.11 1ok4 h GLU 28 CO -0.20 0.66 -0.98 0.72 -1.16 0.00 0.00 179.01 178.05 1ok4 n HIS 29 N -4.57 0.00 0.00 4.33 8.25 -0.02 -2.60 115.22 120.61 1ok4 n HIS 29 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1ok4 n HIS 29 Cb 0.06 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.17 1ok4 n HIS 29 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ok4 n GLY 30 N 2.66 -0.74 0.00 -1.41 0.00 -0.50 -4.62 105.19 100.57 1ok4 n GLY 30 Ca 0.00 -1.70 0.07 0.00 0.00 0.00 0.00 46.02 44.39 1ok4 n GLY 30 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ok4 n PRO 31 N -0.81 0.22 -0.12 1.61 -0.04 -1.26 -2.90 135.00 131.71 1ok4 n PRO 31 Ca 0.00 0.14 0.10 0.00 -0.04 0.00 0.00 63.50 63.70 1ok4 n PRO 31 Cb 0.00 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.40 1ok4 n PRO 31 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ok4 h ALA 32 N 2.72 1.89 -0.48 0.55 0.00 -1.97 -0.46 119.26 121.51 1ok4 h ALA 32 Ca 0.00 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.03 1ok4 h ALA 32 Cb 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ok4 h ALA 32 CO 0.00 -0.01 0.47 -0.44 0.00 0.00 0.00 179.25 179.27 1ok4 h ASP 33 N 0.54 0.00 0.08 0.00 5.19 -1.84 -2.73 116.42 117.67 1ok4 h ASP 33 Ca 0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 1ok4 h ASP 33 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 1ok4 h ASP 33 CO -0.09 0.00 -0.19 0.49 -3.12 0.00 0.00 179.24 176.33 1ok4 n PHE 34 N -3.82 0.00 -0.11 4.55 3.72 -0.18 -4.44 117.46 117.18 1ok4 n PHE 34 Ca 0.09 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.35 1ok4 n PHE 34 Cb 0.66 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 39.13 1ok4 n PHE 34 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 1ok4 h MET 35 N 2.23 0.93 -0.85 -1.08 2.86 -1.55 -2.85 114.93 114.62 1ok4 h MET 35 Ca 0.00 -0.52 0.16 0.00 -2.06 0.00 0.00 59.70 57.27 1ok4 h MET 35 Cb 0.62 0.03 -0.10 0.00 0.06 0.00 0.00 31.60 32.21 1ok4 h MET 35 CO 0.00 1.17 0.42 -0.44 1.06 0.00 0.00 176.91 179.12 1ok4 h ASP 36 N 0.74 0.49 -2.60 1.22 5.19 -1.80 -3.33 116.42 116.34 1ok4 h ASP 36 Ca 0.05 0.10 -0.59 0.00 -0.62 0.00 0.00 57.03 55.96 1ok4 h ASP 36 Cb 1.04 0.03 -0.39 0.00 0.18 0.00 0.00 39.33 40.19 1ok4 h ASP 36 CO 0.11 0.19 -0.88 0.21 -3.12 0.00 0.00 179.24 175.74 1ok4 s ASN 37 N -5.39 2.34 0.59 6.45 2.47 -1.22 -4.78 114.94 115.41 1ok4 s ASN 37 Ca -0.12 -2.85 0.29 0.00 0.42 0.00 0.00 52.86 50.60 1ok4 s ASN 37 Cb 0.22 -0.58 1.52 0.00 -1.45 0.00 0.00 41.25 40.95 1ok4 s ASN 37 CO 0.78 -0.21 1.94 -0.65 -3.72 0.00 0.00 177.10 175.24 1ok4 h PRO 38 N 6.10 0.00 -0.08 0.43 0.11 -1.62 0.67 132.00 137.61 1ok4 h PRO 38 Ca 0.17 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.31 1ok4 h PRO 38 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 1ok4 h PRO 38 CO 0.38 0.00 0.08 -0.44 -0.21 0.00 0.00 178.00 177.81 1ok4 h ASP 39 N 0.00 0.00 0.06 -2.05 3.32 -1.95 -2.40 116.42 113.40 1ok4 h ASP 39 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1ok4 h ASP 39 Cb 1.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1ok4 h ASP 39 CO -0.00 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.29 1ok4 h SER 40 N 0.00 0.00 1.07 6.45 4.64 -1.12 -1.13 113.55 123.46 1ok4 h SER 40 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ok4 h SER 40 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1ok4 h SER 40 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1ok4 h ALA 41 N 2.01 1.00 -2.38 5.18 0.00 -1.64 -3.43 119.26 120.00 1ok4 h ALA 41 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 1ok4 h ALA 41 Cb 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.64 1ok4 h ALA 41 CO 0.00 0.00 -0.17 0.34 0.00 0.00 0.00 179.25 179.42 1ok4 s ASP 42 N -4.58 6.21 0.55 0.00 2.15 -0.43 -4.97 116.67 115.60 1ok4 s ASP 42 Ca 0.06 -0.56 0.23 0.00 0.43 0.00 0.00 52.55 52.71 1ok4 s ASP 42 Cb 0.10 -2.23 1.45 0.00 -0.30 0.00 0.00 42.92 41.93 1ok4 s ASP 42 CO 0.49 -0.57 2.10 -0.65 -0.17 0.00 0.00 175.17 176.36 1ok4 h PRO 43 N 8.70 0.00 -0.73 4.34 0.11 -1.85 -1.84 132.00 140.74 1ok4 h PRO 43 Ca -0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 1ok4 h PRO 43 Cb 1.11 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1ok4 h PRO 43 CO 0.79 0.00 0.40 0.93 -0.21 0.00 0.00 178.00 179.91 1ok4 h GLU 44 N 0.00 1.01 -0.65 1.05 5.08 -1.93 -1.69 114.58 117.45 1ok4 h GLU 44 Ca 0.10 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1ok4 h GLU 44 Cb 0.45 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 1ok4 h GLU 44 CO -0.00 0.76 0.42 -0.92 -1.00 0.00 0.00 179.01 178.27 1ok4 h TYR 45 N 1.00 0.79 -0.89 4.33 3.20 -1.62 -1.26 116.97 122.51 1ok4 h TYR 45 Ca 0.26 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1ok4 h TYR 45 Cb 0.04 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.00 1ok4 h TYR 45 CO -0.00 0.48 0.51 0.82 -1.64 0.00 0.00 178.16 178.33 1ok4 h ILE 46 N 0.84 1.25 -0.40 1.81 1.08 -1.20 -1.16 117.51 119.74 1ok4 h ILE 46 Ca 0.25 -0.59 -0.15 0.00 -0.39 0.00 0.00 64.86 63.97 1ok4 h ILE 46 Cb -0.05 0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 33.72 1ok4 h ILE 46 CO -0.07 0.28 -0.35 -0.07 -0.69 0.00 0.00 178.15 177.24 1ok4 h LEU 47 N 1.24 0.98 -0.59 1.44 3.38 -1.03 -1.48 115.31 119.24 1ok4 h LEU 47 Ca 0.32 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1ok4 h LEU 47 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1ok4 h LEU 47 CO -0.05 1.23 0.12 0.03 0.09 0.00 0.00 178.44 179.85 1ok4 h ARG 48 N 0.76 0.96 -0.36 1.13 3.08 -1.02 -1.39 114.38 117.55 1ok4 h ARG 48 Ca 0.07 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1ok4 h ARG 48 Cb 0.94 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 1ok4 h ARG 48 CO 0.09 0.89 0.23 1.25 -1.07 0.00 0.00 179.97 181.36 1ok4 h LEU 49 N 0.86 0.42 -0.72 3.04 5.85 -1.11 0.18 115.31 123.83 1ok4 h LEU 49 Ca 0.18 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.90 1ok4 h LEU 49 Cb 0.38 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1ok4 h LEU 49 CO 0.01 0.33 0.46 0.00 -0.34 0.00 0.00 178.44 178.89 1ok4 h ALA 50 N 1.11 0.94 -0.10 1.25 0.00 -1.12 -1.73 119.26 119.61 1ok4 h ALA 50 Ca 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1ok4 h ALA 50 Cb -0.02 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1ok4 h ALA 50 CO -0.03 0.25 -0.07 -0.09 0.00 0.00 0.00 179.25 179.31 1ok4 h ARG 51 N 0.90 0.22 0.00 0.00 2.43 -0.91 -1.66 114.38 115.36 1ok4 h ARG 51 Ca 0.28 -0.11 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 1ok4 h ARG 51 Cb -0.01 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1ok4 h ARG 51 CO -0.10 0.61 -0.41 -0.44 -1.51 0.00 0.00 179.97 178.12 1ok4 h ASP 52 N -0.17 0.00 0.61 -3.80 3.32 -0.60 -2.29 116.42 113.49 1ok4 h ASP 52 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ok4 h ASP 52 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1ok4 h ASP 52 CO 0.02 0.41 -0.31 0.00 -1.72 0.00 0.00 179.24 177.64 1ok4 n ALA 53 N -2.38 3.10 -2.18 3.45 0.00 -0.66 -4.95 120.51 116.90 1ok4 n ALA 53 Ca -0.01 -0.28 -0.08 0.00 0.00 0.00 0.00 53.44 53.07 1ok4 n ALA 53 Cb 0.48 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.69 1ok4 n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ok4 n GLY 54 N 1.47 0.03 3.79 0.00 0.00 -0.86 -4.77 105.19 104.84 1ok4 n GLY 54 Ca 0.07 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1ok4 n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ok4 s PHE 55 N -2.44 2.81 -0.25 1.61 0.08 -0.65 -5.00 117.98 114.15 1ok4 s PHE 55 Ca 0.01 1.29 0.21 0.00 0.12 0.00 0.00 56.93 58.56 1ok4 s PHE 55 Cb -0.00 -3.05 0.04 0.00 -0.57 0.00 0.00 43.02 39.44 1ok4 s PHE 55 CO 0.01 -1.70 1.13 -0.44 -0.10 0.00 0.00 175.22 174.11 1ok4 h ASP 56 N -1.05 0.00 -5.55 1.36 3.32 -1.33 -3.46 116.42 109.71 1ok4 h ASP 56 Ca -0.46 0.00 0.25 0.00 0.02 0.00 0.00 57.03 56.84 1ok4 h ASP 56 Cb 1.25 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.71 