#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 -0.64 1.20 3.38 -1.98 -2.76 115.31 114.51 1ok4 h LEU 4 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 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 0.46 0.41 0.74 0.09 0.00 0.00 178.44 180.14 1ok4 h THR 5 N 0.00 1.18 -0.63 0.22 2.02 -1.96 -0.49 112.91 113.24 1ok4 h THR 5 Ca -0.01 -0.36 -0.09 0.00 0.77 0.00 0.00 66.41 66.72 1ok4 h THR 5 Cb 1.36 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1ok4 h THR 5 CO 0.06 0.18 0.03 -0.33 0.37 0.00 0.00 175.52 175.83 1ok4 h GLU 6 N 0.87 1.09 -0.54 6.66 5.08 -1.88 -0.54 114.58 125.32 1ok4 h GLU 6 Ca 0.23 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1ok4 h GLU 6 Cb -0.06 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1ok4 h GLU 6 CO -0.05 1.04 0.31 -0.22 -1.00 0.00 0.00 179.01 179.09 1ok4 h LYS 7 N 1.01 0.74 -0.42 2.33 3.64 -1.38 -1.60 116.57 120.89 1ok4 h LYS 7 Ca 0.18 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1ok4 h LYS 7 Cb 0.53 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.15 1ok4 h LYS 7 CO 0.03 0.56 0.17 0.35 -2.27 0.00 0.00 179.45 178.29 1ok4 h PHE 8 N 0.72 0.30 -0.28 1.91 3.57 -0.47 -2.05 116.94 120.64 1ok4 h PHE 8 Ca 0.19 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1ok4 h PHE 8 Cb 0.03 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1ok4 h PHE 8 CO -0.02 0.13 -0.21 -0.07 -2.23 0.00 0.00 178.31 175.91 1ok4 h LEU 9 N 0.34 0.52 -0.60 0.59 3.38 -0.92 0.74 115.31 119.36 1ok4 h LEU 9 Ca 0.19 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1ok4 h LEU 9 Cb 0.16 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1ok4 h LEU 9 CO -0.18 0.73 -0.06 -0.09 0.09 0.00 0.00 178.44 178.94 1ok4 h ARG 10 N 0.47 1.04 0.10 1.13 2.43 -1.06 -0.66 114.38 117.83 1ok4 h ARG 10 Ca 0.07 -0.36 -0.25 0.00 -0.81 0.00 0.00 59.98 58.63 1ok4 h ARG 10 Cb 0.62 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1ok4 h ARG 10 CO 0.04 1.05 -1.29 0.82 -1.51 0.00 0.00 179.97 179.08 1ok4 h ILE 11 N 0.94 1.08 -0.04 1.20 2.04 -1.19 -3.37 117.51 118.16 1ok4 h ILE 11 Ca 0.16 -2.37 0.00 0.00 1.00 0.00 0.00 64.86 63.64 1ok4 h ILE 11 Cb 0.62 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.42 1ok4 h ILE 11 CO 0.04 0.66 0.00 0.49 0.00 0.00 0.00 178.15 179.34 1ok4 n PHE 12 N -4.02 0.03 -2.72 1.37 3.72 0.24 -4.59 117.46 111.49 1ok4 n PHE 12 Ca -0.25 -0.02 -0.04 0.00 -0.05 0.00 0.00 57.45 57.09 1ok4 n PHE 12 Cb 0.85 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.47 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 0.97 2.59 0.26 4.37 0.00 -0.27 -4.48 120.51 123.95 1ok4 n ALA 13 Ca 0.10 -2.13 0.11 0.00 0.00 0.00 0.00 53.44 51.52 1ok4 n ALA 13 Cb 0.43 -0.91 0.71 0.00 0.00 0.00 0.00 19.45 19.68 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 2.21 0.00 -0.10 0.00 0.11 -1.69 -0.20 114.38 114.71 1ok4 h ARG 14 Ca -0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.85 1ok4 h ARG 14 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 1ok4 h ARG 14 CO 0.13 0.10 0.00 0.54 0.10 0.00 0.00 179.97 180.83 1ok4 n ARG 15 N -3.96 1.59 0.00 0.08 1.74 -1.26 -4.92 116.66 109.93 1ok4 n ARG 15 Ca -0.02 -0.89 0.00 0.00 -0.77 0.00 0.00 57.85 56.17 1ok4 n ARG 15 Cb 0.19 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 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 1.09 2.83 3.25 -0.13 0.00 -0.09 -5.01 105.19 107.14 1ok4 n GLY 16 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.89 1.16 -0.02 1.61 -0.14 -1.26 -4.97 119.74 115.23 1ok4 s LYS 17 Ca 0.00 -1.57 0.02 0.00 -1.36 0.00 0.00 55.97 53.06 1ok4 s LYS 17 Cb 0.00 -0.23 -0.00 0.00 -1.68 0.00 0.00 37.83 35.92 1ok4 s LYS 17 CO 0.00 -0.17 -0.08 0.45 -0.76 0.00 0.00 175.35 174.79 1ok4 s SER 18 N -3.19 1.01 -0.13 2.83 0.15 -0.43 -4.57 113.70 109.36 1ok4 s SER 18 Ca 0.27 -0.15 0.01 0.00 0.70 0.00 0.00 55.95 56.77 1ok4 s SER 18 Cb 0.06 -0.20 0.02 0.00 -1.71 0.00 0.00 66.02 64.20 1ok4 s SER 18 CO 0.06 0.07 -0.14 -0.63 1.20 0.00 0.00 173.24 173.80 1ok4 s ILE 19 N 0.02 1.50 -0.12 6.45 1.01 -1.26 -1.74 121.20 127.06 1ok4 s ILE 19 Ca -0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 60.65 60.04 1ok4 s ILE 19 Cb -0.06 -1.40 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 1ok4 s ILE 19 CO -0.00 0.45 -0.11 -0.63 0.00 0.00 0.00 174.94 174.65 1ok4 s ILE 20 N 1.33 3.30 -0.42 2.92 -1.09 -0.44 -0.90 121.20 125.91 1ok4 s ILE 20 Ca 0.01 -0.58 -0.21 0.00 -2.23 0.00 0.00 60.65 57.63 1ok4 s ILE 20 Cb -0.13 -2.39 0.02 0.00 -1.58 0.00 0.00 42.46 38.38 1ok4 s ILE 20 CO -0.07 0.53 0.68 -0.22 -1.23 0.00 0.00 174.94 174.63 1ok4 s LEU 21 N 0.13 4.36 0.02 2.97 2.96 0.13 -1.03 118.68 128.22 1ok4 s LEU 21 Ca -0.05 -0.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.55 1ok4 s LEU 21 Cb -0.14 -2.81 -0.06 0.00 0.50 0.00 0.00 46.19 43.68 1ok4 s LEU 21 CO 0.04 -0.76 0.54 0.00 -1.32 0.00 0.00 176.35 174.85 1ok4 s ALA 22 N 2.91 3.57 -0.30 5.97 0.00 0.11 -1.55 121.76 132.47 1ok4 s ALA 22 Ca 0.25 -0.04 0.18 0.00 0.00 0.00 0.00 51.96 52.35 1ok4 s ALA 22 Cb -0.14 -2.62 0.46 0.00 0.00 0.00 0.00 23.12 20.82 1ok4 s ALA 22 CO 0.19 0.30 1.28 0.98 0.00 0.00 0.00 175.76 178.51 1ok4 n TYR 23 N 2.24 -0.23 0.64 0.00 9.36 -0.53 -4.25 117.16 124.40 1ok4 n TYR 23 Ca -0.10 -2.02 0.09 0.00 3.32 0.00 0.00 57.90 59.19 1ok4 n TYR 23 Cb 0.51 0.55 0.24 0.00 -0.63 0.00 0.00 39.34 40.01 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 -0.93 2.42 0.23 2.98 5.75 -1.24 -4.53 116.55 121.24 1ok4 n ASP 24 Ca -0.03 -1.94 0.08 0.00 -0.01 0.00 0.00 54.79 52.89 1ok4 n ASP 24 Cb 0.83 -0.26 0.56 0.00 -1.03 0.00 0.00 41.12 41.22 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 2.79 0.00 -0.99 2.11 3.86 -1.93 -2.89 115.15 118.11 1ok4 h HIS 25 Ca 0.00 0.00 0.17 0.00 -1.16 0.00 0.00 60.37 59.38 1ok4 h HIS 25 Cb 0.63 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.01 1ok4 h HIS 25 CO 0.26 0.21 0.61 0.78 0.86 0.00 0.00 177.93 180.66 1ok4 h GLY 26 N 0.94 1.61 0.47 2.45 0.00 -1.82 0.71 103.07 107.44 1ok4 h GLY 26 Ca -0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 47.33 46.63 1ok4 h GLY 26 CO 0.03 0.01 -1.89 4.51 0.00 0.00 0.00 176.54 179.20 1ok4 n ILE 27 N -4.68 1.73 -0.21 2.60 3.06 -1.11 -2.82 119.36 117.93 1ok4 n ILE 27 Ca 0.21 -0.53 -0.09 0.00 -2.50 0.00 0.00 62.75 59.84 1ok4 n ILE 27 Cb 0.52 -1.78 0.02 0.00 0.54 0.00 0.00 39.64 38.94 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 -0.14 1.04 0.00 9.51 4.39 -1.31 -3.35 114.58 124.72 1ok4 h GLU 28 Ca -0.42 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 58.96 1ok4 h GLU 28 Cb 1.89 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.44 1ok4 h GLU 28 CO 0.02 1.01 -0.74 0.72 -1.16 0.00 0.00 179.01 178.87 1ok4 n HIS 29 N -4.22 0.00 0.00 4.33 8.25 0.09 -2.72 115.22 120.94 1ok4 n HIS 29 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1ok4 n HIS 29 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.44 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 1.95 -1.15 0.00 -1.41 0.00 -0.30 -4.58 105.19 99.70 1ok4 n GLY 30 Ca 0.00 -1.62 0.09 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.29 0.40 -0.10 1.61 -0.04 -1.26 -2.90 135.00 131.41 1ok4 n PRO 31 Ca 0.00 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.61 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 2.99 1.85 -0.71 0.55 0.00 -1.97 -0.64 119.26 121.34 1ok4 h ALA 32 Ca 0.00 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.10 1ok4 h ALA 32 Cb 0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1ok4 h ALA 32 CO 0.00 0.04 0.60 -0.44 0.00 0.00 0.00 179.25 179.46 1ok4 h ASP 33 N 0.55 0.00 0.06 0.00 5.19 -1.82 -2.87 116.42 117.53 1ok4 h ASP 33 Ca 0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1ok4 h ASP 33 Cb 0.33 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.84 1ok4 h ASP 33 CO -0.08 0.00 -0.13 0.49 -3.12 0.00 0.00 179.24 176.40 1ok4 n PHE 34 N -3.97 0.00 -0.07 4.55 3.72 -0.25 -4.40 117.46 117.05 1ok4 n PHE 34 Ca 0.14 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.41 1ok4 n PHE 34 Cb 0.86 -0.04 -0.01 0.00 -0.94 0.00 0.00 39.48 39.36 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 2.43 0.81 -0.84 -1.08 2.86 -1.59 -2.79 114.93 114.74 1ok4 h MET 35 Ca 0.00 -0.49 0.16 0.00 -2.06 0.00 0.00 59.70 57.30 1ok4 h MET 35 Cb 0.61 0.05 -0.10 0.00 0.06 0.00 0.00 31.60 