#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 -0.62 1.20 3.38 -1.98 -2.66 115.31 114.63 1ok4 h LEU 4 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 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 0.52 0.41 0.74 0.09 0.00 0.00 178.44 180.20 1ok4 h THR 5 N 0.00 1.14 -0.69 0.22 2.02 -1.96 -0.62 112.91 113.02 1ok4 h THR 5 Ca -0.01 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 66.82 1ok4 h THR 5 Cb 1.39 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1ok4 h THR 5 CO 0.07 0.15 0.13 -0.33 0.37 0.00 0.00 175.52 175.91 1ok4 h GLU 6 N 0.82 1.12 -0.48 6.66 5.08 -1.86 -0.54 114.58 125.38 1ok4 h GLU 6 Ca 0.23 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1ok4 h GLU 6 Cb -0.07 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1ok4 h GLU 6 CO -0.06 1.01 0.23 -0.22 -1.00 0.00 0.00 179.01 178.98 1ok4 h LYS 7 N 1.06 0.70 -0.21 2.33 3.64 -1.31 -1.41 116.57 121.36 1ok4 h LYS 7 Ca 0.21 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1ok4 h LYS 7 Cb 0.42 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1ok4 h LYS 7 CO 0.01 0.59 -0.00 0.35 -2.27 0.00 0.00 179.45 178.13 1ok4 h PHE 8 N 0.64 -0.01 -0.68 1.91 3.57 -0.71 -2.14 116.94 119.52 1ok4 h PHE 8 Ca 0.17 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 1ok4 h PHE 8 Cb 0.12 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1ok4 h PHE 8 CO -0.01 -0.03 0.31 -0.07 -2.23 0.00 0.00 178.31 176.28 1ok4 h LEU 9 N 0.07 0.88 -0.73 0.59 3.38 -0.92 0.13 115.31 118.71 1ok4 h LEU 9 Ca 0.10 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1ok4 h LEU 9 Cb 0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ok4 h LEU 9 CO -0.17 0.76 0.06 -0.09 0.09 0.00 0.00 178.44 179.09 1ok4 h ARG 10 N 0.96 1.02 0.10 1.13 2.43 -1.01 -0.65 114.38 118.38 1ok4 h ARG 10 Ca 0.23 -0.29 -0.28 0.00 -0.81 0.00 0.00 59.98 58.84 1ok4 h ARG 10 Cb 0.13 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1ok4 h ARG 10 CO -0.03 0.97 -1.45 0.82 -1.51 0.00 0.00 179.97 178.77 1ok4 h ILE 11 N 0.95 0.98 -0.05 1.20 2.04 -1.11 -3.37 117.51 118.15 1ok4 h ILE 11 Ca 0.18 -2.37 0.00 0.00 1.00 0.00 0.00 64.86 63.67 1ok4 h ILE 11 Cb 0.47 2.65 0.00 0.00 -0.74 0.00 0.00 36.82 39.20 1ok4 h ILE 11 CO 0.02 0.69 0.00 0.49 0.00 0.00 0.00 178.15 179.35 1ok4 n PHE 12 N -3.93 0.04 -2.74 1.37 3.72 0.43 -4.59 117.46 111.77 1ok4 n PHE 12 Ca -0.26 -0.03 -0.03 0.00 -0.05 0.00 0.00 57.45 57.08 1ok4 n PHE 12 Cb 0.89 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.52 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 1.02 2.64 0.28 4.37 0.00 -0.26 -4.50 120.51 124.06 1ok4 n ALA 13 Ca 0.11 -2.00 0.13 0.00 0.00 0.00 0.00 53.44 51.68 1ok4 n ALA 13 Cb 0.46 -0.88 0.81 0.00 0.00 0.00 0.00 19.45 19.83 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 2.02 0.00 -0.12 0.00 0.11 -1.70 -0.05 114.38 114.64 1ok4 h ARG 14 Ca -0.26 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.82 1ok4 h ARG 14 Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.35 1ok4 h ARG 14 CO 0.06 0.03 0.00 0.54 0.10 0.00 0.00 179.97 180.70 1ok4 n ARG 15 N -3.99 1.71 0.00 0.08 1.74 -1.26 -4.92 116.66 110.01 1ok4 n ARG 15 Ca -0.03 -1.05 0.00 0.00 -0.77 0.00 0.00 57.85 56.00 1ok4 n ARG 15 Cb 0.11 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.14 3.44 3.37 -0.13 0.00 -0.03 -5.02 105.19 107.96 1ok4 n GLY 16 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 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 1.44 -0.01 1.61 -0.14 -1.26 -4.97 119.74 115.52 1ok4 s LYS 17 Ca 0.00 -1.76 0.01 0.00 -1.36 0.00 0.00 55.97 52.87 1ok4 s LYS 17 Cb 0.00 -0.68 0.00 0.00 -1.68 0.00 0.00 37.83 35.48 1ok4 s LYS 17 CO 0.00 -0.13 -0.04 0.45 -0.76 0.00 0.00 175.35 174.86 1ok4 s SER 18 N -3.36 0.60 -0.13 2.83 0.15 -0.50 -4.51 113.70 108.77 1ok4 s SER 18 Ca 0.32 -0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.89 1ok4 s SER 18 Cb 0.07 -0.14 0.02 0.00 -1.71 0.00 0.00 66.02 64.26 1ok4 s SER 18 CO 0.11 0.02 -0.13 -0.63 1.20 0.00 0.00 173.24 173.82 1ok4 s ILE 19 N 0.18 1.43 -0.13 6.45 1.01 -1.26 -1.67 121.20 127.20 1ok4 s ILE 19 Ca -0.02 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 1ok4 s ILE 19 Cb -0.05 -1.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 1ok4 s ILE 19 CO -0.00 0.43 -0.11 -0.63 0.00 0.00 0.00 174.94 174.63 1ok4 s ILE 20 N 1.38 3.24 -0.41 2.92 -1.09 -0.60 -1.02 121.20 125.62 1ok4 s ILE 20 Ca 0.01 -0.60 -0.20 0.00 -2.23 0.00 0.00 60.65 57.64 1ok4 s ILE 20 Cb -0.13 -2.37 0.02 0.00 -1.58 0.00 0.00 42.46 38.39 1ok4 s ILE 20 CO -0.07 0.52 0.62 -0.22 -1.23 0.00 0.00 174.94 174.56 1ok4 s LEU 21 N 0.32 4.43 0.03 2.97 2.96 0.17 -0.89 118.68 128.68 1ok4 s LEU 21 Ca -0.09 -0.20 -0.20 0.00 -0.22 0.00 0.00 54.13 53.43 1ok4 s LEU 21 Cb -0.15 -2.72 -0.06 0.00 0.50 0.00 0.00 46.19 43.76 1ok4 s LEU 21 CO 0.05 -0.69 0.57 0.00 -1.32 0.00 0.00 176.35 174.96 1ok4 s ALA 22 N 2.73 3.55 -0.31 5.97 0.00 -0.08 -1.60 121.76 132.01 1ok4 s ALA 22 Ca 0.22 0.02 0.17 0.00 0.00 0.00 0.00 51.96 52.37 1ok4 s ALA 22 Cb -0.14 -2.67 0.45 0.00 0.00 0.00 0.00 23.12 20.75 1ok4 s ALA 22 CO 0.17 0.29 1.35 0.98 0.00 0.00 0.00 175.76 178.56 1ok4 n TYR 23 N 2.20 -0.74 0.68 0.00 9.36 -0.41 -4.28 117.16 123.97 1ok4 n TYR 23 Ca -0.09 -1.93 0.09 0.00 3.32 0.00 0.00 57.90 59.29 1ok4 n TYR 23 Cb 0.51 0.83 0.27 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 2.45 0.23 2.98 5.75 -1.23 -4.55 116.55 121.09 1ok4 n ASP 24 Ca -0.07 -1.91 0.07 0.00 -0.01 0.00 0.00 54.79 52.88 1ok4 n ASP 24 Cb 0.85 -0.24 0.55 0.00 -1.03 0.00 0.00 41.12 41.25 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 2.94 0.00 -0.96 2.11 3.86 -1.92 -2.71 115.15 118.47 1ok4 h HIS 25 Ca 0.00 0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.35 1ok4 h HIS 25 Cb 0.66 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.05 1ok4 h HIS 25 CO 0.24 0.19 0.61 0.78 0.86 0.00 0.00 177.93 180.61 1ok4 h GLY 26 N 0.73 1.49 0.41 2.45 0.00 -1.81 0.11 103.07 106.45 1ok4 h GLY 26 Ca -0.00 -0.37 -0.28 0.00 0.00 0.00 0.00 47.33 46.68 1ok4 h GLY 26 CO 0.03 0.10 -1.49 1.19 0.00 0.00 0.00 176.54 176.36 1ok4 h ILE 27 N 0.84 0.91 -0.81 2.60 2.10 -1.84 -3.06 117.51 118.24 1ok4 h ILE 27 Ca 0.49 -2.32 -0.04 0.00 1.08 0.00 0.00 64.86 64.07 1ok4 h ILE 27 Cb 0.65 2.54 -0.04 0.00 -1.09 0.00 0.00 36.82 38.88 1ok4 h ILE 27 CO -0.26 0.65 0.35 -0.33 -1.08 0.00 0.00 178.15 177.48 1ok4 h GLU 28 N -0.41 1.19 0.00 2.19 4.39 -1.17 -3.36 114.58 117.41 1ok4 h GLU 28 Ca -0.34 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.16 1ok4 h GLU 28 Cb 1.69 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 1ok4 h GLU 28 CO -0.01 0.95 -0.88 0.72 -1.16 0.00 0.00 179.01 178.63 1ok4 n HIS 29 N -4.30 0.00 0.00 4.33 8.25 0.26 -2.84 115.22 120.91 1ok4 n HIS 29 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1ok4 n HIS 29 Cb 0.17 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.28 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 2.32 -0.92 0.00 -1.41 0.00 -0.46 -4.63 105.19 100.09 1ok4 n GLY 30 Ca 0.00 -1.67 0.09 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.02 0.42 -0.20 1.61 -0.04 -1.26 -2.95 135.00 131.55 1ok4 n PRO 31 Ca 0.00 0.06 0.08 0.00 -0.04 0.00 0.00 63.50 63.60 1ok4 n PRO 31 Cb 0.00 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.33 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 3.04 1.75 -0.58 0.55 0.00 -1.97 -0.40 119.26 121.64 1ok4 h ALA 32 Ca 0.00 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.07 1ok4 h ALA 32 Cb 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1ok4 h ALA 32 CO 0.00 0.11 0.52 -0.44 0.00 0.00 0.00 179.25 179.44 1ok4 h ASP 33 N 0.72 0.00 0.09 0.00 5.19 -1.83 -2.72 116.42 117.87 1ok4 h ASP 33 Ca 0.34 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.75 1ok4 h ASP 33 Cb 0.38 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.89 1ok4 h ASP 33 CO -0.12 0.00 -0.16 0.49 -3.12 0.00 0.00 179.24 176.33 1ok4 n PHE 34 N -3.93 0.00 -0.10 4.55 3.72 -0.16 -4.40 117.46 117.14 1ok4 n PHE 34 Ca 0.11 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.37 1ok4 n PHE 34 Cb 0.75 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 39.20 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 2.11 0.88 -0.75 -1.08 2.86 -1.56 -2.83 114.93 114.56 1ok4 h MET 35 Ca 0.00 -0.50 0.14 0.00 -2.06 0.00 0.00 59.70 57.27 