#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b s LYS 0 N 0.00 3.09 -0.08 0.00 1.02 -1.26 -4.95 119.74 117.55 3k2b s LYS 0 Ca 0.00 1.78 -0.30 0.00 0.02 0.00 0.00 55.97 57.47 3k2b s LYS 0 Cb 0.00 -1.96 -0.02 0.00 -0.52 0.00 0.00 37.83 35.33 3k2b s LYS 0 CO 0.00 -1.10 1.10 -0.51 -0.92 0.00 0.00 175.35 173.92 3k2b s LEU 1 N -3.97 4.26 0.04 3.17 1.43 -0.92 -4.86 118.68 117.83 3k2b s LEU 1 Ca 0.76 1.67 -0.30 0.00 -1.03 0.00 0.00 54.13 55.23 3k2b s LEU 1 Cb -0.29 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 3k2b s LEU 1 CO 0.32 -0.52 1.01 -0.54 0.23 0.00 0.00 176.35 176.85 3k2b s LYS 2 N 2.12 4.57 0.07 1.70 1.02 -1.26 -1.28 119.74 126.68 3k2b s LYS 2 Ca 0.52 1.49 0.08 0.00 0.02 0.00 0.00 55.97 58.08 3k2b s LYS 2 Cb -0.21 -3.42 -0.03 0.00 -0.52 0.00 0.00 37.83 33.65 3k2b s LYS 2 CO 0.20 -0.02 -0.22 0.54 -0.92 0.00 0.00 175.35 174.93 3k2b s VAL 3 N 0.74 1.78 0.06 3.17 0.11 -0.65 -0.91 120.40 124.70 3k2b s VAL 3 Ca 0.52 -1.36 0.09 0.00 -2.93 0.00 0.00 61.98 58.29 3k2b s VAL 3 Cb -0.23 -1.57 -0.03 0.00 -1.53 0.00 0.00 36.38 33.02 3k2b s VAL 3 CO 0.29 0.14 -0.23 0.00 -3.33 0.00 0.00 175.10 171.96 3k2b s ALA 4 N -0.92 2.02 -0.32 1.54 0.00 -0.46 -1.86 121.76 121.75 3k2b s ALA 4 Ca 0.08 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 50.77 3k2b s ALA 4 Cb -0.09 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.68 3k2b s ALA 4 CO 0.03 0.46 0.09 0.42 0.00 0.00 0.00 175.76 176.75 3k2b s ILE 5 N -0.89 3.80 -0.46 0.00 1.01 -0.02 -0.37 121.20 124.27 3k2b s ILE 5 Ca 0.10 -0.96 -0.16 0.00 0.00 0.00 0.00 60.65 59.62 3k2b s ILE 5 Cb -0.10 -3.07 0.06 0.00 0.01 0.00 0.00 42.46 39.37 3k2b s ILE 5 CO 0.03 -0.06 0.41 0.21 0.00 0.00 0.00 174.94 175.53 3k2b s ASN 6 N 1.43 6.15 0.00 3.58 2.47 0.23 -1.47 114.94 127.33 3k2b s ASN 6 Ca -0.00 -1.16 0.00 0.00 0.42 0.00 0.00 52.86 52.12 3k2b s ASN 6 Cb -0.18 -2.20 0.00 0.00 -1.45 0.00 0.00 41.25 37.42 3k2b s ASN 6 CO 0.02 -0.64 0.00 0.61 -3.72 0.00 0.00 177.10 173.37 3k2b n GLY 7 N 5.19 0.14 2.36 1.21 0.00 0.71 -0.33 105.19 114.47 3k2b n GLY 7 Ca -0.11 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 3k2b n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k2b n PHE 8 N 0.00 1.79 -0.28 1.61 7.35 -1.25 -3.94 117.46 122.74 3k2b n PHE 8 Ca 0.00 -2.37 0.00 0.00 -0.76 0.00 0.00 57.45 54.32 3k2b n PHE 8 Cb 0.00 -1.79 0.00 0.00 0.35 0.00 0.00 39.48 38.04 3k2b n PHE 8 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3k2b n GLY 9 N 1.97 1.46 0.12 7.13 0.00 -1.26 -4.56 105.19 110.05 3k2b n GLY 9 Ca 0.58 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 3k2b n GLY 9 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3k2b h ARG 10 N 0.00 -0.20 -0.52 1.61 2.47 -1.91 -1.18 114.38 114.65 3k2b h ARG 10 Ca 0.00 0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.72 3k2b h ARG 10 Cb 0.00 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.34 3k2b h ARG 10 CO 0.00 0.09 0.26 0.82 0.56 0.00 0.00 179.97 181.69 3k2b h ILE 11 N -0.48 1.20 -0.44 2.04 1.08 -1.90 -1.09 117.51 117.92 3k2b h ILE 11 Ca -0.02 -0.55 0.07 0.00 -0.39 0.00 0.00 64.86 63.97 3k2b h ILE 11 Cb 0.38 0.59 -0.06 0.00 -3.07 0.00 0.00 36.82 34.66 3k2b h ILE 11 CO 0.03 0.22 0.09 1.23 -0.69 0.00 0.00 178.15 179.03 3k2b h GLY 12 N 0.70 0.52 1.38 5.37 0.00 -1.66 0.28 103.07 109.66 3k2b h GLY 12 Ca 0.18 -0.02 -0.25 0.00 0.00 0.00 0.00 47.33 47.24 3k2b h GLY 12 CO -0.02 -0.05 -0.99 3.21 0.00 0.00 0.00 176.54 178.69 3k2b h ARG 13 N 0.22 0.56 -0.36 4.80 3.08 -1.05 -2.32 114.38 119.30 3k2b h ARG 13 Ca 0.21 -0.60 0.01 0.00 0.07 0.00 0.00 59.98 59.67 3k2b h ARG 13 Cb 0.27 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 3k2b h ARG 13 CO -0.28 1.22 0.22 -0.91 -1.07 0.00 0.00 179.97 179.15 3k2b h ASN 14 N 0.32 0.37 -0.16 7.04 2.35 -0.99 -0.64 115.58 123.87 3k2b h ASN 14 Ca -0.10 -0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.69 3k2b h ASN 14 Cb 1.64 -0.08 -0.06 0.00 0.05 0.00 0.00 38.32 39.86 3k2b h ASN 14 CO 0.18 0.27 -0.28 0.15 -1.65 0.00 0.00 177.43 176.10 3k2b h PHE 15 N 0.45 -0.77 -0.39 1.19 3.57 -0.36 0.54 116.94 121.18 3k2b h PHE 15 Ca 0.14 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.75 3k2b h PHE 15 Cb -0.02 0.36 -0.07 0.00 2.79 0.00 0.00 35.95 39.02 3k2b h PHE 15 CO -0.07 -0.36 -0.03 1.25 -2.23 0.00 0.00 178.31 176.88 3k2b h LEU 16 N -0.34 -0.21 -0.44 0.59 6.46 -0.82 0.17 115.31 120.73 3k2b h LEU 16 Ca 0.11 0.10 -0.03 0.00 -0.12 0.00 0.00 57.88 57.93 3k2b h LEU 16 Cb 0.51 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 3k2b h LEU 16 CO -0.35 -0.07 0.14 0.03 -0.62 0.00 0.00 178.44 177.57 3k2b h ARG 17 N 0.07 0.67 -0.15 1.25 2.47 -0.19 0.30 114.38 118.81 3k2b h ARG 17 Ca 0.19 -0.14 0.04 0.00 -1.26 0.00 0.00 59.98 58.81 3k2b h ARG 17 Cb 0.28 -0.10 -0.05 0.00 -1.65 0.00 0.00 29.97 28.45 3k2b h ARG 17 CO -0.34 0.65 -0.15 0.00 0.56 0.00 0.00 179.97 180.70 3k2b h TRP 18 N -0.17 0.50 -0.96 0.00 7.01 -0.42 -2.39 115.95 119.52 3k2b h TRP 18 Ca 0.10 0.01 0.20 0.00 2.11 0.00 0.00 58.89 61.31 3k2b h TRP 18 Cb 0.32 -0.17 -0.08 0.00 -2.10 0.00 0.00 29.16 27.12 3k2b h TRP 18 CO -0.27 0.32 0.61 1.25 -2.79 0.00 0.00 178.44 177.56 3k2b h HIS 18 N 0.54 0.76 -0.00 2.65 2.76 0.29 -0.69 115.15 121.46 3k2b h HIS 18 Ca 0.15 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 3k2b h HIS 18 Cb -0.06 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.67 3k2b h HIS 18 CO -0.05 0.18 -0.10 0.41 -1.30 0.00 0.00 177.93 177.07 3k2b n GLY 19 N -1.44 -0.89 3.87 5.26 0.00 -0.65 -4.88 105.19 106.46 3k2b n GLY 19 Ca 0.21 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 3k2b n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k2b s ARG 20 N -2.42 3.60 -0.09 1.61 1.81 -0.27 -5.06 118.95 118.14 3k2b s ARG 20 Ca 0.30 0.73 0.02 0.00 -1.72 0.00 0.00 55.73 55.06 3k2b s ARG 20 Cb 0.20 -2.09 -0.02 0.00 -0.45 0.00 0.00 34.95 32.59 3k2b s ARG 20 CO 0.46 -0.55 -0.14 -1.59 -0.68 0.00 0.00 175.30 172.80 3k2b s LYS 21 N -5.14 2.93 -1.01 3.54 -2.85 -1.26 -4.63 119.74 111.33 3k2b s LYS 21 Ca 0.55 -0.70 -0.03 0.00 -1.00 0.00 0.00 55.97 54.79 3k2b s LYS 21 Cb -0.11 -2.49 0.00 0.00 -2.06 0.00 0.00 37.83 33.17 3k2b s LYS 21 CO 0.53 0.41 0.38 -0.25 0.10 0.00 0.00 175.35 176.53 3k2b n ASP 22 N 2.93 -4.50 -4.73 0.03 8.00 -1.26 -4.95 116.55 112.07 3k2b n ASP 22 Ca -0.18 -0.18 -0.42 0.00 0.71 0.00 0.00 54.79 54.72 3k2b n ASP 22 Cb 0.52 -3.37 -0.02 0.00 -0.02 0.00 0.00 