32.23 1ok4 h MET 35 CO 0.00 1.13 0.40 -0.44 1.06 0.00 0.00 176.91 179.06 1ok4 h ASP 36 N 0.63 0.45 -2.53 1.22 3.32 -1.80 -3.33 116.42 114.38 1ok4 h ASP 36 Ca 0.02 0.11 -0.59 0.00 0.02 0.00 0.00 57.03 56.59 1ok4 h ASP 36 Cb 1.10 0.04 -0.39 0.00 0.22 0.00 0.00 39.33 40.31 1ok4 h ASP 36 CO 0.11 0.16 -0.90 0.21 -1.72 0.00 0.00 179.24 177.10 1ok4 s ASN 37 N -5.37 2.24 0.60 6.45 2.47 -1.21 -4.80 114.94 115.33 1ok4 s ASN 37 Ca -0.12 -2.72 0.29 0.00 0.42 0.00 0.00 52.86 50.74 1ok4 s ASN 37 Cb 0.22 -0.48 1.60 0.00 -1.45 0.00 0.00 41.25 41.14 1ok4 s ASN 37 CO 0.78 -0.23 2.00 -0.65 -3.72 0.00 0.00 177.10 175.27 1ok4 h PRO 38 N 6.23 0.00 -0.13 0.43 0.11 -1.62 0.28 132.00 137.31 1ok4 h PRO 38 Ca 0.17 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.32 1ok4 h PRO 38 Cb 0.93 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1ok4 h PRO 38 CO 0.34 0.00 0.10 -0.44 -0.21 0.00 0.00 178.00 177.79 1ok4 h ASP 39 N 0.00 0.00 0.00 -2.05 3.32 -1.95 -2.53 116.42 113.22 1ok4 h ASP 39 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ok4 h ASP 39 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1ok4 h ASP 39 CO -0.00 0.00 0.05 0.77 -1.72 0.00 0.00 179.24 178.34 1ok4 h SER 40 N 0.00 0.00 1.10 6.45 4.64 -1.20 -0.57 113.55 123.97 1ok4 h SER 40 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1ok4 h SER 40 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 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 1.90 1.00 -2.39 5.18 0.00 -1.66 -3.43 119.26 119.87 1ok4 h ALA 41 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 1ok4 h ALA 41 Cb 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.72 1ok4 h ALA 41 CO 0.00 0.00 -0.11 0.34 0.00 0.00 0.00 179.25 179.48 1ok4 s ASP 42 N -4.92 6.25 0.56 0.00 2.15 -0.22 -4.98 116.67 115.52 1ok4 s ASP 42 Ca 0.05 -0.37 0.24 0.00 0.43 0.00 0.00 52.55 52.90 1ok4 s ASP 42 Cb 0.09 -2.25 1.59 0.00 -0.30 0.00 0.00 42.92 42.05 1ok4 s ASP 42 CO 0.50 -0.56 2.21 -0.65 -0.17 0.00 0.00 175.17 176.51 1ok4 h PRO 43 N 8.64 0.00 -0.54 4.34 0.11 -1.85 -1.26 132.00 141.45 1ok4 h PRO 43 Ca -0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 1ok4 h PRO 43 Cb 1.12 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1ok4 h PRO 43 CO 0.79 0.00 0.19 0.93 -0.21 0.00 0.00 178.00 179.70 1ok4 h GLU 44 N 0.00 0.82 -0.97 1.05 5.08 -1.93 -0.90 114.58 117.73 1ok4 h GLU 44 Ca -0.00 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1ok4 h GLU 44 Cb 0.00 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.07 1ok4 h GLU 44 CO 0.00 0.74 0.63 -0.92 -1.00 0.00 0.00 179.01 178.46 1ok4 h TYR 45 N 0.74 1.18 -0.41 4.33 3.20 -1.52 0.40 116.97 124.89 1ok4 h TYR 45 Ca 0.18 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1ok4 h TYR 45 Cb 0.24 -0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 1ok4 h TYR 45 CO 0.01 0.66 0.01 0.82 -1.64 0.00 0.00 178.16 178.03 1ok4 h ILE 46 N 1.20 1.26 -0.52 1.81 1.08 -1.11 -0.88 117.51 120.36 1ok4 h ILE 46 Ca 0.40 -1.00 0.03 0.00 -0.39 0.00 0.00 64.86 63.90 1ok4 h ILE 46 Cb 0.04 1.09 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 1ok4 h ILE 46 CO -0.14 0.34 0.30 -0.07 -0.69 0.00 0.00 178.15 177.89 1ok4 h LEU 47 N 0.56 0.46 -0.42 1.44 3.38 -1.10 -1.80 115.31 117.84 1ok4 h LEU 47 Ca 0.12 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1ok4 h LEU 47 Cb 0.47 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1ok4 h LEU 47 CO 0.02 0.32 0.24 0.03 0.09 0.00 0.00 178.44 179.14 1ok4 h ARG 48 N 0.58 0.47 -0.59 1.13 3.08 -0.71 -1.48 114.38 116.87 1ok4 h ARG 48 Ca 0.22 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1ok4 h ARG 48 Cb 0.07 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 1ok4 h ARG 48 CO -0.12 0.31 0.29 1.25 -1.07 0.00 0.00 179.97 180.63 1ok4 h LEU 49 N 0.48 0.76 -0.59 3.04 5.85 -1.06 -0.19 115.31 123.60 1ok4 h LEU 49 Ca 0.17 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1ok4 h LEU 49 Cb 0.03 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1ok4 h LEU 49 CO -0.09 0.67 0.17 0.00 -0.34 0.00 0.00 178.44 178.84 1ok4 h ALA 50 N 1.12 0.78 0.38 1.25 0.00 -0.98 -2.02 119.26 119.80 1ok4 h ALA 50 Ca 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ok4 h ALA 50 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ok4 h ALA 50 CO -0.03 0.47 -0.31 -0.09 0.00 0.00 0.00 179.25 179.29 1ok4 h ARG 51 N 0.85 -0.67 0.00 0.00 2.43 -1.01 -1.13 114.38 114.85 1ok4 h ARG 51 Ca 0.19 0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 1ok4 h ARG 51 Cb 0.32 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1ok4 h ARG 51 CO -0.00 -0.45 -0.40 -0.44 -1.51 0.00 0.00 179.97 177.17 1ok4 h ASP 52 N -0.70 0.00 0.79 -3.80 3.32 -0.99 -2.54 116.42 112.50 1ok4 h ASP 52 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1ok4 h ASP 52 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1ok4 h ASP 52 CO -0.02 0.40 -0.25 0.00 -1.72 0.00 0.00 179.24 177.65 1ok4 n ALA 53 N -2.45 2.89 -2.27 3.45 0.00 -0.77 -4.94 120.51 116.43 1ok4 n ALA 53 Ca -0.02 -0.21 -0.07 0.00 0.00 0.00 0.00 53.44 53.14 1ok4 n ALA 53 Cb 0.43 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 1.48 0.14 3.78 0.00 0.00 -0.96 -4.78 105.19 104.85 1ok4 n GLY 54 Ca 0.06 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.49 2.68 -0.20 1.61 0.08 -0.44 -5.00 117.98 114.22 1ok4 s PHE 55 Ca 0.04 1.20 0.19 0.00 0.12 0.00 0.00 56.93 58.48 1ok4 s PHE 55 Cb -0.02 -3.12 -0.02 0.00 -0.57 0.00 0.00 43.02 39.29 1ok4 s PHE 55 CO 0.04 -1.94 1.04 -0.44 -0.10 0.00 0.00 175.22 173.82 1ok4 h ASP 56 N -1.21 0.00 -5.34 1.36 3.32 -1.32 -3.46 116.42 109.77 1ok4 h ASP 56 Ca -0.47 0.00 0.19 0.00 0.02 0.00 0.00 57.03 56.77 1ok4 h ASP 56 Cb 1.27 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.73 1ok4 h ASP 56 CO 0.58 0.29 0.53 -0.83 -1.72 0.00 0.00 179.24 178.09 1ok4 s GLY 57 N -4.54 -0.27 0.15 2.75 0.00 -1.21 -4.06 107.32 100.14 1ok4 s GLY 57 Ca -0.00 0.26 0.08 0.00 0.00 0.00 0.00 44.72 45.05 1ok4 s GLY 57 CO 0.79 0.04 -0.17 -1.34 0.00 0.00 0.00 173.10 172.41 1ok4 s VAL 58 N -3.15 1.67 -0.21 1.40 -7.23 -0.74 -0.69 120.40 111.45 1ok4 s VAL 58 Ca 0.12 -1.83 -0.01 0.00 -1.81 0.00 0.00 61.98 58.45 1ok4 s VAL 58 Cb -0.01 -1.73 0.01 0.00 0.56 0.00 0.00 36.38 35.22 1ok4 s VAL 58 CO 0.01 -0.32 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.66 1ok4 s VAL 59 N -2.00 2.61 0.09 1.32 1.01 -0.59 -0.92 120.40 121.93 1ok4 s VAL 59 Ca 0.13 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.36 1ok4 s VAL 59 Cb -0.06 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1ok4 s VAL 59 CO 0.05 0.44 -0.21 -0.36 0.00 0.00 0.00 175.10 175.02 1ok4 s PHE 60 N 1.35 1.83 0.85 5.22 0.08 -1.02 -1.45 117.98 124.84 1ok4 s PHE 60 Ca 0.04 -0.41 -0.12 0.00 0.12 0.00 0.00 56.93 56.57 1ok4 s PHE 60 Cb -0.14 -1.01 0.10 0.00 -0.57 0.00 0.00 43.02 41.40 1ok4 s PHE 60 CO -0.08 0.20 1.11 -0.65 -0.10 0.00 0.00 175.22 175.69 1ok4 s GLN 61 N -1.80 1.64 0.29 0.44 -1.52 -1.26 -1.14 119.66 116.31 1ok4 s GLN 61 Ca 0.07 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 0.45 0.00 -0.22 0.00 0.00 33.01 31.27 1ok4 s GLN 61 CO 0.04 -1.91 1.93 0.07 -0.25 0.00 0.00 175.29 175.17 1ok4 h ARG 62 N -1.30 1.09 -0.36 2.91 0.11 -1.94 -1.44 114.38 113.45 1ok4 h ARG 62 Ca -0.49 -0.07 -0.15 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 0.72 -0.37 0.78 0.10 0.00 0.00 179.97 181.79 1ok4 h GLY 63 N 1.13 0.94 1.08 0.08 0.00 -1.97 0.58 103.07 104.90 1ok4 h GLY 63 Ca 0.36 -0.94 -0.14 0.00 0.00 0.00 0.00 47.33 46.61 1ok4 h GLY 63 CO -0.11 0.85 -0.29 -2.22 0.00 0.00 0.00 176.54 174.77 1ok4 h ILE 64 N 0.71 1.28 -0.55 2.60 1.08 -1.86 -2.47 117.51 118.29 1ok4 h ILE 64 Ca 0.06 -1.45 -0.02 0.00 -0.39 0.00 0.00 64.86 63.06 1ok4 h ILE 64 Cb 0.94 1.32 -0.02 0.00 -3.07 0.00 0.00 36.82 35.99 1ok4 h ILE 64 CO 0.09 0.49 0.25 0.00 -0.69 0.00 0.00 178.15 178.29 1ok4 h ALA 65 N 0.80 0.71 -0.57 1.87 0.00 -1.04 -0.94 119.26 120.09 1ok4 h ALA 65 Ca 0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ok4 h ALA 65 Cb 0.87 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1ok4 h ALA 65 CO 0.08 0.28 0.23 1.49 0.00 0.00 0.00 179.25 181.34 1ok4 h GLU 66 N 0.74 0.85 0.00 0.00 4.81 -0.86 -1.46 114.58 118.66 1ok4 h GLU 66 Ca 0.19 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1ok4 h GLU 66 Cb 0.14 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ok4 