1ok4 h MET 35 Cb 0.58 0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.18 1ok4 h MET 35 CO 0.00 1.15 0.31 -0.44 1.06 0.00 0.00 176.91 178.99 1ok4 h ASP 36 N 0.67 0.31 -2.75 1.22 3.32 -1.80 -3.33 116.42 114.06 1ok4 h ASP 36 Ca 0.04 0.10 -0.59 0.00 0.02 0.00 0.00 57.03 56.60 1ok4 h ASP 36 Cb 1.04 0.07 -0.39 0.00 0.22 0.00 0.00 39.33 40.27 1ok4 h ASP 36 CO 0.10 0.12 -0.85 0.21 -1.72 0.00 0.00 179.24 177.11 1ok4 s ASN 37 N -5.36 2.71 0.58 6.45 2.47 -1.20 -4.82 114.94 115.77 1ok4 s ASN 37 Ca -0.12 -2.77 0.28 0.00 0.42 0.00 0.00 52.86 50.66 1ok4 s ASN 37 Cb 0.20 -0.67 1.53 0.00 -1.45 0.00 0.00 41.25 40.86 1ok4 s ASN 37 CO 0.76 -0.23 1.99 -0.65 -3.72 0.00 0.00 177.10 175.26 1ok4 h PRO 38 N 6.28 0.00 -0.04 0.43 0.11 -1.62 0.31 132.00 137.47 1ok4 h PRO 38 Ca 0.13 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.25 1ok4 h PRO 38 Cb 0.92 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ok4 h PRO 38 CO 0.39 0.00 0.04 -0.44 -0.21 0.00 0.00 178.00 177.79 1ok4 h ASP 39 N 0.00 0.00 0.07 -2.05 3.32 -1.95 -2.29 116.42 113.52 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 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 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 1.15 6.45 4.64 -1.19 -1.16 113.55 123.44 1ok4 h SER 40 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1ok4 h SER 40 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 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 -2.32 5.18 0.00 -1.62 -3.43 119.26 120.09 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 -0.17 0.00 0.00 0.00 0.00 17.79 17.65 1ok4 h ALA 41 CO 0.00 0.00 -0.10 0.34 0.00 0.00 0.00 179.25 179.49 1ok4 s ASP 42 N -5.44 6.24 0.54 0.00 2.15 -0.44 -4.97 116.67 114.76 1ok4 s ASP 42 Ca 0.03 -0.54 0.22 0.00 0.43 0.00 0.00 52.55 52.69 1ok4 s ASP 42 Cb 0.09 -2.26 1.43 0.00 -0.30 0.00 0.00 42.92 41.88 1ok4 s ASP 42 CO 0.54 -0.64 2.12 -0.65 -0.17 0.00 0.00 175.17 176.37 1ok4 h PRO 43 N 8.77 0.00 -0.98 4.34 0.11 -1.85 -1.38 132.00 141.00 1ok4 h PRO 43 Ca -0.26 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.86 1ok4 h PRO 43 Cb 1.11 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 1ok4 h PRO 43 CO 0.83 0.00 0.64 0.93 -0.21 0.00 0.00 178.00 180.19 1ok4 h GLU 44 N 0.00 1.31 -0.49 1.05 5.08 -1.93 -1.76 114.58 117.84 1ok4 h GLU 44 Ca 0.07 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1ok4 h GLU 44 Cb 0.28 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1ok4 h GLU 44 CO -0.00 0.87 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.95 1ok4 h TYR 45 N 1.34 0.87 -0.08 4.33 3.20 -1.54 -1.89 116.97 123.20 1ok4 h TYR 45 Ca 0.36 -0.13 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1ok4 h TYR 45 Cb -0.14 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 37.89 1ok4 h TYR 45 CO 0.00 0.81 0.03 0.82 -1.64 0.00 0.00 178.16 178.18 1ok4 h ILE 46 N 0.76 1.14 -0.77 1.81 1.08 -1.25 0.47 117.51 120.74 1ok4 h ILE 46 Ca 0.14 -0.42 0.04 0.00 -0.39 0.00 0.00 64.86 64.24 1ok4 h ILE 46 Cb 0.48 1.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 1ok4 h ILE 46 CO 0.02 0.12 0.48 -0.07 -0.69 0.00 0.00 178.15 178.01 1ok4 h LEU 47 N -0.03 0.78 -0.70 1.44 3.38 -1.26 -0.13 115.31 118.79 1ok4 h LEU 47 Ca 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1ok4 h LEU 47 Cb 0.16 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1ok4 h LEU 47 CO -0.00 0.53 0.22 0.03 0.09 0.00 0.00 178.44 179.30 1ok4 h ARG 48 N 0.92 1.10 -0.28 1.13 3.08 -1.14 -1.87 114.38 117.31 1ok4 h ARG 48 Ca 0.32 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1ok4 h ARG 48 Cb 0.06 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1ok4 h ARG 48 CO -0.13 0.95 0.13 1.25 -1.07 0.00 0.00 179.97 181.10 1ok4 h LEU 49 N 1.04 0.38 -0.63 3.04 5.85 -0.54 0.73 115.31 125.18 1ok4 h LEU 49 Ca 0.23 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1ok4 h LEU 49 Cb 0.31 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1ok4 h LEU 49 CO -0.01 0.41 0.39 0.00 -0.34 0.00 0.00 178.44 178.89 1ok4 h ALA 50 N 0.98 0.80 0.32 1.25 0.00 -0.92 -1.44 119.26 120.25 1ok4 h ALA 50 Ca 0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ok4 h ALA 50 Cb 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ok4 h ALA 50 CO -0.01 0.26 -0.15 -0.09 0.00 0.00 0.00 179.25 179.25 1ok4 h ARG 51 N 0.85 -0.42 0.00 0.00 2.43 -1.26 -0.75 114.38 115.23 1ok4 h ARG 51 Ca 0.23 0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.38 1ok4 h ARG 51 Cb -0.05 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1ok4 h ARG 51 CO -0.05 -0.19 -0.23 -0.44 -1.51 0.00 0.00 179.97 177.56 1ok4 h ASP 52 N -0.58 0.00 0.56 -3.80 3.32 -0.68 -0.92 116.42 114.33 1ok4 h ASP 52 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1ok4 h ASP 52 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1ok4 h ASP 52 CO 0.07 0.23 -0.23 0.00 -1.72 0.00 0.00 179.24 177.59 1ok4 n ALA 53 N -2.46 2.94 -2.49 3.45 0.00 -0.56 -4.94 120.51 116.46 1ok4 n ALA 53 Ca -0.02 -0.26 -0.12 0.00 0.00 0.00 0.00 53.44 53.03 1ok4 n ALA 53 Cb 0.29 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.47 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 1.42 -0.06 3.74 0.00 0.00 -0.35 -4.76 105.19 105.18 1ok4 n GLY 54 Ca 0.09 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.77 2.44 -0.14 1.61 0.08 -0.31 -5.01 117.98 113.88 1ok4 s PHE 55 Ca 0.10 1.10 0.18 0.00 0.12 0.00 0.00 56.93 58.42 1ok4 s PHE 55 Cb -0.04 -3.21 -0.11 0.00 -0.57 0.00 0.00 43.02 39.09 1ok4 s PHE 55 CO 0.12 -2.33 0.88 -0.44 -0.10 0.00 0.00 175.22 173.35 1ok4 h ASP 56 N -1.49 0.00 -5.34 1.36 3.32 -1.38 -3.45 116.42 109.43 1ok4 h ASP 56 Ca -0.50 0.00 0.20 0.00 0.02 0.00 0.00 57.03 56.75 1ok4 h ASP 56 Cb 1.30 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.76 1ok4 h ASP 56 CO 0.58 0.48 0.54 -0.83 -1.72 0.00 0.00 179.24 178.28 1ok4 s GLY 57 N -4.71 -0.27 0.16 2.75 0.00 -1.23 -4.02 107.32 100.00 1ok4 s GLY 57 Ca -0.02 0.27 0.08 0.00 0.00 0.00 0.00 44.72 45.05 1ok4 s GLY 57 CO 0.81 0.04 -0.18 -1.34 0.00 0.00 0.00 173.10 172.43 1ok4 s VAL 58 N -3.14 1.77 -0.22 1.40 -7.23 -0.59 -0.65 120.40 111.74 1ok4 s VAL 58 Ca 0.12 -1.88 -0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1ok4 s VAL 58 Cb -0.00 -1.80 0.02 0.00 0.56 0.00 0.00 36.38 35.15 1ok4 s VAL 58 CO 0.01 -0.31 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.69 1ok4 s VAL 59 N -2.00 2.69 0.09 1.32 1.01 -0.63 -0.55 120.40 122.33 1ok4 s VAL 59 Ca 0.15 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1ok4 s VAL 59 Cb -0.06 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 1ok4 s VAL 59 CO 0.06 0.35 -0.22 -0.36 0.00 0.00 0.00 175.10 174.93 1ok4 s PHE 60 N 1.34 1.90 0.85 5.22 0.08 -1.01 -1.29 117.98 125.07 1ok4 s PHE 60 Ca 0.03 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.56 1ok4 s PHE 60 Cb -0.15 -1.06 0.10 0.00 -0.57 0.00 0.00 43.02 41.34 1ok4 s PHE 60 CO -0.07 0.20 1.10 -0.65 -0.10 0.00 0.00 175.22 175.70 1ok4 s GLN 61 N -1.74 1.64 0.28 0.44 -1.52 -1.26 -1.08 119.66 116.42 1ok4 s GLN 61 Ca 0.08 0.64 -0.03 0.00 -1.95 0.00 0.00 55.36 54.10 1ok4 s GLN 61 Cb -0.10 -1.87 0.41 0.00 -0.22 0.00 0.00 33.01 31.23 1ok4 s GLN 61 CO 0.04 -1.93 1.94 0.07 -0.25 0.00 0.00 175.29 175.16 1ok4 h ARG 62 N -1.31 1.14 -0.53 2.91 0.11 -1.94 -1.71 114.38 113.04 1ok4 h ARG 62 Ca -0.49 -0.07 -0.11 0.00 0.10 0.00 0.00 59.98 59.42 1ok4 h ARG 62 Cb 1.28 -0.26 -0.02 0.00 1.11 0.00 0.00 29.97 32.09 1ok4 h ARG 62 CO 0.58 0.75 -0.10 0.78 0.10 0.00 0.00 179.97 182.08 1ok4 h GLY 63 N 1.17 1.07 1.06 0.08 0.00 -1.97 0.21 103.07 104.70 1ok4 h GLY 63 Ca 0.35 -0.85 -0.14 0.00 0.00 0.00 0.00 47.33 46.69 1ok4 h GLY 63 CO -0.09 0.78 -0.31 -2.22 0.00 0.00 0.00 176.54 174.70 1ok4 h ILE 64 N 0.88 1.28 -0.10 2.60 1.08 -1.83 -2.31 117.51 119.11 1ok4 h ILE 64 Ca 0.14 -1.47 -0.00 0.00 -0.39 0.00 0.00 64.86 63.14 1ok4 h ILE 64 Cb 0.66 1.40 -0.00 0.00 -3.07 0.00 0.00 36.82 35.81 1ok4 h ILE 64 CO 0.05 0.49 0.06 0.00 -0.69 0.00 0.00 178.15 178.05 1ok4 h ALA 65 N 0.77 0.12 -0.58 1.87 0.00 -1.11 -0.56 119.26 119.78 1ok4 h ALA 65 Ca 0.07 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ok4 h ALA 65 Cb 0.89 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1ok4 h ALA 65 CO 0.08 -0.36 0.38 1.49 0.00 0.00 0.00 179.25 180.84 1ok4 h GLU 66 N 0.10 0.76 0.00 0.00 4.81 -0.93 -0.66 114.58 118.66 1ok4 h GLU 66 Ca 0.04 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 1ok4 h GLU 66 Cb 0.03 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1ok4 h GLU 66 CO -0.01 0.50 -0.79 0.87 -0.73 0.00 0.00 179.01 178.86 1ok4 h LYS 67 N 0.78 0.00 0.00 1.92 6.56 -1.34 -3.42 116.57 121.07 1ok4 h LYS 67 Ca 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.80 1ok4 h LYS 67 Cb -0.