41.12 38.23 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3k2b n SER 23 N -0.98 3.55 0.00 -2.24 2.88 -1.26 -4.83 113.62 110.73 3k2b n SER 23 Ca -0.08 1.16 0.15 0.00 -1.33 0.00 0.00 58.87 58.78 3k2b n SER 23 Cb 0.58 -1.55 0.87 0.00 -0.75 0.00 0.00 64.21 63.35 3k2b n SER 23 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3k2b n PRO 24 N 1.84 0.81 -3.48 -1.46 -0.04 -1.26 -4.82 135.00 126.58 3k2b n PRO 24 Ca 0.08 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.32 3k2b n PRO 24 Cb 0.36 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 3k2b n PRO 24 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k2b s LEU 25 N -2.17 4.02 -0.30 1.53 1.43 -1.26 -2.16 118.68 119.76 3k2b s LEU 25 Ca 0.41 0.21 -0.00 0.00 -1.03 0.00 0.00 54.13 53.71 3k2b s LEU 25 Cb 0.21 -3.06 0.14 0.00 0.03 0.00 0.00 46.19 43.50 3k2b s LEU 25 CO 0.39 -0.34 0.29 -0.62 0.23 0.00 0.00 176.35 176.30 3k2b s ASP 26 N -4.08 1.79 -0.30 2.29 2.15 -0.40 -4.84 116.67 113.28 3k2b s ASP 26 Ca 0.41 -0.91 -0.29 0.00 0.43 0.00 0.00 52.55 52.19 3k2b s ASP 26 Cb -0.09 0.43 -0.02 0.00 -0.30 0.00 0.00 42.92 42.94 3k2b s ASP 26 CO 0.34 -0.38 1.66 -0.63 -0.17 0.00 0.00 175.17 175.99 3k2b s ILE 27 N 2.22 3.64 -0.20 4.11 1.09 -1.26 -1.64 121.20 129.15 3k2b s ILE 27 Ca 0.10 0.68 0.05 0.00 -1.10 0.00 0.00 60.65 60.37 3k2b s ILE 27 Cb -0.14 -3.77 -0.05 0.00 -1.06 0.00 0.00 42.46 37.44 3k2b s ILE 27 CO -0.30 -0.43 0.19 2.30 -0.10 0.00 0.00 174.94 176.60 3k2b n ILE 28 N 6.99 0.00 -3.79 2.92 -5.35 -0.78 -4.83 119.36 114.53 3k2b n ILE 28 Ca 0.20 -0.37 -0.13 0.00 -0.27 0.00 0.00 62.75 62.19 3k2b n ILE 28 Cb 0.46 0.94 -0.09 0.00 -1.74 0.00 0.00 39.64 39.22 3k2b n ILE 28 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k2b s ALA 29 N -1.52 -0.68 -0.01 -1.28 0.00 -1.21 -1.47 121.76 115.60 3k2b s ALA 29 Ca 0.01 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.29 3k2b s ALA 29 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 23.12 23.15 3k2b s ALA 29 CO 0.19 -0.23 -0.06 0.42 0.00 0.00 0.00 175.76 176.07 3k2b s ILE 30 N -1.13 0.51 -0.04 0.00 1.01 0.78 -0.84 121.20 121.48 3k2b s ILE 30 Ca -0.12 -0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.27 3k2b s ILE 30 Cb -0.05 -0.43 0.02 0.00 0.01 0.00 0.00 42.46 42.01 3k2b s ILE 30 CO 0.03 0.15 -0.03 0.21 0.00 0.00 0.00 174.94 175.30 3k2b s ASN 31 N -0.10 0.85 0.19 3.58 2.47 -0.54 -0.35 114.94 121.04 3k2b s ASN 31 Ca 0.02 -0.09 -0.13 0.00 0.42 0.00 0.00 52.86 53.07 3k2b s ASN 31 Cb -0.03 -0.38 0.01 0.00 -1.45 0.00 0.00 41.25 39.40 3k2b s ASN 31 CO -0.00 -0.08 0.41 -0.62 -3.72 0.00 0.00 177.10 173.09 3k2b s ASP 32 N 1.04 -0.10 0.00 -4.21 2.15 -0.69 -0.20 116.67 114.65 3k2b s ASP 32 Ca -0.09 -0.72 0.06 0.00 0.43 0.00 0.00 52.55 52.22 3k2b s ASP 32 Cb -0.14 0.52 0.19 0.00 -0.30 0.00 0.00 42.92 43.19 3k2b s ASP 32 CO -0.01 -1.00 1.15 0.35 -0.17 0.00 0.00 175.17 175.50 3k2b n THR 33 N -0.29 0.23 0.43 1.71 -2.24 -1.26 -4.00 114.28 108.85 3k2b n THR 33 Ca -0.07 -0.23 0.05 0.00 -2.27 0.00 0.00 64.05 61.52 3k2b n THR 33 Cb 0.63 0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.95 3k2b n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k2b n GLY 34 N 0.79 -0.07 0.34 3.38 0.00 -1.26 -5.03 105.19 103.34 3k2b n GLY 34 Ca 0.06 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.86 3k2b n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k2b n GLY 36 N 0.98 -2.12 0.40 -0.02 0.00 -1.26 -4.30 105.19 98.87 3k2b n GLY 36 Ca 0.03 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 3k2b n GLY 36 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k2b h VAL 37 N -0.32 0.15 -0.72 1.61 2.07 -1.91 -2.15 116.25 114.97 3k2b h VAL 37 Ca -0.02 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.64 3k2b h VAL 37 Cb 0.32 0.15 -0.14 0.00 -1.52 0.00 0.00 31.29 30.11 3k2b h VAL 37 CO 0.01 0.00 -0.24 0.50 0.02 0.00 0.00 177.57 177.86 3k2b h LYS 38 N -0.52 -0.05 -0.30 1.57 3.64 -1.95 0.72 116.57 119.69 3k2b h LYS 38 Ca 0.06 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.27 3k2b h LYS 38 Cb 0.63 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3k2b h LYS 38 CO -0.36 -0.03 -0.52 1.96 -2.27 0.00 0.00 179.45 178.22 3k2b h GLN 39 N -0.05 0.88 -0.22 1.90 7.50 -1.72 -2.52 115.11 120.88 3k2b h GLN 39 Ca 0.32 -0.54 -0.00 0.00 0.50 0.00 0.00 58.65 58.93 3k2b h GLN 39 Cb 0.55 0.06 -0.01 0.00 0.05 0.00 0.00 27.48 28.13 3k2b h GLN 39 CO -0.76 1.18 0.14 0.00 -1.50 0.00 0.00 178.83 177.89 3k2b h ALA 40 N 0.71 0.28 0.38 3.87 0.00 -0.52 0.31 119.26 124.30 3k2b h ALA 40 Ca 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3k2b h ALA 40 Cb 1.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3k2b h ALA 40 CO 0.12 -0.22 -0.18 1.03 0.00 0.00 0.00 179.25 179.99 3k2b h SER 41 N 0.28 -0.43 -0.26 0.00 0.87 -0.96 -2.04 113.55 111.00 3k2b h SER 41 Ca 0.08 -0.08 0.06 0.00 -1.23 0.00 0.00 61.79 60.62 3k2b h SER 41 Cb 0.00 0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 62.02 3k2b h SER 41 CO -0.02 -0.18 -0.11 -0.74 -0.53 0.00 0.00 176.83 175.25 3k2b h HIS 42 N -0.68 -0.26 0.00 2.24 6.17 -1.37 -1.56 115.15 119.69 3k2b h HIS 42 Ca -0.05 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.06 3k2b h HIS 42 Cb 0.49 0.16 0.00 0.00 2.52 0.00 0.00 27.41 30.57 3k2b h HIS 42 CO -0.01 -0.17 0.00 1.28 0.71 0.00 0.00 177.93 179.74 3k2b n LEU 43 N -5.28 0.00 -0.01 0.26 4.77 0.09 -1.50 117.00 115.33 3k2b n LEU 43 Ca -0.01 0.46 -0.11 0.00 -0.03 0.00 0.00 56.01 56.32 3k2b n LEU 43 Cb 0.20 -0.46 -0.14 0.00 -2.33 0.00 0.00 43.42 40.69 3k2b n LEU 43 CO 0.19 -0.15 -0.55 0.25 -1.33 0.00 0.00 177.39 175.80 3k2b h LEU 44 N 0.00 0.08 -0.05 2.23 5.85 -0.68 -3.39 115.31 119.36 3k2b h LEU 44 Ca 0.00 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.46 3k2b h LEU 44 Cb 0.30 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.31 3k2b h LEU 44 CO 0.00 1.16 -0.26 0.50 -0.34 0.00 0.00 178.44 179.51 3k2b h LYS 45 N 0.01 0.26 -5.42 1.25 1.63 -0.66 -3.39 116.57 110.26 3k2b h LYS 45 Ca -0.30 -0.22 -0.66 0.00 -0.85 0.00 0.00 60.65 58.63 3k2b h LYS 45 Cb 2.01 0.05 -0.25 0.00 -0.60 0.00 0.00 32.23 33.44 3k2b h LYS 45 CO 0.08 0.87 -0.74 0.71 -3.45 0.00 0.00 179.45 176.92 3k2b s TYR 46 N -3.57 2.86 -0.14 1.91 2.02 -0.56 -0.09 117.35 119.77 3k2b s TYR 46 Ca -0.15 -0.51 -0.04 0.00 -0.37 0.00 0.00 57.07 56.00 3k2b s TYR 46 Cb 0.03 -1.85 0.06 0.00 -0.40 0.00 0.00 41.96 39.80 3k2b s TYR 46 CO 0.75 -0.12 0.12 0.34 -1.57 0.00 0.00 175.55 175.07 3k2b s ASP 47 N 0.23 1.78 0.52 2.29 -1.08 -1.15 -4.57 116.67 114.69 3k2b s ASP 47 Ca -0.07 -0.32 0.24 0.00 -0.52 0.00 0.00 52.55 51.89 3k2b s ASP 47 Cb -0.15 -0.05 1.33 0.00 -1.46 0.00 0.00 42.92 42.59 3k2b s ASP 47 CO 0.05 -0.32 1.72 0.28 0.52 0.00 0.00 175.17 177.41 3k2b h SER 48 N 8.40 0.00 0.00 -0.34 0.02 -1.96 0.57 113.55 120.24 3k2b h SER 48 Ca -0.15 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.49 3k2b h SER 48 Cb 1.14 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.64 3k2b h SER 48 CO 0.25 0.00 -2.00 0.41 -1.14 0.00 0.00 176.83 174.34 3k2b n THR 49 N -2.56 1.36 0.09 -2.27 -1.04 -1.26 -4.71 114.28 103.89 3k2b n THR 49 Ca -0.02 -0.22 -0.02 0.00 -2.04 0.00 0.00 64.05 61.75 3k2b n THR 49 Cb 0.31 -1.93 -0.05 0.00 -1.82 0.00 0.00 70.33 66.84 3k2b n THR 49 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3k2b h LEU 50 N -0.87 0.00 0.00 -4.42 3.38 -1.92 -3.51 115.31 107.98 3k2b h LEU 50 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3k2b h LEU 50 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3k2b h LEU 50 CO -0.29 0.75 0.00 0.61 0.09 0.00 0.00 178.44 179.60 3k2b n GLY 51 N 1.30 0.43 3.72 0.83 0.00 0.20 -4.93 105.19 106.74 3k2b n GLY 51 Ca 0.00 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 3k2b n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k2b s ILE 52 N -1.07 3.35 -0.10 -0.61 1.01 -1.26 -2.95 121.20 119.57 3k2b s ILE 52 Ca 0.00 1.02 -0.30 0.00 0.00 0.00 0.00 60.65 61.38 3k2b s ILE 52 Cb 0.00 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 3k2b s ILE 52 CO 0.00 0.11 1.45 0.12 0.00 0.00 0.00 174.94 176.62 3k2b s PHE 53 N 0.67 2.48 -1.27 3.97 5.36 0.87 -4.90 117.98 125.16 3k2b s PHE 53 Ca 0.60 0.63 -0.13 0.00 -0.96 0.00 0.00 56.93 57.08 3k2b s PHE 53 Cb -0.36 -3.70 -0.05 0.00 -0.34 0.00 0.00 43.02 38.57 3k2b s PHE 53 CO 0.33 -2.72 2.33 -3.47 -1.46 0.00 0.00 175.22 170.24 3k2b n ASP 54 N 6.67 5.00 -3.48 6.13 2.03 -1.26 -4.77 116.55 126.87 3k2b n ASP 54 Ca 0.15 -2.65 -0.14 0.00 0.52 0.00 0.00 54.79 52.67 3k2b n ASP 54 Cb 0.44 -1.42 -0.04 0.00 -0.72 0.00 0.00 41.12 39.38 3k2b n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k2b s ALA 55 N 3.36 -1.60 -0.69 -1.67 0.00 -1.26 -5.09 121.76 114.80 3k2b s ALA 55 Ca 0.54 0.76 -0.26 0.00 0.00 0.00 0.00 51.96 53.00 3k2b s ALA 55 Cb 0.14 0.53 0.04 0.00 0.00 0.00 0.00 23.12 23.83 3k2b s ALA 55 CO -0.03 -0.60 1.19 0.34 0.00 0.00 0.00 175.76 176.65 3k2b s ASP 56 N -2.15 6.21 -0.15 0.00 3.68 -1.26 -4.87 116.67 118.13 3k2b s ASP 56 Ca -0.04 -0.49 -0.04 0.00 2.13 0.00 0.00 52.55 54.11 3k2b s ASP 56 Cb -0.01 -2.52 -0.03 0.00 -1.45 0.00 0.00 42.92 38.91 3k2b s ASP 56 CO -0.04 -1.68 0.00 -0.69 0.13 0.00 0.00 175.17 172.89 3k2b s VAL 57 N 5.20 4.27 -0.17 1.11 1.01 -1.26 -0.24 120.40 130.32 3k2b s VAL 57 Ca 0.33 -0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 3k2b s VAL 57 Cb -0.10 -2.87 0.11 0.00 0.00 0.00 0.00 36.38 33.52 3k2b s VAL 57 CO 0.16 0.51 0.92 -1.59 0.00 0.00 0.00 175.10 175.09 3k2b s LYS 58 N 0.08 0.69 0.52 2.72 -2.85 -0.56 -4.99 119.74 115.35 3k2b s LYS 58 Ca 0.02 0.33 -0.22 0.00 -1.00 0.00 0.00 55.97 55.09 3k2b s LYS 58 Cb -0.13 0.33 -0.06 0.00 -2.06 0.00 0.00 37.83 35.91 3k2b s LYS 58 CO 0.02 -0.18 1.28 -0.35 0.10 0.00 0.00 175.35 176.22 3k2b n PRO 59 N 1.22 1.64 -3.73 1.78 -0.04 -1.26 0.14 135.00 134.76 3k2b n PRO 59 Ca -0.13 0.60 -0.28 0.00 -0.04 0.00 0.00 63.50 63.65 3k2b n PRO 59 Cb 0.57 -2.47 -0.12 0.00 -0.04 0.00 0.00 33.50 31.44 3k2b n PRO 59 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3k2b s SER 60 N -0.86 3.62 0.00 3.54 0.15 0.24 -4.64 113.70 115.75 3k2b s SER 60 Ca 0.69 -3.28 0.00 0.00 0.70 0.00 0.00 55.95 54.06 3k2b s SER 60 Cb -0.44 -1.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.69 3k2b s SER 60 CO 0.51 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.40 3k2b n GLY 60 N 2.67 -0.21 0.26 9.45 0.00 -1.26 -3.59 105.19 112.51 3k2b n GLY 60 Ca 0.18 -1.86 0.16 0.00 0.00 0.00 0.00 46.02 44.51 3k2b n GLY 60 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3k2b h GLU 61 N 0.00 0.00 -0.38 1.61 4.57 -2.03 -3.33 114.58 115.02 3k2b h GLU 61 Ca 0.00 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.91 3k2b h GLU 61 Cb 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 28.75 28.21 3k2b h GLU 61 CO 0.00 0.00 -1.00 0.25 -1.18 0.00 0.00 179.01 177.08 3k2b n THR 62 N -3.01 1.32 -3.49 0.32 -2.24 -1.26 -4.84 114.28 101.09 3k2b n THR 62 Ca 0.01 -2.81 -0.09 0.00 -2.27 0.00 0.00 64.05 58.89 3k2b n THR 62 Cb 0.32 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 69.20 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b s ALA 63 N -2.97 -1.79 0.28 6.98 0.00 -1.24 -2.44 121.76 120.59 3k2b s ALA 63 Ca 0.34 0.95 0.12 0.00 0.00 0.00 0.00 51.96 53.36 3k2b s ALA 63 Cb 0.35 0.46 -0.05 0.00 0.00 0.00 0.00 23.12 23.89 3k2b s ALA 63 CO -0.05 -0.69 -0.19 0.96 0.00 0.00 0.00 175.76 175.79 3k2b s ILE 64 N -3.16 2.44 -0.07 0.00 -4.36 -0.67 0.81 121.20 116.19 3k2b s ILE 64 Ca 0.04 -2.39 0.05 0.00 -0.26 0.00 0.00 60.65 58.09 3k2b s ILE 64 Cb -0.01 -2.31 -0.00 0.00 1.25 0.00 0.00 42.46 41.38 3k2b s ILE 64 CO -0.09 -0.40 -0.23 -0.55 0.24 0.00 0.00 174.94 173.91 3k2b s SER 65 N -3.51 2.87 -0.21 4.36 0.15 0.12 -0.77 113.70 116.71 3k2b s SER 65 Ca 0.30 -0.49 0.01 0.00 0.70 0.00 0.00 55.95 56.47 3k2b s SER 65 Cb -0.04 -0.99 0.05 0.00 -1.71 0.00 0.00 66.02 63.32 3k2b s SER 65 CO 0.15 0.19 -0.10 -0.69 1.20 0.00 0.00 173.24 173.99 3k2b s VAL 66 N 0.08 1.71 -1.29 4.45 1.01 0.08 -1.50 120.40 124.94 3k2b s VAL 66 Ca -0.09 -1.11 -0.10 0.00 0.00 0.00 0.00 61.98 60.68 3k2b s VAL 66 Cb -0.15 -1.80 0.08 0.00 0.00 0.00 0.00 36.38 34.51 3k2b s VAL 66 CO 0.05 0.13 0.49 0.47 0.00 0.00 0.00 175.10 176.24 3k2b n ASP 67 N 4.65 -3.67 0.00 3.32 8.00 0.67 -0.19 116.55 129.34 3k2b n ASP 67 Ca -0.15 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 54.95 3k2b n ASP 67 Cb 0.46 -3.04 0.00 0.00 -0.02 0.00 0.00 41.12 38.52 3k2b n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k2b n GLY 68 N -1.17 3.36 3.68 0.44 0.00 -1.26 -4.98 105.19 105.25 3k2b n GLY 68 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3k2b n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k2b s LYS 69 N -0.72 4.35 0.18 1.61 2.20 0.74 -5.02 119.74 123.08 3k2b s LYS 69 Ca 0.00 1.08 -0.30 0.00 -0.36 0.00 0.00 55.97 56.40 3k2b s LYS 