1ok4 h ASP 56 CO 0.57 0.13 0.65 -0.83 -1.72 0.00 0.00 179.24 178.04 1ok4 s GLY 57 N -4.42 -0.28 0.13 2.75 0.00 -1.22 -4.12 107.32 100.16 1ok4 s GLY 57 Ca 0.01 0.33 0.07 0.00 0.00 0.00 0.00 44.72 45.13 1ok4 s GLY 57 CO 0.77 0.39 -0.16 -1.34 0.00 0.00 0.00 173.10 172.76 1ok4 s VAL 58 N -2.80 1.47 -0.22 1.40 -7.23 -0.77 -0.79 120.40 111.46 1ok4 s VAL 58 Ca 0.14 -1.73 -0.02 0.00 -1.81 0.00 0.00 61.98 58.56 1ok4 s VAL 58 Cb 0.01 -1.59 0.01 0.00 0.56 0.00 0.00 36.38 35.38 1ok4 s VAL 58 CO -0.00 -0.35 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.66 1ok4 s VAL 59 N -1.99 2.89 0.10 1.32 1.01 -0.59 -1.12 120.40 122.00 1ok4 s VAL 59 Ca 0.10 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.36 1ok4 s VAL 59 Cb -0.06 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1ok4 s VAL 59 CO 0.04 0.36 -0.22 -0.36 0.00 0.00 0.00 175.10 174.92 1ok4 s PHE 60 N 1.38 1.87 0.86 5.22 0.08 -0.96 -1.70 117.98 124.72 1ok4 s PHE 60 Ca 0.03 -0.41 -0.12 0.00 0.12 0.00 0.00 56.93 56.56 1ok4 s PHE 60 Cb -0.15 -1.04 0.10 0.00 -0.57 0.00 0.00 43.02 41.37 1ok4 s PHE 60 CO -0.06 0.21 1.11 -0.65 -0.10 0.00 0.00 175.22 175.72 1ok4 s GLN 61 N -1.81 1.59 0.29 0.44 -1.52 -1.26 -1.22 119.66 116.16 1ok4 s GLN 61 Ca 0.08 0.58 -0.02 0.00 -1.95 0.00 0.00 55.36 54.04 1ok4 s GLN 61 Cb -0.10 -1.87 0.42 0.00 -0.22 0.00 0.00 33.01 31.25 1ok4 s GLN 61 CO 0.04 -1.95 1.94 0.07 -0.25 0.00 0.00 175.29 175.15 1ok4 h ARG 62 N -1.33 1.12 -0.28 2.91 0.11 -1.94 -1.87 114.38 113.11 1ok4 h ARG 62 Ca -0.49 -0.07 -0.14 0.00 0.10 0.00 0.00 59.98 59.38 1ok4 h ARG 62 Cb 1.29 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 32.11 1ok4 h ARG 62 CO 0.59 0.74 -0.40 0.78 0.10 0.00 0.00 179.97 181.79 1ok4 h GLY 63 N 1.16 0.72 1.08 0.08 0.00 -1.97 0.76 103.07 104.90 1ok4 h GLY 63 Ca 0.34 -0.72 -0.17 0.00 0.00 0.00 0.00 47.33 46.79 1ok4 h GLY 63 CO -0.09 0.65 -0.47 -2.22 0.00 0.00 0.00 176.54 174.41 1ok4 h ILE 64 N 0.54 1.29 -0.39 2.60 1.08 -1.86 -2.35 117.51 118.43 1ok4 h ILE 64 Ca 0.05 -1.66 -0.01 0.00 -0.39 0.00 0.00 64.86 62.84 1ok4 h ILE 64 Cb 0.92 1.65 -0.02 0.00 -3.07 0.00 0.00 36.82 36.31 1ok4 h ILE 64 CO 0.08 0.54 0.20 0.00 -0.69 0.00 0.00 178.15 178.28 1ok4 h ALA 65 N 0.67 0.49 -0.32 1.87 0.00 -1.11 -0.57 119.26 120.30 1ok4 h ALA 65 Ca 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ok4 h ALA 65 Cb 1.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1ok4 h ALA 65 CO 0.11 0.03 0.16 1.49 0.00 0.00 0.00 179.25 181.04 1ok4 h GLU 66 N 0.49 0.46 0.00 0.00 4.81 -0.84 -1.32 114.58 118.18 1ok4 h GLU 66 Ca 0.13 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.18 1ok4 h GLU 66 Cb 0.08 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 1ok4 h GLU 66 CO -0.02 0.41 -0.67 0.87 -0.73 0.00 0.00 179.01 178.87 1ok4 h LYS 67 N 0.39 0.00 0.00 1.92 6.56 -1.34 -3.42 116.57 120.68 1ok4 h LYS 67 Ca 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1ok4 h LYS 67 Cb 0.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.76 1ok4 h LYS 67 CO -0.02 0.48 -0.57 0.66 -2.06 0.00 0.00 179.45 177.94 1ok4 n TYR 68 N -3.17 0.00 -1.88 -1.35 4.01 -0.23 -5.06 117.16 109.48 1ok4 n TYR 68 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 1ok4 n TYR 68 Cb 0.76 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.76 1ok4 n TYR 68 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1ok4 s TYR 69 N -1.45 2.97 -0.01 -0.72 5.04 -0.50 -4.89 117.35 117.80 1ok4 s TYR 69 Ca 0.00 0.66 0.01 0.00 -2.44 0.00 0.00 57.07 55.30 1ok4 s TYR 69 Cb 0.00 -3.98 0.01 0.00 0.35 0.00 0.00 41.96 38.35 1ok4 s TYR 69 CO 0.00 -3.50 0.91 -0.40 -1.34 0.00 0.00 175.55 171.22 1ok4 n ASP 70 N 3.41 1.60 0.00 4.32 5.75 -1.26 -4.96 116.55 125.42 1ok4 n ASP 70 Ca 0.12 -1.86 0.00 0.00 -0.01 0.00 0.00 54.79 53.04 1ok4 n ASP 70 Cb 0.38 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1ok4 n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ok4 n GLY 71 N -0.44 0.77 0.17 6.12 0.00 -1.26 -4.92 105.19 105.63 1ok4 n GLY 71 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1ok4 n GLY 71 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ok4 h SER 72 N 0.00 0.00 -3.71 1.61 4.64 -1.98 -3.43 113.55 110.67 1ok4 h SER 72 Ca 0.00 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.09 1ok4 h SER 72 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 1ok4 h SER 72 CO 0.00 0.00 -0.66 -0.69 -0.87 0.00 0.00 176.83 174.62 1ok4 s VAL 73 N -3.26 -0.01 0.30 0.95 1.01 -1.26 -4.94 120.40 113.19 1ok4 s VAL 73 Ca 0.04 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.77 1ok4 s VAL 73 Cb 0.07 -0.10 -0.14 0.00 0.00 0.00 0.00 36.38 36.22 1ok4 s VAL 73 CO 0.71 0.01 1.11 -2.65 0.00 0.00 0.00 175.10 174.29 1ok4 n PRO 74 N 3.21 1.60 -4.65 2.72 -0.02 -1.26 -4.76 135.00 131.84 1ok4 n PRO 74 Ca -0.14 0.56 -0.33 0.00 -2.02 0.00 0.00 63.50 61.57 1ok4 n PRO 74 Cb 0.58 -2.01 -0.13 0.00 -0.02 0.00 0.00 33.50 31.93 1ok4 n PRO 74 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ok4 s LEU 75 N 0.01 2.96 -0.29 2.45 2.96 -1.26 -1.84 118.68 123.66 1ok4 s LEU 75 Ca 0.58 -0.21 -0.10 0.00 -0.22 0.00 0.00 54.13 54.19 1ok4 s LEU 75 Cb -0.67 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.33 1ok4 s LEU 75 CO 0.60 0.21 0.15 -0.63 -1.32 0.00 0.00 176.35 175.36 1ok4 s ILE 76 N 0.09 4.73 -0.39 6.68 1.01 -0.28 -0.68 121.20 132.37 1ok4 s ILE 76 Ca -0.03 -0.22 -0.21 0.00 0.00 0.00 0.00 60.65 60.18 1ok4 s ILE 76 Cb -0.14 -3.34 0.01 0.00 0.01 0.00 0.00 42.46 39.00 1ok4 s ILE 76 CO 0.04 0.16 0.66 -0.22 0.00 0.00 0.00 174.94 175.58 1ok4 s LEU 77 N 1.65 4.31 -0.38 2.97 1.98 -0.46 -2.28 118.68 126.48 1ok4 s LEU 77 Ca 0.06 0.01 -0.29 0.00 -2.89 0.00 0.00 54.13 51.01 1ok4 s LEU 77 Cb -0.16 -2.81 0.02 0.00 0.66 0.00 0.00 46.19 43.90 1ok4 s LEU 77 CO 0.07 -0.69 1.18 -0.75 -1.89 0.00 0.00 176.35 174.27 1ok4 s LYS 78 N 2.83 3.87 0.06 1.98 2.47 -0.36 -0.60 119.74 129.98 1ok4 s LYS 78 Ca 0.25 0.92 0.02 0.00 -1.56 0.00 0.00 55.97 55.60 1ok4 s LYS 78 Cb -0.14 -3.86 -0.25 0.00 -1.46 0.00 0.00 37.83 32.13 1ok4 s LYS 78 CO 0.17 -1.18 1.06 -0.07 0.16 0.00 0.00 175.35 175.48 1ok4 h LEU 79 N 10.86 0.20 -9.46 5.43 3.38 -1.27 -3.39 115.31 121.06 1ok4 h LEU 79 Ca -0.23 -0.25 -0.58 0.00 0.09 0.00 0.00 57.88 56.91 1ok4 h LEU 79 Cb 1.07 -0.07 -0.11 0.00 0.09 0.00 0.00 40.66 41.65 1ok4 h LEU 79 CO 1.07 1.20 -0.68 0.54 0.09 0.00 0.00 178.44 180.67 1ok4 s ASN 80 N -6.81 4.35 -0.17 -0.43 4.22 -1.26 -0.56 114.94 114.28 1ok4 s ASN 80 Ca -0.03 -0.69 -0.28 0.00 -2.14 0.00 0.00 52.86 49.71 1ok4 s ASN 80 Cb 0.08 -0.74 0.09 0.00 1.28 0.00 0.00 41.25 41.96 1ok4 s ASN 80 CO 0.84 0.03 0.79 -0.83 -2.04 0.00 0.00 177.10 175.89 1ok4 s GLY 81 N -3.50 -0.46 0.24 0.45 0.00 -1.19 -4.84 107.32 98.02 1ok4 s GLY 81 Ca 0.30 1.84 0.01 0.00 0.00 0.00 0.00 44.72 46.87 1ok4 s GLY 81 CO 0.18 1.34 0.10 -1.59 0.00 0.00 0.00 173.10 173.14 1ok4 s LYS 82 N -0.48 1.35 0.31 2.90 -2.85 -1.26 -4.17 119.74 115.54 1ok4 s LYS 82 Ca -0.04 -1.72 0.08 0.00 -1.00 0.00 0.00 55.97 53.28 1ok4 s LYS 82 Cb -0.02 -0.14 -0.03 0.00 -2.06 0.00 0.00 37.83 35.58 1ok4 s LYS 82 CO 0.04 -0.31 0.22 0.95 0.10 0.00 0.00 175.35 176.34 1ok4 s THR 83 N -3.85 3.70 -0.95 3.79 -4.23 -1.26 -3.23 115.64 109.61 1ok4 s THR 83 Ca 0.38 -1.48 0.28 0.00 -1.18 0.00 0.00 61.69 59.69 1ok4 s THR 83 Cb 0.08 -3.18 0.24 0.00 1.34 0.00 0.00 72.50 70.97 1ok4 s THR 83 CO 0.13 -0.24 1.88 0.35 -0.54 0.00 0.00 174.62 176.20 1ok4 n THR 84 N -1.24 0.15 0.21 3.99 -2.24 -1.07 -3.25 114.28 110.83 1ok4 n THR 84 Ca -0.04 -0.03 0.07 0.00 -2.27 0.00 0.00 64.05 61.77 1ok4 n THR 84 Cb 0.59 -0.54 0.48 0.00 -2.10 0.00 0.00 70.33 68.77 1ok4 n THR 84 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ok4 h LEU 85 N 0.00 0.00 -9.78 3.22 3.38 -1.94 -3.44 115.31 106.75 1ok4 h LEU 85 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1ok4 h LEU 