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.57 1ok4 h LYS 67 CO -0.05 0.27 -0.55 0.66 -2.06 0.00 0.00 179.45 177.73 1ok4 n TYR 68 N -3.01 0.00 -1.99 -1.35 4.01 -0.23 -5.06 117.16 109.54 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 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.70 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 -1.39 3.06 0.00 -0.72 5.04 -0.27 -4.89 117.35 118.18 1ok4 s TYR 69 Ca 0.00 0.84 0.00 0.00 -2.44 0.00 0.00 57.07 55.47 1ok4 s TYR 69 Cb 0.00 -3.86 0.00 0.00 0.35 0.00 0.00 41.96 38.45 1ok4 s TYR 69 CO 0.00 -2.99 0.85 -0.40 -1.34 0.00 0.00 175.55 171.68 1ok4 n ASP 70 N 3.22 1.51 0.00 4.32 5.75 -1.26 -4.96 116.55 125.13 1ok4 n ASP 70 Ca 0.10 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 1ok4 n ASP 70 Cb 0.40 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 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 -0.36 0.53 0.12 6.12 0.00 -1.26 -4.91 105.19 105.42 1ok4 n GLY 71 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.44 113.55 110.67 1ok4 h SER 72 Ca 0.00 -0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 61.05 1ok4 h SER 72 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.82 1ok4 h SER 72 CO 0.00 0.03 -0.57 -0.69 -0.87 0.00 0.00 176.83 174.73 1ok4 s VAL 73 N -3.27 -0.01 0.32 0.95 1.01 -1.26 -4.92 120.40 113.21 1ok4 s VAL 73 Ca 0.03 0.04 -0.28 0.00 0.00 0.00 0.00 61.98 61.77 1ok4 s VAL 73 Cb 0.10 -0.20 -0.13 0.00 0.00 0.00 0.00 36.38 36.15 1ok4 s VAL 73 CO 0.74 0.02 1.19 -2.65 0.00 0.00 0.00 175.10 174.40 1ok4 n PRO 74 N 3.26 1.84 -4.51 2.72 -0.02 -1.26 -4.74 135.00 132.30 1ok4 n PRO 74 Ca -0.15 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 1ok4 n PRO 74 Cb 0.58 -2.16 -0.12 0.00 -0.02 0.00 0.00 33.50 31.78 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 -0.45 3.13 -0.29 2.45 2.96 -1.26 -1.54 118.68 123.67 1ok4 s LEU 75 Ca 0.57 -0.15 -0.10 0.00 -0.22 0.00 0.00 54.13 54.23 1ok4 s LEU 75 Cb -0.62 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 1ok4 s LEU 75 CO 0.61 0.20 0.16 -0.63 -1.32 0.00 0.00 176.35 175.36 1ok4 s ILE 76 N 0.18 4.86 -0.44 6.68 1.01 0.29 -0.87 121.20 132.92 1ok4 s ILE 76 Ca -0.03 -0.13 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 1ok4 s ILE 76 Cb -0.14 -3.38 0.02 0.00 0.01 0.00 0.00 42.46 38.98 1ok4 s ILE 76 CO 0.03 0.19 0.72 -0.22 0.00 0.00 0.00 174.94 175.66 1ok4 s LEU 77 N 1.68 4.36 -0.34 2.97 1.98 -0.51 -2.40 118.68 126.41 1ok4 s LEU 77 Ca 0.06 -0.20 -0.29 0.00 -2.89 0.00 0.00 54.13 50.81 1ok4 s LEU 77 Cb -0.16 -2.86 0.00 0.00 0.66 0.00 0.00 46.19 43.83 1ok4 s LEU 77 CO 0.08 -0.85 1.35 -0.75 -1.89 0.00 0.00 176.35 174.28 1ok4 s LYS 78 N 3.07 3.78 0.09 1.98 2.47 -0.25 -0.91 119.74 129.98 1ok4 s LYS 78 Ca 0.27 1.13 -0.00 0.00 -1.56 0.00 0.00 55.97 55.80 1ok4 s LYS 78 Cb -0.13 -3.94 -0.26 0.00 -1.46 0.00 0.00 37.83 32.04 1ok4 s LYS 78 CO 0.21 -1.30 1.19 -0.07 0.16 0.00 0.00 175.35 175.54 1ok4 h LEU 79 N 11.39 0.28 -9.53 5.43 3.38 -1.32 -3.39 115.31 121.55 1ok4 h LEU 79 Ca -0.27 -0.30 -0.57 0.00 0.09 0.00 0.00 57.88 56.83 1ok4 h LEU 79 Cb 1.10 -0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.66 1ok4 h LEU 79 CO 1.05 1.23 -0.65 0.54 0.09 0.00 0.00 178.44 180.71 1ok4 s ASN 80 N -6.99 4.32 -0.19 -0.43 4.22 -1.26 -0.61 114.94 114.00 1ok4 s ASN 80 Ca -0.02 -0.79 -0.28 0.00 -2.14 0.00 0.00 52.86 49.63 1ok4 s ASN 80 Cb 0.08 -0.68 0.11 0.00 1.28 0.00 0.00 41.25 42.04 1ok4 s ASN 80 CO 0.86 -0.07 0.92 -0.83 -2.04 0.00 0.00 177.10 175.95 1ok4 s GLY 81 N -3.67 -0.32 0.23 0.45 0.00 -1.18 -4.84 107.32 98.00 1ok4 s GLY 81 Ca 0.32 2.12 0.01 0.00 0.00 0.00 0.00 44.72 47.17 1ok4 s GLY 81 CO 0.19 1.36 0.09 -1.59 0.00 0.00 0.00 173.10 173.16 1ok4 s LYS 82 N -0.52 1.33 0.34 2.90 -2.85 -1.26 -4.16 119.74 115.52 1ok4 s LYS 82 Ca -0.02 -1.71 0.08 0.00 -1.00 0.00 0.00 55.97 53.33 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 0.00 -0.30 0.23 0.95 0.10 0.00 0.00 175.35 176.34 1ok4 s THR 83 N -3.84 3.31 -0.92 3.79 -4.23 -1.26 -3.44 115.64 109.05 1ok4 s THR 83 Ca 0.36 -1.51 0.28 0.00 -1.18 0.00 0.00 61.69 59.65 1ok4 s THR 83 Cb 0.07 -3.10 0.21 0.00 1.34 0.00 0.00 72.50 71.03 1ok4 s THR 83 CO 0.12 -0.17 1.80 0.35 -0.54 0.00 0.00 174.62 176.18 1ok4 n THR 84 N -1.28 0.16 0.24 3.99 -2.24 -1.13 -3.18 114.28 110.83 1ok4 n THR 84 Ca -0.02 -0.08 0.11 0.00 -2.27 0.00 0.00 64.05 61.79 1ok4 n THR 84 Cb 0.60 -0.41 0.60 0.00 -2.10 0.00 0.00 70.33 69.02 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 -9.74 3.22 3.38 -1.95 -3.44 115.31 106.79 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 0.57 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.35 1ok4 h LEU 85 CO 0.00 0.18 0.56 -0.47 0.09 0.00 0.00 178.44 178.80 1ok4 s TYR 86 N -3.97 3.39 -0.30 1.13 5.04 -1.19 -4.97 117.35 116.48 1ok4 s TYR 86 Ca -0.01 1.47 0.08 0.00 -2.44 0.00 0.00 57.07 56.17 1ok4 s TYR 86 Cb 0.12 -3.45 -0.10 0.00 0.35 0.00 0.00 41.96 38.88 1ok4 s TYR 86 CO 0.61 -1.20 0.31 -1.71 -1.34 0.00 0.00 175.55 172.22 1ok4 n ASN 87 N 1.90 0.95 -2.55 4.32 2.85 -1.26 -5.02 115.26 116.45 1ok4 n ASN 87 Ca 0.02 -0.55 0.00 0.00 -0.11 0.00 0.00 54.58 53.95 1ok4 n ASN 87 Cb 0.44 1.08 0.00 0.00 1.24 0.00 0.00 39.78 42.54 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 1.36 -2.52 3.75 8.20 0.00 -1.26 -4.96 105.19 109.77 1ok4 n GLY 88 Ca 0.01 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 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 -2.97 4.27 0.09 1.61 0.41 -1.26 -4.86 118.70 116.00 1ok4 s GLU 89 Ca 0.00 2.31 -0.34 0.00 -0.41 0.00 0.00 54.97 56.53 1ok4 s GLU 89 Cb 0.00 -3.09 -0.13 0.00 -1.78 0.00 0.00 34.13 29.13 1ok4 s GLU 89 CO 0.00 -0.38 1.66 -2.30 -0.49 0.00 0.00 175.26 173.75 1ok4 n PRO 90 N 1.90 2.16 -3.71 0.39 -0.02 -1.26 -4.78 135.00 129.68 1ok4 n PRO 90 Ca 0.05 0.78 -0.14 0.00 -2.02 0.00 0.00 63.50 62.18 1ok4 n PRO 90 Cb 0.40 -2.57 -0.09 0.00 -0.02 0.00 0.00 33.50 31.22 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 1.83 0.01 -0.15 -1.45 0.11 -1.26 -4.47 120.40 115.02 1ok4 s VAL 91 Ca 0.83 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 59.74 1ok4 s VAL 91 Cb -0.68 -0.67 0.07 0.00 -1.53 0.00 0.00 36.38 33.57 1ok4 s VAL 91 CO 0.42 -0.05 0.20 -0.55 -3.33 0.00 0.00 175.10 171.79 1ok4 s SER 92 N -0.20 1.02 0.20 3.54 0.15 -1.26 -4.73 113.70 112.41 1ok4 s SER 92 Ca -0.04 0.10 0.05 0.00 0.70 0.00 0.00 55.95 56.77 1ok4 s SER 92 Cb -0.03 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.62 1ok4 s SER 92 CO 0.02 -0.28 0.20 0.68 1.20 0.00 0.00 173.24 175.06 1ok4 s VAL 93 N 2.33 4.68 0.20 4.45 -7.23 -1.26 -4.69 120.40 118.87 1ok4 s VAL 93 Ca 0.04 -1.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.80 1ok4 s VAL 93 Cb -0.14 -3.45 -0.10 0.00 0.56 0.00 0.00 36.38 33.25 1ok4 s VAL 93 CO -0.09 -0.20 1.49 0.00 -0.31 0.00 0.00 175.10 175.99 1ok4 s ALA 94 N -1.88 3.69 -1.59 1.32 0.00 -1.26 -3.10 121.76 118.93 1ok4 s ALA 94 Ca 0.32 1.32 0.15 0.00 0.00 0.00 0.00 51.96 53.76 1ok4 s ALA 94 Cb -0.09 -3.58 0.27 0.00 0.00 0.00 0.00 23.12 19.71 1ok4 s ALA 94 CO 0.25 -0.74 1.16 0.27 0.00 0.00 0.00 175.76 176.70 1ok4 n ASN 95 N 3.25 2.76 -3.69 0.00 0.23 0.22 -4.95 115.26 113.08 1ok4 n ASN 95 Ca 0.10 -1.81 -0.14 0.00 -0.53 0.00 0.00 54.58 52.20 1ok4 n ASN 95 Cb 0.40 -0.16 -0.08 0.00 -2.08 0.00 0.00 39.78 37.86 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 -0.92 5.90 0.19 0.00 1.04 -1.26 -4.88 113.70 113.77 1ok4 s SER 97 Ca -0.10 0.17 -0.11 0.00 0.48 0.00 0.00 55.95 56.40 1ok4 s SER 97 Cb -0.04 -1.49 0.12 0.00 0.10 0.00 0.00 66.02 64.72 1ok4 s SER 97 CO 0.05 -0.60 1.80 0.58 0.98 0.00 0.00 173.24 176.05 1ok4 h VAL 98 N 0.55 1.22 -0.89 5.02 2.07 -1.95 -1.80 116.25 120.47 1ok4 h VAL 98 Ca -0.46 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 66.52 1ok4 h VAL 98 Cb 1.25 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 1ok4 h VAL 98 CO 0.56 0.25 0.58 -0.08 0.02 0.00 0.00 177.57 178.90 