h GLU 66 CO -0.02 0.73 -0.88 0.87 -0.73 0.00 0.00 179.01 178.97 1ok4 h LYS 67 N 0.78 0.00 0.00 1.92 6.56 -1.35 -3.42 116.57 121.06 1ok4 h LYS 67 Ca 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 1ok4 h LYS 67 Cb 0.19 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.85 1ok4 h LYS 67 CO -0.02 0.11 -0.42 0.66 -2.06 0.00 0.00 179.45 177.72 1ok4 n TYR 68 N -2.85 0.00 -1.93 -1.35 4.01 -0.37 -5.06 117.16 109.61 1ok4 n TYR 68 Ca -0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 1ok4 n TYR 68 Cb 0.63 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.63 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 -1.13 3.05 -0.02 -0.72 5.04 -0.55 -4.89 117.35 118.13 1ok4 s TYR 69 Ca 0.00 0.66 0.02 0.00 -2.44 0.00 0.00 57.07 55.32 1ok4 s TYR 69 Cb 0.00 -3.93 0.04 0.00 0.35 0.00 0.00 41.96 38.42 1ok4 s TYR 69 CO 0.00 -3.37 0.95 -0.40 -1.34 0.00 0.00 175.55 171.39 1ok4 n ASP 70 N 3.75 1.73 0.00 4.32 5.75 -1.26 -4.96 116.55 125.88 1ok4 n ASP 70 Ca 0.13 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.91 1ok4 n ASP 70 Cb 0.39 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 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 -0.53 0.58 0.16 6.12 0.00 -1.26 -4.91 105.19 105.34 1ok4 n GLY 71 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.72 1.61 4.64 -1.98 -3.44 113.55 110.66 1ok4 h SER 72 Ca 0.00 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.11 1ok4 h SER 72 Cb 0.08 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 61.90 1ok4 h SER 72 CO 0.00 0.01 -0.52 -0.69 -0.87 0.00 0.00 176.83 174.76 1ok4 s VAL 73 N -3.24 -0.01 0.27 0.95 1.01 -1.26 -4.93 120.40 113.19 1ok4 s VAL 73 Ca 0.05 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1ok4 s VAL 73 Cb 0.08 -0.26 -0.14 0.00 0.00 0.00 0.00 36.38 36.07 1ok4 s VAL 73 CO 0.70 0.01 1.23 -2.65 0.00 0.00 0.00 175.10 174.39 1ok4 n PRO 74 N 3.21 1.74 -4.49 2.72 -0.02 -1.26 -4.75 135.00 132.16 1ok4 n PRO 74 Ca -0.15 0.62 -0.34 0.00 -2.02 0.00 0.00 63.50 61.61 1ok4 n PRO 74 Cb 0.58 -2.15 -0.12 0.00 -0.02 0.00 0.00 33.50 31.79 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 -0.03 3.18 -0.31 2.45 2.96 -1.26 -1.79 118.68 123.87 1ok4 s LEU 75 Ca 0.63 -0.13 -0.10 0.00 -0.22 0.00 0.00 54.13 54.30 1ok4 s LEU 75 Cb -0.67 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.26 1ok4 s LEU 75 CO 0.56 0.20 0.17 -0.63 -1.32 0.00 0.00 176.35 175.34 1ok4 s ILE 76 N 0.15 4.76 -0.43 6.68 1.01 -0.09 -0.67 121.20 132.61 1ok4 s ILE 76 Ca -0.02 -0.35 -0.23 0.00 0.00 0.00 0.00 60.65 60.05 1ok4 s ILE 76 Cb -0.14 -3.42 0.02 0.00 0.01 0.00 0.00 42.46 38.93 1ok4 s ILE 76 CO 0.03 0.07 0.77 -0.22 0.00 0.00 0.00 174.94 175.59 1ok4 s LEU 77 N 1.64 4.24 -0.35 2.97 1.98 -0.44 -2.44 118.68 126.28 1ok4 s LEU 77 Ca 0.05 -0.02 -0.29 0.00 -2.89 0.00 0.00 54.13 50.99 1ok4 s LEU 77 Cb -0.17 -2.95 0.01 0.00 0.66 0.00 0.00 46.19 43.73 1ok4 s LEU 77 CO 0.07 -0.86 1.31 -0.75 -1.89 0.00 0.00 176.35 174.24 1ok4 s LYS 78 N 3.20 3.79 0.06 1.98 2.47 -0.29 -0.94 119.74 130.02 1ok4 s LYS 78 Ca 0.29 1.08 0.03 0.00 -1.56 0.00 0.00 55.97 55.81 1ok4 s LYS 78 Cb -0.13 -3.92 -0.25 0.00 -1.46 0.00 0.00 37.83 32.08 1ok4 s LYS 78 CO 0.21 -1.28 1.05 -0.07 0.16 0.00 0.00 175.35 175.43 1ok4 h LEU 79 N 11.30 0.19 -9.50 5.43 3.38 -1.31 -3.39 115.31 121.42 1ok4 h LEU 79 Ca -0.26 -0.24 -0.57 0.00 0.09 0.00 0.00 57.88 56.90 1ok4 h LEU 79 Cb 1.09 -0.06 -0.10 0.00 0.09 0.00 0.00 40.66 41.68 1ok4 h LEU 79 CO 1.06 1.20 -0.66 0.54 0.09 0.00 0.00 178.44 180.66 1ok4 s ASN 80 N -6.79 4.39 -0.14 -0.43 4.22 -1.26 -0.40 114.94 114.54 1ok4 s ASN 80 Ca -0.03 -0.70 -0.29 0.00 -2.14 0.00 0.00 52.86 49.69 1ok4 s ASN 80 Cb 0.08 -0.76 0.09 0.00 1.28 0.00 0.00 41.25 41.94 1ok4 s ASN 80 CO 0.84 0.01 0.79 -0.83 -2.04 0.00 0.00 177.10 175.87 1ok4 s GLY 81 N -3.64 -0.47 0.25 0.45 0.00 -1.16 -4.84 107.32 97.92 1ok4 s GLY 81 Ca 0.31 1.73 0.01 0.00 0.00 0.00 0.00 44.72 46.77 1ok4 s GLY 81 CO 0.19 1.20 0.10 -1.59 0.00 0.00 0.00 173.10 173.00 1ok4 s LYS 82 N -0.76 1.39 0.30 2.90 -2.85 -1.26 -4.20 119.74 115.26 1ok4 s LYS 82 Ca -0.06 -1.75 0.08 0.00 -1.00 0.00 0.00 55.97 53.24 1ok4 s LYS 82 Cb -0.01 -0.18 -0.04 0.00 -2.06 0.00 0.00 37.83 35.54 1ok4 s LYS 82 CO 0.05 -0.32 0.19 0.95 0.10 0.00 0.00 175.35 176.32 1ok4 s THR 83 N -3.80 3.68 -0.88 3.79 -4.23 -1.26 -3.37 115.64 109.57 1ok4 s THR 83 Ca 0.38 -1.53 0.27 0.00 -1.18 0.00 0.00 61.69 59.63 1ok4 s THR 83 Cb 0.08 -3.15 0.26 0.00 1.34 0.00 0.00 72.50 71.02 1ok4 s THR 83 CO 0.14 -0.26 1.85 0.35 -0.54 0.00 0.00 174.62 176.16 1ok4 n THR 84 N -1.20 0.28 0.25 3.99 -2.24 -1.10 -3.17 114.28 111.09 1ok4 n THR 84 Ca -0.05 -0.10 0.11 0.00 -2.27 0.00 0.00 64.05 61.75 1ok4 n THR 84 Cb 0.59 -0.56 0.64 0.00 -2.10 0.00 0.00 70.33 68.90 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 -9.72 3.22 3.38 -1.94 -3.44 115.31 106.82 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 0.58 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.36 1ok4 h LEU 85 CO 0.00 0.16 0.56 -0.47 0.09 0.00 0.00 178.44 178.79 1ok4 s TYR 86 N -4.06 3.39 -0.34 1.13 5.04 -1.19 -4.97 117.35 116.34 1ok4 s TYR 86 Ca -0.02 1.45 0.04 0.00 -2.44 0.00 0.00 57.07 56.10 1ok4 s TYR 86 Cb 0.13 -3.45 -0.01 0.00 0.35 0.00 0.00 41.96 38.97 1ok4 s TYR 86 CO 0.61 -1.24 0.37 -1.71 -1.34 0.00 0.00 175.55 172.23 1ok4 n ASN 87 N 2.10 0.69 -2.47 4.32 2.85 -1.26 -5.02 115.26 116.47 1ok4 n ASN 87 Ca 0.03 -0.84 0.00 0.00 -0.11 0.00 0.00 54.58 53.66 1ok4 n ASN 87 Cb 0.44 0.58 0.00 0.00 1.24 0.00 0.00 39.78 42.04 1ok4 n ASN 87 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ok4 n GLY 88 N 0.74 -2.23 3.75 8.20 0.00 -1.26 -4.97 105.19 109.42 1ok4 n GLY 88 Ca 0.02 -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 -2.88 4.23 0.06 1.61 0.41 -1.26 -4.85 118.70 116.04 1ok4 s GLU 89 Ca 0.00 2.37 -0.34 0.00 -0.41 0.00 0.00 54.97 56.59 1ok4 s GLU 89 Cb 0.00 -3.07 -0.13 0.00 -1.78 0.00 0.00 34.13 29.14 1ok4 s GLU 89 CO 0.00 -0.44 1.66 -2.30 -0.49 0.00 0.00 175.26 173.69 1ok4 n PRO 90 N 1.89 2.04 -3.71 0.39 -0.02 -1.26 -4.79 135.00 129.53 1ok4 n PRO 90 Ca 0.05 0.74 -0.14 0.00 -2.02 0.00 0.00 63.50 62.14 1ok4 n PRO 90 Cb 0.40 -2.52 -0.09 0.00 -0.02 0.00 0.00 33.50 31.26 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 1.94 0.01 -0.13 -1.45 0.11 -1.26 -4.47 120.40 115.15 1ok4 s VAL 91 Ca 0.84 -0.06 -0.04 0.00 -2.93 0.00 0.00 61.98 59.80 1ok4 s VAL 91 Cb -0.72 -0.65 0.06 0.00 -1.53 0.00 0.00 36.38 33.54 1ok4 s VAL 91 CO 0.44 -0.03 0.16 -0.55 -3.33 0.00 0.00 175.10 171.79 1ok4 s SER 92 N -0.03 1.17 0.19 3.54 0.15 -1.26 -4.73 113.70 112.73 1ok4 s SER 92 Ca -0.02 0.04 0.05 0.00 0.70 0.00 0.00 55.95 56.71 1ok4 s SER 92 Cb -0.03 0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.45 1ok4 s SER 92 CO 0.02 -0.28 0.19 0.68 1.20 0.00 0.00 173.24 175.04 1ok4 s VAL 93 N 2.28 4.66 0.18 4.45 -7.23 -1.26 -4.73 120.40 118.75 1ok4 s VAL 93 Ca 0.04 -1.09 -0.31 0.00 -1.81 0.00 0.00 61.98 58.81 1ok4 s VAL 93 Cb -0.14 -3.43 -0.10 0.00 0.56 0.00 0.00 36.38 33.28 1ok4 s VAL 93 CO -0.08 -0.18 1.51 0.00 -0.31 0.00 0.00 175.10 176.04 1ok4 s ALA 94 N -1.86 3.71 -1.39 1.32 0.00 -1.26 -3.00 121.76 119.28 1ok4 s ALA 94 Ca 0.32 1.32 0.14 0.00 0.00 0.00 0.00 51.96 53.74 1ok4 s ALA 94 Cb -0.10 -3.59 0.30 0.00 0.00 0.00 0.00 23.12 19.73 1ok4 s ALA 94 CO 0.25 -0.74 1.20 0.27 0.00 0.00 0.00 175.76 176.74 1ok4 n ASN 95 N 3.55 2.86 -3.67 0.00 0.23 0.47 -4.93 115.26 113.76 1ok4 n ASN 95 Ca 0.12 -1.86 -0.15 0.00 -0.53 0.00 0.00 54.58 52.16 1ok4 n ASN 95 Cb 0.40 -0.20 -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 -0.60 5.92 0.21 0.00 1.04 -1.26 -4.87 113.70 114.14 1ok4 s SER 97 Ca -0.07 0.30 -0.09 0.00 0.48 0.00 0.00 55.95 56.57 1ok4 s SER 97 Cb -0.03 -1.61 0.15 0.00 0.10 0.00 0.00 66.02 64.63 1ok4 s SER 97 CO 0.04 -0.62 1.79 0.58 0.98 0.00 0.00 173.24 176.01 1ok4 h VAL 98 N 0.48 1.25 -0.77 5.02 2.07 -1.95 -1.61 116.25 120.74 1ok4 h VAL 98 Ca -0.47 -0.74 0.06 0.00 0.82 0.00 0.00 66.70 66.37 1ok4 h VAL 98 Cb 1.25 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 1ok4 h VAL 98 CO 0.58 0.31 0.47 -0.08 0.02 0.00 0.00 177.57 178.86 1ok4 h GLU 99 N 1.10 0.83 -0.23 1.57 4.81 -1.95 -0.72 114.58 119.99 1ok4 h GLU 99 Ca 0.26 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.31 1ok4 h GLU 99 Cb 0.16 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1ok4 h GLU 99 CO -0.03 0.55 -0.41 0.93 -0.73 0.00 0.00 179.01 179.33 1ok4 h GLU 100 N 0.86 0.53 -0.53 1.92 5.08 -1.92 -2.62 114.58 117.91 1ok4 h GLU 100 Ca 0.34 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1ok4 h GLU 100 Cb 0.