85 Cb 0.53 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.33 1ok4 h LEU 85 CO 0.00 0.27 0.66 -0.47 0.09 0.00 0.00 178.44 178.99 1ok4 s TYR 86 N -4.09 3.14 -0.39 1.13 5.04 -1.20 -4.98 117.35 116.01 1ok4 s TYR 86 Ca -0.02 1.28 0.10 0.00 -2.44 0.00 0.00 57.07 55.98 1ok4 s TYR 86 Cb 0.13 -3.66 -0.11 0.00 0.35 0.00 0.00 41.96 38.67 1ok4 s TYR 86 CO 0.67 -1.97 0.38 0.09 -1.34 0.00 0.00 175.55 173.38 1ok4 n ASN 87 N 1.79 0.78 -2.44 4.32 3.02 -1.26 -5.02 115.26 116.44 1ok4 n ASN 87 Ca 0.04 -0.62 -0.00 0.00 -0.03 0.00 0.00 54.58 53.96 1ok4 n ASN 87 Cb 0.42 1.06 0.00 0.00 -0.61 0.00 0.00 39.78 40.66 1ok4 n ASN 87 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ok4 n GLY 88 N 1.33 -2.24 3.75 7.41 0.00 -1.26 -4.97 105.19 109.21 1ok4 n GLY 88 Ca 0.01 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 1ok4 n GLY 88 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ok4 s GLU 89 N -3.04 4.25 0.08 1.61 0.41 -1.26 -4.86 118.70 115.89 1ok4 s GLU 89 Ca 0.01 2.33 -0.35 0.00 -0.41 0.00 0.00 54.97 56.56 1ok4 s GLU 89 Cb -0.00 -3.09 -0.14 0.00 -1.78 0.00 0.00 34.13 29.11 1ok4 s GLU 89 CO 0.01 -0.43 1.60 -2.30 -0.49 0.00 0.00 175.26 173.65 1ok4 n PRO 90 N 2.19 1.93 -3.70 0.39 -0.02 -1.26 -4.79 135.00 129.74 1ok4 n PRO 90 Ca 0.06 0.70 -0.14 0.00 -2.02 0.00 0.00 63.50 62.11 1ok4 n PRO 90 Cb 0.40 -2.46 -0.09 0.00 -0.02 0.00 0.00 33.50 31.33 1ok4 n PRO 90 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ok4 s VAL 91 N 1.58 0.01 -0.12 -1.45 0.11 -1.26 -4.46 120.40 114.81 1ok4 s VAL 91 Ca 0.83 -0.05 -0.04 0.00 -2.93 0.00 0.00 61.98 59.80 1ok4 s VAL 91 Cb -0.75 -0.69 0.06 0.00 -1.53 0.00 0.00 36.38 33.47 1ok4 s VAL 91 CO 0.43 -0.03 0.16 -0.55 -3.33 0.00 0.00 175.10 171.78 1ok4 s SER 92 N 0.00 1.12 0.19 3.54 0.15 -1.26 -4.73 113.70 112.71 1ok4 s SER 92 Ca -0.02 0.08 0.06 0.00 0.70 0.00 0.00 55.95 56.76 1ok4 s SER 92 Cb -0.03 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.44 1ok4 s SER 92 CO 0.02 -0.28 0.15 0.68 1.20 0.00 0.00 173.24 175.01 1ok4 s VAL 93 N 2.27 4.43 0.22 4.45 -7.23 -1.26 -4.72 120.40 118.56 1ok4 s VAL 93 Ca 0.04 -1.21 -0.31 0.00 -1.81 0.00 0.00 61.98 58.69 1ok4 s VAL 93 Cb -0.13 -3.30 -0.10 0.00 0.56 0.00 0.00 36.38 33.40 1ok4 s VAL 93 CO -0.07 -0.19 1.51 0.00 -0.31 0.00 0.00 175.10 176.04 1ok4 s ALA 94 N -1.88 3.70 -1.59 1.32 0.00 -1.26 -3.18 121.76 118.87 1ok4 s ALA 94 Ca 0.31 1.38 0.15 0.00 0.00 0.00 0.00 51.96 53.81 1ok4 s ALA 94 Cb -0.09 -3.59 0.31 0.00 0.00 0.00 0.00 23.12 19.74 1ok4 s ALA 94 CO 0.24 -0.79 1.21 0.27 0.00 0.00 0.00 175.76 176.69 1ok4 n ASN 95 N 2.97 2.91 -3.65 0.00 0.23 0.28 -4.93 115.26 113.07 1ok4 n ASN 95 Ca 0.10 -1.86 -0.15 0.00 -0.53 0.00 0.00 54.58 52.14 1ok4 n ASN 95 Cb 0.39 -0.19 -0.08 0.00 -2.08 0.00 0.00 39.78 37.82 1ok4 n ASN 95 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ok4 s SER 97 N -0.72 5.96 0.22 0.00 1.04 -1.26 -4.87 113.70 114.06 1ok4 s SER 97 Ca -0.08 0.27 -0.08 0.00 0.48 0.00 0.00 55.95 56.54 1ok4 s SER 97 Cb -0.03 -1.62 0.17 0.00 0.10 0.00 0.00 66.02 64.64 1ok4 s SER 97 CO 0.05 -0.57 1.81 0.58 0.98 0.00 0.00 173.24 176.08 1ok4 h VAL 98 N 0.54 1.26 -0.84 5.02 2.07 -1.95 -1.57 116.25 120.77 1ok4 h VAL 98 Ca -0.47 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1ok4 h VAL 98 Cb 1.24 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 1ok4 h VAL 98 CO 0.58 0.31 0.54 -0.08 0.02 0.00 0.00 177.57 178.94 1ok4 h GLU 99 N 1.17 1.12 -0.28 1.57 4.81 -1.95 -0.62 114.58 120.40 1ok4 h GLU 99 Ca 0.28 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.33 1ok4 h GLU 99 Cb 0.13 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1ok4 h GLU 99 CO -0.03 0.76 -0.27 0.93 -0.73 0.00 0.00 179.01 179.67 1ok4 h GLU 100 N 1.15 0.55 -0.67 1.92 5.08 -1.91 -2.78 114.58 117.92 1ok4 h GLU 100 Ca 0.31 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1ok4 h GLU 100 Cb -0.11 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1ok4 h GLU 100 CO -0.06 0.77 0.42 0.00 -1.00 0.00 0.00 179.01 179.13 1ok4 h ALA 101 N 1.23 0.85 -0.44 3.43 0.00 -0.49 -1.56 119.26 122.29 1ok4 h ALA 101 Ca 0.07 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1ok4 h ALA 101 Cb 0.71 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1ok4 h ALA 101 CO 0.05 0.31 0.20 0.28 0.00 0.00 0.00 179.25 180.10 1ok4 h VAL 102 N 0.91 0.94 0.00 0.00 2.07 -1.07 -1.93 116.25 117.17 1ok4 h VAL 102 Ca 0.24 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 1ok4 h VAL 102 Cb -0.05 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1ok4 h VAL 102 CO -0.05 0.07 -0.09 0.77 0.02 0.00 0.00 177.57 178.30 1ok4 h SER 103 N 0.40 0.00 0.12 0.57 4.64 -1.12 -2.42 113.55 115.75 1ok4 h SER 103 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1ok4 h SER 103 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1ok4 h SER 103 CO -0.15 0.09 -0.05 0.18 -0.87 0.00 0.00 176.83 176.03 1ok4 n LEU 104 N -3.29 0.73 0.00 5.97 4.77 -0.64 -4.93 117.00 119.60 1ok4 n LEU 104 Ca -0.00 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1ok4 n LEU 104 Cb 0.30 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1ok4 n LEU 104 CO 0.29 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1ok4 n GLY 105 N 1.17 0.90 3.77 -0.72 0.00 -0.91 -4.89 105.19 104.51 1ok4 n GLY 105 Ca 0.19 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1ok4 n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok4 s ALA 106 N -2.00 3.38 -1.54 4.61 0.00 -0.77 -4.57 121.76 120.87 1ok4 s ALA 106 Ca 0.00 1.12 0.22 0.00 0.00 0.00 0.00 51.96 53.31 1ok4 s ALA 106 Cb 0.00 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1ok4 s ALA 106 CO 0.00 -0.54 1.05 0.43 0.00 0.00 0.00 175.76 176.70 1ok4 n SER 107 N 0.64 1.47 -3.64 0.00 7.64 0.15 -4.72 113.62 115.16 1ok4 n SER 107 Ca 0.01 -1.21 -0.09 0.00 1.01 0.00 0.00 58.87 58.60 1ok4 n SER 107 Cb 0.44 0.67 -0.02 0.00 -1.01 0.00 0.00 64.21 64.28 1ok4 n SER 107 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ok4 s ALA 108 N -2.72 -1.47 0.11 -0.43 0.00 -1.06 -4.17 121.76 112.01 1ok4 s ALA 108 Ca 0.14 0.18 0.09 0.00 0.00 0.00 0.00 51.96 52.37 1ok4 s ALA 108 Cb 0.17 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 1ok4 s ALA 108 CO 0.70 -0.90 -0.23 0.14 0.00 0.00 0.00 175.76 175.47 1ok4 s VAL 109 N -3.71 1.90 0.11 0.00 -7.23 -0.52 -1.35 120.40 109.60 1ok4 s VAL 109 Ca 0.07 -1.60 0.10 0.00 -1.81 0.00 0.00 61.98 58.74 1ok4 s VAL 109 Cb -0.03 -1.71 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 1ok4 s VAL 109 CO -0.03 0.01 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.68 1ok4 s GLY 110 N -1.92 1.57 -0.18 2.32 0.00 0.23 -0.35 107.32 108.99 1ok4 s GLY 110 Ca 0.09 -1.42 -0.11 0.00 0.00 0.00 0.00 44.72 43.28 1ok4 s GLY 110 CO 0.05 -1.39 0.45 -0.47 0.00 0.00 0.00 173.10 171.74 1ok4 s TYR 111 N -1.03 -0.64 -0.08 1.90 5.04 -0.62 -0.77 117.35 121.15 1ok4 s TYR 111 Ca 0.14 1.37 -0.17 0.00 -2.44 0.00 0.00 57.07 55.97 1ok4 s TYR 111 Cb -0.10 0.29 -0.05 0.00 0.35 0.00 0.00 41.96 42.45 1ok4 s TYR 111 CO 0.06 -0.35 0.45 0.99 -1.34 0.00 0.00 175.55 175.36 1ok4 s THR 112 N 1.24 5.12 0.10 4.34 2.01 -1.26 -1.04 115.64 126.16 1ok4 s THR 112 Ca -0.08 0.91 0.08 0.00 0.31 0.00 0.00 61.69 62.91 1ok4 s THR 112 Cb -0.07 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 1ok4 s THR 112 CO -0.11 0.41 -0.15 0.27 -0.69 0.00 0.00 174.62 174.34 1ok4 s ILE 113 N 0.06 3.02 -0.70 1.82 -4.36 -0.49 -4.84 121.20 115.71 1ok4 s ILE 113 Ca 0.25 -1.38 0.05 0.00 -0.26 0.00 0.00 60.65 59.31 1ok4 s ILE 113 Cb -0.16 -2.38 0.18 0.00 1.25 0.00 0.00 42.46 41.36 1ok4 s ILE 113 CO 0.11 0.14 0.54 -1.22 0.24 0.00 0.00 174.94 174.75 1ok4 n TYR 114 N 0.87 3.32 -1.65 1.37 4.01 -1.26 -1.66 117.16 122.16 1ok4 n TYR 114 Ca -0.15 -4.29 -0.45 0.00 -0.16 0.00 0.00 57.90 52.85 1ok4 n TYR 114 Cb 0.52 -0.61 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 