1ok4 h GLU 99 N 0.95 1.09 -0.21 1.57 4.81 -1.95 -0.65 114.58 120.20 1ok4 h GLU 99 Ca 0.24 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.29 1ok4 h GLU 99 Cb 0.06 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1ok4 h GLU 99 CO -0.04 0.72 -0.35 0.93 -0.73 0.00 0.00 179.01 179.55 1ok4 h GLU 100 N 1.13 0.45 -0.60 1.92 5.08 -1.91 -2.74 114.58 117.91 1ok4 h GLU 100 Ca 0.35 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1ok4 h GLU 100 Cb -0.01 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1ok4 h GLU 100 CO -0.11 0.74 0.31 0.00 -1.00 0.00 0.00 179.01 178.94 1ok4 h ALA 101 N 1.25 0.77 -0.43 3.43 0.00 -0.42 -1.80 119.26 122.05 1ok4 h ALA 101 Ca 0.04 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1ok4 h ALA 101 Cb 0.79 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1ok4 h ALA 101 CO 0.06 0.31 0.16 0.28 0.00 0.00 0.00 179.25 180.05 1ok4 h VAL 102 N 0.81 0.87 0.00 0.00 2.07 -1.06 -1.91 116.25 117.02 1ok4 h VAL 102 Ca 0.21 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.59 1ok4 h VAL 102 Cb 0.08 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1ok4 h VAL 102 CO -0.03 0.06 -0.13 0.77 0.02 0.00 0.00 177.57 178.26 1ok4 h SER 103 N 0.32 0.00 0.09 0.57 4.64 -1.17 -2.17 113.55 115.84 1ok4 h SER 103 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1ok4 h SER 103 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1ok4 h SER 103 CO -0.20 0.13 -0.04 0.18 -0.87 0.00 0.00 176.83 176.03 1ok4 n LEU 104 N -3.43 0.76 0.00 5.97 4.77 -0.71 -4.93 117.00 119.43 1ok4 n LEU 104 Ca -0.01 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1ok4 n LEU 104 Cb 0.30 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1ok4 n LEU 104 CO 0.30 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1ok4 n GLY 105 N 1.15 0.85 3.77 -0.72 0.00 -0.81 -4.89 105.19 104.54 1ok4 n GLY 105 Ca 0.19 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 3.16 -1.66 4.61 0.00 -0.76 -4.58 121.76 120.52 1ok4 s ALA 106 Ca 0.00 1.03 0.21 0.00 0.00 0.00 0.00 51.96 53.19 1ok4 s ALA 106 Cb 0.00 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.65 1ok4 s ALA 106 CO 0.00 -0.61 0.98 0.43 0.00 0.00 0.00 175.76 176.56 1ok4 n SER 107 N 0.04 1.69 -3.55 0.00 7.64 -0.05 -4.73 113.62 114.66 1ok4 n SER 107 Ca 0.04 -1.34 -0.09 0.00 1.01 0.00 0.00 58.87 58.49 1ok4 n SER 107 Cb 0.46 0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 64.25 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 -2.48 -1.59 0.16 -0.43 0.00 -1.09 -4.19 121.76 112.15 1ok4 s ALA 108 Ca 0.15 0.44 0.11 0.00 0.00 0.00 0.00 51.96 52.65 1ok4 s ALA 108 Cb 0.16 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 1ok4 s ALA 108 CO 0.60 -0.83 -0.23 0.14 0.00 0.00 0.00 175.76 175.45 1ok4 s VAL 109 N -3.58 2.45 0.10 0.00 -7.23 -0.34 -1.43 120.40 110.37 1ok4 s VAL 109 Ca 0.05 -1.85 0.08 0.00 -1.81 0.00 0.00 61.98 58.45 1ok4 s VAL 109 Cb -0.02 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 1ok4 s VAL 109 CO -0.07 -0.02 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.66 1ok4 s GLY 110 N -2.42 1.22 -0.22 2.32 0.00 -0.09 -0.47 107.32 107.66 1ok4 s GLY 110 Ca 0.19 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.55 1ok4 s GLY 110 CO 0.09 -1.24 0.53 -0.47 0.00 0.00 0.00 173.10 172.02 1ok4 s TYR 111 N -1.17 -0.84 -0.10 1.90 5.04 -0.61 -0.87 117.35 120.71 1ok4 s TYR 111 Ca 0.06 1.69 -0.18 0.00 -2.44 0.00 0.00 57.07 56.20 1ok4 s TYR 111 Cb -0.10 0.44 -0.04 0.00 0.35 0.00 0.00 41.96 42.61 1ok4 s TYR 111 CO 0.04 -0.44 0.49 0.99 -1.34 0.00 0.00 175.55 175.28 1ok4 s THR 112 N 1.65 5.15 0.06 4.34 2.01 -1.26 -1.46 115.64 126.12 1ok4 s THR 112 Ca -0.09 0.98 0.06 0.00 0.31 0.00 0.00 61.69 62.95 1ok4 s THR 112 Cb -0.07 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1ok4 s THR 112 CO -0.16 0.35 -0.12 0.27 -0.69 0.00 0.00 174.62 174.27 1ok4 s ILE 113 N 0.44 3.21 -0.75 1.82 -4.36 -0.61 -4.83 121.20 116.12 1ok4 s ILE 113 Ca 0.26 -1.12 0.03 0.00 -0.26 0.00 0.00 60.65 59.57 1ok4 s ILE 113 Cb -0.16 -2.42 0.20 0.00 1.25 0.00 0.00 42.46 41.33 1ok4 s ILE 113 CO 0.11 0.27 0.64 -1.22 0.24 0.00 0.00 174.94 174.97 1ok4 n TYR 114 N 1.23 3.54 -1.62 1.37 4.01 -1.26 -1.81 117.16 122.63 1ok4 n TYR 114 Ca -0.15 -4.20 -0.47 0.00 -0.16 0.00 0.00 57.90 52.92 1ok4 n TYR 114 Cb 0.52 -0.76 -0.03 0.00 -0.31 0.00 0.00 39.34 38.76 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 1.83 1.59 0.00 -0.72 -0.02 -1.26 -1.88 135.00 134.53 1ok4 n PRO 115 Ca 0.22 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1ok4 n PRO 115 Cb 0.36 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 2.11 3.06 3.64 -1.23 0.00 -1.26 -1.84 105.19 109.67 1ok4 n GLY 116 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 0.07 1.38 0.13 1.61 2.88 -0.52 -2.40 113.62 116.77 1ok4 n SER 117 Ca 0.00 0.91 0.19 0.00 -1.33 0.00 0.00 58.87 58.65 1ok4 n SER 117 Cb 0.00 -1.43 0.76 0.00 -0.75 0.00 0.00 64.21 62.80 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 1.03 0.00 -2.94 0.46 0.00 -1.86 -0.50 103.07 99.24 1ok4 h GLY 118 Ca -0.48 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.73 1ok4 h GLY 118 CO 0.54 0.00 0.12 0.69 0.00 0.00 0.00 176.54 177.89 1ok4 n PHE 119 N -3.65 1.86 -0.31 5.60 0.99 -1.26 -4.67 117.46 116.01 1ok4 n PHE 119 Ca 0.06 -1.09 0.07 0.00 -0.00 0.00 0.00 57.45 56.49 1ok4 n PHE 119 Cb 0.56 -0.54 0.27 0.00 -1.00 0.00 0.00 39.48 38.77 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 2.49 0.92 -0.50 -1.08 4.11 -1.32 -1.46 114.58 117.74 1ok4 h GLU 120 Ca 0.15 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.52 1ok4 h GLU 120 Cb 1.98 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 31.00 1ok4 h GLU 120 CO 0.53 0.61 0.30 0.11 0.07 0.00 0.00 179.01 180.63 1ok4 h TRP 121 N 0.94 0.64 -0.61 2.06 5.08 -1.83 -1.54 115.95 120.69 1ok4 h TRP 121 Ca 0.44 0.01 -0.09 0.00 1.08 0.00 0.00 58.89 60.32 1ok4 h TRP 121 Cb 0.40 -0.21 -0.02 0.00 -3.00 0.00 0.00 29.16 26.33 1ok4 h TRP 121 CO -0.00 0.43 0.05 -0.22 -1.28 0.00 0.00 178.44 177.41 1ok4 h LYS 122 N 0.68 1.05 -0.05 0.12 3.64 -1.62 -1.10 116.57 119.28 1ok4 h LYS 122 Ca 0.18 -0.31 -0.19 0.00 -1.27 0.00 0.00 60.65 59.06 1ok4 h LYS 122 Cb -0.03 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1ok4 h LYS 122 CO -0.03 1.00 -0.78 0.52 -2.27 0.00 0.00 179.45 177.89 1ok4 h MET 123 N 0.95 0.37 -0.54 1.90 2.86 -1.45 -2.21 114.93 116.81 1ok4 h MET 123 Ca 0.18 -0.33 -0.10 0.00 -2.06 0.00 0.00 59.70 57.39 1ok4 h MET 123 Cb 0.50 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 1ok4 h MET 123 CO 0.02 0.98 -0.06 0.74 1.06 0.00 0.00 176.91 179.66 1ok4 h PHE 124 N 0.24 1.11 -0.27 -0.22 0.04 -1.15 0.12 116.94 116.81 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 1.36 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 39.22 1ok4 h PHE 124 CO 0.04 1.02 0.17 1.49 -0.60 0.00 0.00 178.31 180.43 1ok4 h GLU 125 N 0.88 0.36 -0.31 1.51 4.81 -1.19 -1.39 114.58 119.25 1ok4 h GLU 125 Ca 0.15 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.18 1ok4 h GLU 125 Cb 0.62 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 1ok4 h GLU 125 CO 0.04 0.27 -0.48 1.49 -0.73 0.00 0.00 179.01 179.60 1ok4 h GLU 126 N 0.35 0.84 -0.66 1.92 4.81 -1.31 -2.96 114.58 117.57 1ok4 h GLU 126 Ca 0.10 -0.49 0.04 0.00 -0.13 0.00 0.00 59.36 58.88 1ok4 h GLU 126 Cb -0.00 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 1ok4 h GLU 126 CO -0.02 1.13 0.43 1.25 -0.73 0.00 0.00 179.01 181.07 1ok4 h LEU 127 N 0.66 0.65 -0.74 1.64 5.85 -0.56 -1.55 115.31 121.27 1ok4 h LEU 127 Ca 0.03 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.82 1ok4 h LEU 127 Cb 1.07 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1ok4 h LEU 127 CO 0.11 0.44 0.42 0.00 -0.34 0.00 0.00 178.44 179.07 1ok4 h ALA 128 N 1.63 1.01 -0.32 1.25 0.00 -1.08 0.24 119.26 121.99 1ok4 h ALA 128 Ca 0.27 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 1ok4 h ALA 128 Cb 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ok4 h ALA 128 CO -0.08 0.09 -0.24 0.00 0.00 0.00 0.00 179.25 179.03 1ok4 h ARG 129 N 0.75 0.73 -0.54 0.00 3.08 -1.33 -2.37 114.38 114.70 1ok4 h ARG 129 Ca 0.34 -0.35 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 1ok4 h ARG 129 Cb 0.23 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1ok4 h ARG 129 CO -0.20 0.97 0.18 0.82 -1.07 0.00 