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1ok4 h GLU 100 CO -0.17 0.85 0.31 0.00 -1.00 0.00 0.00 179.01 179.00 1ok4 h ALA 101 N 1.12 0.68 -0.47 3.43 0.00 -0.54 -1.29 119.26 122.19 1ok4 h ALA 101 Ca 0.04 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1ok4 h ALA 101 Cb 0.90 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1ok4 h ALA 101 CO 0.08 0.02 0.15 0.28 0.00 0.00 0.00 179.25 179.77 1ok4 h VAL 102 N 0.62 0.82 0.00 0.00 2.07 -0.99 -1.82 116.25 116.95 1ok4 h VAL 102 Ca 0.21 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 1ok4 h VAL 102 Cb 0.03 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1ok4 h VAL 102 CO -0.10 0.06 -0.13 0.77 0.02 0.00 0.00 177.57 178.19 1ok4 h SER 103 N 0.31 0.00 -0.01 0.57 4.64 -1.07 -2.27 113.55 115.73 1ok4 h SER 103 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1ok4 h SER 103 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1ok4 h SER 103 CO -0.25 0.13 -0.00 0.18 -0.87 0.00 0.00 176.83 176.02 1ok4 n LEU 104 N -3.31 0.81 0.00 5.97 4.77 -0.53 -4.92 117.00 119.79 1ok4 n LEU 104 Ca 0.00 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1ok4 n LEU 104 Cb 0.36 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1ok4 n LEU 104 CO 0.31 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1ok4 n GLY 105 N 1.10 0.85 3.77 -0.72 0.00 -0.85 -4.90 105.19 104.44 1ok4 n GLY 105 Ca 0.21 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 3.40 -1.53 4.61 0.00 -0.82 -4.58 121.76 120.83 1ok4 s ALA 106 Ca 0.00 1.16 0.22 0.00 0.00 0.00 0.00 51.96 53.34 1ok4 s ALA 106 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1ok4 s ALA 106 CO 0.00 -0.58 1.05 0.43 0.00 0.00 0.00 175.76 176.66 1ok4 n SER 107 N 0.65 1.47 -3.54 0.00 7.64 0.15 -4.74 113.62 115.25 1ok4 n SER 107 Ca 0.01 -1.20 -0.10 0.00 1.01 0.00 0.00 58.87 58.59 1ok4 n SER 107 Cb 0.43 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 -2.73 -1.56 0.14 -0.43 0.00 -1.06 -4.16 121.76 111.97 1ok4 s ALA 108 Ca 0.14 0.38 0.10 0.00 0.00 0.00 0.00 51.96 52.58 1ok4 s ALA 108 Cb 0.17 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1ok4 s ALA 108 CO 0.70 -0.83 -0.23 0.14 0.00 0.00 0.00 175.76 175.55 1ok4 s VAL 109 N -3.67 2.51 0.09 0.00 -7.23 -0.37 -1.33 120.40 110.40 1ok4 s VAL 109 Ca 0.04 -1.73 0.10 0.00 -1.81 0.00 0.00 61.98 58.58 1ok4 s VAL 109 Cb -0.02 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 1ok4 s VAL 109 CO -0.07 0.04 -0.26 -0.83 -0.31 0.00 0.00 175.10 173.67 1ok4 s GLY 110 N -2.24 1.51 -0.18 2.32 0.00 -0.11 -0.13 107.32 108.48 1ok4 s GLY 110 Ca 0.17 -1.37 -0.11 0.00 0.00 0.00 0.00 44.72 43.42 1ok4 s GLY 110 CO 0.08 -1.30 0.44 -0.47 0.00 0.00 0.00 173.10 171.85 1ok4 s TYR 111 N -0.95 -0.63 -0.07 1.90 5.04 -0.60 -0.84 117.35 121.21 1ok4 s TYR 111 Ca 0.13 1.35 -0.19 0.00 -2.44 0.00 0.00 57.07 55.92 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 0.04 -0.35 0.51 0.99 -1.34 0.00 0.00 175.55 175.41 1ok4 s THR 112 N 1.28 5.08 0.09 4.34 2.01 -1.26 -1.10 115.64 126.08 1ok4 s THR 112 Ca -0.08 1.05 0.08 0.00 0.31 0.00 0.00 61.69 63.04 1ok4 s THR 112 Cb -0.07 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 1ok4 s THR 112 CO -0.12 0.38 -0.19 0.27 -0.69 0.00 0.00 174.62 174.28 1ok4 s ILE 113 N 0.18 2.77 -0.72 1.82 -4.36 -0.53 -4.84 121.20 115.51 1ok4 s ILE 113 Ca 0.28 -1.40 0.05 0.00 -0.26 0.00 0.00 60.65 59.31 1ok4 s ILE 113 Cb -0.16 -2.23 0.17 0.00 1.25 0.00 0.00 42.46 41.49 1ok4 s ILE 113 CO 0.13 0.19 0.52 -1.22 0.24 0.00 0.00 174.94 174.80 1ok4 n TYR 114 N 1.10 3.34 -1.67 1.37 4.01 -1.26 -1.72 117.16 122.34 1ok4 n TYR 114 Ca -0.16 -4.31 -0.44 0.00 -0.16 0.00 0.00 57.90 52.83 1ok4 n TYR 114 Cb 0.52 -0.66 -0.02 0.00 -0.31 0.00 0.00 39.34 38.87 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 1.94 2.00 0.00 -0.72 -0.02 -1.26 -2.00 135.00 134.95 1ok4 n PRO 115 Ca 0.20 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1ok4 n PRO 115 Cb 0.35 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 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 1.90 3.11 3.65 -1.23 0.00 -1.26 -1.80 105.19 109.57 1ok4 n GLY 116 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 0.03 1.46 0.26 1.61 2.88 -0.67 -2.31 113.62 116.88 1ok4 n SER 117 Ca 0.00 0.93 0.18 0.00 -1.33 0.00 0.00 58.87 58.64 1ok4 n SER 117 Cb 0.00 -1.43 0.88 0.00 -0.75 0.00 0.00 64.21 62.91 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 1.10 0.00 -2.65 0.46 0.00 -1.87 -0.54 103.07 99.57 1ok4 h GLY 118 Ca -0.48 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 1ok4 h GLY 118 CO 0.54 0.00 0.05 0.69 0.00 0.00 0.00 176.54 177.83 1ok4 n PHE 119 N -3.28 1.62 -0.36 5.60 0.99 -1.26 -4.70 117.46 116.07 1ok4 n PHE 119 Ca 0.00 -0.96 0.06 0.00 -0.00 0.00 0.00 57.45 56.55 1ok4 n PHE 119 Cb 0.35 -0.47 0.22 0.00 -1.00 0.00 0.00 39.48 38.59 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 2.56 1.02 -0.33 -1.08 4.11 -1.33 -1.07 114.58 118.46 1ok4 h GLU 120 Ca 0.08 -0.06 0.03 0.00 0.07 0.00 0.00 59.36 59.48 1ok4 h GLU 120 Cb 1.82 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.82 1ok4 h GLU 120 CO 0.43 0.68 0.22 0.11 0.07 0.00 0.00 179.01 180.52 1ok4 h TRP 121 N 1.05 0.31 -0.32 2.06 5.08 -1.84 -1.57 115.95 120.72 1ok4 h TRP 121 Ca 0.47 0.01 -0.16 0.00 1.08 0.00 0.00 58.89 60.30 1ok4 h TRP 121 Cb 0.38 -0.10 -0.01 0.00 -3.00 0.00 0.00 29.16 26.44 1ok4 h TRP 121 CO -0.00 0.18 -0.42 -0.22 -1.28 0.00 0.00 178.44 176.69 1ok4 h LYS 122 N 0.32 0.80 -0.03 0.12 3.64 -1.55 -1.11 116.57 118.76 1ok4 h LYS 122 Ca 0.14 -0.44 -0.19 0.00 -1.27 0.00 0.00 60.65 58.89 1ok4 h LYS 122 Cb 0.15 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1ok4 h LYS 122 CO -0.03 1.07 -0.82 0.52 -2.27 0.00 0.00 179.45 177.92 1ok4 h MET 123 N 0.65 0.30 -0.53 1.90 2.86 -1.42 -2.52 114.93 116.17 1ok4 h MET 123 Ca 0.05 -0.28 -0.10 0.00 -2.06 0.00 0.00 59.70 57.30 1ok4 h MET 123 Cb 0.99 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 1ok4 h MET 123 CO 0.10 0.96 -0.07 0.74 1.06 0.00 0.00 176.91 179.70 1ok4 h PHE 124 N 0.18 1.09 -0.16 -0.22 0.04 -1.21 0.12 116.94 116.78 1ok4 h PHE 124 Ca -0.04 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.52 1ok4 h PHE 124 Cb 1.42 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.29 1ok4 h PHE 124 CO 0.04 1.01 0.10 1.49 -0.60 0.00 0.00 178.31 180.35 1ok4 h GLU 125 N 0.85 0.21 -0.45 1.51 4.81 -1.24 -1.55 114.58 118.71 1ok4 h GLU 125 Ca 0.14 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.22 1ok4 h GLU 125 Cb 0.62 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1ok4 h GLU 125 CO 0.04 0.14 -0.25 1.49 -0.73 0.00 0.00 179.01 179.70 1ok4 h GLU 126 N 0.21 0.97 -0.94 1.92 4.81 -1.38 -2.99 114.58 117.18 1ok4 h GLU 126 Ca 0.06 -0.44 0.07 0.00 -0.13 0.00 0.00 59.36 58.93 1ok4 h GLU 126 Cb -0.02 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 1ok4 h GLU 126 CO -0.01 1.11 0.61 1.25 -0.73 0.00 0.00 179.01 181.23 1ok4 h LEU 127 N 0.82 0.93 -0.78 1.64 5.85 -0.58 -1.06 115.31 122.13 1ok4 h LEU 127 Ca 0.10 0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.94 1ok4 h LEU 127 Cb 0.83 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.60 1ok4 h LEU 127 CO 0.07 0.58 0.39 0.00 -0.34 0.00 0.00 178.44 179.15 1ok4 h ALA 128 N 1.50 1.11 -0.26 1.25 0.00 -1.13 0.35 119.26 122.08 1ok4 h ALA 128 Ca 0.41 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.26 1ok4 h ALA 128 Cb 0.25 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ok4 h ALA 128 CO -0.17 -0.05 -0.36 0.00 0.00 0.00 0.00 179.25 178.67 1ok4 h ARG 129 N 0.63 0.70 -0.47 0.00 3.08 -1.22 -2.39 114.38 114.71 1ok4 h ARG 129 Ca 0.40 -0.41 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1ok4 h ARG 129 Cb 0.47 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1ok4 h ARG 129 CO -0.31 1.03 0.19 0.82 -1.07 0.00 0.00 179.97 180.64 1ok4 h ILE 130 N 0.43 1.21 -0.63 2.04 2.04 -0.94 -1.62 117.51 120.04 1ok4 h ILE 130 Ca 0.03 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.29 1ok4 h ILE 130 Cb 0.95 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 