1ok4 n TYR 114 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1ok4 n PRO 115 N 1.77 1.87 0.00 -0.72 -0.02 -1.26 -1.81 135.00 134.82 1ok4 n PRO 115 Ca 0.22 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1ok4 n PRO 115 Cb 0.36 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1ok4 n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ok4 n GLY 116 N 2.01 3.12 3.65 -1.23 0.00 -1.26 -1.87 105.19 109.62 1ok4 n GLY 116 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1ok4 n GLY 116 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ok4 n SER 117 N 0.08 1.49 0.12 1.61 2.88 -0.59 -2.31 113.62 116.90 1ok4 n SER 117 Ca 0.00 0.92 0.20 0.00 -1.33 0.00 0.00 58.87 58.66 1ok4 n SER 117 Cb 0.00 -1.44 0.74 0.00 -0.75 0.00 0.00 64.21 62.76 1ok4 n SER 117 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1ok4 h GLY 118 N 1.07 0.00 -3.09 0.46 0.00 -1.86 -0.69 103.07 98.96 1ok4 h GLY 118 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1ok4 h GLY 118 CO 0.54 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.77 1ok4 n PHE 119 N -3.58 1.81 -0.32 5.60 0.99 -1.26 -4.70 117.46 116.00 1ok4 n PHE 119 Ca 0.07 -0.76 0.05 0.00 -0.00 0.00 0.00 57.45 56.80 1ok4 n PHE 119 Cb 0.62 -0.46 0.20 0.00 -1.00 0.00 0.00 39.48 38.84 1ok4 n PHE 119 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.76 177.81 1ok4 h GLU 120 N 3.51 0.84 -0.67 -1.08 4.11 -1.35 -1.02 114.58 118.92 1ok4 h GLU 120 Ca 0.00 -0.05 0.09 0.00 0.07 0.00 0.00 59.36 59.47 1ok4 h GLU 120 Cb 1.85 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.86 1ok4 h GLU 120 CO 0.42 0.56 0.44 0.11 0.07 0.00 0.00 179.01 180.62 1ok4 h TRP 121 N 0.87 0.57 -0.52 2.06 5.08 -1.84 -1.20 115.95 120.97 1ok4 h TRP 121 Ca 0.44 0.02 -0.11 0.00 1.08 0.00 0.00 58.89 60.31 1ok4 h TRP 121 Cb 0.42 -0.19 -0.02 0.00 -3.00 0.00 0.00 29.16 26.38 1ok4 h TRP 121 CO -0.04 0.28 -0.11 -0.22 -1.28 0.00 0.00 178.44 177.07 1ok4 h LYS 122 N 0.54 1.00 -0.06 0.12 3.64 -1.54 -0.81 116.57 119.45 1ok4 h LYS 122 Ca 0.31 -0.37 -0.19 0.00 -1.27 0.00 0.00 60.65 59.13 1ok4 h LYS 122 Cb 0.48 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1ok4 h LYS 122 CO -0.10 1.05 -0.76 0.52 -2.27 0.00 0.00 179.45 177.89 1ok4 h MET 123 N 0.86 0.37 -0.47 1.90 2.86 -1.36 -2.40 114.93 116.70 1ok4 h MET 123 Ca 0.13 -0.32 -0.12 0.00 -2.06 0.00 0.00 59.70 57.33 1ok4 h MET 123 Cb 0.68 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 1ok4 h MET 123 CO 0.05 0.97 -0.18 0.74 1.06 0.00 0.00 176.91 179.54 1ok4 h PHE 124 N 0.24 1.04 -0.31 -0.22 0.04 -1.09 0.91 116.94 117.56 1ok4 h PHE 124 Ca -0.04 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.49 1ok4 h PHE 124 Cb 1.34 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 39.23 1ok4 h PHE 124 CO 0.04 1.02 0.16 1.49 -0.60 0.00 0.00 178.31 180.42 1ok4 h GLU 125 N 0.81 0.44 -0.30 1.51 4.81 -1.16 -1.70 114.58 118.99 1ok4 h GLU 125 Ca 0.11 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.12 1ok4 h GLU 125 Cb 0.73 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.03 1ok4 h GLU 125 CO 0.06 0.40 -0.48 1.49 -0.73 0.00 0.00 179.01 179.75 1ok4 h GLU 126 N 0.37 0.82 -0.67 1.92 4.81 -1.32 -2.98 114.58 117.53 1ok4 h GLU 126 Ca 0.11 -0.48 0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1ok4 h GLU 126 Cb 0.10 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 1ok4 h GLU 126 CO -0.01 1.11 0.44 1.25 -0.73 0.00 0.00 179.01 181.07 1ok4 h LEU 127 N 0.65 0.73 -0.65 1.64 5.85 -0.67 -1.71 115.31 121.16 1ok4 h LEU 127 Ca 0.03 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.83 1ok4 h LEU 127 Cb 1.07 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.85 1ok4 h LEU 127 CO 0.11 0.52 0.29 0.00 -0.34 0.00 0.00 178.44 179.01 1ok4 h ALA 128 N 1.60 0.86 -0.32 1.25 0.00 -1.15 0.35 119.26 121.84 1ok4 h ALA 128 Ca 0.26 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.14 1ok4 h ALA 128 Cb -0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ok4 h ALA 128 CO -0.06 -0.12 -0.16 0.00 0.00 0.00 0.00 179.25 178.90 1ok4 h ARG 129 N 0.50 0.68 -0.49 0.00 3.08 -1.35 -2.12 114.38 114.69 1ok4 h ARG 129 Ca 0.32 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1ok4 h ARG 129 Cb 0.35 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1ok4 h ARG 129 CO -0.28 0.90 0.18 0.82 -1.07 0.00 0.00 179.97 180.52 1ok4 h ILE 130 N 0.45 1.22 -0.23 2.04 2.04 -0.94 -1.60 117.51 120.48 1ok4 h ILE 130 Ca 0.07 -0.70 0.02 0.00 1.00 0.00 0.00 64.86 65.26 1ok4 h ILE 130 Cb 0.70 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1ok4 h ILE 130 CO 0.05 0.26 0.09 0.50 0.00 0.00 0.00 178.15 179.05 1ok4 h LYS 131 N 0.65 0.20 -0.54 2.37 1.63 -0.31 0.28 116.57 120.85 1ok4 h LYS 131 Ca 0.16 -0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.02 1ok4 h LYS 131 Cb 0.23 -0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.75 1ok4 h LYS 131 CO -0.01 0.13 0.23 -0.09 -3.45 0.00 0.00 179.45 176.26 1ok4 h ARG 132 N 0.20 0.43 -0.52 1.90 2.43 -1.17 -1.71 114.38 115.94 1ok4 h ARG 132 Ca 0.10 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.15 1ok4 h ARG 132 Cb 0.06 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1ok4 h ARG 132 CO -0.09 0.28 -0.06 -0.44 -1.51 0.00 0.00 179.97 178.15 1ok4 h ASP 133 N 0.44 0.92 -0.68 -3.80 3.32 -0.83 -2.23 116.42 113.57 1ok4 h ASP 133 Ca 0.25 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 57.04 1ok4 h ASP 133 Cb 0.24 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1ok4 h ASP 133 CO -0.23 1.01 0.45 0.00 -1.72 0.00 0.00 179.24 178.76 1ok4 h ALA 134 N 1.07 0.87 -0.53 3.45 0.00 0.10 0.06 119.26 124.29 1ok4 h ALA 134 Ca 0.15 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ok4 h ALA 134 Cb 0.59 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1ok4 h ALA 134 CO 0.04 0.27 0.30 0.28 0.00 0.00 0.00 179.25 180.14 1ok4 h VAL 135 N 0.90 1.17 -0.66 0.00 2.07 -1.18 0.12 116.25 118.67 1ok4 h VAL 135 Ca 0.25 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 1ok4 h VAL 135 Cb -0.08 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 1ok4 h VAL 135 CO -0.07 0.18 0.20 0.50 0.02 0.00 0.00 177.57 178.40 1ok4 h LYS 136 N 0.71 1.03 -0.08 1.57 3.64 -0.77 -2.64 116.57 120.03 1ok4 h LYS 136 Ca 0.19 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ok4 h LYS 136 Cb 0.02 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1ok4 h LYS 136 CO -0.03 0.90 0.00 1.19 -2.27 0.00 0.00 179.45 179.24 1ok4 n PHE 137 N -4.33 0.09 -3.61 1.91 3.72 -0.05 -4.97 117.46 110.22 1ok4 n PHE 137 Ca 0.04 -0.04 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 1ok4 n PHE 137 Cb 0.22 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.84 1ok4 n PHE 137 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1ok4 n ASP 138 N 0.59 -5.03 -4.32 4.37 2.03 0.28 -5.00 116.55 109.48 1ok4 n ASP 138 Ca 0.17 -0.60 -0.34 0.00 0.52 0.00 0.00 54.79 54.54 1ok4 n ASP 138 Cb 0.43 -4.87 -0.14 0.00 -0.72 0.00 0.00 41.12 35.82 1ok4 n ASP 138 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ok4 s LEU 139 N -7.08 2.81 0.46 -2.67 1.02 -0.38 -5.03 118.68 107.80 1ok4 s LEU 139 Ca 0.45 -0.38 -0.24 0.00 0.02 0.00 0.00 54.13 53.98 1ok4 s LEU 139 Cb -0.20 -1.69 -0.08 0.00 0.02 0.00 0.00 46.19 44.24 1ok4 s LEU 139 CO 0.75 0.04 1.23 -2.65 0.02 0.00 0.00 176.35 175.74 1ok4 n PRO 140 N 4.37 1.74 -3.75 1.29 -0.02 -1.26 -4.47 135.00 132.90 1ok4 n PRO 140 Ca -0.18 0.63 -0.37 0.00 -2.02 0.00 0.00 63.50 61.56 1ok4 n PRO 140 Cb 0.51 -2.37 -0.11 0.00 -0.02 0.00 0.00 33.50 31.51 1ok4 n PRO 140 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ok4 s LEU 141 N -1.93 3.75 -0.27 2.45 2.96 -1.26 -1.44 118.68 122.95 1ok4 s LEU 141 Ca 0.64 -0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 54.42 1ok4 s LEU 141 Cb -0.49 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1ok4 s LEU 141 CO 0.55 0.01 0.07 -0.69 -1.32 