69 Cb 0.00 -3.55 -0.08 0.00 -1.51 0.00 0.00 37.83 32.70 3k2b s LYS 69 CO 0.00 -0.26 0.93 0.42 -0.36 0.00 0.00 175.35 176.09 3k2b s ILE 70 N 1.88 4.26 -0.08 5.43 1.09 -1.26 -0.74 121.20 131.78 3k2b s ILE 70 Ca 0.41 2.05 -0.01 0.00 -1.10 0.00 0.00 60.65 62.00 3k2b s ILE 70 Cb -0.17 -4.31 0.03 0.00 -1.06 0.00 0.00 42.46 36.94 3k2b s ILE 70 CO 0.15 0.43 -0.02 -0.63 -0.10 0.00 0.00 174.94 174.77 3k2b s ILE 71 N -0.73 0.53 0.42 2.92 1.01 0.05 -4.86 121.20 120.55 3k2b s ILE 71 Ca 0.43 0.01 -0.26 0.00 0.00 0.00 0.00 60.65 60.83 3k2b s ILE 71 Cb -0.25 -0.64 -0.08 0.00 0.01 0.00 0.00 42.46 41.50 3k2b s ILE 71 CO 0.31 0.28 1.34 -1.10 0.00 0.00 0.00 174.94 175.77 3k2b s GLN 72 N 1.80 3.85 -0.08 2.79 1.11 -0.54 -1.67 119.66 126.93 3k2b s GLN 72 Ca 0.03 2.23 0.03 0.00 0.01 0.00 0.00 55.36 57.66 3k2b s GLN 72 Cb -0.13 -2.70 0.01 0.00 -1.01 0.00 0.00 33.01 29.18 3k2b s GLN 72 CO -0.05 -0.61 -0.17 0.08 0.01 0.00 0.00 175.29 174.54 3k2b s VAL 73 N -1.25 1.49 0.06 1.09 1.01 -1.02 -0.16 120.40 121.63 3k2b s VAL 73 Ca 0.59 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.91 3k2b s VAL 73 Cb -0.40 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 3k2b s VAL 73 CO 0.51 0.43 -0.11 0.68 0.00 0.00 0.00 175.10 176.62 3k2b s VAL 74 N 0.52 0.83 -0.61 2.92 -7.23 0.53 -4.66 120.40 112.69 3k2b s VAL 74 Ca -0.16 -1.25 0.04 0.00 -1.81 0.00 0.00 61.98 58.80 3k2b s VAL 74 Cb -0.16 -0.90 0.15 0.00 0.56 0.00 0.00 36.38 36.03 3k2b s VAL 74 CO 0.06 -0.35 0.39 -0.44 -0.31 0.00 0.00 175.10 174.45 3k2b s SER 75 N -1.77 4.39 -0.21 4.85 0.01 -1.26 -1.70 113.70 118.01 3k2b s SER 75 Ca -0.05 -3.45 -0.02 0.00 1.31 0.00 0.00 55.95 53.75 3k2b s SER 75 Cb -0.09 -1.53 0.06 0.00 0.21 0.00 0.00 66.02 64.68 3k2b s SER 75 CO 0.01 -0.15 0.02 0.21 0.41 0.00 0.00 173.24 173.74 3k2b s ASN 76 N -0.86 3.22 0.10 2.44 3.84 -1.26 -4.95 114.94 117.47 3k2b s ASN 76 Ca 0.22 -0.97 0.16 0.00 0.21 0.00 0.00 52.86 52.48 3k2b s ASN 76 Cb -0.13 -0.76 0.68 0.00 -0.55 0.00 0.00 41.25 40.49 3k2b s ASN 76 CO -0.10 -0.30 1.49 0.54 -2.79 0.00 0.00 177.10 175.94 3k2b n ARG 77 N 4.94 0.06 -3.62 0.43 1.74 -1.26 -4.40 116.66 114.55 3k2b n ARG 77 Ca -0.09 0.36 -0.40 0.00 -0.77 0.00 0.00 57.85 56.95 3k2b n ARG 77 Cb 0.46 -1.64 -0.10 0.00 -1.02 0.00 0.00 32.46 30.16 3k2b n ARG 77 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3k2b s ASN 78 N -3.42 5.59 0.23 0.55 2.47 -1.26 -4.98 114.94 114.11 3k2b s ASN 78 Ca 0.05 -1.68 -0.10 0.00 0.42 0.00 0.00 52.86 51.55 3k2b s ASN 78 Cb 0.08 -1.97 0.34 0.00 -1.45 0.00 0.00 41.25 38.26 3k2b s ASN 78 CO 0.26 -0.57 1.64 -0.65 -3.72 0.00 0.00 177.10 174.05 3k2b h PRO 79 N 8.36 0.07 -1.48 0.43 0.11 -1.91 -0.56 132.00 137.02 3k2b h PRO 79 Ca -0.21 -0.00 0.44 0.00 0.11 0.00 0.00 66.00 66.33 3k2b h PRO 79 Cb 1.08 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.09 3k2b h PRO 79 CO 0.77 0.04 1.03 0.77 -0.21 0.00 0.00 178.00 180.41 3k2b h SER 80 N 0.07 0.09 -0.37 -2.05 0.02 -1.94 0.17 113.55 109.54 3k2b h SER 80 Ca 0.36 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 3k2b h SER 80 Cb 0.60 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.17 3k2b h SER 80 CO -0.64 -0.03 0.00 0.18 -1.14 0.00 0.00 176.83 175.20 3k2b n LEU 81 N -4.25 2.89 -4.78 5.07 4.77 -0.22 -4.23 117.00 116.25 3k2b n LEU 81 Ca 0.35 -1.29 -0.34 0.00 -0.03 0.00 0.00 56.01 54.70 3k2b n LEU 81 Cb 1.52 -0.24 -0.00 0.00 -2.33 0.00 0.00 43.42 42.37 3k2b n LEU 81 CO 0.36 0.64 0.75 -0.76 -1.33 0.00 0.00 177.39 177.06 3k2b s LEU 82 N -1.39 3.69 -0.03 2.23 1.43 0.60 -4.89 118.68 120.32 3k2b s LEU 82 Ca 0.37 2.05 -0.04 0.00 -1.03 0.00 0.00 54.13 55.48 3k2b s LEU 82 Cb 0.21 -4.57 -0.15 0.00 0.03 0.00 0.00 46.19 41.71 3k2b s LEU 82 CO 0.29 -1.16 3.01 -0.81 0.23 0.00 0.00 176.35 177.91 3k2b n PRO 83 N -1.45 1.69 -0.22 1.29 -0.04 -1.26 -4.51 135.00 130.49 3k2b n PRO 83 Ca 0.11 -0.75 -0.09 0.00 -0.04 0.00 0.00 63.50 62.72 3k2b n PRO 83 Cb 0.52 -1.67 0.03 0.00 -0.04 0.00 0.00 33.50 32.33 3k2b n PRO 83 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k2b h TRP 84 N 2.31 1.18 0.07 0.54 -0.00 -1.90 -2.68 115.95 115.48 3k2b h TRP 84 Ca 0.14 -0.20 -0.00 0.00 -0.00 0.00 0.00 58.89 58.82 3k2b h TRP 84 Cb 1.30 -0.31 0.00 0.00 -0.00 0.00 0.00 29.16 30.15 3k2b h TRP 84 CO 1.24 1.04 -0.04 -0.22 -0.00 0.00 0.00 178.44 180.46 3k2b h LYS 85 N 0.99 -0.10 0.00 0.49 3.64 -1.45 0.58 116.57 120.72 3k2b h LYS 85 Ca 0.18 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3k2b h LYS 85 Cb 0.56 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3k2b h LYS 85 CO 0.03 0.13 -0.02 1.05 -2.27 0.00 0.00 179.45 178.37 3k2b h GLU 86 N -0.31 0.00 0.00 1.90 9.09 -1.85 -1.45 114.58 121.96 3k2b h GLU 86 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.40 3k2b h GLU 86 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.36 3k2b h GLU 86 CO 0.02 0.02 -0.89 1.28 0.05 0.00 0.00 179.01 179.48 3k2b n LEU 87 N -3.20 0.88 -2.67 3.06 4.77 -1.01 -4.99 117.00 113.83 3k2b n LEU 87 Ca -0.02 -0.38 -0.12 0.00 -0.03 0.00 0.00 56.01 55.46 3k2b n LEU 87 Cb 0.16 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.26 3k2b n LEU 87 CO 0.24 0.22 0.09 0.61 -1.33 0.00 0.00 177.39 177.22 3k2b n GLY 88 N 1.50 -0.11 3.69 -0.72 0.00 0.05 -4.95 105.19 104.66 3k2b n GLY 88 Ca 0.04 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3k2b n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k2b s ILE 89 N -3.24 4.09 -0.18 -0.61 -1.09 -0.37 -4.70 121.20 115.10 3k2b s ILE 89 Ca 0.06 1.45 -0.17 0.00 -2.23 0.00 0.00 60.65 59.75 3k2b s ILE 89 Cb -0.02 -3.93 -0.14 0.00 -1.58 0.00 0.00 42.46 36.79 3k2b s ILE 89 CO 0.50 0.02 0.12 0.44 -1.23 0.00 0.00 174.94 174.80 3k2b h ASP 90 N 7.42 0.00 -3.44 3.58 3.32 -1.38 -3.09 116.42 122.82 3k2b h ASP 90 Ca -0.36 -0.36 -0.68 0.00 0.02 0.00 0.00 57.03 55.65 3k2b h ASP 90 Cb 1.17 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.42 3k2b h ASP 90 CO 0.87 1.18 -0.84 -0.63 -1.72 0.00 0.00 179.24 178.10 3k2b s ILE 91 N -2.28 2.37 -0.21 0.35 1.01 -0.75 -0.49 121.20 121.21 3k2b s ILE 91 Ca -0.22 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.47 3k2b s ILE 91 Cb 0.04 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 3k2b s ILE 91 CO 0.46 0.55 -0.03 -0.69 0.00 0.00 0.00 174.94 175.23 3k2b s VAL 92 N 0.24 3.58 -0.61 2.92 1.01 0.44 -1.36 120.40 126.62 3k2b s VAL 92 Ca -0.14 -0.43 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 