0.00 179.97 180.67 1ok4 h ILE 130 N 0.49 1.23 -0.01 2.04 2.04 -0.98 -1.71 117.51 120.60 1ok4 h ILE 130 Ca 0.06 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1ok4 h ILE 130 Cb 0.79 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1ok4 h ILE 130 CO 0.06 0.28 0.01 0.50 0.00 0.00 0.00 178.15 179.01 1ok4 h LYS 131 N 0.74 0.02 -0.70 2.37 1.63 -0.55 0.21 116.57 120.30 1ok4 h LYS 131 Ca 0.18 -0.00 0.08 0.00 -0.85 0.00 0.00 60.65 60.05 1ok4 h LYS 131 Cb 0.25 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.82 1ok4 h LYS 131 CO -0.01 0.01 0.37 -0.09 -3.45 0.00 0.00 179.45 176.28 1ok4 h ARG 132 N 0.02 0.64 -0.35 1.90 2.43 -1.29 -1.81 114.38 115.91 1ok4 h ARG 132 Ca 0.01 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 1ok4 h ARG 132 Cb -0.00 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1ok4 h ARG 132 CO -0.00 0.42 -0.26 -0.44 -1.51 0.00 0.00 179.97 178.18 1ok4 h ASP 133 N 0.65 0.73 -0.81 -3.80 3.32 -0.88 -2.07 116.42 113.57 1ok4 h ASP 133 Ca 0.33 -0.27 0.03 0.00 0.02 0.00 0.00 57.03 57.13 1ok4 h ASP 133 Cb 0.28 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 1ok4 h ASP 133 CO -0.22 0.96 0.52 0.00 -1.72 0.00 0.00 179.24 178.77 1ok4 h ALA 134 N 1.09 1.06 -0.31 3.45 0.00 -0.05 0.31 119.26 124.81 1ok4 h ALA 134 Ca 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ok4 h ALA 134 Cb 0.76 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ok4 h ALA 134 CO 0.06 0.35 0.09 0.28 0.00 0.00 0.00 179.25 180.03 1ok4 h VAL 135 N 1.02 1.21 -0.75 0.00 2.07 -1.20 0.11 116.25 118.70 1ok4 h VAL 135 Ca 0.32 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 1ok4 h VAL 135 Cb -0.00 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1ok4 h VAL 135 CO -0.11 0.23 0.33 0.50 0.02 0.00 0.00 177.57 178.54 1ok4 h LYS 136 N 0.34 1.09 -0.15 1.57 3.64 -0.84 -2.22 116.57 120.01 1ok4 h LYS 136 Ca 0.10 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1ok4 h LYS 136 Cb 0.26 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1ok4 h LYS 136 CO -0.00 0.87 0.00 1.19 -2.27 0.00 0.00 179.45 179.23 1ok4 n PHE 137 N -4.30 0.17 -3.68 1.91 3.72 0.05 -4.96 117.46 110.37 1ok4 n PHE 137 Ca 0.07 -0.09 -0.24 0.00 -0.05 0.00 0.00 57.45 57.14 1ok4 n PHE 137 Cb 0.16 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.76 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 0.78 -4.20 -4.33 4.37 2.03 0.18 -5.00 116.55 110.39 1ok4 n ASP 138 Ca 0.17 -0.67 -0.34 0.00 0.52 0.00 0.00 54.79 54.47 1ok4 n ASP 138 Cb 0.46 -4.56 -0.14 0.00 -0.72 0.00 0.00 41.12 36.16 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 -7.01 2.79 0.44 -2.67 1.02 -0.09 -5.03 118.68 108.12 1ok4 s LEU 139 Ca 0.39 -0.37 -0.25 0.00 0.02 0.00 0.00 54.13 53.92 1ok4 s LEU 139 Cb -0.19 -1.68 -0.09 0.00 0.02 0.00 0.00 46.19 44.25 1ok4 s LEU 139 CO 0.77 0.06 1.21 -2.65 0.02 0.00 0.00 176.35 175.76 1ok4 n PRO 140 N 4.27 1.75 -3.69 1.29 -0.02 -1.26 -4.51 135.00 132.82 1ok4 n PRO 140 Ca -0.18 0.62 -0.37 0.00 -2.02 0.00 0.00 63.50 61.55 1ok4 n PRO 140 Cb 0.51 -2.31 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.57 3.71 -0.26 2.45 2.96 -1.26 -1.20 118.68 123.51 1ok4 s LEU 141 Ca 0.63 -0.19 -0.07 0.00 -0.22 0.00 0.00 54.13 54.27 1ok4 s LEU 141 Cb -0.51 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.16 1ok4 s LEU 141 CO 0.57 -0.06 0.08 -0.69 -1.32 0.00 0.00 176.35 174.92 1ok4 s VAL 142 N 1.66 4.33 -0.23 1.68 1.01 0.38 -0.62 120.40 128.60 1ok4 s VAL 142 Ca 0.06 -0.21 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 1ok4 s VAL 142 Cb -0.16 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 1ok4 s VAL 142 CO 0.06 0.31 0.10 -0.69 0.00 0.00 0.00 175.10 174.88 1ok4 s VAL 143 N 1.61 4.85 -0.54 2.92 1.01 -0.62 -1.57 120.40 128.06 1ok4 s VAL 143 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 1ok4 s VAL 143 Cb -0.15 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.01 1ok4 s VAL 143 CO 0.04 0.37 1.08 0.26 0.00 0.00 0.00 175.10 176.85 1ok4 s TRP 144 N 1.07 2.73 -0.53 5.22 0.23 -0.54 -0.82 118.94 126.30 1ok4 s TRP 144 Ca 0.05 0.36 -0.13 0.00 -2.03 0.00 0.00 56.10 54.35 1ok4 s TRP 144 Cb -0.14 -4.32 0.13 0.00 0.03 0.00 0.00 33.47 29.17 1ok4 s TRP 144 CO 0.04 -1.41 0.45 0.45 0.96 0.00 0.00 176.95 177.44 1ok4 s SER 145 N 2.74 6.01 -0.62 2.95 0.15 -0.26 -1.57 113.70 123.11 1ok4 s SER 145 Ca 0.40 -1.90 0.04 0.00 0.70 0.00 0.00 55.95 55.19 1ok4 s SER 145 Cb -0.09 -2.13 0.16 0.00 -1.71 0.00 0.00 66.02 62.25 1ok4 s SER 145 CO 0.25 -0.77 0.42 -0.31 1.20 0.00 0.00 173.24 174.03 1ok4 s TYR 146 N 1.41 3.06 0.16 3.44 2.02 -0.75 -4.65 117.35 122.03 1ok4 s TYR 146 Ca 0.05 -3.11 -0.34 0.00 -0.37 0.00 0.00 57.07 53.30 1ok4 s TYR 146 Cb -0.27 -2.42 -0.15 0.00 -0.40 0.00 0.00 41.96 38.71 1ok4 s TYR 146 CO 0.01 -0.63 1.41 -2.30 -1.57 0.00 0.00 175.55 172.47 1ok4 n PRO 147 N 2.38 1.68 -3.62 -1.71 -0.02 -1.26 -4.14 135.00 128.30 1ok4 n PRO 147 Ca 0.18 0.60 -0.11 0.00 -2.02 0.00 0.00 63.50 62.15 1ok4 n PRO 147 Cb 0.36 -2.27 -0.07 0.00 -0.02 0.00 0.00 33.50 31.50 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 0.32 0.63 0.39 -0.52 3.52 -0.77 -4.85 118.95 117.68 1ok4 s ARG 148 Ca 0.77 0.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.02 1ok4 s ARG 148 Cb -0.78 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 32.91 1ok4 s ARG 148 CO 0.45 -0.09 0.00 0.41 -0.81 0.00 0.00 175.30 175.26 1ok4 n GLY 149 N 2.14 -2.30 7.00 8.12 0.00 -1.26 -1.43 105.19 117.46 1ok4 n GLY 149 Ca -0.13 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.51 3.44 0.28 -0.02 0.00 -1.01 -1.83 105.19 105.53 1ok4 n GLY 150 Ca 0.00 -0.03 0.14 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 1.26 -2.41 1.61 5.02 -1.26 -4.88 118.16 131.49 1ok4 n LYS 151 Ca 0.00 -0.56 -0.42 0.00 -2.02 0.00 0.00 58.31 55.31 1ok4 n LYS 151 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.49 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 -2.13 4.08 0.00 -0.18 1.01 -0.76 -4.92 120.40 117.50 1ok4 s VAL 152 Ca 0.38 1.46 -0.01 0.00 0.00 0.00 0.00 61.98 63.80 1ok4 s VAL 152 Cb 0.21 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.65 1ok4 s VAL 152 CO 0.38 0.04 -0.01 1.33 0.00 0.00 0.00 175.10 176.84 1ok4 n VAL 153 N 4.35 0.21 -3.42 2.92 0.24 -1.26 -4.44 118.33 116.93 1ok4 n VAL 153 Ca 0.10 0.16 -0.40 0.00 -2.04 0.00 0.00 64.34 62.16 1ok4 n VAL 153 Cb 0.46 -1.23 -0.09 0.00 -1.47 0.00 0.00 33.84 31.50 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 -4.94 6.17 0.23 -1.34 0.01 -1.26 -4.94 114.94 108.87 1ok4 s ASN 154 Ca -0.01 -0.15 0.24 0.00 -0.71 0.00 0.00 52.86 52.23 1ok4 s ASN 154 Cb 0.00 -2.19 0.93 0.00 0.41 0.00 0.00 41.25 40.40 1ok4 s ASN 154 CO 0.02 -0.29 1.72 -0.62 -1.51 0.00 0.00 177.10 176.42 1ok4 n GLU 155 N 5.34 0.20 -0.18 -0.60 1.02 -1.26 -2.76 120.64 122.40 1ok4 n GLU 155 Ca -0.09 0.35 0.11 0.00 -0.02 0.00 0.00 57.16 57.51 1ok4 n GLU 155 Cb 0.50 -1.83 0.20 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 -2.20 0.54 -1.80 2.62 -2.24 -1.26 -4.41 114.28 105.53 1ok4 n THR 156 Ca 0.03 -0.77 -0.41 0.00 -2.27 0.00 0.00 64.05 60.63 1ok4 n THR 156 Cb 0.28 0.93 -0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1ok4 n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ok4 s ALA 157 N -1.35 3.59 0.26 6.98 0.00 -1.11 -4.43 121.76 125.70 1ok4 s ALA 157 Ca 0.35 1.58 -0.02 0.00 0.00 0.00 0.00 51.96 53.87 1ok4 s ALA 157 Cb 0.21 -3.61 0.57 0.00 0.00 0.00 0.00 23.12 20.28 1ok4 s ALA 157 CO 0.29 -1.05 1.67 -1.35 0.00 0.00 0.00 175.76 175.31 1ok4 h PRO 158 N 3.18 0.25 0.00 0.00 0.11 -1.93 -1.59 132.00 132.03 1ok4 h PRO 158 Ca -0.50 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.49 1ok4 h PRO 158 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1ok4 h PRO 158 CO 0.66 0.17 -0.48 1.05 -0.21 0.00 0.00 178.00 179.18 1ok4 h GLU 159 N 0.26 0.00 -0.01 1.05 9.09 -1.96 -1.97 114.58 121.04 1ok4 h GLU 159 Ca 0.48 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.69 1ok4 h GLU 159 Cb 0.88 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.99 1ok4 h GLU 159 CO -0.57 0.48 -0.75 0.82 0.05 0.00 0.00 179.01 179.04 1ok4 h ILE 160 N 0.00 1.37 -0.57 -1.06 1.08 -1.66 -2.10 117.51 114.56 1ok4 h ILE 160 Ca -0.00 -2.11 -0.11 0.00 -0.39 0.00 0.00 64.86 62.25 1ok4 h ILE 160 Cb 0.99 2.47 -0.02 0.00 -3.07 0.00 0.00 36.82 37.19 1ok4 h ILE 160 CO 0.06 0.63 -0.06 0.58 -0.69 0.00 0.00 178.15 178.68 1ok4 h VAL 161 N 0.11 1.27 -0.67 1.67 2.07 -1.32 0.29 116.25 119.67 1ok4 h VAL 161 Ca -0.09 -1.21 -0.08 0.00 0.82 0.00 0.00 66.70 66.14 1ok4 h VAL 161 Cb 1.44 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1ok4 h VAL 161 CO 0.15 0.43 0.12 0.00 0.02 0.00 0.00 177.57 178.29 1ok4 h ALA 162 N 0.99 0.89 -0.65 1.67 0.00 -1.42 -1.45 119.26 119.29 1ok4 h ALA 162 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ok4 h ALA 162 Cb 0.62 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1ok4 h ALA 162 CO 0.04 0.64 0.41 -0.92 0.00 0.00 0.00 179.25 179.42 1ok4 h TYR 163 N 1.02 0.83 -0.43 0.00 -0.00 -1.03 -1.28 116.97 116.08 1ok4 h TYR 163 Ca 0.21 0.01 0.04 0.00 -0.00 0.00 0.00 58.73 58.99 1ok4 h TYR 163 Cb 0.42 -0.28 -0.04 0.00 -0.00 0.00 0.00 36.73 36.83 1ok4 h TYR 163 CO 0.03 0.55 0.19 0.00 -0.00 0.00 0.00 178.16 178.93 1ok4 h ALA 164 N 1.22 0.53 -0.37 1.82 0.00 -0.50 -0.67 119.26 121.29 1ok4 h ALA 164 Ca 0.23 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1ok4 h ALA 164 Cb -0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1ok4 h ALA 164 CO -0.05 -0.18 0.11 0.00 0.00 0.00 0.00 179.25 179.14 1ok4 h ALA 165 N 1.25 0.49 -0.63 0.00 0.00 -1.00 -2.49 119.26 116.88 1ok4 h ALA 165 Ca 0.19 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1ok4 h ALA 165 Cb 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1ok4 h ALA 165 CO -0.16 0.14 0.18 -0.09 0.00 0.00 0.00 179.25 179.32 1ok4 h ARG 166 N 0.46 0.99 -0.83 0.00 9.65 -0.91 -2.66 114.38 121.08 1ok4 h ARG 166 Ca 0.12 -0.22 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 1ok4 h ARG 166 Cb 0.26 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 1ok4 h ARG 166 CO -0.00 0.88 0.45 0.82 2.80 0.00 0.00 179.97 184.92 1ok4 h ILE 167 N 0.91 1.24 -0.47 1.20 2.04 -0.98 -0.57 117.51 120.89 1ok4 h ILE 167 Ca 0.20 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 1ok4 h ILE 167 Cb 0.32 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1ok4 h ILE 167 CO -0.00 0.27 0.29 0.00 0.00 0.00 0.00 178.15 178.71 1ok4 h ALA 168 N 1.24 0.60 -0.21 1.87 0.00 -1.31 -1.04 119.26 120.42 1ok4 h ALA 168 Ca 0.29 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1ok4 h ALA 168 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1ok4 h ALA 168 CO -0.05 0.08 0.11 1.25 0.00 0.00 0.00 179.25 180.64 1ok4 h LEU 169 N 0.63 0.17 -1.28 0.00 5.85 -1.08 -1.28 115.31 118.32 1ok4 h LEU 169 Ca 0.17 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1ok4 h LEU 169 Cb -0.03 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1ok4 h LEU 169 CO -0.03 0.13 -0.08 -0.33 -0.34 0.00 0.00 178.44 177.78 1ok4 h GLU 170 N 0.23 0.38 -0.00 1.25 4.39 -0.74 -2.58 114.58 117.52 1ok4 h GLU 170 Ca 0.08 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1ok4 h GLU 170 Cb 0.01 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1ok4 h GLU 170 CO -0.05 0.48 -0.15 1.28 -1.16 0.00 0.00 179.01 179.42 1ok4 n LEU 171 N -4.26 0.64 0.00 1.33 4.77 -0.43 -4.92 117.00 114.13 1ok4 n LEU 171 Ca 0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1ok4 n LEU 171 Cb 0.27 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1ok4 n LEU 171 CO 0.39 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1ok4 n GLY 172 N 1.29 1.23 3.67 -0.72 0.00 -0.97 -4.98 105.19 104.71 1ok4 n GLY 172 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.15 0.85 0.06 4.61 0.00 -0.51 -4.90 120.51 119.47 1ok4 n ALA 173 Ca 0.00 0.38 0.08 0.00 0.00 0.00 0.00 53.44 53.89 1ok4 n ALA 173 Cb 0.00 -2.19 -0.06 0.00 0.00 0.00 0.00 19.45 17.20 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 1.05 0.67 -3.71 0.00 8.00 0.21 -4.78 116.55 117.98 1ok4 n ASP 174 Ca 0.07 0.27 -0.10 0.00 0.71 0.00 0.00 54.79 55.74 1ok4 n ASP 174 Cb 0.34 0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 42.08 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 -3.25 -0.83 0.04 2.24 0.00 -1.09 -4.33 121.76 114.54 1ok4 s ALA 175 Ca -0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 1ok4 s ALA 175 Cb 0.10 0.78 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 1ok4 s ALA 175 CO 0.82 -0.71 0.02 0.00 0.00 0.00 0.00 175.76 175.89 1ok4 s MET 176 N -3.85 0.57 -0.14 0.00 0.23 -0.55 -1.59 119.30 113.96 1ok4 s MET 176 Ca 0.07 -0.96 0.01 0.00 -1.03 0.00 0.00 55.69 53.78 1ok4 s MET 176 Cb 0.01 0.21 0.02 0.00 -1.53 0.00 0.00 34.83 33.53 1ok4 s MET 176 CO -0.07 -0.12 -0.17 0.21 -2.03 0.00 0.00 175.02 172.85 1ok4 s LYS 177 N -3.10 2.49 0.16 3.16 2.20 -0.00 -0.17 119.74 124.47 1ok4 s LYS 177 Ca -0.01 -0.65 0.01 0.00 -0.36 0.00 0.00 55.97 54.97 1ok4 s LYS 177 Cb 0.02 -2.16 -0.05 0.00 -1.51 0.00 0.00 37.83 34.13 1ok4 s LYS 177 CO -0.07 -0.14 0.00 0.96 -0.36 0.00 0.00 175.35 175.74 1ok4 s ILE 178 N 1.20 0.61 0.39 5.43 -4.36 -0.76 -1.11 121.20 122.61 1ok4 s ILE 178 Ca -0.00 -1.97 -0.24 0.00 -0.26 0.00 0.00 60.65 58.18 1ok4 s ILE 178 Cb -0.14 -2.08 -0.10 0.00 1.25 0.00 0.00 42.46 41.40 1ok4 s ILE 178 CO -0.07 -0.51 0.99 -0.54 0.24 0.00 0.00 174.94 175.06 1ok4 s LYS 179 N -3.92 4.28 0.28 0.37 1.02 -1.26 -0.86 119.74 119.64 1ok4 s LYS 179 Ca 0.23 1.35 -0.29 0.00 0.02 0.00 0.00 55.97 57.27 1ok4 s LYS 179 Cb 0.06 -2.50 -0.09 0.00 -0.52 0.00 0.00 37.83 34.78 1ok4 s LYS 179 CO 0.03 -0.01 1.07 -0.47 -0.92 0.00 0.00 175.35 175.05 1ok4 s TYR 180 N -1.80 3.64 -0.57 3.18 5.04 -1.26 -4.89 117.35 120.69 1ok4 s TYR 180 Ca 0.57 1.74 0.25 0.00 -2.44 0.00 0.00 57.07 57.19 1ok4 s TYR 180 Cb -0.17 -3.23 0.73 0.00 0.35 0.00 0.00 41.96 39.63 1ok4 s TYR 180 CO 0.22 -0.38 1.73 1.79 -1.34 0.00 0.00 175.55 177.58 1ok4 h THR 181 N 3.08 0.00 0.00 4.34 1.35 -1.95 -3.45 112.91 116.28 1ok4 h THR 181 Ca -0.46 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1ok4 h THR 181 Cb 1.21 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 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 1.03 0.16 3.34 5.82 0.00 -1.26 -4.89 105.19 109.39 1ok4 n GLY 182 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.27 -0.38 0.43 1.61 -4.77 -1.26 -5.07 116.67 104.96 1ok4 s ASP 183 Ca 0.00 0.50 0.12 0.00 -3.30 0.00 0.00 52.55 49.86 1ok4 s ASP 183 Cb 0.00 0.57 0.94 0.00 -1.09 0.00 0.00 42.92 43.34 1ok4 s ASP 183 CO 0.00 -0.39 2.00 1.55 0.70 0.00 0.00 175.17 179.03 1ok4 h PRO 184 N 4.19 0.18 0.10 2.11 0.13 -1.97 -2.37 132.00 134.37 1ok4 h PRO 184 Ca -0.28 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1ok4 h PRO 184 Cb 1.17 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1ok4 h PRO 184 CO 0.34 0.25 -0.05 -0.22 -0.23 0.00 0.00 178.00 178.09 1ok4 h LYS 185 N 0.18 -0.13 -0.32 0.86 3.64 -1.97 -1.38 116.57 117.46 1ok4 h LYS 185 Ca 0.04 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1ok4 h LYS 185 Cb 0.22 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1ok4 h LYS 185 CO 0.01 0.18 -0.30 1.79 -2.27 0.00 0.00 179.45 178.86 1ok4 h THR 186 N -0.44 1.28 -0.10 1.00 1.35 -1.98 -2.81 112.91 111.21 1ok4 h THR 186 Ca -0.01 -1.41 -0.08 0.00 -0.55 0.00 0.00 66.41 64.36 1ok4 h THR 186 Cb 0.37 1.35 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 1ok4 h THR 186 CO 0.02 0.46 -0.28 0.15 -0.25 0.00 0.00 175.52 175.62 1ok4 h PHE 187 N 0.57 0.19 0.00 4.73 3.57 -1.40 -2.67 116.94 121.93 1ok4 h PHE 187 Ca 0.07 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 1ok4 h PHE 187 Cb 0.79 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1ok4 h PHE 187 CO 0.04 0.45 -0.27 0.66 -2.23 0.00 0.00 178.31 176.96 1ok4 h SER 188 N 0.16 0.00 -0.52 0.41 4.64 -0.97 -1.69 113.55 115.57 1ok4 h SER 188 Ca 0.02 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 1ok4 h SER 188 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 1ok4 h SER 188 CO 0.04 0.27 0.16 -0.25 -0.87 0.00 0.00 176.83 176.18 1ok4 h TRP 189 N 0.00 0.84 -0.51 4.77 -0.00 -1.46 -0.47 115.95 119.13 1ok4 h TRP 189 Ca -0.00 -0.09 -0.01 0.00 -0.00 0.00 0.00 58.89 58.79 1ok4 h TRP 189 Cb 0.62 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.16 29.51 1ok4 h TRP 189 CO 0.00 0.72 0.28 0.00 -0.00 0.00 0.00 178.44 179.44 1ok4 h ALA 190 N 1.03 0.65 -0.93 2.65 0.00 -1.37 -1.32 119.26 119.97 1ok4 h ALA 190 Ca 0.17 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ok4 h ALA 190 Cb 0.28 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1ok4 h ALA 190 CO -0.01 0.17 0.58 0.28 0.00 0.00 