1ok4 h ILE 130 CO 0.08 0.24 0.38 0.50 0.00 0.00 0.00 178.15 179.35 1ok4 h LYS 131 N 0.62 0.71 -0.57 2.37 1.63 -0.35 0.13 116.57 121.11 1ok4 h LYS 131 Ca 0.16 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.89 1ok4 h LYS 131 Cb 0.19 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1ok4 h LYS 131 CO -0.01 0.47 0.27 -0.09 -3.45 0.00 0.00 179.45 176.63 1ok4 h ARG 132 N 0.73 0.82 -0.33 1.90 2.43 -1.09 -1.86 114.38 116.97 1ok4 h ARG 132 Ca 0.26 -0.12 -0.13 0.00 -0.81 0.00 0.00 59.98 59.18 1ok4 h ARG 132 Cb 0.06 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1ok4 h ARG 132 CO -0.12 0.67 -0.31 -0.44 -1.51 0.00 0.00 179.97 178.26 1ok4 h ASP 133 N 0.77 0.75 -0.65 -3.80 3.32 -0.91 -2.34 116.42 113.55 1ok4 h ASP 133 Ca 0.19 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 56.96 1ok4 h ASP 133 Cb 0.13 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.43 1ok4 h ASP 133 CO -0.02 1.00 0.42 0.00 -1.72 0.00 0.00 179.24 178.92 1ok4 h ALA 134 N 1.04 0.84 -0.41 3.45 0.00 -0.35 -0.24 119.26 123.59 1ok4 h ALA 134 Ca 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1ok4 h ALA 134 Cb 0.83 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1ok4 h ALA 134 CO 0.07 0.20 0.23 0.28 0.00 0.00 0.00 179.25 180.03 1ok4 h VAL 135 N 0.83 1.15 -0.86 0.00 2.07 -1.26 0.37 116.25 118.55 1ok4 h VAL 135 Ca 0.25 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1ok4 h VAL 135 Cb -0.03 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1ok4 h VAL 135 CO -0.08 0.16 0.44 0.50 0.02 0.00 0.00 177.57 178.61 1ok4 h LYS 136 N 0.53 1.22 -0.09 1.57 3.64 -0.98 -2.42 116.57 120.05 1ok4 h LYS 136 Ca 0.14 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1ok4 h LYS 136 Cb 0.05 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1ok4 h LYS 136 CO -0.02 0.92 0.00 1.19 -2.27 0.00 0.00 179.45 179.27 1ok4 n PHE 137 N -4.33 0.09 -3.67 1.91 3.72 -0.14 -4.96 117.46 110.08 1ok4 n PHE 137 Ca 0.09 -0.04 -0.24 0.00 -0.05 0.00 0.00 57.45 57.20 1ok4 n PHE 137 Cb 0.12 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.72 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 0.67 -4.74 -4.35 4.37 2.03 -0.02 -5.00 116.55 109.50 1ok4 n ASP 138 Ca 0.17 -0.65 -0.35 0.00 0.52 0.00 0.00 54.79 54.49 1ok4 n ASP 138 Cb 0.45 -4.64 -0.14 0.00 -0.72 0.00 0.00 41.12 36.07 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 -7.09 2.94 0.41 -2.67 1.02 -0.36 -5.03 118.68 107.88 1ok4 s LEU 139 Ca 0.46 -0.34 -0.26 0.00 0.02 0.00 0.00 54.13 54.01 1ok4 s LEU 139 Cb -0.21 -1.73 -0.10 0.00 0.02 0.00 0.00 46.19 44.17 1ok4 s LEU 139 CO 0.77 0.04 1.26 -2.65 0.02 0.00 0.00 176.35 175.78 1ok4 n PRO 140 N 4.40 1.93 -3.71 1.29 -0.02 -1.26 -4.50 135.00 133.14 1ok4 n PRO 140 Ca -0.18 0.69 -0.37 0.00 -2.02 0.00 0.00 63.50 61.62 1ok4 n PRO 140 Cb 0.51 -2.35 -0.11 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.50 3.91 -0.24 2.45 2.96 -1.26 -1.24 118.68 123.76 1ok4 s LEU 141 Ca 0.60 0.01 -0.06 0.00 -0.22 0.00 0.00 54.13 54.46 1ok4 s LEU 141 Cb -0.52 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.09 1ok4 s LEU 141 CO 0.59 0.03 0.02 -0.69 -1.32 0.00 0.00 176.35 174.97 1ok4 s VAL 142 N 1.29 3.91 -0.23 1.68 1.01 0.81 -0.70 120.40 128.16 1ok4 s VAL 142 Ca 0.06 -0.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.65 1ok4 s VAL 142 Cb -0.14 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1ok4 s VAL 142 CO 0.06 0.37 0.12 -0.69 0.00 0.00 0.00 175.10 174.96 1ok4 s VAL 143 N 1.56 4.97 -0.49 2.92 1.01 -0.46 -1.55 120.40 128.36 1ok4 s VAL 143 Ca 0.06 0.05 -0.28 0.00 0.00 0.00 0.00 61.98 61.81 1ok4 s VAL 143 Cb -0.15 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.95 1ok4 s VAL 143 CO 0.01 0.36 1.09 0.26 0.00 0.00 0.00 175.10 176.81 1ok4 s TRP 144 N 1.13 2.81 -0.45 5.22 0.23 -0.26 -0.78 118.94 126.84 1ok4 s TRP 144 Ca 0.06 0.57 -0.10 0.00 -2.03 0.00 0.00 56.10 54.60 1ok4 s TRP 144 Cb -0.14 -4.33 0.10 0.00 0.03 0.00 0.00 33.47 29.13 1ok4 s TRP 144 CO 0.04 -1.28 0.32 0.45 0.96 0.00 0.00 176.95 177.44 1ok4 s SER 145 N 2.50 5.71 -0.55 2.95 0.15 -0.43 -1.46 113.70 122.57 1ok4 s SER 145 Ca 0.44 -1.73 0.04 0.00 0.70 0.00 0.00 55.95 55.40 1ok4 s SER 145 Cb -0.08 -2.02 0.16 0.00 -1.71 0.00 0.00 66.02 62.37 1ok4 s SER 145 CO 0.29 -0.64 0.37 -0.31 1.20 0.00 0.00 173.24 174.16 1ok4 s TYR 146 N 1.41 2.54 0.14 3.44 2.02 -0.70 -4.60 117.35 121.59 1ok4 s TYR 146 Ca 0.04 -2.85 -0.35 0.00 -0.37 0.00 0.00 57.07 53.55 1ok4 s TYR 146 Cb -0.25 -2.08 -0.15 0.00 -0.40 0.00 0.00 41.96 39.08 1ok4 s TYR 146 CO 0.01 -0.69 1.37 -2.30 -1.57 0.00 0.00 175.55 172.37 1ok4 n PRO 147 N 2.68 1.49 -3.64 -1.71 -0.02 -1.26 -4.13 135.00 128.41 1ok4 n PRO 147 Ca 0.18 0.54 -0.09 0.00 -2.02 0.00 0.00 63.50 62.10 1ok4 n PRO 147 Cb 0.38 -2.18 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 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 0.31 0.51 0.42 -0.52 3.52 -0.74 -4.84 118.95 117.61 1ok4 s ARG 148 Ca 0.79 0.61 0.00 0.00 -0.13 0.00 0.00 55.73 56.99 1ok4 s ARG 148 Cb -0.83 0.25 0.00 0.00 -1.56 0.00 0.00 34.95 32.81 1ok4 s ARG 148 CO 0.46 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 175.30 1ok4 n GLY 149 N 2.22 -2.28 7.00 8.12 0.00 -1.26 -1.68 105.19 117.31 1ok4 n GLY 149 Ca -0.12 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.50 3.34 0.12 -0.02 0.00 -0.98 -1.77 105.19 105.39 1ok4 n GLY 150 Ca 0.00 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 0.74 -2.33 1.61 5.02 -1.26 -4.88 118.16 131.06 1ok4 n LYS 151 Ca 0.00 -0.23 -0.42 0.00 -2.02 0.00 0.00 58.31 55.64 1ok4 n LYS 151 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 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 -2.42 3.71 0.00 -0.18 1.01 -0.73 -4.94 120.40 116.85 1ok4 s VAL 152 Ca 0.31 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1ok4 s VAL 152 Cb 0.20 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1ok4 s VAL 152 CO 0.46 0.11 0.00 1.33 0.00 0.00 0.00 175.10 177.00 1ok4 n VAL 153 N 3.71 0.00 -3.08 2.92 0.24 -1.26 -4.45 118.33 116.42 1ok4 n VAL 153 Ca 0.09 0.04 -0.42 0.00 -2.04 0.00 0.00 64.34 62.02 1ok4 n VAL 153 Cb 0.45 -0.87 -0.06 0.00 -1.47 0.00 0.00 33.84 31.88 1ok4 n VAL 153 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1ok4 s ASN 154 N -2.58 6.46 0.20 -1.34 0.01 -1.26 -4.92 114.94 111.51 1ok4 s ASN 154 Ca 0.00 0.23 0.21 0.00 -0.71 0.00 0.00 52.86 52.59 1ok4 s ASN 154 Cb 0.00 -2.34 0.90 0.00 0.41 0.00 0.00 41.25 40.21 1ok4 s ASN 154 CO 0.00 -0.61 1.65 -0.62 -1.51 0.00 0.00 177.10 176.00 1ok4 n GLU 155 N 6.11 0.15 -0.13 -0.60 1.02 -1.26 -2.50 120.64 123.43 1ok4 n GLU 155 Ca -0.00 0.40 0.11 0.00 -0.02 0.00 0.00 57.16 57.64 1ok4 n GLU 155 Cb 0.48 -1.79 0.17 0.00 -0.02 0.00 0.00 31.44 30.28 1ok4 n GLU 155 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ok4 n THR 156 N -2.07 0.40 -1.76 2.62 -2.24 -1.26 -4.40 114.28 105.56 1ok4 n THR 156 Ca 0.02 -0.70 -0.41 0.00 -2.27 0.00 0.00 64.05 60.69 1ok4 n THR 156 Cb 0.21 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 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 2.21 -0.25 6.98 0.00 -1.04 -4.39 120.51 125.30 1ok4 n ALA 157 Ca 0.16 0.33 0.06 0.00 0.00 0.00 0.00 53.44 53.99 1ok4 n ALA 157 Cb 0.55 -2.40 0.18 0.00 0.00 0.00 0.00 19.45 17.78 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 2.82 0.21 0.00 0.00 0.11 -1.92 -1.63 132.00 131.58 1ok4 h PRO 158 Ca -0.50 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 1ok4 h PRO 158 Cb 1.25 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1ok4 h PRO 158 CO 0.63 0.14 -0.42 1.05 -0.21 0.00 0.00 178.00 179.19 1ok4 h GLU 159 N 0.22 0.00 0.04 1.05 9.09 -1.96 -1.77 114.58 121.25 1ok4 h GLU 159 Ca 0.42 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.56 1ok4 h GLU 159 Cb 0.73 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.86 1ok4 h GLU 159 CO -0.55 0.42 -1.07 0.82 0.05 0.00 0.00 179.01 178.67 1ok4 h ILE 160 N 0.00 1.29 -0.39 -1.06 1.08 -1.66 -2.04 117.51 114.73 1ok4 h ILE 160 Ca -0.00 -2.30 -0.14 0.00 -0.39 0.00 0.00 64.86 62.03 1ok4 h ILE 160 Cb 0.86 2.50 -0.01 0.00 -3.07 0.00 0.00 36.82 37.10 1ok4 h ILE 160 CO 0.05 0.71 -0.31 0.58 -0.69 0.00 0.00 178.15 178.49 1ok4 h VAL 161 N 0.32 1.28 -0.55 1.67 2.07 -1.33 0.08 116.25 119.78 1ok4 h VAL 161 Ca -0.15 -1.47 -0.07 0.00 0.82 0.00 0.00 