3k2b s VAL 92 Cb -0.17 -2.62 0.07 0.00 0.00 0.00 0.00 36.38 33.66 3k2b s VAL 92 CO 0.07 0.43 0.89 -0.63 0.00 0.00 0.00 175.10 175.86 3k2b s ILE 93 N 1.22 4.46 -0.99 2.22 -1.09 0.50 -0.90 121.20 126.62 3k2b s ILE 93 Ca 0.03 -0.35 -0.23 0.00 -2.23 0.00 0.00 60.65 57.87 3k2b s ILE 93 Cb -0.14 -4.59 0.06 0.00 -1.58 0.00 0.00 42.46 36.20 3k2b s ILE 93 CO -0.00 -1.29 1.40 -0.70 -1.23 0.00 0.00 174.94 173.12 3k2b s GLU 94 N 3.71 3.56 -0.33 2.79 -6.30 -0.86 -0.60 118.70 120.66 3k2b s GLU 94 Ca 0.21 -1.14 0.06 0.00 -2.50 0.00 0.00 54.97 51.61 3k2b s GLU 94 Cb -0.17 -5.24 0.45 0.00 0.00 0.00 0.00 34.13 29.17 3k2b s GLU 94 CO 0.11 -2.16 1.21 0.41 0.02 0.00 0.00 175.26 174.85 3k2b n GLY 95 N 6.64 6.32 0.06 -1.50 0.00 0.55 -2.14 105.19 115.12 3k2b n GLY 95 Ca 0.30 -2.68 0.10 0.00 0.00 0.00 0.00 46.02 43.75 3k2b n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k2b n THR 96 N -0.67 0.37 0.00 2.61 -2.24 -1.15 -4.57 114.28 108.63 3k2b n THR 96 Ca 0.44 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3k2b n THR 96 Cb 0.90 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.93 3k2b n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k2b n GLY 97 N 1.24 2.58 0.90 3.38 0.00 -1.26 -4.88 105.19 107.14 3k2b n GLY 97 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 3k2b n GLY 97 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k2b n VAL 98 N -2.00 2.27 -3.08 1.61 0.24 -1.26 -4.61 118.33 111.50 3k2b n VAL 98 Ca 0.00 -1.86 -0.16 0.00 -2.04 0.00 0.00 64.34 60.28 3k2b n VAL 98 Cb 0.00 -0.24 -0.00 0.00 -1.47 0.00 0.00 33.84 32.12 3k2b n VAL 98 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3k2b n PHE 99 N -0.49 -0.54 1.00 6.34 3.72 -1.26 -4.93 117.46 121.31 3k2b n PHE 99 Ca 0.21 -3.43 0.11 0.00 -0.05 0.00 0.00 57.45 54.29 3k2b n PHE 99 Cb 0.89 0.05 0.00 0.00 -0.94 0.00 0.00 39.48 39.49 3k2b n PHE 99 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 3k2b n VAL 100 N 0.32 0.00 -2.84 -4.37 0.24 -1.26 -3.62 118.33 106.81 3k2b n VAL 100 Ca 0.21 -0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.31 3k2b n VAL 100 Cb 0.67 0.75 0.02 0.00 -1.47 0.00 0.00 33.84 33.81 3k2b n VAL 100 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3k2b s ASP 101 N -3.00 5.48 0.21 -1.34 1.47 -1.26 -1.44 116.67 116.79 3k2b s ASP 101 Ca 0.09 -0.16 -0.08 0.00 1.18 0.00 0.00 52.55 53.57 3k2b s ASP 101 Cb 0.17 -0.84 0.15 0.00 -0.34 0.00 0.00 42.92 42.05 3k2b s ASP 101 CO 0.81 -0.94 1.77 -0.09 0.68 0.00 0.00 175.17 177.40 3k2b h ARG 102 N 0.34 1.15 -0.34 2.11 2.43 -1.93 0.28 114.38 118.42 3k2b h ARG 102 Ca -0.42 -0.21 0.03 0.00 -0.81 0.00 0.00 59.98 58.57 3k2b h ARG 102 Cb 1.29 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.62 3k2b h ARG 102 CO 0.50 0.93 0.17 1.49 -1.51 0.00 0.00 179.97 181.55 3k2b h GLU 103 N 1.11 0.34 0.02 0.20 4.22 -1.94 -0.92 114.58 117.60 3k2b h GLU 103 Ca 0.26 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.68 3k2b h GLU 103 Cb 0.21 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3k2b h GLU 103 CO -0.02 0.22 -0.01 0.78 -2.18 0.00 0.00 179.01 177.80 3k2b h GLY 104 N 0.35 -0.03 0.76 1.92 0.00 -1.83 -3.29 103.07 100.95 3k2b h GLY 104 Ca 0.15 0.01 0.15 0.00 0.00 0.00 0.00 47.33 47.64 3k2b h GLY 104 CO -0.11 -0.01 0.47 0.00 0.00 0.00 0.00 176.54 176.89 3k2b h ALA 105 N -0.03 2.27 -0.04 3.60 0.00 -0.48 -1.97 119.26 122.61 3k2b h ALA 105 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3k2b h ALA 105 Cb 0.77 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3k2b h ALA 105 CO 0.00 -0.45 -0.11 0.78 0.00 0.00 0.00 179.25 179.47 3k2b h GLY 106 N 0.26 0.06 0.49 0.00 0.00 -1.23 -2.98 103.07 99.68 3k2b h GLY 106 Ca 0.33 -0.03 0.14 0.00 0.00 0.00 0.00 47.33 47.77 3k2b h GLY 106 CO -0.08 0.03 0.62 0.50 0.00 0.00 0.00 176.54 177.62 3k2b h LYS 107 N 0.06 0.00 -0.16 4.80 1.57 -1.46 0.54 116.57 121.92 3k2b h LYS 107 Ca 0.01 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.64 3k2b h LYS 107 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3k2b h LYS 107 CO 0.01 0.00 -0.55 0.45 -0.57 0.00 0.00 179.45 178.80 3k2b h HIS 108 N 0.00 0.62 -0.21 -1.35 3.86 -1.73 -0.88 115.15 115.46 3k2b h HIS 108 Ca 0.23 -0.22 -0.13 0.00 -1.16 0.00 0.00 60.37 59.10 3k2b h HIS 108 Cb 1.47 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.82 3k2b h HIS 108 CO 0.00 0.93 -0.36 0.82 0.86 0.00 0.00 177.93 180.18 3k2b h ILE 109 N 0.38 1.33 -0.28 2.45 2.04 -0.10 0.01 117.51 123.33 3k2b h ILE 109 Ca 0.01 -1.58 0.03 0.00 1.00 0.00 0.00 64.86 64.31 3k2b h ILE 109 Cb 1.08 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 3k2b h ILE 109 CO 0.10 0.49 0.19 -0.33 0.00 0.00 0.00 178.15 178.60 3k2b h GLU 110 N 0.29 0.25 0.00 2.37 5.08 -1.38 0.28 114.58 121.48 3k2b h GLU 110 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k2b h GLU 110 Cb 0.96 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.15 3k2b h GLU 110 CO 0.08 0.17 0.00 0.00 -1.00 0.00 0.00 179.01 178.26 3k2b n ALA 111 N -2.52 2.35 0.00 3.43 0.00 -0.34 -4.89 120.51 118.53 3k2b n ALA 111 Ca 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3k2b n ALA 111 Cb 0.16 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3k2b n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k2b n GLY 112 N 1.01 1.19 3.88 0.00 0.00 1.00 -1.55 105.19 110.72 3k2b n GLY 112 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3k2b n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b s ALA 113 N -2.00 2.81 -0.09 4.61 0.00 -0.06 -4.19 121.76 122.84 3k2b s ALA 113 Ca 0.00 -0.40 0.14 0.00 0.00 0.00 0.00 51.96 51.70 3k2b s ALA 113 Cb 0.00 -3.02 -0.20 0.00 0.00 0.00 0.00 23.12 19.90 3k2b s ALA 113 CO 0.00 -1.28 0.17 1.63 0.00 0.00 0.00 175.76 176.28 3k2b n LYS 114 N -3.09 1.18 -3.85 0.00 5.02 -0.94 -4.26 118.16 112.21 3k2b n LYS 114 Ca 0.07 -0.06 -0.11 0.00 -2.02 0.00 0.00 58.31 56.19 3k2b n LYS 114 Cb 0.58 -1.36 -0.09 0.00 -0.02 0.00 0.00 35.03 34.13 3k2b n LYS 114 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3k2b s LYS 115 N -2.64 0.57 -0.07 1.97 2.20 0.36 -4.78 119.74 117.35 3k2b s LYS 115 Ca -0.06 -0.46 0.00 0.00 -0.36 0.00 0.00 55.97 55.09 3k2b s LYS 115 Cb 0.07 0.24 0.02 0.00 -1.51 0.00 0.00 37.83 36.65 3k2b s LYS 115 CO 0.60 -0.15 -0.04 0.08 -0.36 0.00 0.00 175.35 175.48 3k2b s VAL 116 N -1.78 0.63 -0.36 4.02 1.01 0.59 -0.42 120.40 124.09 3k2b s VAL 116 Ca -0.11 -0.10 -0.07 0.00 0.00 0.00 0.00 61.98 61.69 3k2b