0.00 0.00 176.35 174.98 1ok4 s VAL 142 N 1.35 4.16 -0.26 1.68 1.01 0.53 -0.78 120.40 128.09 1ok4 s VAL 142 Ca 0.06 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 1ok4 s VAL 142 Cb -0.15 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1ok4 s VAL 142 CO 0.05 0.25 0.17 -0.69 0.00 0.00 0.00 175.10 174.88 1ok4 s VAL 143 N 1.57 5.34 -0.50 2.92 1.01 -0.56 -1.58 120.40 128.59 1ok4 s VAL 143 Ca 0.05 0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.92 1ok4 s VAL 143 Cb -0.16 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1ok4 s VAL 143 CO 0.03 0.31 1.12 0.26 0.00 0.00 0.00 175.10 176.82 1ok4 s TRP 144 N 1.35 2.77 -0.46 5.22 0.23 -0.21 -0.85 118.94 126.98 1ok4 s TRP 144 Ca 0.07 0.58 -0.10 0.00 -2.03 0.00 0.00 56.10 54.63 1ok4 s TRP 144 Cb -0.15 -4.41 0.11 0.00 0.03 0.00 0.00 33.47 29.06 1ok4 s TRP 144 CO 0.07 -1.34 0.34 0.45 0.96 0.00 0.00 176.95 177.43 1ok4 s SER 145 N 2.58 5.73 -0.61 2.95 0.15 -0.41 -1.39 113.70 122.70 1ok4 s SER 145 Ca 0.45 -1.80 0.04 0.00 0.70 0.00 0.00 55.95 55.34 1ok4 s SER 145 Cb -0.08 -2.02 0.17 0.00 -1.71 0.00 0.00 66.02 62.38 1ok4 s SER 145 CO 0.29 -0.67 0.43 -0.31 1.20 0.00 0.00 173.24 174.18 1ok4 s TYR 146 N 1.40 2.83 0.13 3.44 2.02 -0.66 -4.63 117.35 121.88 1ok4 s TYR 146 Ca 0.05 -3.02 -0.35 0.00 -0.37 0.00 0.00 57.07 53.38 1ok4 s TYR 146 Cb -0.26 -2.21 -0.15 0.00 -0.40 0.00 0.00 41.96 38.94 1ok4 s TYR 146 CO 0.00 -0.64 1.41 -2.30 -1.57 0.00 0.00 175.55 172.45 1ok4 n PRO 147 N 2.33 1.57 -3.63 -1.71 -0.02 -1.26 -4.18 135.00 128.11 1ok4 n PRO 147 Ca 0.21 0.57 -0.10 0.00 -2.02 0.00 0.00 63.50 62.16 1ok4 n PRO 147 Cb 0.38 -2.24 -0.07 0.00 -0.02 0.00 0.00 33.50 31.55 1ok4 n PRO 147 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ok4 s ARG 148 N 0.47 0.55 0.72 -0.52 3.52 -0.78 -4.84 118.95 118.07 1ok4 s ARG 148 Ca 0.80 0.61 0.00 0.00 -0.13 0.00 0.00 55.73 57.01 1ok4 s ARG 148 Cb -0.82 0.27 0.00 0.00 -1.56 0.00 0.00 34.95 32.84 1ok4 s ARG 148 CO 0.44 -0.08 0.00 0.41 -0.81 0.00 0.00 175.30 175.27 1ok4 n GLY 149 N 2.15 -2.16 7.00 8.12 0.00 -1.26 -1.54 105.19 117.50 1ok4 n GLY 149 Ca -0.13 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1ok4 n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ok4 n GLY 150 N -0.24 3.36 0.30 -0.02 0.00 -0.98 -1.57 105.19 106.05 1ok4 n GLY 150 Ca 0.00 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.14 1ok4 n GLY 150 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ok4 n LYS 151 N 14.00 1.41 -2.40 1.61 5.02 -1.26 -4.86 118.16 131.67 1ok4 n LYS 151 Ca 0.00 -0.59 -0.43 0.00 -2.02 0.00 0.00 58.31 55.27 1ok4 n LYS 151 Cb 0.00 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.50 1ok4 n LYS 151 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ok4 s VAL 152 N -2.00 4.23 -0.13 -0.18 1.01 -0.61 -4.83 120.40 117.90 1ok4 s VAL 152 Ca 0.42 1.47 0.04 0.00 0.00 0.00 0.00 61.98 63.91 1ok4 s VAL 152 Cb 0.21 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1ok4 s VAL 152 CO 0.35 -0.18 0.14 1.33 0.00 0.00 0.00 175.10 176.74 1ok4 n VAL 153 N 5.51 0.00 -3.46 2.92 0.24 -1.26 -4.50 118.33 117.78 1ok4 n VAL 153 Ca 0.14 -0.30 -0.20 0.00 -2.04 0.00 0.00 64.34 61.94 1ok4 n VAL 153 Cb 0.45 0.80 -0.12 0.00 -1.47 0.00 0.00 33.84 33.50 1ok4 n VAL 153 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1ok4 s ASN 154 N -1.74 1.96 0.50 -1.34 2.47 -1.26 -5.04 114.94 110.49 1ok4 s ASN 154 Ca 0.00 -0.70 0.30 0.00 0.42 0.00 0.00 52.86 52.89 1ok4 s ASN 154 Cb 0.03 0.30 1.05 0.00 -1.45 0.00 0.00 41.25 41.17 1ok4 s ASN 154 CO 0.16 -0.38 1.86 -0.33 -3.72 0.00 0.00 177.10 174.70 1ok4 h GLU 155 N 8.31 0.00 -0.43 0.43 5.08 -1.93 -2.85 114.58 123.19 1ok4 h GLU 155 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1ok4 h GLU 155 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1ok4 h GLU 155 CO 0.34 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.60 1ok4 n THR 156 N -3.05 0.67 -1.77 1.13 -2.24 -1.26 -4.46 114.28 103.30 1ok4 n THR 156 Ca 0.02 -0.84 -0.41 0.00 -2.27 0.00 0.00 64.05 60.55 1ok4 n THR 156 Cb 0.37 0.80 -0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1ok4 n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ok4 n ALA 157 N 1.28 2.46 -0.26 6.98 0.00 -1.08 -4.41 120.51 125.47 1ok4 n ALA 157 Ca 0.18 0.35 0.07 0.00 0.00 0.00 0.00 53.44 54.04 1ok4 n ALA 157 Cb 0.55 -2.44 0.20 0.00 0.00 0.00 0.00 19.45 17.76 1ok4 n ALA 157 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ok4 h PRO 158 N 3.29 0.20 0.00 0.00 0.11 -1.91 -1.55 132.00 132.13 1ok4 h PRO 158 Ca -0.50 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 1ok4 h PRO 158 Cb 1.24 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1ok4 h PRO 158 CO 0.67 0.13 -0.51 1.05 -0.21 0.00 0.00 178.00 179.12 1ok4 h GLU 159 N 0.20 0.00 -0.09 1.05 9.09 -1.95 -1.72 114.58 121.15 1ok4 h GLU 159 Ca 0.45 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.73 1ok4 h GLU 159 Cb 0.82 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.92 1ok4 h GLU 159 CO -0.59 0.51 -0.46 0.82 0.05 0.00 0.00 179.01 179.34 1ok4 h ILE 160 N 0.00 1.38 -0.59 -1.06 1.08 -1.63 -2.03 117.51 114.66 1ok4 h ILE 160 Ca -0.01 -1.80 -0.10 0.00 -0.39 0.00 0.00 64.86 62.56 1ok4 h ILE 160 Cb 1.00 2.23 -0.02 0.00 -3.07 0.00 0.00 36.82 36.96 1ok4 h ILE 160 CO 0.07 0.54 -0.02 0.58 -0.69 0.00 0.00 178.15 178.62 1ok4 h VAL 161 N 0.05 1.27 -0.74 1.67 2.07 -1.28 -0.18 116.25 119.11 1ok4 h VAL 161 Ca -0.03 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.26 1ok4 h VAL 161 Cb 1.11 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1ok4 h VAL 161 CO 0.10 0.43 0.28 0.00 0.02 0.00 0.00 177.57 178.40 1ok4 h ALA 162 N 0.97 0.96 -0.41 1.67 0.00 -1.38 -1.73 119.26 119.34 1ok4 h ALA 162 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ok4 h ALA 162 Cb 0.59 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ok4 h ALA 162 CO 0.04 0.60 0.19 -0.92 0.00 0.00 0.00 179.25 179.16 1ok4 h TYR 163 N 1.07 0.59 -0.81 0.00 -0.00 -1.12 -1.54 116.97 115.17 1ok4 h TYR 163 Ca 0.25 -0.03 0.12 0.00 -0.00 0.00 0.00 58.73 59.07 1ok4 h TYR 163 Cb 0.23 -0.18 -0.08 0.00 -0.00 0.00 0.00 36.73 36.69 1ok4 h TYR 163 CO 0.02 0.49 0.42 0.00 -0.00 0.00 0.00 178.16 179.09 1ok4 h ALA 164 N 1.04 1.18 -0.21 1.82 0.00 -0.77 -0.67 119.26 121.66 1ok4 h ALA 164 Ca 0.14 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1ok4 h ALA 164 Cb 0.13 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ok4 h ALA 164 CO -0.02 -0.04 -0.24 0.00 0.00 0.00 0.00 179.25 178.96 1ok4 h ALA 165 N 1.50 0.31 -0.66 0.00 0.00 -0.98 -2.71 119.26 116.73 1ok4 h ALA 165 Ca 0.42 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1ok4 h ALA 165 Cb 0.52 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1ok4 h ALA 165 CO -0.31 0.28 0.20 -0.09 0.00 0.00 0.00 179.25 179.32 1ok4 h ARG 166 N 0.21 1.02 -0.72 0.00 9.65 -0.97 -2.43 114.38 121.13 1ok4 h ARG 166 Ca 0.03 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.69 1ok4 h ARG 166 Cb 0.80 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 29.19 1ok4 h ARG 166 CO 0.06 0.90 0.48 0.82 2.80 0.00 0.00 179.97 185.02 1ok4 h ILE 167 N 0.95 1.18 -0.71 1.20 2.04 -1.07 -0.36 117.51 120.74 1ok4 h ILE 167 Ca 0.21 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1ok4 h ILE 167 Cb 0.30 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1ok4 h ILE 167 CO -0.01 0.18 0.37 0.00 0.00 0.00 0.00 178.15 178.70 1ok4 h ALA 168 N 1.27 0.91 -0.23 1.87 0.00 -1.29 -1.28 119.26 120.51 1ok4 h ALA 168 Ca 0.27 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ok4 h ALA 168 Cb -0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1ok4 h ALA 168 CO -0.06 0.44 0.14 1.25 0.00 0.00 0.00 179.25 181.03 1ok4 h LEU 169 N 0.98 0.28 -1.34 0.00 5.85 -0.94 -1.21 115.31 118.93 1ok4 h LEU 169 Ca 0.25 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1ok4 h LEU 