66.70 65.83 1ok4 h VAL 161 Cb 1.74 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1ok4 h VAL 161 CO 0.21 0.49 0.08 0.00 0.02 0.00 0.00 177.57 178.37 1ok4 h ALA 162 N 0.91 0.73 -0.75 1.67 0.00 -1.38 -1.59 119.26 118.85 1ok4 h ALA 162 Ca 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1ok4 h ALA 162 Cb 0.87 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1ok4 h ALA 162 CO 0.08 0.48 0.42 -0.92 0.00 0.00 0.00 179.25 179.31 1ok4 h TYR 163 N 0.80 1.03 -0.61 0.00 -0.00 -1.17 -1.52 116.97 115.50 1ok4 h TYR 163 Ca 0.17 -0.02 0.05 0.00 -0.00 0.00 0.00 58.73 58.93 1ok4 h TYR 163 Cb 0.42 -0.33 -0.05 0.00 -0.00 0.00 0.00 36.73 36.77 1ok4 h TYR 163 CO 0.03 0.72 0.33 0.00 -0.00 0.00 0.00 178.16 179.24 1ok4 h ALA 164 N 1.21 0.81 -0.42 1.82 0.00 -0.64 -1.47 119.26 120.57 1ok4 h ALA 164 Ca 0.27 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 1ok4 h ALA 164 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ok4 h ALA 164 CO -0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 179.25 179.17 1ok4 h ALA 165 N 1.32 0.57 -0.38 0.00 0.00 -0.85 -2.78 119.26 117.15 1ok4 h ALA 165 Ca 0.27 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1ok4 h ALA 165 Cb 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ok4 h ALA 165 CO -0.18 0.39 -0.12 -0.09 0.00 0.00 0.00 179.25 179.26 1ok4 h ARG 166 N 0.60 0.75 -0.91 0.00 9.65 -0.99 -2.63 114.38 120.85 1ok4 h ARG 166 Ca 0.11 -0.30 0.04 0.00 -1.10 0.00 0.00 59.98 58.73 1ok4 h ARG 166 Cb 0.54 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 29.03 1ok4 h ARG 166 CO 0.03 0.91 0.58 0.82 2.80 0.00 0.00 179.97 185.11 1ok4 h ILE 167 N 0.56 1.13 -0.61 1.20 2.04 -1.26 0.72 117.51 121.28 1ok4 h ILE 167 Ca 0.09 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1ok4 h ILE 167 Cb 0.65 -0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 1ok4 h ILE 167 CO 0.04 0.20 0.23 0.00 0.00 0.00 0.00 178.15 178.62 1ok4 h ALA 168 N 1.38 0.80 -0.07 1.87 0.00 -1.32 -1.19 119.26 120.73 1ok4 h ALA 168 Ca 0.37 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ok4 h ALA 168 Cb 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ok4 h ALA 168 CO -0.13 0.44 0.04 1.25 0.00 0.00 0.00 179.25 180.84 1ok4 h LEU 169 N 0.86 0.06 -1.19 0.00 5.85 -1.01 -1.13 115.31 118.75 1ok4 h LEU 169 Ca 0.20 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 1ok4 h LEU 169 Cb 0.24 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1ok4 h LEU 169 CO -0.01 0.04 0.10 -0.33 -0.34 0.00 0.00 178.44 177.90 1ok4 h GLU 170 N 0.08 0.67 -0.00 1.25 4.39 -0.51 -2.61 114.58 117.83 1ok4 h GLU 170 Ca 0.03 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1ok4 h GLU 170 Cb -0.00 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1ok4 h GLU 170 CO -0.02 0.61 -0.14 1.28 -1.16 0.00 0.00 179.01 179.58 1ok4 n LEU 171 N -4.30 0.51 0.00 1.33 4.77 -0.48 -4.92 117.00 113.91 1ok4 n LEU 171 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1ok4 n LEU 171 Cb 0.21 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1ok4 n LEU 171 CO 0.39 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1ok4 n GLY 172 N 1.31 1.27 3.65 -0.72 0.00 -0.98 -4.97 105.19 104.75 1ok4 n GLY 172 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.08 0.59 0.04 4.61 0.00 -0.45 -4.89 120.51 119.33 1ok4 n ALA 173 Ca 0.00 0.36 0.09 0.00 0.00 0.00 0.00 53.44 53.88 1ok4 n ALA 173 Cb 0.00 -2.14 -0.09 0.00 0.00 0.00 0.00 19.45 17.22 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 0.90 0.47 -3.71 0.00 8.00 0.12 -4.79 116.55 117.54 1ok4 n ASP 174 Ca 0.07 0.19 -0.10 0.00 0.71 0.00 0.00 54.79 55.66 1ok4 n ASP 174 Cb 0.35 1.05 -0.05 0.00 -0.02 0.00 0.00 41.12 42.45 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 -3.32 -0.81 0.05 2.24 0.00 -1.05 -4.35 121.76 114.51 1ok4 s ALA 175 Ca -0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 51.96 51.67 1ok4 s ALA 175 Cb 0.11 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 1ok4 s ALA 175 CO 0.84 -0.70 0.03 0.00 0.00 0.00 0.00 175.76 175.93 1ok4 s MET 176 N -3.85 0.60 -0.13 0.00 0.23 -0.74 -1.35 119.30 114.06 1ok4 s MET 176 Ca 0.07 -0.99 0.01 0.00 -1.03 0.00 0.00 55.69 53.74 1ok4 s MET 176 Cb 0.01 0.22 0.02 0.00 -1.53 0.00 0.00 34.83 33.55 1ok4 s MET 176 CO -0.07 -0.13 -0.14 0.21 -2.03 0.00 0.00 175.02 172.86 1ok4 s LYS 177 N -3.27 2.17 0.20 3.16 2.20 0.04 -0.35 119.74 123.88 1ok4 s LYS 177 Ca 0.01 -0.52 0.02 0.00 -0.36 0.00 0.00 55.97 55.11 1ok4 s LYS 177 Cb 0.03 -1.94 -0.05 0.00 -1.51 0.00 0.00 37.83 34.36 1ok4 s LYS 177 CO -0.08 -0.16 0.03 0.96 -0.36 0.00 0.00 175.35 175.75 1ok4 s ILE 178 N 1.27 0.64 0.43 5.43 -4.36 -0.77 -1.31 121.20 122.54 1ok4 s ILE 178 Ca -0.01 -1.99 -0.22 0.00 -0.26 0.00 0.00 60.65 58.18 1ok4 s ILE 178 Cb -0.14 -2.28 -0.09 0.00 1.25 0.00 0.00 42.46 41.20 1ok4 s ILE 178 CO -0.06 -0.33 1.01 -0.54 0.24 0.00 0.00 174.94 175.26 1ok4 s LYS 179 N -3.95 4.10 0.26 0.37 1.02 -1.26 -0.82 119.74 119.46 1ok4 s LYS 179 Ca 0.28 1.34 -0.30 0.00 0.02 0.00 0.00 55.97 57.31 1ok4 s LYS 179 Cb 0.07 -2.32 -0.09 0.00 -0.52 0.00 0.00 37.83 34.96 1ok4 s LYS 179 CO 0.07 -0.17 1.01 -0.47 -0.92 0.00 0.00 175.35 174.87 1ok4 s TYR 180 N -1.90 3.82 -0.63 3.18 5.04 -1.26 -4.89 117.35 120.71 1ok4 s TYR 180 Ca 0.61 1.83 0.26 0.00 -2.44 0.00 0.00 57.07 57.33 1ok4 s TYR 180 Cb -0.16 -3.11 0.75 0.00 0.35 0.00 0.00 41.96 39.79 1ok4 s TYR 180 CO 0.21 0.04 1.74 1.79 -1.34 0.00 0.00 175.55 177.99 1ok4 h THR 181 N 3.13 0.00 0.00 4.34 1.35 -1.94 -3.45 112.91 116.34 1ok4 h THR 181 Ca -0.46 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 1ok4 h THR 181 Cb 1.20 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1ok4 h THR 181 CO 0.68 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.56 1ok4 n GLY 182 N 1.13 0.16 3.29 5.82 0.00 -1.26 -4.87 105.19 109.45 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 -2.05 -0.30 0.40 1.61 -4.77 -1.26 -5.07 116.67 105.23 1ok4 s ASP 183 Ca 0.00 0.33 0.10 0.00 -3.30 0.00 0.00 52.55 49.68 1ok4 s ASP 183 Cb 0.00 0.46 0.84 0.00 -1.09 0.00 0.00 42.92 43.13 1ok4 s ASP 183 CO 0.00 -0.40 1.95 1.55 0.70 0.00 0.00 175.17 178.97 1ok4 h PRO 184 N 4.12 0.23 -0.03 2.11 0.13 -1.97 -2.36 132.00 134.24 1ok4 h PRO 184 Ca -0.29 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1ok4 h PRO 184 Cb 1.17 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1ok4 h PRO 184 CO 0.36 0.34 -0.00 -0.22 -0.23 0.00 0.00 178.00 178.25 1ok4 h LYS 185 N 0.23 0.06 -0.12 0.86 3.64 -1.97 -1.26 116.57 118.01 1ok4 h LYS 185 Ca 0.05 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.25 1ok4 h LYS 185 Cb 0.31 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1ok4 h LYS 185 CO 0.02 0.36 -0.59 1.79 -2.27 0.00 0.00 179.45 178.75 1ok4 h THR 186 N -0.24 1.36 -0.02 1.00 1.35 -1.98 -2.99 112.91 111.38 1ok4 h THR 186 Ca 0.01 -1.91 -0.08 0.00 -0.55 0.00 0.00 66.41 63.88 1ok4 h THR 186 Cb 0.33 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.65 1ok4 h THR 186 CO 0.00 0.58 -0.38 0.15 -0.25 0.00 0.00 175.52 175.62 1ok4 h PHE 187 N 0.29 0.05 0.00 4.73 3.57 -1.39 -2.60 116.94 121.59 1ok4 h PHE 187 Ca -0.00 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 1ok4 h PHE 187 Cb 1.12 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 1ok4 h PHE 187 CO 0.03 0.42 -0.31 0.66 -2.23 0.00 0.00 178.31 176.88 1ok4 h SER 188 N 0.04 0.00 -0.65 0.41 4.64 -1.07 -1.98 113.55 114.93 1ok4 h SER 188 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1ok4 h SER 188 Cb 0.69 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.75 1ok4 h SER 188 CO 0.05 0.31 0.26 -0.25 -0.87 0.00 0.00 176.83 176.33 1ok4 h TRP 189 N 0.00 0.99 -0.66 4.77 -0.00 -1.47 0.08 115.95 119.65 1ok4 h TRP 189 Ca -0.00 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.89 58.80 1ok4 h TRP 189 Cb 0.63 -0.30 -0.03 0.00 -0.00 0.00 0.00 29.16 29.46 1ok4 h TRP 189 CO 0.00 0.78 0.37 0.00 -0.00 0.00 0.00 178.44 179.58 1ok4 h ALA 190 N 1.11 0.85 -0.68 2.65 0.00 -1.42 -1.57 119.26 120.20 1ok4 h ALA 190 Ca 0.22 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1ok4 h ALA 190 Cb 0.20 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1ok4 h ALA 190 CO -0.02 0.36 0.25 0.28 0.00 0.00 0.00 179.25 180.13 1ok4 h VAL 191 N 0.91 1.25 -0.36 0.00 2.07 -1.13 -2.55 116.25 116.44 1ok4 h VAL 191 Ca 0.23 