s VAL 116 Cb -0.05 -0.69 0.05 0.00 0.00 0.00 0.00 36.38 35.69 3k2b s VAL 116 CO 0.00 0.28 0.15 -0.63 0.00 0.00 0.00 175.10 174.90 3k2b s ILE 117 N 1.41 3.94 -0.16 2.22 1.01 -0.08 -1.48 121.20 128.07 3k2b s ILE 117 Ca -0.03 -1.21 -0.29 0.00 0.00 0.00 0.00 60.65 59.12 3k2b s ILE 117 Cb -0.13 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.03 3k2b s ILE 117 CO -0.03 -0.28 1.22 -0.63 0.00 0.00 0.00 174.94 175.22 3k2b s ILE 118 N 1.41 4.33 -0.20 2.92 1.01 0.14 -2.03 121.20 128.78 3k2b s ILE 118 Ca 0.00 1.62 -0.06 0.00 0.00 0.00 0.00 60.65 62.21 3k2b s ILE 118 Cb -0.20 -4.04 -0.18 0.00 0.01 0.00 0.00 42.46 38.04 3k2b s ILE 118 CO 0.03 -0.12 3.38 0.35 0.00 0.00 0.00 174.94 178.58 3k2b n THR 119 N 5.25 3.17 -3.70 2.92 -2.24 -0.91 -1.75 114.28 117.02 3k2b n THR 119 Ca 0.13 -1.94 0.02 0.00 -2.27 0.00 0.00 64.05 60.00 3k2b n THR 119 Cb 0.45 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 66.75 3k2b n THR 119 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b s ALA 120 N 0.39 -2.35 0.24 6.98 0.00 -1.22 -4.96 121.76 120.84 3k2b s ALA 120 Ca 0.65 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 3k2b s ALA 120 Cb 0.33 0.47 -0.10 0.00 0.00 0.00 0.00 23.12 23.82 3k2b s ALA 120 CO -0.06 -1.08 1.40 -2.14 0.00 0.00 0.00 175.76 173.88 3k2b s PRO 121 N -2.25 4.31 0.50 0.00 0.02 -1.25 -3.89 135.00 132.44 3k2b s PRO 121 Ca 0.18 2.22 -0.05 0.00 0.02 0.00 0.00 61.00 63.38 3k2b s PRO 121 Cb 0.04 -3.13 -0.02 0.00 0.02 0.00 0.00 34.50 31.41 3k2b s PRO 121 CO -0.04 -0.36 0.80 0.20 -0.33 0.00 0.00 177.00 177.27 3k2b s GLY 122 N 0.33 1.53 0.14 0.52 0.00 -1.26 -4.92 107.32 103.66 3k2b s GLY 122 Ca 0.58 -0.63 0.04 0.00 0.00 0.00 0.00 44.72 44.71 3k2b s GLY 122 CO 0.42 -0.44 0.17 0.54 0.00 0.00 0.00 173.10 173.80 3k2b s LYS 122 N -4.78 3.09 0.08 2.90 1.02 -0.52 -4.86 119.74 116.67 3k2b s LYS 122 Ca 0.49 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 55.74 3k2b s LYS 122 Cb -0.10 -2.78 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 3k2b s LYS 122 CO 0.44 0.52 0.00 0.41 -0.92 0.00 0.00 175.35 175.80 3k2b n GLY 123 N -0.24 -1.53 3.56 -3.33 0.00 -1.26 -4.15 105.19 98.24 3k2b n GLY 123 Ca -0.08 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 3k2b n GLY 123 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3k2b s ASP 124 N -3.60 5.60 -0.12 1.61 1.47 -1.26 -4.92 116.67 115.46 3k2b s ASP 124 Ca 0.00 -0.72 0.02 0.00 1.18 0.00 0.00 52.55 53.03 3k2b s ASP 124 Cb 0.00 -2.56 0.01 0.00 -0.34 0.00 0.00 42.92 40.03 3k2b s ASP 124 CO 0.00 -2.29 -0.19 -0.63 0.68 0.00 0.00 175.17 172.74 3k2b s ILE 125 N 8.23 1.78 -0.36 2.11 1.01 -1.26 -5.03 121.20 127.69 3k2b s ILE 125 Ca 0.61 -0.82 -0.41 0.00 0.00 0.00 0.00 60.65 60.02 3k2b s ILE 125 Cb -0.06 -1.59 -0.16 0.00 0.01 0.00 0.00 42.46 40.66 3k2b s ILE 125 CO 0.01 0.50 1.82 -2.65 0.00 0.00 0.00 174.94 174.62 3k2b n PRO 126 N 4.05 0.79 -4.78 2.79 -0.02 -1.26 -4.72 135.00 131.85 3k2b n PRO 126 Ca -0.20 0.28 -0.33 0.00 -2.02 0.00 0.00 63.50 61.23 3k2b n PRO 126 Cb 0.52 -1.97 -0.13 0.00 -0.02 0.00 0.00 33.50 31.90 3k2b n PRO 126 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3k2b s THR 127 N 4.21 3.30 0.03 3.45 2.01 -1.26 -0.67 115.64 126.71 3k2b s THR 127 Ca 1.04 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 62.43 3k2b s THR 127 Cb -1.18 -2.33 -0.02 0.00 0.01 0.00 0.00 72.50 68.99 3k2b s THR 127 CO 0.67 0.58 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.81 3k2b s TYR 128 N -0.62 0.58 -0.17 4.92 2.02 0.29 -4.77 117.35 119.60 3k2b s TYR 128 Ca 0.09 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.33 3k2b s TYR 128 Cb -0.11 -0.35 0.05 0.00 -0.40 0.00 0.00 41.96 41.14 3k2b s TYR 128 CO 0.01 -0.09 -0.02 0.08 -1.57 0.00 0.00 175.55 173.97 3k2b s VAL 129 N -1.21 0.90 0.23 0.71 1.01 -1.26 -3.89 120.40 116.89 3k2b s VAL 129 Ca -0.09 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 60.97 3k2b s VAL 129 Cb -0.09 -1.19 -0.11 0.00 0.00 0.00 0.00 36.38 34.99 3k2b s VAL 129 CO 0.00 0.01 1.59 -0.69 0.00 0.00 0.00 175.10 176.01 3k2b s VAL 130 N 1.71 2.33 0.00 2.92 1.01 -1.26 -1.31 120.40 125.79 3k2b s VAL 130 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.23 3k2b s VAL 130 Cb -0.16 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.06 3k2b s VAL 130 CO -0.07 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.67 3k2b n GLY 131 N 3.05 3.30 0.74 4.51 0.00 -1.26 -4.86 105.19 110.67 3k2b n GLY 131 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 3k2b n GLY 131 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k2b n VAL 132 N -1.69 0.77 -1.64 1.61 0.31 -0.43 -4.95 118.33 112.32 3k2b n VAL 132 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3k2b n VAL 132 Cb 0.00 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.24 3k2b n VAL 132 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3k2b n ASN 133 N -3.53 0.00 0.31 4.52 2.04 -0.87 -4.84 115.26 112.89 3k2b n ASN 133 Ca -0.13 -1.45 0.21 0.00 -0.44 0.00 0.00 54.58 52.78 3k2b n ASN 133 Cb 0.46 -0.09 1.14 0.00 -2.53 0.00 0.00 39.78 38.76 3k2b n ASN 133 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3k2b h ALA 134 N 0.00 1.00 0.00 -2.53 0.00 -1.92 0.17 119.26 115.98 3k2b h ALA 134 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k2b h ALA 134 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3k2b h ALA 134 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 178.85 3k2b n ASP 135 N -2.96 0.00 0.01 0.00 5.75 -1.26 -2.16 116.55 115.92 3k2b n ASP 135 Ca -0.03 -0.19 0.11 0.00 -0.01 0.00 0.00 54.79 54.67 3k2b n ASP 135 Cb 0.07 -0.18 -0.09 0.00 -1.03 0.00 0.00 41.12 39.89 3k2b n ASP 135 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k2b n ALA 136 N -1.18 3.72 -1.69 2.12 0.00 0.60 -4.95 120.51 119.13 3k2b n ALA 136 Ca 0.10 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 3k2b n ALA 136 Cb 0.11 -0.83 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 3k2b n ALA 136 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3k2b n TYR 137 N -1.88 2.22 -4.36 0.00 9.36 -0.92 -4.98 117.16 116.60 3k2b n TYR 137 Ca 0.01 0.55 -0.20 0.00 3.32 0.00 0.00 57.90 61.58 3k2b n TYR 137 Cb 0.44 -2.40 -0.16 0.00 -0.63 0.00 0.00 39.34 36.59 3k2b n TYR 137 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3k2b s SER 138 N -0.34 1.17 0.65 2.98 0.15 -1.26 -5.01 113.70 112.03 3k2b s SER 138 Ca 0.56 -0.18 0.29 0.00 0.70 0.00 0.00 55.95 