169 Cb 0.07 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1ok4 h LEU 169 CO -0.04 0.25 -0.10 -0.33 -0.34 0.00 0.00 178.44 177.88 1ok4 h GLU 170 N 0.29 0.32 -0.00 1.25 4.39 -0.73 -2.82 114.58 117.27 1ok4 h GLU 170 Ca 0.08 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1ok4 h GLU 170 Cb 0.02 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1ok4 h GLU 170 CO -0.02 0.43 -0.31 1.28 -1.16 0.00 0.00 179.01 179.24 1ok4 n LEU 171 N -4.27 0.53 0.00 1.33 4.77 -0.51 -4.94 117.00 113.91 1ok4 n LEU 171 Ca -0.00 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1ok4 n LEU 171 Cb 0.27 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1ok4 n LEU 171 CO 0.38 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1ok4 n GLY 172 N 1.43 1.34 3.64 -0.72 0.00 -1.06 -4.97 105.19 104.85 1ok4 n GLY 172 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1ok4 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok4 n ALA 173 N -0.87 0.50 0.03 4.61 0.00 -0.48 -4.89 120.51 119.41 1ok4 n ALA 173 Ca 0.00 0.38 0.07 0.00 0.00 0.00 0.00 53.44 53.88 1ok4 n ALA 173 Cb 0.00 -2.13 -0.09 0.00 0.00 0.00 0.00 19.45 17.23 1ok4 n ALA 173 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ok4 n ASP 174 N 1.01 0.53 -3.72 0.00 8.00 0.04 -4.80 116.55 117.61 1ok4 n ASP 174 Ca 0.07 0.22 -0.10 0.00 0.71 0.00 0.00 54.79 55.69 1ok4 n ASP 174 Cb 0.34 0.88 -0.05 0.00 -0.02 0.00 0.00 41.12 42.27 1ok4 n ASP 174 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ok4 s ALA 175 N -3.22 -0.75 0.04 2.24 0.00 -1.05 -4.34 121.76 114.67 1ok4 s ALA 175 Ca -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 51.96 51.65 1ok4 s ALA 175 Cb 0.10 0.73 -0.03 0.00 0.00 0.00 0.00 23.12 23.93 1ok4 s ALA 175 CO 0.83 -0.67 0.01 0.00 0.00 0.00 0.00 175.76 175.93 1ok4 s MET 176 N -3.85 0.52 -0.14 0.00 0.23 -0.52 -1.50 119.30 114.04 1ok4 s MET 176 Ca 0.06 -0.91 0.02 0.00 -1.03 0.00 0.00 55.69 53.84 1ok4 s MET 176 Cb 0.02 0.19 0.01 0.00 -1.53 0.00 0.00 34.83 33.52 1ok4 s MET 176 CO -0.08 -0.10 -0.19 0.21 -2.03 0.00 0.00 175.02 172.82 1ok4 s LYS 177 N -2.83 2.76 0.19 3.16 2.20 -0.03 -0.06 119.74 125.13 1ok4 s LYS 177 Ca -0.03 -0.75 0.01 0.00 -0.36 0.00 0.00 55.97 54.84 1ok4 s LYS 177 Cb 0.00 -2.31 -0.05 0.00 -1.51 0.00 0.00 37.83 33.96 1ok4 s LYS 177 CO -0.06 -0.10 0.05 0.96 -0.36 0.00 0.00 175.35 175.84 1ok4 s ILE 178 N 1.04 0.47 0.40 5.43 -4.36 -0.71 -1.29 121.20 122.18 1ok4 s ILE 178 Ca -0.03 -1.97 -0.23 0.00 -0.26 0.00 0.00 60.65 58.16 1ok4 s ILE 178 Cb -0.14 -2.25 -0.10 0.00 1.25 0.00 0.00 42.46 41.21 1ok4 s ILE 178 CO -0.05 -0.33 0.97 -0.54 0.24 0.00 0.00 174.94 175.23 1ok4 s LYS 179 N -3.99 4.28 0.28 0.37 1.02 -1.26 -0.82 119.74 119.61 1ok4 s LYS 179 Ca 0.28 1.23 -0.29 0.00 0.02 0.00 0.00 55.97 57.22 1ok4 s LYS 179 Cb 0.07 -2.37 -0.09 0.00 -0.52 0.00 0.00 37.83 34.91 1ok4 s LYS 179 CO 0.06 0.01 1.05 -0.47 -0.92 0.00 0.00 175.35 175.08 1ok4 s TYR 180 N -1.96 3.68 -0.66 3.18 5.04 -1.26 -4.89 117.35 120.48 1ok4 s TYR 180 Ca 0.59 1.76 0.26 0.00 -2.44 0.00 0.00 57.07 57.24 1ok4 s TYR 180 Cb -0.13 -3.18 0.82 0.00 0.35 0.00 0.00 41.96 39.81 1ok4 s TYR 180 CO 0.18 -0.25 1.76 1.79 -1.34 0.00 0.00 175.55 177.69 1ok4 h THR 181 N 3.05 0.00 0.00 4.34 1.35 -1.95 -3.45 112.91 116.25 1ok4 h THR 181 Ca -0.46 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1ok4 h THR 181 Cb 1.21 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 1ok4 h THR 181 CO 0.67 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 1ok4 n GLY 182 N 1.08 0.09 3.28 5.82 0.00 -1.26 -4.89 105.19 109.30 1ok4 n GLY 182 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1ok4 n GLY 182 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ok4 s ASP 183 N -2.12 -0.28 0.39 1.61 -4.77 -1.26 -5.07 116.67 105.17 1ok4 s ASP 183 Ca 0.00 0.30 0.08 0.00 -3.30 0.00 0.00 52.55 49.63 1ok4 s ASP 183 Cb 0.00 0.44 0.80 0.00 -1.09 0.00 0.00 42.92 43.08 1ok4 s ASP 183 CO 0.00 -0.39 1.98 1.55 0.70 0.00 0.00 175.17 179.01 1ok4 h PRO 184 N 4.15 0.42 0.17 2.11 0.13 -1.97 -2.35 132.00 134.66 1ok4 h PRO 184 Ca -0.29 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.78 1ok4 h PRO 184 Cb 1.17 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ok4 h PRO 184 CO 0.37 0.39 -0.08 -0.22 -0.23 0.00 0.00 178.00 178.22 1ok4 h LYS 185 N 0.42 -0.23 -0.18 0.86 3.64 -1.97 -0.60 116.57 118.51 1ok4 h LYS 185 Ca 0.10 0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.37 1ok4 h LYS 185 Cb 0.15 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1ok4 h LYS 185 CO -0.01 0.04 -0.41 1.79 -2.27 0.00 0.00 179.45 178.59 1ok4 h THR 186 N -0.49 1.31 -0.08 1.00 1.35 -1.98 -2.82 112.91 111.20 1ok4 h THR 186 Ca -0.02 -1.57 -0.10 0.00 -0.55 0.00 0.00 66.41 64.16 1ok4 h THR 186 Cb 0.37 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1ok4 h THR 186 CO 0.04 0.48 -0.41 0.15 -0.25 0.00 0.00 175.52 175.54 1ok4 h PHE 187 N 0.36 0.20 0.00 4.73 3.57 -1.35 -2.79 116.94 121.66 1ok4 h PHE 187 Ca 0.03 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 1ok4 h PHE 187 Cb 0.88 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1ok4 h PHE 187 CO 0.03 0.56 -0.21 0.66 -2.23 0.00 0.00 178.31 177.12 1ok4 h SER 188 N 0.15 0.00 -0.50 0.41 4.64 -0.84 -1.91 113.55 115.51 1ok4 h SER 188 Ca 0.01 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1ok4 h SER 188 Cb 0.79 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 1ok4 h SER 188 CO 0.06 0.21 0.15 -0.25 -0.87 0.00 0.00 176.83 176.13 1ok4 h TRP 189 N 0.00 0.81 -0.65 4.77 -0.00 -1.47 -0.78 115.95 118.63 1ok4 h TRP 189 Ca -0.00 -0.08 -0.01 0.00 -0.00 0.00 0.00 58.89 58.79 1ok4 h TRP 189 Cb 0.51 -0.23 -0.03 0.00 -0.00 0.00 0.00 29.16 29.41 1ok4 h TRP 189 CO 0.00 0.71 0.37 0.00 -0.00 0.00 0.00 178.44 179.52 1ok4 h ALA 190 N 1.01 0.83 -0.79 2.65 0.00 -1.43 -1.31 119.26 120.23 1ok4 h ALA 190 Ca 0.16 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1ok4 h ALA 190 Cb 0.28 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1ok4 h ALA 190 CO -0.00 0.33 0.34 0.28 0.00 0.00 0.00 179.25 180.20 1ok4 h VAL 191 N 0.88 1.25 -0.36 0.00 2.07 -1.25 -2.41 116.25 116.43 1ok4 h VAL 191 Ca 0.23 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.94 1ok4 h VAL 191 Cb 0.02 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1ok4 h VAL 191 CO -0.04 0.32 0.04 0.50 0.02 0.00 0.00 177.57 178.41 1ok4 h LYS 192 N 1.13 0.61 0.00 1.57 3.64 -0.78 -3.02 116.57 119.72 1ok4 h LYS 192 Ca 0.27 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1ok4 h LYS 192 Cb 0.17 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1ok4 h LYS 192 CO -0.03 0.69 0.00 -0.39 -2.27 0.00 0.00 179.45 177.46 1ok4 h VAL 193 N 0.44 0.00 0.00 2.00 -1.51 -1.09 -1.90 116.25 114.19 1ok4 h VAL 193 Ca 0.11 -0.58 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1ok4 h VAL 193 Cb 0.39 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1ok4 h VAL 193 CO 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 1ok4 h ALA 194 N 2.09 1.00 -0.95 5.19 0.00 -1.30 -3.42 119.26 121.86 1ok4 h ALA 194 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ok4 h ALA 194 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ok4 h ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1ok4 n GLY 195 N -0.06 4.02 0.00 0.00 0.00 -0.72 -1.79 105.19 106.65 1ok4 n GLY 195 Ca 0.02 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1ok4 n GLY 195 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ok4 n LYS 196 N 14.00 0.33 -3.25 1.61 5.02 -1.26 -4.72 118.16 129.88 1ok4 n LYS 196 Ca 0.00 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.94 1ok4 n LYS 196 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.44 1ok4 n LYS 196 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ok4 s VAL 197 N -2.62 5.09 0.53 -0.18 1.01 -0.74 -5.04 120.40 118.45 1ok4 s VAL 197 Ca 0.23 0.87 -0.21 0.00 0.00 0.00 0.00 61.98 62.87 1ok4 s VAL 197 Cb 0.17 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1ok4 s VAL 197 CO 0.40 0.11 1.24 -2.16 0.00 0.00 0.00 175.10 174.69 1ok4 s PRO 198 N 2.13 3.31 -0.15 2.72 0.04 -1.26 -4.83 135.00 136.95 1ok4 s PRO 198 Ca 0.21 1.93 -0.01 0.00 0.04 0.00 0.00 61.00 63.17 1ok4 s PRO 198 Cb -0.16 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1ok4 s PRO 198 CO 0.09 -0.96 -0.12 0.08 0.04 0.00 0.00 177.00 176.12 1ok4 s VAL 199 N -1.49 2.97 -0.14 -0.36 1.01 -1.26 -1.44 120.40 119.69 1ok4 s VAL 199 Ca 0.71 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 1ok4 s VAL 199 Cb -0.33 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1ok4 s VAL 199 CO 0.38 0.50 0.03 -0.76 0.00 0.00 0.00 175.10 175.26 1ok4 s LEU 200 N 0.70 3.70 0.03 3.92 1.43 0.92 -0.96 118.68 128.43 1ok4 s LEU 200 Ca -0.06 0.10 -0.30 0.00 -1.03 0.00 0.00 54.13 52.84 1ok4 s LEU 200 Cb -0.15 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 1ok4 s LEU 200 CO 0.02 0.26 1.05 -0.32 0.23 0.00 0.00 176.35 177.58 1ok4 s MET 201 N -0.15 4.53 0.10 1.70 -2.45 -0.05 -1.75 119.30 121.24 1ok4 s MET 201 Ca 0.06 1.54 -0.30 0.00 -1.25 0.00 0.00 55.69 55.73 1ok4 s MET 201 Cb -0.12 -3.41 -0.06 0.00 1.25 0.00 0.00 34.83 32.48 1ok4 s MET 201 CO 0.02 -0.08 1.20 0.45 1.05 0.00 0.00 175.02 177.65 1ok4 s SER 202 N 0.90 7.08 0.24 1.11 0.15 -0.00 -0.39 113.70 122.79 1ok4 s SER 202 Ca 0.53 2.08 -0.03 0.00 0.70 0.00 0.00 55.95 59.24 1ok4 s SER 202 Cb -0.24 -2.59 0.27 0.00 -1.71 0.00 0.00 66.02 61.76 1ok4 s SER 202 CO 0.29 -0.44 1.70 1.23 1.20 0.00 0.00 173.24 177.23 1ok4 h GLY 203 N 6.33 0.84 0.00 9.45 0.00 -1.76 -3.40 103.07 114.53 1ok4 h GLY 203 Ca -0.42 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 46.28 1ok4 h GLY 203 CO 0.79 0.57 0.00 0.61 0.00 0.00 0.00 176.54 178.52 1ok4 n GLY 204 N -0.47 -2.18 3.69 4.60 0.00 -1.26 -4.90 105.19 104.67 1ok4 n GLY 204 Ca 0.01 -1.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 1ok4 n GLY 204 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ok4 n PRO 205 N -0.34 1.31 -1.67 1.61 -0.02 -1.26 -4.42 135.00 130.20 1ok4 n PRO 205 Ca 0.00 0.49 -0.49 0.00 -2.02 0.00 0.00 63.50 61.48 1ok4 n PRO 205 Cb 0.00 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.02 1ok4 n PRO 205 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ok4 n LYS 206 N -1.14 1.86 -1.59 -0.52 4.81 -1.26 -4.85 118.16 115.47 1ok4 n LYS 206 Ca 0.13 0.68 -0.30 0.00 -0.87 0.00 0.00 58.31 57.94 1ok4 n LYS 206 Cb 0.46 -2.44 0.07 0.00 0.02 0.00 0.00 35.03 33.13 1ok4 n LYS 206 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1ok4 s THR 207 N 2.34 3.53 0.18 3.15 -4.23 -1.26 -4.97 115.64 114.37 1ok4 s THR 207 Ca 0.87 0.50 -0.12 0.00 -1.18 0.00 0.00 61.69 61.76 1ok4 s THR 207 Cb -0.78 -3.27 0.08 0.00 1.34 0.00 0.00 72.50 69.87 1ok4 s THR 207 CO 0.48 -0.65 1.77 0.11 -0.54 0.00 0.00 174.62 175.79 1ok4 h LYS 208 N -0.89 0.86 -5.84 3.99 1.57 -1.99 -3.43 116.57 110.84 1ok4 h LYS 208 Ca -0.45 -0.12 -0.51 0.00 -1.87 0.00 0.00 60.65 57.69 1ok4 h LYS 208 Cb 1.24 -0.16 -0.15 0.00 0.08 0.00 0.00 32.23 33.24 1ok4 h LYS 208 CO 0.59 0.69 -0.76 0.95 -0.57 0.00 0.00 179.45 180.35 1ok4 s THR 209 N -5.72 1.93 0.31 -0.16 -4.23 -1.26 -5.03 115.64 101.47 1ok4 s THR 209 Ca -0.13 -2.15 -0.01 0.00 -1.18 0.00 0.00 61.69 58.22 1ok4 s THR 209 Cb 0.13 -2.04 0.27 0.00 1.34 0.00 0.00 72.50 72.20 1ok4 s THR 209 CO 0.78 -0.45 1.96 -0.33 -0.54 0.00 0.00 174.62 176.04 1ok4 h GLU 210 N 2.74 1.04 -0.93 3.99 5.08 -2.00 -2.54 114.58 121.95 1ok4 h GLU 210 Ca -0.40 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1ok4 h GLU 210 Cb 1.22 -0.23 -0.05 0.00 0.50 0.00 0.00 28.75 30.19 1ok4 h GLU 210 CO 0.58 0.68 0.58 1.49 -1.00 0.00 0.00 179.01 181.34 1ok4 h GLU 211 N 1.07 1.25 -0.52 2.33 4.57 -1.98 -1.21 114.58 120.09 1ok4 h GLU 211 Ca 0.32 -0.10 0.05 0.00 -1.18 0.00 0.00 59.36 58.44 1ok4 h GLU 211 Cb -0.04 -0.27 -0.04 0.00 -0.16 0.00 0.00 28.75 28.24 1ok4 h GLU 211 CO -0.08 0.86 0.26 -0.44 -1.18 0.00 0.00 179.01 178.43 1ok4 h ASP 212 N 1.28 0.38 -0.34 1.04 3.32 -1.87 -1.89 116.42 118.34 1ok4 h ASP 212 Ca 0.34 0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.29 1ok4 h ASP 212 Cb -0.08 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ok4 h ASP 212 CO -0.07 0.26 -0.23 0.15 -1.72 0.00 0.00 179.24 177.64 1ok4 h PHE 213 N 0.51 0.95 -0.39 4.55 3.57 -1.38 -2.52 116.94 122.24 1ok4 h PHE 213 Ca 0.23 -0.22 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1ok4 h PHE 213 Cb 0.14 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1ok4 h PHE 213 CO -0.10 0.97 0.10 -0.07 -2.23 0.00 0.00 178.31 176.98 1ok4 h LEU 214 N 0.72 0.52 -0.39 0.59 3.38 -0.90 -1.31 115.31 117.91 1ok4 h LEU 214 Ca 0.10 -0.07 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 1ok4 h LEU 214 Cb 0.76 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ok4 h LEU 214 CO 0.06 0.52 -0.74 0.11 0.09 0.00 0.00 178.44 178.47 1ok4 h LYS 215 N 0.55 0.41 -0.35 1.13 1.57 -0.98 -1.52 116.57 117.38 1ok4 h LYS 215 Ca 0.13 -0.34 -0.16 0.00 -1.87 0.00 0.00 60.65 58.41 1ok4 h LYS 215 Cb 0.20 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1ok4 h LYS 215 CO -0.00 0.98 -0.41 1.96 -0.57 0.00 0.00 179.45 181.41 1ok4 h GLN 216 N 0.27 0.87 -0.43 3.15 4.20 -1.03 -2.89 115.11 119.25 1ok4 h GLN 216 Ca -0.03 -0.47 -0.03 0.00 0.06 0.00 0.00 58.65 58.18 1ok4 h GLN 216 Cb 1.32 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.10 1ok4 h GLN 216 CO 0.13 1.11 0.14 0.28 -0.67 0.00 0.00 178.83 179.82 1ok4 h VAL 217 N 0.71 1.22 -0.31 -0.54 2.07 -1.12 -1.67 116.25 116.60 1ok4 h VAL 217 Ca 0.05 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 66.88 1ok4 h VAL 217 Cb 0.99 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1ok4 h VAL 217 CO 0.10 0.25 0.21 -0.08 0.02 0.00 0.00 177.57 178.07 1ok4 h GLU 218 N 0.55 0.38 0.00 1.57 4.57 -1.29 -1.32 114.58 119.04 1ok4 h GLU 218 Ca 0.14 -0.02 -0.17 0.00 -1.18 0.00 0.00 59.36 58.12 1ok4 h GLU 218 Cb 0.25 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1ok4 h GLU 218 CO -0.01 0.25 -0.83 0.78 -1.18 0.00 0.00 179.01 178.02 1ok4 h GLY 219 N 0.39 0.00 0.92 1.92 0.00 -1.17 0.22 103.07 105.35 1ok4 h GLY 219 Ca 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 1ok4 h GLY 219 CO -0.03 0.00 0.05 -2.08 0.00 0.00 0.00 176.54 174.48 1ok4 h VAL 220 N 0.00 1.24 -0.38 4.60 2.07 -0.82 -1.26 116.25 121.71 1ok4 h VAL 220 Ca -0.01 -0.86 -0.09 0.00 0.82 0.00 0.00 66.70 66.55 1ok4 h VAL 220 Cb 1.56 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 32.43 1ok4 h VAL 220 CO 0.11 0.29 -0.15 -0.07 0.02 0.00 0.00 177.57 177.77 1ok4 h LEU 221 N 0.44 0.69 -0.64 2.57 3.38 0.11 -2.53 115.31 119.32 1ok4 h LEU 221 Ca 0.11 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 1ok4 h LEU 221 Cb 0.37 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1ok4 h LEU 221 CO 0.01 0.85 -0.59 -0.33 0.09 0.00 0.00 178.44 178.47 1ok4 h GLU 222 N 0.62 0.00 0.00 1.13 5.08 -0.56 -2.45 114.58 118.41 1ok4 h GLU 222 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1ok4 h GLU 222 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1ok4 h GLU 222 CO 0.04 0.59 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 1ok4 n ALA 223 N -2.36 1.90 -0.17 3.43 0.00 -0.48 -4.90 120.51 117.93 1ok4 n ALA 223 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1ok4 n ALA 223 Cb 0.64 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1ok4 n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ok4 n GLY 224 N 0.52 0.91 3.78 0.00 0.00 -0.92 -4.46 105.19 105.01 1ok4 n GLY 224 Ca 0.04 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1ok4 n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ok4 s ALA 225 N -2.00 2.49 0.32 4.61 0.00 -0.98 -4.92 121.76 121.29 1ok4 s ALA 225 Ca 0.00 0.36 0.12 0.00 0.00 0.00 