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 1ok4 h VAL 191 Cb 0.04 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1ok4 h VAL 191 CO -0.04 0.32 0.06 0.50 0.02 0.00 0.00 177.57 178.43 1ok4 h LYS 192 N 0.98 0.58 0.00 1.57 3.64 -0.66 -2.85 116.57 119.83 1ok4 h LYS 192 Ca 0.22 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1ok4 h LYS 192 Cb 0.24 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1ok4 h LYS 192 CO -0.01 0.65 0.00 -0.39 -2.27 0.00 0.00 179.45 177.43 1ok4 h VAL 193 N 0.42 0.00 0.00 2.00 -1.51 -1.20 -1.54 116.25 114.42 1ok4 h VAL 193 Ca 0.11 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1ok4 h VAL 193 Cb 0.35 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1ok4 h VAL 193 CO 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 1ok4 n ALA 194 N -1.99 1.80 -0.89 5.19 0.00 -0.97 -4.61 120.51 119.04 1ok4 n ALA 194 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1ok4 n ALA 194 Cb 0.32 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1ok4 n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ok4 n GLY 195 N 0.29 3.82 0.00 0.00 0.00 -0.58 -1.65 105.19 107.07 1ok4 n GLY 195 Ca 0.03 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.22 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 0.39 -3.15 1.61 5.02 -1.26 -4.72 118.16 130.04 1ok4 n LYS 196 Ca 0.00 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.92 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 -2.55 5.01 0.52 -0.18 1.01 -0.66 -5.05 120.40 118.51 1ok4 s VAL 197 Ca 0.25 1.06 -0.21 0.00 0.00 0.00 0.00 61.98 63.08 1ok4 s VAL 197 Cb 0.18 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.59 1ok4 s VAL 197 CO 0.39 0.05 1.18 -2.16 0.00 0.00 0.00 175.10 174.57 1ok4 s PRO 198 N 2.38 3.42 -0.15 2.72 0.04 -1.26 -4.83 135.00 137.31 1ok4 s PRO 198 Ca 0.25 1.78 -0.01 0.00 0.04 0.00 0.00 61.00 63.06 1ok4 s PRO 198 Cb -0.16 -2.18 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 1ok4 s PRO 198 CO 0.09 -0.84 -0.12 0.08 0.04 0.00 0.00 177.00 176.25 1ok4 s VAL 199 N -1.60 3.04 -0.14 -0.36 1.01 -1.26 -1.79 120.40 119.31 1ok4 s VAL 199 Ca 0.70 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.99 1ok4 s VAL 199 Cb -0.29 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 1ok4 s VAL 199 CO 0.33 0.50 0.01 -0.76 0.00 0.00 0.00 175.10 175.18 1ok4 s LEU 200 N 0.66 3.53 0.05 3.92 1.43 0.52 -0.98 118.68 127.81 1ok4 s LEU 200 Ca -0.06 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1ok4 s LEU 200 Cb -0.15 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1ok4 s LEU 200 CO 0.02 0.25 1.08 -0.32 0.23 0.00 0.00 176.35 177.61 1ok4 s MET 201 N -0.08 4.52 0.10 1.70 -2.45 -0.14 -1.84 119.30 121.11 1ok4 s MET 201 Ca 0.04 1.60 -0.31 0.00 -1.25 0.00 0.00 55.69 55.77 1ok4 s MET 201 Cb -0.13 -3.39 -0.07 0.00 1.25 0.00 0.00 34.83 32.50 1ok4 s MET 201 CO 0.02 -0.10 1.29 0.45 1.05 0.00 0.00 175.02 177.72 1ok4 s SER 202 N 0.83 6.96 0.17 1.11 0.15 0.00 -0.65 113.70 122.27 1ok4 s SER 202 Ca 0.54 2.19 -0.10 0.00 0.70 0.00 0.00 55.95 59.28 1ok4 s SER 202 Cb -0.26 -2.59 0.06 0.00 -1.71 0.00 0.00 66.02 61.53 1ok4 s SER 202 CO 0.29 -0.54 1.66 1.23 1.20 0.00 0.00 173.24 177.08 1ok4 h GLY 203 N 6.58 1.08 0.00 9.45 0.00 -1.75 -3.40 103.07 115.03 1ok4 h GLY 203 Ca -0.42 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.17 1ok4 h GLY 203 CO 0.83 0.69 0.00 0.61 0.00 0.00 0.00 176.54 178.66 1ok4 n GLY 204 N -0.51 -2.39 3.70 4.60 0.00 -1.26 -4.92 105.19 104.40 1ok4 n GLY 204 Ca 0.03 -1.61 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.45 1.32 -1.67 1.61 -0.02 -1.26 -4.38 135.00 130.15 1ok4 n PRO 205 Ca 0.00 0.50 -0.49 0.00 -2.02 0.00 0.00 63.50 61.49 1ok4 n PRO 205 Cb 0.00 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 30.98 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 -1.24 1.91 -1.57 -0.52 4.81 -1.26 -4.85 118.16 115.44 1ok4 n LYS 206 Ca 0.13 0.69 -0.30 0.00 -0.87 0.00 0.00 58.31 57.96 1ok4 n LYS 206 Cb 0.46 -2.47 0.07 0.00 0.02 0.00 0.00 35.03 33.12 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 2.37 3.45 0.17 3.15 -4.23 -1.26 -4.97 115.64 114.32 1ok4 s THR 207 Ca 0.87 0.47 -0.12 0.00 -1.18 0.00 0.00 61.69 61.73 1ok4 s THR 207 Cb -0.77 -3.22 0.07 0.00 1.34 0.00 0.00 72.50 69.92 1ok4 s THR 207 CO 0.48 -0.62 1.75 0.11 -0.54 0.00 0.00 174.62 175.80 1ok4 h LYS 208 N -0.93 0.85 -5.75 3.99 1.57 -2.00 -3.44 116.57 110.86 1ok4 h LYS 208 Ca -0.46 -0.13 -0.49 0.00 -1.87 0.00 0.00 60.65 57.70 1ok4 h LYS 208 Cb 1.25 -0.15 -0.15 0.00 0.08 0.00 0.00 32.23 33.25 1ok4 h LYS 208 CO 0.58 0.69 -0.75 0.95 -0.57 0.00 0.00 179.45 180.36 1ok4 s THR 209 N -5.69 1.88 0.23 -0.16 -4.23 -1.26 -5.05 115.64 101.37 1ok4 s THR 209 Ca -0.13 -2.19 -0.05 0.00 -1.18 0.00 0.00 61.69 58.14 1ok4 s THR 209 Cb 0.13 -2.05 0.12 0.00 1.34 0.00 0.00 72.50 72.04 1ok4 s THR 209 CO 0.78 -0.50 1.75 -0.33 -0.54 0.00 0.00 174.62 175.78 1ok4 h GLU 210 N 2.65 0.98 -0.34 3.99 5.08 -2.00 -3.04 114.58 121.90 1ok4 h GLU 210 Ca -0.39 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 57.68 1ok4 h GLU 210 Cb 1.22 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1ok4 h GLU 210 CO 0.59 0.90 -0.01 1.49 -1.00 0.00 0.00 179.01 180.98 1ok4 h GLU 211 N 0.93 0.53 -0.69 2.33 4.57 -1.98 -1.53 114.58 118.74 1ok4 h GLU 211 Ca 0.19 -0.12 0.03 0.00 -1.18 0.00 0.00 59.36 58.28 1ok4 h GLU 211 Cb 0.38 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 1ok4 h GLU 211 CO 0.01 0.57 0.43 -0.44 -1.18 0.00 0.00 179.01 178.40 1ok4 h ASP 212 N 0.51 0.71 -0.23 1.04 3.32 -1.95 -0.52 116.42 119.30 1ok4 h ASP 212 Ca 0.11 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 1ok4 h ASP 212 Cb 0.35 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 1ok4 h ASP 212 CO 0.01 0.50 -0.34 0.15 -1.72 0.00 0.00 179.24 177.84 1ok4 h PHE 213 N 0.85 0.79 -0.74 4.55 3.57 -1.44 -1.92 116.94 122.60 1ok4 h PHE 213 Ca 0.28 -0.26 0.14 0.00 3.53 0.00 0.00 57.97 61.65 1ok4 h PHE 213 Cb 0.01 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 1ok4 h PHE 213 CO -0.04 1.01 0.50 -0.07 -2.23 0.00 0.00 178.31 177.47 1ok4 h LEU 214 N 0.35 0.42 -0.17 0.59 3.38 -1.11 -1.35 115.31 117.42 1ok4 h LEU 214 Ca 0.02 0.02 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 1ok4 h LEU 214 Cb 0.92 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.62 1ok4 h LEU 214 CO 0.08 0.22 -0.81 0.11 0.09 0.00 0.00 178.44 178.13 1ok4 h LYS 215 N 0.45 0.72 -0.66 1.13 1.57 -0.78 -1.79 116.57 117.21 1ok4 h LYS 215 Ca 0.36 -0.62 0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1ok4 h LYS 215 Cb 0.78 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1ok4 h LYS 215 CO -0.12 1.22 0.43 1.96 -0.57 0.00 0.00 179.45 182.37 1ok4 h GLN 216 N 0.48 0.85 -0.55 3.15 4.20 -0.71 -2.37 115.11 120.15 1ok4 h GLN 216 Ca -0.06 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.51 1ok4 h GLN 216 Cb 1.44 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 29.01 1ok4 h GLN 216 CO 0.16 0.56 -0.01 0.28 -0.67 0.00 0.00 178.83 179.15 1ok4 h VAL 217 N 0.87 1.26 -0.72 -0.54 2.07 -1.18 -0.65 116.25 117.36 1ok4 h VAL 217 Ca 0.25 -1.11 0.01 0.00 0.82 0.00 0.00 66.70 66.67 1ok4 h VAL 217 Cb -0.08 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 1ok4 h VAL 217 CO -0.06 0.40 0.47 -0.08 0.02 0.00 0.00 177.57 178.32 1ok4 h GLU 218 N 0.88 0.92 -0.52 1.57 4.81 -1.20 -0.97 114.58 120.08 1ok4 h GLU 218 Ca 0.16 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1ok4 h GLU 218 Cb 0.53 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 1ok4 h GLU 218 CO 0.03 0.61 0.26 0.78 -0.73 0.00 0.00 179.01 179.96 1ok4 h GLY 219 N 0.95 0.79 1.00 1.92 0.00 -0.87 -0.92 103.07 105.95 1ok4 h GLY 219 Ca 0.27 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1ok4 h GLY 219 CO -0.07 0.37 0.37 -2.08 0.00 0.00 0.00 176.54 175.13 1ok4 h VAL 220 N 0.69 1.17 -0.48 4.60 2.07 -0.85 -1.33 116.25 122.12 1ok4 h VAL 220 Ca 0.18 -0.34 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 1ok4 h VAL 220 Cb 0.10 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1ok4 h VAL 220 CO -0.02 0.17 -0.02 -0.07 0.02 0.00 0.00 177.57 177.64 1ok4 h LEU 221 N 0.80 0.85 -1.67 2.57 3.38 -0.99 -2.61 115.31 117.63 1ok4 h LEU 221 Ca 0.21 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.90 1ok4 h LEU 221 Cb -0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1ok4 