0.00 179.25 180.27 1ok4 h VAL 191 N 0.68 1.25 -0.39 0.00 2.07 -1.20 -2.42 116.25 116.23 1ok4 h VAL 191 Ca 0.18 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 67.09 1ok4 h VAL 191 Cb 0.04 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.73 1ok4 h VAL 191 CO -0.03 0.26 -0.07 0.50 0.02 0.00 0.00 177.57 178.25 1ok4 h LYS 192 N 1.28 0.74 0.00 1.57 3.64 -0.67 -3.06 116.57 120.07 1ok4 h LYS 192 Ca 0.34 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1ok4 h LYS 192 Cb -0.08 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1ok4 h LYS 192 CO -0.07 0.87 0.00 -0.39 -2.27 0.00 0.00 179.45 177.59 1ok4 h VAL 193 N 0.55 0.00 0.00 2.00 -1.51 -1.02 -1.90 116.25 114.36 1ok4 h VAL 193 Ca 0.10 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 1ok4 h VAL 193 Cb 0.58 1.45 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 1ok4 h VAL 193 CO 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.37 1ok4 h ALA 194 N 2.14 1.00 -0.92 5.19 0.00 -1.33 -3.42 119.26 121.93 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 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 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 0.30 3.86 0.00 0.00 0.00 -0.72 -1.64 105.19 107.00 1ok4 n GLY 195 Ca 0.03 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.21 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 0.44 -3.25 1.61 5.02 -1.26 -4.72 118.16 130.00 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 -2.45 5.09 0.50 -0.18 1.01 -0.65 -5.05 120.40 118.66 1ok4 s VAL 197 Ca 0.26 0.88 -0.22 0.00 0.00 0.00 0.00 61.98 62.91 1ok4 s VAL 197 Cb 0.17 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 1ok4 s VAL 197 CO 0.36 0.12 1.22 -2.16 0.00 0.00 0.00 175.10 174.64 1ok4 s PRO 198 N 2.05 3.51 -0.16 2.72 0.04 -1.26 -4.83 135.00 137.07 1ok4 s PRO 198 Ca 0.22 1.89 -0.01 0.00 0.04 0.00 0.00 61.00 63.13 1ok4 s PRO 198 Cb -0.15 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.07 1ok4 s PRO 198 CO 0.09 -0.79 -0.10 0.08 0.04 0.00 0.00 177.00 176.32 1ok4 s VAL 199 N -1.50 3.13 -0.15 -0.36 1.01 -1.26 -1.48 120.40 119.79 1ok4 s VAL 199 Ca 0.67 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.99 1ok4 s VAL 199 Cb -0.32 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 1ok4 s VAL 199 CO 0.38 0.49 0.01 -0.76 0.00 0.00 0.00 175.10 175.22 1ok4 s LEU 200 N 0.76 3.58 0.04 3.92 1.43 0.76 -1.05 118.68 128.11 1ok4 s LEU 200 Ca -0.04 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 52.79 1ok4 s LEU 200 Cb -0.15 -1.87 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 1ok4 s LEU 200 CO 0.01 0.23 1.10 -0.32 0.23 0.00 0.00 176.35 177.61 1ok4 s MET 201 N -0.01 4.50 0.07 1.70 -2.45 -0.21 -1.82 119.30 121.07 1ok4 s MET 201 Ca 0.04 1.61 -0.31 0.00 -1.25 0.00 0.00 55.69 55.78 1ok4 s MET 201 Cb -0.13 -3.39 -0.06 0.00 1.25 0.00 0.00 34.83 32.50 1ok4 s MET 201 CO 0.02 -0.15 1.29 0.45 1.05 0.00 0.00 175.02 177.68 1ok4 s SER 202 N 0.99 6.96 0.23 1.11 0.15 -0.04 -0.61 113.70 122.49 1ok4 s SER 202 Ca 0.55 2.14 -0.06 0.00 0.70 0.00 0.00 55.95 59.28 1ok4 s SER 202 Cb -0.26 -2.58 0.22 0.00 -1.71 0.00 0.00 66.02 61.70 1ok4 s SER 202 CO 0.29 -0.57 1.77 1.23 1.20 0.00 0.00 173.24 177.15 1ok4 h GLY 203 N 7.02 1.13 0.00 9.45 0.00 -1.74 -3.40 103.07 115.53 1ok4 h GLY 203 Ca -0.41 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.25 1ok4 h GLY 203 CO 0.84 0.63 0.00 0.61 0.00 0.00 0.00 176.54 178.62 1ok4 n GLY 204 N -0.78 -2.21 3.69 4.60 0.00 -1.26 -4.91 105.19 104.32 1ok4 n GLY 204 Ca 0.05 -1.50 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.51 1.25 -1.67 1.61 -0.02 -1.26 -4.36 135.00 130.04 1ok4 n PRO 205 Ca 0.00 0.47 -0.49 0.00 -2.02 0.00 0.00 63.50 61.46 1ok4 n PRO 205 Cb 0.00 -2.39 -0.05 0.00 -0.02 0.00 0.00 33.50 31.04 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 -1.17 1.91 -1.67 -0.52 4.81 -1.26 -4.84 118.16 115.42 1ok4 n LYS 206 Ca 0.13 0.69 -0.31 0.00 -0.87 0.00 0.00 58.31 57.96 1ok4 n LYS 206 Cb 0.46 -2.46 0.05 0.00 0.02 0.00 0.00 35.03 33.10 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 2.27 3.82 0.18 3.15 -4.23 -1.26 -4.97 115.64 114.60 1ok4 s THR 207 Ca 0.87 0.59 -0.12 0.00 -1.18 0.00 0.00 61.69 61.85 1ok4 s THR 207 Cb -0.77 -3.42 0.09 0.00 1.34 0.00 0.00 72.50 69.75 1ok4 s THR 207 CO 0.47 -0.77 1.78 0.11 -0.54 0.00 0.00 174.62 175.67 1ok4 h LYS 208 N -0.73 0.88 -5.82 3.99 1.57 -2.00 -3.43 116.57 111.03 1ok4 h LYS 208 Ca -0.45 -0.12 -0.51 0.00 -1.87 0.00 0.00 60.65 57.71 1ok4 h LYS 208 Cb 1.23 -0.17 -0.15 0.00 0.08 0.00 0.00 32.23 33.22 1ok4 h LYS 208 CO 0.59 0.69 -0.75 0.95 -0.57 0.00 0.00 179.45 180.36 1ok4 s THR 209 N -5.77 1.96 0.21 -0.16 -4.23 -1.26 -5.04 115.64 101.36 1ok4 s THR 209 Ca -0.13 -2.22 -0.08 0.00 -1.18 0.00 0.00 61.69 58.08 1ok4 s THR 209 Cb 0.13 -2.08 0.16 0.00 1.34 0.00 0.00 72.50 72.05 1ok4 s THR 209 CO 0.78 -0.49 1.80 -0.33 -0.54 0.00 0.00 174.62 175.84 1ok4 h GLU 210 N 2.60 1.17 -0.73 3.99 5.08 -2.00 -2.87 114.58 121.82 1ok4 h GLU 210 Ca -0.39 -0.18 0.04 0.00 -1.00 0.00 0.00 59.36 57.82 1ok4 h GLU 210 Cb 1.23 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 1ok4 h GLU 210 CO 0.59 0.91 0.48 1.49 -1.00 0.00 0.00 179.01 181.49 1ok4 h GLU 211 N 1.15 0.86 -0.14 2.33 4.57 -1.98 -1.60 114.58 119.76 1ok4 h GLU 211 Ca 0.27 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1ok4 h GLU 211 Cb 0.14 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 1ok4 h GLU 211 CO -0.03 0.57 0.08 -0.44 -1.18 0.00 0.00 179.01 178.01 1ok4 h ASP 212 N 0.88 0.17 -0.39 1.04 3.32 -1.92 -1.16 116.42 118.37 1ok4 h ASP 212 Ca 0.29 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.26 1ok4 h ASP 212 Cb 0.07 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1ok4 h ASP 212 CO -0.08 0.18 0.13 0.15 -1.72 0.00 0.00 179.24 177.89 1ok4 h PHE 213 N 0.15 0.61 -0.93 4.55 3.57 -1.47 -1.70 116.94 121.72 1ok4 h PHE 213 Ca 0.05 -0.06 0.10 0.00 3.53 0.00 0.00 57.97 61.60 1ok4 h PHE 213 Cb 0.04 -0.18 -0.07 0.00 2.79 0.00 0.00 35.95 38.53 1ok4 h PHE 213 CO -0.05 0.57 0.60 -0.07 -2.23 0.00 0.00 178.31 177.12 1ok4 h LEU 214 N 0.48 0.85 -0.59 0.59 3.38 -1.17 -0.40 115.31 118.45 1ok4 h LEU 214 Ca 0.13 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 1ok4 h LEU 214 Cb 0.24 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1ok4 h LEU 214 CO -0.01 0.48 0.14 0.11 0.09 0.00 0.00 178.44 179.26 1ok4 h LYS 215 N 0.93 0.95 -0.48 1.13 1.57 -0.82 -1.47 116.57 118.38 1ok4 h LYS 215 Ca 0.44 -0.23 0.03 0.00 -1.87 0.00 0.00 60.65 59.02 1ok4 h LYS 215 Cb 0.43 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 1ok4 h LYS 215 CO -0.20 0.88 0.26 1.96 -0.57 0.00 0.00 179.45 181.78 1ok4 h GLN 216 N 0.86 0.51 -0.60 3.15 4.20 -0.41 -1.81 115.11 121.01 1ok4 h GLN 216 Ca 0.19 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 1ok4 h GLN 216 Cb 0.35 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1ok4 h GLN 216 CO 0.00 0.33 0.28 0.28 -0.67 0.00 0.00 178.83 179.06 1ok4 h VAL 217 N 0.52 1.21 -0.81 -0.54 2.07 -0.73 -1.07 116.25 116.90 1ok4 h VAL 217 Ca 0.20 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1ok4 h VAL 217 Cb 0.08 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 1ok4 h VAL 217 CO -0.12 0.25 0.52 -0.33 0.02 0.00 0.00 177.57 177.90 1ok4 h GLU 218 N 0.82 0.96 -0.34 1.57 5.08 -1.04 -0.92 114.58 120.72 1ok4 h GLU 218 Ca 0.21 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1ok4 h GLU 218 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1ok4 h GLU 218 CO -0.02 0.64 0.12 0.78 -1.00 0.00 0.00 179.01 179.53 1ok4 h GLY 219 N 0.99 0.56 0.35 -3.84 0.00 -0.55 -1.16 103.07 99.43 1ok4 h GLY 219 Ca 0.33 -0.32 0.09 0.00 0.00 0.00 0.00 47.33 47.43 1ok4 h GLY 219 CO -0.13 0.30 0.13 -2.08 0.00 0.00 0.00 176.54 174.76 1ok4 h VAL 220 N 0.40 0.73 -0.42 4.60 2.07 -0.75 -0.88 116.25 122.01 1ok4 h VAL 220 Ca 0.11 -0.10 -0.13 0.00 0.82 0.00 0.00 66.70 67.41 1ok4 h VAL 220 Cb 0.22 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1ok4 h VAL 220 CO -0.01 0.05 -0.24 -0.07 0.02 0.00 0.00 177.57 177.33 1ok4 h LEU 221 N 0.28 0.89 -1.49 2.57 3.38 -0.89 -2.74 115.31 117.30 1ok4 h LEU 221 Ca 0.27 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1ok4 h LEU 221 Cb 0.35 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ok4 h LEU 221 CO -0.32 1.09 -0.26 -0.33 0.09 0.00 0.00 178.44 