57.32 3k2b s SER 138 Cb -0.57 -0.35 1.56 0.00 -1.71 0.00 0.00 66.02 64.95 3k2b s SER 138 CO 0.62 0.05 1.90 -0.74 1.20 0.00 0.00 173.24 176.26 3k2b h HIS 139 N 6.50 0.00 0.00 3.44 2.76 -1.94 -0.71 115.15 125.20 3k2b h HIS 139 Ca -0.34 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 3k2b h HIS 139 Cb 1.17 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.13 3k2b h HIS 139 CO 0.45 0.00 0.00 -0.44 -1.30 0.00 0.00 177.93 176.64 3k2b h ASP 140 N 0.00 0.00 -3.42 3.26 3.32 -1.95 -3.40 116.42 114.23 3k2b h ASP 140 Ca 0.05 0.00 -0.70 0.00 0.02 0.00 0.00 57.03 56.39 3k2b h ASP 140 Cb 0.80 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.16 3k2b h ASP 140 CO -0.00 0.00 -0.17 -1.61 -1.72 0.00 0.00 179.24 175.74 3k2b s GLU 141 N -3.70 3.07 0.39 3.56 2.02 -0.27 -4.96 118.70 118.80 3k2b s GLU 141 Ca -0.02 -0.92 0.16 0.00 0.02 0.00 0.00 54.97 54.22 3k2b s GLU 141 Cb 0.09 -4.03 0.79 0.00 0.10 0.00 0.00 34.13 31.08 3k2b s GLU 141 CO 0.30 -0.98 1.82 -1.00 0.02 0.00 0.00 175.26 175.43 3k2b h PRO 142 N 8.80 0.00 -4.45 0.39 0.13 -1.86 -3.43 132.00 131.57 3k2b h PRO 142 Ca -0.27 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.33 3k2b h PRO 142 Cb 1.11 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.89 3k2b h PRO 142 CO 0.85 0.35 -0.81 0.42 -0.23 0.00 0.00 178.00 178.58 3k2b s ILE 143 N -3.99 1.16 0.11 -3.56 1.01 -1.26 -0.30 121.20 114.36 3k2b s ILE 143 Ca -0.02 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.21 3k2b s ILE 143 Cb 0.13 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3k2b s ILE 143 CO 0.70 0.38 -0.04 0.27 0.00 0.00 0.00 174.94 176.25 3k2b s ILE 144 N 1.14 0.56 -0.03 2.92 -4.36 -0.55 -4.27 121.20 116.62 3k2b s ILE 144 Ca -0.05 -1.92 0.06 0.00 -0.26 0.00 0.00 60.65 58.48 3k2b s ILE 144 Cb -0.14 -1.77 -0.02 0.00 1.25 0.00 0.00 42.46 41.77 3k2b s ILE 144 CO -0.02 -0.78 -0.22 -0.55 0.24 0.00 0.00 174.94 173.61 3k2b s SER 145 N -3.05 3.43 -0.32 4.36 0.15 0.15 0.24 113.70 118.66 3k2b s SER 145 Ca 0.14 -0.37 0.09 0.00 0.70 0.00 0.00 55.95 56.51 3k2b s SER 145 Cb 0.06 -0.53 0.73 0.00 -1.71 0.00 0.00 66.02 64.58 3k2b s SER 145 CO -0.03 0.32 1.80 -3.20 1.20 0.00 0.00 173.24 173.33 3k2b n ASN 146 N 2.33 4.78 -0.25 5.45 5.15 -0.72 -0.55 115.26 131.46 3k2b n ASN 146 Ca -0.16 -3.20 0.00 0.00 -0.60 0.00 0.00 54.58 50.62 3k2b n ASN 146 Cb 0.51 -0.75 0.00 0.00 -0.53 0.00 0.00 39.78 39.02 3k2b n ASN 146 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3k2b n ALA 147 N -0.15 0.00 -2.37 5.20 0.00 -1.25 -4.81 120.51 117.13 3k2b n ALA 147 Ca 0.41 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.65 3k2b n ALA 147 Cb 1.39 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.81 3k2b n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k2b s SER 148 N -4.00 5.36 0.12 0.00 1.04 -1.26 -3.44 113.70 111.52 3k2b s SER 148 Ca 0.00 -0.51 -0.23 0.00 0.48 0.00 0.00 55.95 55.69 3k2b s SER 148 Cb 0.00 -0.86 -0.05 0.00 0.10 0.00 0.00 66.02 65.21 3k2b s SER 148 CO 0.00 -0.49 1.68 0.00 0.98 0.00 0.00 173.24 175.40 3k2b h THR 150 N -0.19 0.85 -0.47 0.00 2.02 -1.95 -1.91 112.91 111.27 3k2b h THR 150 Ca 0.07 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 3k2b h THR 150 Cb 0.29 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3k2b h THR 150 CO -0.19 0.10 0.19 0.74 0.37 0.00 0.00 175.52 176.73 3k2b h THR 151 N 0.57 1.21 -0.02 3.16 2.02 -1.75 -1.32 112.91 116.78 3k2b h THR 151 Ca 0.33 -0.65 0.01 0.00 0.77 0.00 0.00 66.41 66.87 3k2b h THR 151 Cb 0.33 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3k2b h THR 151 CO -0.26 0.24 0.02 0.78 0.37 0.00 0.00 175.52 176.67 3k2b h ASN 152 N 0.62 0.00 0.00 4.18 4.21 -0.47 0.73 115.58 124.85 3k2b h ASN 152 Ca 0.16 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.63 3k2b h ASN 152 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 3k2b h ASN 152 CO -0.01 0.00 -0.14 0.00 -1.29 0.00 0.00 177.43 175.98 3k2b h LEU 154 N -0.66 -0.94 -0.88 0.00 4.07 -0.67 -3.33 115.31 112.90 3k2b h LEU 154 Ca -0.02 0.03 0.12 0.00 0.08 0.00 0.00 57.88 58.10 3k2b h LEU 154 Cb 0.94 0.24 -0.13 0.00 1.08 0.00 0.00 40.66 42.79 3k2b h LEU 154 CO 0.03 -0.66 -0.39 0.00 -1.08 0.00 0.00 178.44 176.34 3k2b n ALA 155 N -2.56 -0.22 -0.25 1.53 0.00 0.20 -1.12 120.51 118.10 3k2b n ALA 155 Ca -0.14 0.85 0.12 0.00 0.00 0.00 0.00 53.44 54.27 3k2b n ALA 155 Cb 0.44 -0.33 0.39 0.00 0.00 0.00 0.00 19.45 19.95 3k2b n ALA 155 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3k2b h PRO 156 N 0.00 0.64 0.00 0.00 0.11 -1.71 0.30 132.00 131.34 3k2b h PRO 156 Ca 0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.34 3k2b h PRO 156 Cb 0.49 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.46 3k2b h PRO 156 CO -0.87 0.42 -1.04 1.97 -0.21 0.00 0.00 178.00 178.28 3k2b n PHE 157 N -4.54 0.25 0.08 0.65 1.16 -0.27 -3.29 117.46 111.49 3k2b n PHE 157 Ca 0.16 0.07 -0.09 0.00 -1.87 0.00 0.00 57.45 55.73 3k2b n PHE 157 Cb 0.46 -0.42 -0.03 0.00 -1.61 0.00 0.00 39.48 37.88 3k2b n PHE 157 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 3k2b h VAL 158 N 0.00 1.52 -0.32 1.97 2.07 -0.94 -1.32 116.25 119.23 3k2b h VAL 158 Ca 0.00 -2.77 0.02 0.00 0.82 0.00 0.00 66.70 64.77 3k2b h VAL 158 Cb 0.72 2.56 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 3k2b h VAL 158 CO 0.00 0.80 0.18 0.50 0.02 0.00 0.00 177.57 179.07 3k2b h LYS 159 N 0.09 0.36 -0.11 1.57 3.64 -1.00 -0.03 116.57 121.08 3k2b h LYS 159 Ca -0.05 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3k2b h LYS 159 Cb 1.58 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.32 3k2b h LYS 159 CO 0.14 0.24 0.03 0.28 -2.27 0.00 0.00 179.45 177.86 3k2b h VAL 160 N 0.37 1.20 -0.15 2.00 2.07 -1.52 -2.20 116.25 118.02 3k2b h VAL 160 Ca 0.13 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.05 3k2b h VAL 160 Cb 0.01 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3k2b h VAL 160 CO -0.07 0.18 -0.04 -0.07 0.02 0.00 0.00 177.57 177.59 3k2b h LEU 161 N -0.02 -0.15 -0.86 2.57 3.38 -1.00 -0.88 115.31 118.35 3k2b h LEU 161 Ca 0.04 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 3k2b h LEU 161 Cb 0.26 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3k2b h LEU 161 CO 0.00 -0.06 -0.04 -0.78 0.09 0.00 0.00 178.44 177.66 3k2b h ASP 162 N -0.01 0.78 0.64 -0.43 3.58 -0.99 0.22 116.42 120.21 3k2b h ASP 162 Ca 0.07 -0.21 -0.13 0.00 0.42 0.00 0.00 57.03 57.19 3k2b h ASP 162 Cb 0.12 