0.00 51.96 52.44 1ok4 s ALA 225 Cb 0.00 -3.27 0.56 0.00 0.00 0.00 0.00 23.12 20.42 1ok4 s ALA 225 CO 0.00 -1.33 1.73 1.25 0.00 0.00 0.00 175.76 177.41 1ok4 h LEU 226 N -0.37 0.00 0.00 0.00 5.85 -1.37 -3.43 115.31 115.99 1ok4 h LEU 226 Ca -0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1ok4 h LEU 226 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1ok4 h LEU 226 CO 0.54 0.48 0.00 0.61 -0.34 0.00 0.00 178.44 179.73 1ok4 n GLY 227 N -0.13 -0.39 3.14 3.75 0.00 -1.21 -1.27 105.19 109.08 1ok4 n GLY 227 Ca -0.02 -0.83 -0.18 0.00 0.00 0.00 0.00 46.02 44.99 1ok4 n GLY 227 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ok4 s ILE 228 N -4.00 1.01 -0.36 -0.61 -4.36 -0.66 -0.87 121.20 111.36 1ok4 s ILE 228 Ca 0.00 -1.08 0.00 0.00 -0.26 0.00 0.00 60.65 59.31 1ok4 s ILE 228 Cb 0.00 -0.95 0.09 0.00 1.25 0.00 0.00 42.46 42.85 1ok4 s ILE 228 CO 0.00 -0.12 0.10 0.00 0.24 0.00 0.00 174.94 175.16 1ok4 s ALA 229 N -1.03 2.97 -0.07 2.27 0.00 0.47 -1.27 121.76 125.11 1ok4 s ALA 229 Ca -0.01 -2.37 0.04 0.00 0.00 0.00 0.00 51.96 49.62 1ok4 s ALA 229 Cb -0.09 -2.12 -0.02 0.00 0.00 0.00 0.00 23.12 20.89 1ok4 s ALA 229 CO 0.01 -1.64 -0.19 0.54 0.00 0.00 0.00 175.76 174.48 1ok4 s VAL 230 N 1.06 2.57 0.00 0.00 0.11 -0.19 -2.07 120.40 121.88 1ok4 s VAL 230 Ca 0.06 -0.88 0.00 0.00 -2.93 0.00 0.00 61.98 58.23 1ok4 s VAL 230 Cb -0.21 -1.99 0.00 0.00 -1.53 0.00 0.00 36.38 32.65 1ok4 s VAL 230 CO -0.05 0.57 0.00 0.61 -3.33 0.00 0.00 175.10 172.89 1ok4 n GLY 231 N 2.87 0.31 0.36 6.54 0.00 -1.26 -0.82 105.19 113.19 1ok4 n GLY 231 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1ok4 n GLY 231 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ok4 h ARG 232 N 0.00 1.09 0.00 1.61 3.08 -1.85 -0.71 114.38 117.61 1ok4 h ARG 232 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1ok4 h ARG 232 Cb 0.00 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.80 1ok4 h ARG 232 CO 0.00 0.72 0.00 0.09 -1.07 0.00 0.00 179.97 179.71 1ok4 n ASN 233 N -4.42 0.20 -0.02 7.04 3.02 -1.26 -1.46 115.26 118.37 1ok4 n ASN 233 Ca 0.10 0.56 -0.02 0.00 -0.03 0.00 0.00 54.58 55.19 1ok4 n ASN 233 Cb 0.05 -0.60 -0.01 0.00 -0.61 0.00 0.00 39.78 38.61 1ok4 n ASN 233 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ok4 n VAL 234 N -1.73 0.34 1.29 2.41 0.31 -0.37 -4.78 118.33 115.80 1ok4 n VAL 234 Ca 0.02 0.39 0.14 0.00 -0.01 0.00 0.00 64.34 64.89 1ok4 n VAL 234 Cb 0.16 -1.66 0.71 0.00 -0.91 0.00 0.00 33.84 32.14 1ok4 n VAL 234 CO 0.00 0.00 0.00 -2.67 -1.32 0.00 0.00 176.83 172.84 1ok4 n TRP 235 N -2.94 0.00 1.19 3.52 4.27 -0.64 -2.33 117.44 120.51 1ok4 n TRP 235 Ca -0.03 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.72 1ok4 n TRP 235 Cb 0.11 -0.34 0.60 0.00 -1.36 0.00 0.00 31.31 30.32 1ok4 n TRP 235 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 1ok4 n GLN 236 N -1.34 0.25 -3.63 -2.67 6.02 -0.54 -4.65 117.38 110.83 1ok4 n GLN 236 Ca 0.12 -0.05 -0.38 0.00 -0.01 0.00 0.00 57.00 56.68 1ok4 n GLN 236 Cb 0.26 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 1ok4 n GLN 236 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1ok4 s ARG 237 N -2.78 3.77 0.42 -1.09 0.52 -0.98 -4.16 118.95 114.64 1ok4 s ARG 237 Ca 0.20 0.22 0.21 0.00 -0.52 0.00 0.00 55.73 55.85 1ok4 s ARG 237 Cb 0.19 -3.22 0.91 0.00 0.52 0.00 0.00 34.95 33.35 1ok4 s ARG 237 CO 0.53 0.70 1.84 0.00 0.02 0.00 0.00 175.30 178.38 1ok4 h ARG 238 N 4.87 0.00 -1.55 3.54 2.47 -1.87 -2.17 114.38 119.68 1ok4 h ARG 238 Ca -0.52 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 57.66 1ok4 h ARG 238 Cb 1.22 0.00 -0.21 0.00 -1.65 0.00 0.00 29.97 29.33 1ok4 h ARG 238 CO 0.61 0.28 0.65 -0.40 0.56 0.00 0.00 179.97 181.67 1ok4 n ASP 239 N -3.56 7.00 -0.20 7.04 5.75 -1.26 -4.80 116.55 126.51 1ok4 n ASP 239 Ca -0.01 -3.43 -0.02 0.00 -0.01 0.00 0.00 54.79 51.33 1ok4 n ASP 239 Cb 0.42 -1.08 0.08 0.00 -1.03 0.00 0.00 41.12 39.52 1ok4 n ASP 239 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ok4 h ALA 240 N 2.20 0.78 -0.28 2.12 0.00 -1.59 -1.61 119.26 120.88 1ok4 h ALA 240 Ca 0.45 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.28 1ok4 h ALA 240 Cb 0.70 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ok4 h ALA 240 CO 1.14 -0.06 -0.26 1.25 0.00 0.00 0.00 179.25 181.31 1ok4 h LEU 241 N 0.55 0.72 -0.17 0.00 5.85 -1.88 0.05 115.31 120.44 1ok4 h LEU 241 Ca 0.27 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1ok4 h LEU 241 Cb 0.22 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1ok4 h LEU 241 CO -0.20 1.04 0.11 0.50 -0.34 0.00 0.00 178.44 179.54 1ok4 h LYS 242 N 0.41 0.22 -0.29 1.25 3.64 -1.90 -1.19 116.57 118.72 1ok4 h LYS 242 Ca 0.05 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1ok4 h LYS 242 Cb 0.83 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1ok4 h LYS 242 CO 0.07 0.14 -0.27 0.35 -2.27 0.00 0.00 179.45 177.47 1ok4 h PHE 243 N 0.22 0.65 -0.89 1.91 3.57 -1.22 -2.37 116.94 118.81 1ok4 h PHE 243 Ca 0.06 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 1ok4 h PHE 243 Cb -0.03 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 1ok4 h PHE 243 CO -0.07 0.79 0.47 0.00 -2.23 0.00 0.00 178.31 177.27 1ok4 h ALA 244 N 1.21 1.15 -0.11 2.41 0.00 -0.68 -0.71 119.26 122.53 1ok4 h ALA 244 Ca 0.07 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1ok4 h ALA 244 Cb 0.73 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ok4 h ALA 244 CO 0.06 0.67 -0.45 0.00 0.00 0.00 0.00 179.25 179.53 1ok4 h ARG 245 N 1.26 0.26 -0.37 0.00 3.08 -0.93 -1.07 114.38 116.60 1ok4 h ARG 245 Ca 0.31 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 60.12 1ok4 h ARG 245 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1ok4 h ARG 245 CO -0.05 0.66 -0.23 0.00 -1.07 0.00 0.00 179.97 179.29 1ok4 h ALA 246 N 1.32 0.90 -0.55 0.04 0.00 -0.91 -1.45 119.26 118.60 1ok4 h ALA 246 Ca 0.01 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1ok4 h ALA 246 Cb 0.88 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1ok4 h ALA 246 CO 0.07 0.62 0.08 -0.07 0.00 0.00 0.00 179.25 179.96 1ok4 h LEU 247 N 0.65 0.88 -0.57 0.00 3.38 -0.74 -1.88 115.31 117.03 1ok4 h LEU 247 Ca 0.09 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.82 1ok4 h LEU 247 Cb 0.73 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1ok4 h LEU 247 CO 0.06 0.92 0.35 0.00 0.09 0.00 0.00 178.44 179.86 1ok4 h ALA 248 N 0.99 0.73 -0.24 1.53 0.00 -1.08 -0.05 119.26 121.15 1ok4 h ALA 248 Ca 0.17 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1ok4 h ALA 248 Cb 0.42 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1ok4 h ALA 248 CO 0.01 0.08 0.02 1.49 0.00 0.00 0.00 179.25 180.86 1ok4 h GLU 249 N 0.69 0.10 0.09 0.00 4.57 -1.03 -0.43 114.58 118.57 1ok4 h GLU 249 Ca 0.23 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1ok4 h GLU 249 Cb 0.01 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1ok4 h GLU 249 CO -0.09 0.07 -0.04 1.25 -1.18 0.00 0.00 179.01 179.02 1ok4 h LEU 250 N 0.11 -0.10 -0.20 1.64 5.85 -1.07 -3.23 115.31 118.32 1ok4 h LEU 250 Ca 0.11 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.55 1ok4 h LEU 250 Cb 0.13 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1ok4 h LEU 250 CO -0.17 0.09 -0.43 0.58 -0.34 0.00 0.00 178.44 178.16 1ok4 h VAL 251 N -0.28 1.32 -0.01 1.05 2.07 -0.91 -3.35 116.25 116.14 1ok4 h VAL 251 Ca -0.01 -1.66 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1ok4 h VAL 251 Cb 0.24 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1ok4 h VAL 251 CO 0.02 0.52 -0.27 -1.22 0.02 0.00 0.00 177.57 176.64 1ok4 n TYR 252 N -4.21 0.00 0.00 1.57 4.01 -0.18 -4.82 117.16 113.52 1ok4 n TYR 252 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 1ok4 n TYR 252 Cb 0.56 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1ok4 n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81