h LEU 221 CO -0.04 0.96 0.28 -0.33 0.09 0.00 0.00 178.44 179.40 1ok4 h GLU 222 N 0.71 0.41 0.00 1.13 5.08 -0.85 -1.66 114.58 119.40 1ok4 h GLU 222 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1ok4 h GLU 222 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1ok4 h GLU 222 CO 0.03 0.27 0.00 0.00 -1.00 0.00 0.00 179.01 178.31 1ok4 n ALA 223 N -2.50 2.04 -0.08 3.43 0.00 -0.53 -4.89 120.51 117.98 1ok4 n ALA 223 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1ok4 n ALA 223 Cb 0.17 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.25 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 0.85 0.96 3.79 0.00 0.00 -0.62 -4.44 105.19 105.72 1ok4 n GLY 224 Ca 0.05 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 2.56 0.35 4.61 0.00 -1.06 -4.92 121.76 121.31 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 -3.25 0.63 0.00 0.00 0.00 0.00 23.12 20.50 1ok4 s ALA 225 CO 0.00 -1.19 1.78 1.25 0.00 0.00 0.00 175.76 177.59 1ok4 h LEU 226 N -0.17 0.00 0.00 0.00 5.85 -1.40 -3.44 115.31 116.16 1ok4 h LEU 226 Ca -0.46 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 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 0.55 0.43 0.00 0.61 -0.34 0.00 0.00 178.44 179.69 1ok4 n GLY 227 N -0.30 -0.26 3.08 3.75 0.00 -1.21 -1.32 105.19 108.94 1ok4 n GLY 227 Ca -0.02 -0.85 -0.16 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 0.76 -0.35 -0.61 -4.36 -0.71 -0.97 121.20 110.96 1ok4 s ILE 228 Ca 0.00 -0.92 -0.00 0.00 -0.26 0.00 0.00 60.65 59.47 1ok4 s ILE 228 Cb 0.00 -0.74 0.09 0.00 1.25 0.00 0.00 42.46 43.06 1ok4 s ILE 228 CO 0.00 -0.15 0.09 0.00 0.24 0.00 0.00 174.94 175.12 1ok4 s ALA 229 N -0.96 2.96 -0.05 2.27 0.00 0.17 -1.32 121.76 124.82 1ok4 s ALA 229 Ca -0.03 -2.31 0.05 0.00 0.00 0.00 0.00 51.96 49.67 1ok4 s ALA 229 Cb -0.08 -2.11 -0.02 0.00 0.00 0.00 0.00 23.12 20.91 1ok4 s ALA 229 CO 0.01 -1.61 -0.21 0.54 0.00 0.00 0.00 175.76 174.49 1ok4 s VAL 230 N 1.09 2.48 0.00 0.00 0.11 -0.19 -1.99 120.40 121.89 1ok4 s VAL 230 Ca 0.05 -0.93 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 1ok4 s VAL 230 Cb -0.21 -1.93 0.00 0.00 -1.53 0.00 0.00 36.38 32.71 1ok4 s VAL 230 CO -0.05 0.57 0.00 0.61 -3.33 0.00 0.00 175.10 172.91 1ok4 n GLY 231 N 2.68 0.36 0.35 6.54 0.00 -1.26 -0.72 105.19 113.14 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 0.99 0.00 1.61 3.08 -1.85 -1.16 114.38 117.05 1ok4 h ARG 232 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1ok4 h ARG 232 Cb 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.84 1ok4 h ARG 232 CO 0.00 0.69 0.00 0.09 -1.07 0.00 0.00 179.97 179.68 1ok4 n ASN 233 N -4.40 0.02 -0.01 7.04 3.02 -1.26 -1.49 115.26 118.18 1ok4 n ASN 233 Ca 0.08 0.50 -0.01 0.00 -0.03 0.00 0.00 54.58 55.12 1ok4 n ASN 233 Cb 0.06 -0.51 -0.00 0.00 -0.61 0.00 0.00 39.78 38.72 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 -1.52 0.19 1.41 2.41 0.31 -0.51 -4.78 118.33 115.84 1ok4 n VAL 234 Ca 0.03 0.45 0.15 0.00 -0.01 0.00 0.00 64.34 64.96 1ok4 n VAL 234 Cb 0.17 -1.60 0.75 0.00 -0.91 0.00 0.00 33.84 32.25 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 -2.74 0.00 1.20 3.52 4.27 -0.78 -2.20 117.44 120.70 1ok4 n TRP 235 Ca -0.02 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.73 1ok4 n TRP 235 Cb 0.06 -0.29 0.61 0.00 -1.36 0.00 0.00 31.31 30.33 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 -1.29 0.25 -3.61 -2.67 6.02 -0.56 -4.65 117.38 110.86 1ok4 n GLN 236 Ca 0.14 -0.04 -0.36 0.00 -0.01 0.00 0.00 57.00 56.72 1ok4 n GLN 236 Cb 0.25 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 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 3.76 0.35 -1.09 0.52 -0.93 -4.17 118.95 114.60 1ok4 s ARG 237 Ca 0.20 0.20 0.18 0.00 -0.52 0.00 0.00 55.73 55.79 1ok4 s ARG 237 Cb 0.19 -3.13 0.54 0.00 0.52 0.00 0.00 34.95 33.07 1ok4 s ARG 237 CO 0.52 0.66 1.67 0.00 0.02 0.00 0.00 175.30 178.17 1ok4 h ARG 238 N 4.37 0.00 -1.52 3.54 3.08 -1.87 -2.53 114.38 119.45 1ok4 h ARG 238 Ca -0.51 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.00 1ok4 h ARG 238 Cb 1.21 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 31.05 1ok4 h ARG 238 CO 0.63 0.41 0.66 -0.40 -1.07 0.00 0.00 179.97 180.20 1ok4 n ASP 239 N -3.46 7.03 -0.23 7.04 5.75 -1.26 -4.77 116.55 126.65 1ok4 n ASP 239 Ca 0.00 -3.44 -0.01 0.00 -0.01 0.00 0.00 54.79 51.34 1ok4 n ASP 239 Cb 0.56 -1.07 0.11 0.00 -1.03 0.00 0.00 41.12 39.69 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 2.18 0.91 -0.21 2.12 0.00 -1.65 -1.52 119.26 121.08 1ok4 h ALA 240 Ca 0.46 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.29 1ok4 h ALA 240 Cb 0.71 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1ok4 h ALA 240 CO 1.15 -0.01 -0.29 1.25 0.00 0.00 0.00 179.25 181.35 1ok4 h LEU 241 N 0.62 0.62 -0.36 0.00 5.85 -1.88 -0.41 115.31 119.75 1ok4 h LEU 241 Ca 0.31 -0.51 0.01 0.00 0.84 0.00 0.00 57.88 58.53 1ok4 h LEU 241 Cb 0.27 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1ok4 h LEU 241 CO -0.22 1.01 0.23 0.50 -0.34 0.00 0.00 178.44 179.62 1ok4 h LYS 242 N 0.24 0.46 -0.44 1.25 3.64 -1.89 -0.79 116.57 119.05 1ok4 h LYS 242 Ca 0.02 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 1ok4 h LYS 242 Cb 0.87 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1ok4 h LYS 242 CO 0.07 0.30 -0.21 0.35 -2.27 0.00 0.00 179.45 177.69 1ok4 h PHE 243 N 0.47 1.00 -0.98 1.91 3.57 -1.25 -2.43 116.94 119.23 1ok4 h PHE 243 Ca 0.13 -0.23 0.02 0.00 3.53 0.00 0.00 57.97 61.42 1ok4 h PHE 243 Cb -0.04 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.41 1ok4 h PHE 243 CO -0.06 1.00 0.65 0.00 -2.23 0.00 0.00 178.31 177.67 1ok4 h ALA 244 N 0.99 1.26 -0.10 2.41 0.00 -0.77 -0.69 119.26 122.36 1ok4 h ALA 244 Ca 0.10 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1ok4 h ALA 244 Cb 0.75 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ok4 h ALA 244 CO 0.06 0.60 -0.47 0.00 0.00 0.00 0.00 179.25 179.43 1ok4 h ARG 245 N 1.30 0.24 -0.28 0.00 3.08 -0.99 -1.34 114.38 116.39 1ok4 h ARG 245 Ca 0.37 -0.13 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 1ok4 h ARG 245 Cb -0.10 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1ok4 h ARG 245 CO -0.09 0.67 -0.27 0.00 -1.07 0.00 0.00 179.97 179.21 1ok4 h ALA 246 N 1.31 1.03 -0.37 0.04 0.00 -0.92 -1.44 119.26 118.91 1ok4 h ALA 246 Ca 0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1ok4 h ALA 246 Cb 0.91 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ok4 h ALA 246 CO 0.07 0.58 0.08 -0.07 0.00 0.00 0.00 179.25 179.91 1ok4 h LEU 247 N 0.48 0.57 -0.53 0.00 3.38 -0.78 -2.05 115.31 116.37 1ok4 h LEU 247 Ca 0.07 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.82 1ok4 h LEU 247 Cb 0.71 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1ok4 h LEU 247 CO 0.05 0.67 0.31 0.00 0.09 0.00 0.00 178.44 179.56 1ok4 h ALA 248 N 0.92 0.68 -0.43 1.53 0.00 -1.10 0.03 119.26 120.89 1ok4 h ALA 248 Ca 0.11 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1ok4 h ALA 248 Cb 0.33 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1ok4 h ALA 248 CO 0.00 0.02 0.17 1.49 0.00 0.00 0.00 179.25 180.93 1ok4 h GLU 249 N 0.62 0.33 -0.07 0.00 4.57 -1.12 -1.36 114.58 117.55 1ok4 h GLU 249 Ca 0.21 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1ok4 h GLU 249 Cb 0.03 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1ok4 h GLU 249 CO -0.10 0.22 0.00 1.25 -1.18 0.00 0.00 179.01 179.20 1ok4 h LEU 250 N 0.34 0.11 -0.14 1.64 5.85 -0.96 -3.18 115.31 118.97 1ok4 h LEU 250 Ca 0.20 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.48 1ok4 h LEU 250 Cb 0.17 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1ok4 h LEU 250 CO -0.19 0.38 -0.44 0.58 -0.34 0.00 0.00 178.44 178.44 1ok4 h VAL 251 N -0.17 1.35 0.18 1.05 2.07 -0.88 -3.37 116.25 116.49 1ok4 h VAL 251 Ca 0.02 -1.72 -0.33 0.00 0.82 0.00 0.00 66.70 65.49 1ok4 h VAL 251 Cb 0.33 2.06 0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1ok4 h VAL 251 CO 0.00 0.52 -1.58 1.88 0.02 0.00 0.00 177.57 178.42 1ok4 h TYR 252 N 0.17 0.71 0.00 1.57 0.05 -1.38 -3.45 116.97 114.63 1ok4 h TYR 252 Ca -0.01 -0.52 0.00 0.00 0.05 0.00 0.00 58.73 58.25 1ok4 h TYR 252 Cb 1.06 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.77 1ok4 h TYR 252 CO 0.10 1.54 0.00 0.41 -1.05 0.00 0.00 178.16 179.16