178.70 1ok4 h GLU 222 N 0.75 0.00 0.00 1.13 5.08 -0.86 -2.37 114.58 118.32 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 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1ok4 h GLU 222 CO 0.06 0.26 0.00 0.00 -1.00 0.00 0.00 179.01 178.34 1ok4 n ALA 223 N -2.45 2.09 -0.26 3.43 0.00 -0.37 -4.91 120.51 118.04 1ok4 n ALA 223 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1ok4 n ALA 223 Cb 0.32 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.38 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 0.95 0.85 3.80 0.00 0.00 -0.89 -4.44 105.19 105.46 1ok4 n GLY 224 Ca 0.06 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 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 2.57 0.28 4.61 0.00 -1.06 -4.91 121.76 121.26 1ok4 s ALA 225 Ca 0.00 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.29 1ok4 s ALA 225 Cb 0.00 -3.23 0.40 0.00 0.00 0.00 0.00 23.12 20.29 1ok4 s ALA 225 CO 0.00 -1.26 1.65 1.25 0.00 0.00 0.00 175.76 177.40 1ok4 h LEU 226 N -0.46 0.12 0.00 0.00 5.85 -1.42 -3.44 115.31 115.95 1ok4 h LEU 226 Ca -0.45 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1ok4 h LEU 226 Cb 1.22 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1ok4 h LEU 226 CO 0.55 0.64 0.00 0.61 -0.34 0.00 0.00 178.44 179.90 1ok4 n GLY 227 N 0.07 -0.51 2.99 3.75 0.00 -1.21 -1.41 105.19 108.87 1ok4 n GLY 227 Ca -0.02 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 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 0.37 -0.37 -0.61 -4.36 -0.67 -1.05 121.20 110.51 1ok4 s ILE 228 Ca 0.00 -0.65 -0.02 0.00 -0.26 0.00 0.00 60.65 59.72 1ok4 s ILE 228 Cb 0.00 -0.40 0.09 0.00 1.25 0.00 0.00 42.46 43.40 1ok4 s ILE 228 CO 0.00 -0.20 0.12 0.00 0.24 0.00 0.00 174.94 175.10 1ok4 s ALA 229 N -0.83 3.02 -0.03 2.27 0.00 0.22 -1.55 121.76 124.86 1ok4 s ALA 229 Ca -0.06 -2.27 0.07 0.00 0.00 0.00 0.00 51.96 49.70 1ok4 s ALA 229 Cb -0.06 -2.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 1ok4 s ALA 229 CO -0.00 -1.61 -0.25 0.54 0.00 0.00 0.00 175.76 174.44 1ok4 s VAL 230 N 1.16 2.14 0.00 0.00 0.11 -0.07 -1.96 120.40 121.78 1ok4 s VAL 230 Ca 0.04 -1.07 0.00 0.00 -2.93 0.00 0.00 61.98 58.02 1ok4 s VAL 230 Cb -0.21 -1.75 0.00 0.00 -1.53 0.00 0.00 36.38 32.88 1ok4 s VAL 230 CO -0.03 0.58 0.00 0.61 -3.33 0.00 0.00 175.10 172.92 1ok4 n GLY 231 N 2.53 0.36 0.37 6.54 0.00 -1.26 -0.90 105.19 112.83 1ok4 n GLY 231 Ca -0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 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 1.29 0.00 1.61 3.08 -1.86 -1.11 114.38 117.39 1ok4 h ARG 232 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1ok4 h ARG 232 Cb 0.00 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 29.77 1ok4 h ARG 232 CO 0.00 0.89 0.00 0.09 -1.07 0.00 0.00 179.97 179.88 1ok4 n ASN 233 N -4.36 0.00 -0.02 7.04 3.02 -1.26 -1.44 115.26 118.24 1ok4 n ASN 233 Ca 0.11 0.26 -0.02 0.00 -0.03 0.00 0.00 54.58 54.89 1ok4 n ASN 233 Cb 0.05 -0.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.84 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 -1.37 0.42 1.36 2.41 0.31 -0.61 -4.81 118.33 116.05 1ok4 n VAL 234 Ca 0.05 0.33 0.15 0.00 -0.01 0.00 0.00 64.34 64.86 1ok4 n VAL 234 Cb 0.12 -1.62 0.74 0.00 -0.91 0.00 0.00 33.84 32.17 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 -3.00 0.00 1.16 3.52 4.27 -0.52 -2.32 117.44 120.55 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 0.12 -0.31 0.58 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 -1.31 0.22 -3.60 -2.67 6.02 -0.52 -4.65 117.38 110.87 1ok4 n GLN 236 Ca 0.13 -0.05 -0.36 0.00 -0.01 0.00 0.00 57.00 56.71 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 -2.81 3.76 0.44 -1.09 0.52 -0.98 -4.14 118.95 114.65 1ok4 s ARG 237 Ca 0.19 0.20 0.26 0.00 -0.52 0.00 0.00 55.73 55.86 1ok4 s ARG 237 Cb 0.19 -3.12 0.62 0.00 0.52 0.00 0.00 34.95 33.17 1ok4 s ARG 237 CO 0.54 0.65 1.71 0.00 0.02 0.00 0.00 175.30 178.21 1ok4 h ARG 238 N 4.28 0.00 -1.38 3.54 3.08 -1.87 -2.24 114.38 119.79 1ok4 h ARG 238 Ca -0.51 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 58.89 1ok4 h ARG 238 Cb 1.21 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 31.00 1ok4 h ARG 238 CO 0.63 0.00 0.85 -0.40 -1.07 0.00 0.00 179.97 179.98 1ok4 n ASP 239 N -3.01 7.45 -0.11 7.04 5.75 -1.26 -4.83 116.55 127.58 1ok4 n ASP 239 Ca 0.03 -3.68 -0.05 0.00 -0.01 0.00 0.00 54.79 51.08 1ok4 n ASP 239 Cb 0.47 -1.03 0.02 0.00 -1.03 0.00 0.00 41.12 39.55 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 2.26 0.37 -0.37 2.12 0.00 -1.61 -1.52 119.26 120.51 1ok4 h ALA 240 Ca 0.55 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.48 1ok4 h ALA 240 Cb 0.61 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1ok4 h ALA 240 CO 1.42 -0.38 -0.08 1.25 0.00 0.00 0.00 179.25 181.46 1ok4 h LEU 241 N 0.13 0.71 -0.31 0.00 5.85 -1.88 0.34 115.31 120.15 1ok4 h LEU 241 Ca 0.19 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.55 1ok4 h LEU 241 Cb 0.25 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1ok4 h LEU 241 CO -0.29 0.90 0.19 0.50 -0.34 0.00 0.00 178.44 179.40 1ok4 h LYS 242 N 0.50 0.38 -0.47 1.25 3.64 -1.88 -1.26 116.57 118.73 1ok4 h LYS 242 Ca 0.09 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1ok4 h LYS 242 Cb 0.59 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1ok4 h LYS 242 CO 0.03 0.25 -0.11 0.35 -2.27 0.00 0.00 179.45 177.71 1ok4 h PHE 243 N 0.39 0.94 -0.84 1.91 3.57 -1.14 -2.44 116.94 119.34 1ok4 h PHE 243 Ca 0.12 -0.18 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1ok4 h PHE 243 Cb -0.02 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.44 1ok4 h PHE 243 CO -0.07 0.91 0.52 0.00 -2.23 0.00 0.00 178.31 177.45 1ok4 h ALA 244 N 1.10 1.07 -0.07 2.41 0.00 -0.65 -0.54 119.26 122.57 1ok4 h ALA 244 Ca 0.13 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1ok4 h ALA 244 Cb 0.62 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ok4 h ALA 244 CO 0.04 0.51 -0.44 0.00 0.00 0.00 0.00 179.25 179.37 1ok4 h ARG 245 N 1.15 0.17 -0.36 0.00 3.08 -1.08 -0.71 114.38 116.62 1ok4 h ARG 245 Ca 0.30 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 60.16 1ok4 h ARG 245 Cb -0.07 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1ok4 h ARG 245 CO -0.06 0.58 -0.22 0.00 -1.07 0.00 0.00 179.97 179.20 1ok4 h ALA 246 N 1.41 0.94 -0.40 0.04 0.00 -0.93 -1.46 119.26 118.86 1ok4 h ALA 246 Ca 0.01 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1ok4 h ALA 246 Cb 0.83 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1ok4 h ALA 246 CO 0.06 0.61 0.12 -0.07 0.00 0.00 0.00 179.25 179.98 1ok4 h LEU 247 N 0.62 0.58 -0.71 0.00 3.38 -0.62 -2.06 115.31 116.50 1ok4 h LEU 247 Ca 0.09 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.87 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 0.64 0.46 0.00 0.09 0.00 0.00 178.44 179.68 1ok4 h ALA 248 N 0.97 0.91 -0.39 1.53 0.00 -1.02 -0.05 119.26 121.20 1ok4 h ALA 248 Ca 0.13 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ok4 h ALA 248 Cb 0.26 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1ok4 h ALA 248 CO -0.00 0.28 0.21 1.49 0.00 0.00 0.00 179.25 181.22 1ok4 h GLU 249 N 0.92 0.41 -0.00 0.00 4.57 -1.07 -0.97 114.58 118.43 1ok4 h GLU 249 Ca 0.27 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1ok4 h GLU 249 Cb -0.06 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.44 1ok4 h GLU 249 CO -0.08 0.27 0.00 1.25 -1.18 0.00 0.00 179.01 179.27 1ok4 h LEU 250 N 0.42 0.00 -0.12 1.64 5.85 -0.95 -2.59 115.31 119.58 1ok4 h LEU 250 Ca 0.16 -0.26 -0.13 0.00 0.84 0.00 0.00 57.88 58.50 1ok4 h LEU 250 Cb 0.05 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1ok4 h LEU 250 CO -0.10 0.26 -0.42 0.58 -0.34 0.00 0.00 178.44 178.42 1ok4 h VAL 251 N -0.25 1.37 0.06 1.05 2.07 -0.95 -3.35 116.25 116.25 1ok4 h VAL 251 Ca 0.00 -1.74 -0.28 0.00 0.82 0.00 0.00 66.70 65.51 1ok4 h VAL 251 Cb 0.26 2.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1ok4 h VAL 251 CO 0.00 0.52 -1.45 1.88 0.02 0.00 0.00 177.57 178.54 1ok4 h TYR 252 N 0.08 0.25 0.00 1.57 0.05 -1.30 -3.46 116.97 114.17 1ok4 h TYR 252 Ca -0.02 -0.18 0.00 0.00 0.05 0.00 0.00 58.73 58.58 1ok4 h TYR 252 Cb 1.05 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.78 1ok4 h TYR 252 CO 0.11 1.21 0.00 0.41 -1.05 0.00 0.00 178.16 178.85