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 3k2b h ASP 162 CO -0.16 0.87 -0.63 1.56 -2.88 0.00 0.00 179.24 178.01 3k2b h GLN 163 N 0.74 0.00 0.00 0.28 4.20 -1.17 -1.84 115.11 117.32 3k2b h GLN 163 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 3k2b h GLN 163 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 3k2b h GLN 163 CO 0.03 0.63 -0.86 1.63 -0.67 0.00 0.00 178.83 179.58 3k2b n LYS 164 N -3.78 1.78 0.00 1.46 5.02 -0.35 -4.72 118.16 117.55 3k2b n LYS 164 Ca -0.01 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3k2b n LYS 164 Cb 0.62 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 3k2b n LYS 164 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3k2b n PHE 165 N -1.46 0.00 -1.51 2.13 3.72 0.73 -4.96 117.46 116.10 3k2b n PHE 165 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 3k2b n PHE 165 Cb 0.26 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 3k2b n PHE 165 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k2b n GLY 166 N 0.04 -4.29 3.67 1.37 0.00 -0.69 -2.05 105.19 103.24 3k2b n GLY 166 Ca 0.00 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 3k2b n GLY 166 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k2b s ILE 167 N -0.27 5.06 -0.12 -0.61 1.01 -1.26 -1.01 121.20 123.99 3k2b s ILE 167 Ca 0.00 1.13 -0.19 0.00 0.00 0.00 0.00 60.65 61.58 3k2b s ILE 167 Cb 0.00 -3.91 -0.26 0.00 0.01 0.00 0.00 42.46 38.29 3k2b s ILE 167 CO 0.00 0.15 0.56 0.40 0.00 0.00 0.00 174.94 176.06 3k2b h ILE 168 N 5.10 1.17 -1.14 2.92 5.03 -1.14 -3.48 117.51 125.97 3k2b h ILE 168 Ca -0.33 -2.37 0.30 0.00 -0.12 0.00 0.00 64.86 62.34 3k2b h ILE 168 Cb 1.15 2.78 -0.21 0.00 -3.03 0.00 0.00 36.82 37.50 3k2b h ILE 168 CO 0.76 0.63 0.94 -1.59 -0.68 0.00 0.00 178.15 178.21 3k2b s LYS 169 N -2.42 0.10 0.28 2.37 -2.85 -1.22 -4.90 119.74 111.10 3k2b s LYS 169 Ca -0.21 -0.03 -0.17 0.00 -1.00 0.00 0.00 55.97 54.56 3k2b s LYS 169 Cb 0.03 0.04 0.01 0.00 -2.06 0.00 0.00 37.83 35.86 3k2b s LYS 169 CO 0.73 -0.04 0.63 0.20 0.10 0.00 0.00 175.35 176.97 3k2b s GLY 170 N -1.90 0.20 0.14 0.59 0.00 0.18 -0.82 107.32 105.72 3k2b s GLY 170 Ca 0.11 -0.57 0.05 0.00 0.00 0.00 0.00 44.72 44.31 3k2b s GLY 170 CO -0.04 -0.32 -0.12 -1.08 0.00 0.00 0.00 173.10 171.54 3k2b s THR 171 N -3.83 1.29 -0.09 0.90 -1.32 0.37 -2.94 115.64 110.01 3k2b s THR 171 Ca 0.16 -1.93 -0.12 0.00 -1.21 0.00 0.00 61.69 58.58 3k2b s THR 171 Cb -0.04 -1.72 0.03 0.00 -1.51 0.00 0.00 72.50 69.26 3k2b s THR 171 CO 0.08 -0.59 0.33 -0.32 -2.21 0.00 0.00 174.62 171.91 3k2b s MET 172 N -3.28 0.47 -0.04 7.08 0.00 -0.13 -0.94 119.30 122.46 3k2b s MET 172 Ca 0.14 0.28 0.02 0.00 0.00 0.00 0.00 55.69 56.13 3k2b s MET 172 Cb -0.01 0.22 0.02 0.00 0.00 0.00 0.00 34.83 35.06 3k2b s MET 172 CO 0.02 -0.08 -0.07 0.99 0.00 0.00 0.00 175.02 175.88 3k2b s THR 173 N -0.24 0.73 -0.16 10.11 2.01 -0.65 -1.65 115.64 125.78 3k2b s THR 173 Ca -0.04 -0.26 -0.03 0.00 0.31 0.00 0.00 61.69 61.68 3k2b s THR 173 Cb -0.03 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 3k2b s THR 173 CO 0.01 0.26 -0.06 0.28 -0.69 0.00 0.00 174.62 174.42 3k2b s THR 174 N 0.69 3.56 -0.49 -0.82 -1.32 -0.88 -0.29 115.64 116.10 3k2b s THR 174 Ca -0.11 -0.47 -0.14 0.00 -1.21 0.00 0.00 61.69 59.77 3k2b s THR 174 Cb -0.14 -2.56 0.10 0.00 -1.51 0.00 0.00 72.50 68.40 3k2b s THR 174 CO 0.01 0.49 0.41 -0.89 -2.21 0.00 0.00 174.62 172.43 3k2b s THR 175 N 0.60 4.94 -0.05 5.08 2.01 0.33 -0.22 115.64 128.33 3k2b s THR 175 Ca -0.04 -1.38 0.01 0.00 0.31 0.00 0.00 61.69 60.59 3k2b s THR 175 Cb -0.15 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 3k2b s THR 175 CO 0.03 -0.71 -0.06 -2.28 -0.69 0.00 0.00 174.62 170.91 3k2b s HIS 176 N 1.56 2.96 0.82 4.92 5.04 0.15 -1.05 115.29 129.68 3k2b s HIS 176 Ca 0.04 0.03 -0.13 0.00 -1.54 0.00 0.00 55.06 53.46 3k2b s HIS 176 Cb -0.27 -1.69 0.09 0.00 0.04 0.00 0.00 32.58 30.75 3k2b s HIS 176 CO 0.04 0.37 1.20 -1.12 -2.34 0.00 0.00 174.74 172.89 3k2b s SER 177 N -1.01 3.49 0.62 9.88 0.01 -1.25 -0.74 113.70 124.71 3k2b s SER 177 Ca 0.14 2.37 -0.13 0.00 1.31 0.00 0.00 55.95 59.64 3k2b s SER 177 Cb -0.11 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 3k2b s SER 177 CO 0.04 -2.74 1.04 -0.72 0.41 0.00 0.00 173.24 171.27 3k2b s TYR 178 N -2.18 3.25 0.40 2.43 -0.85 -0.56 -4.66 117.35 115.17 3k2b s TYR 178 Ca 0.73 1.43 0.04 0.00 -0.52 0.00 0.00 57.07 58.74 3k2b s TYR 178 Cb -0.28 -2.86 -0.03 0.00 0.38 0.00 0.00 41.96 39.16 3k2b s TYR 178 CO 0.51 -0.94 0.12 0.95 -1.52 0.00 0.00 175.55 174.67 3k2b s THR 179 N -2.85 0.69 -1.34 -3.49 -4.23 -1.26 -4.69 115.64 98.47 3k2b s THR 179 Ca 0.59 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.15 3k2b s THR 179 Cb -0.13 -2.40 0.08 0.00 1.34 0.00 0.00 72.50 71.38 3k2b s THR 179 CO 0.46 0.00 1.02 0.61 -0.54 0.00 0.00 174.62 176.17 3k2b n GLY 180 N -0.88 -0.49 0.01 3.99 0.00 -1.26 -1.82 105.19 104.74 3k2b n GLY 180 Ca -0.06 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.07 3k2b n GLY 180 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k2b n ASP 181 N -1.33 0.23 -4.91 1.61 2.03 -1.26 -4.82 116.55 108.10 3k2b n ASP 181 Ca 0.02 0.09 -0.28 0.00 0.52 0.00 0.00 54.79 55.14 3k2b n ASP 181 Cb 0.04 -0.18 -0.03 0.00 -0.72 0.00 0.00 41.12 40.23 3k2b n ASP 181 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3k2b s GLN 182 N -2.93 3.58 0.12 -0.67 -0.21 -0.76 -4.90 119.66 113.89 3k2b s GLN 182 Ca 0.15 -0.15 -0.15 0.00 0.02 0.00 0.00 55.36 55.24 3k2b s GLN 182 Cb 0.19 -2.73 -0.07 0.00 1.00 0.00 0.00 33.01 31.40 3k2b s GLN 182 CO 0.58 0.29 0.52 1.03 -2.12 0.00 0.00 175.29 175.60 3k2b s ARG 183 N -3.46 3.98 0.25 2.91 1.81 -1.03 -4.95 118.95 118.47 3k2b s ARG 183 Ca 0.41 0.49 -0.04 0.00 -1.72 0.00 0.00 55.73 54.87 3k2b s ARG 183 Cb -0.11 -3.01 0.28 0.00 -0.45 0.00 0.00 34.95 31.67 3k2b s ARG 183 CO 0.30 0.53 1.76 1.25 -0.68 0.00 0.00 175.30 178.45 3k2b h LEU 184 N 3.82 0.86 -8.57 2.53 5.85 -1.91 -1.68 115.31 116.20 3k2b h LEU 184 Ca -0.49 -0.19 -0.26 0.00 0.84 0.00 0.00 57.88 57.78 3k2b h LEU 184 Cb 1.20 -0.23 -0.15 0.00 0.37 0.00 0.00 40.66 41.85 3k2b h LEU 184 CO 0.65 0.88 -0.68 -0.76 -0.34 0.00 0.00 178.44 178.19 3k2b s LEU 185 N -9.31 2.25 -0.45 2.25 1.43 -1.26 -4.09 118.68 109.51 3k2b s LEU 185 Ca -0.10 -1.11 -0.37 0.00 -1.03 0.00 0.00 54.13 51.52 3k2b s LEU 185 Cb 0.15 -0.06 -0.14 0.00 0.03 0.00 0.00 46.19 46.17 3k2b s LEU 185 CO 0.82 -0.53 2.22 0.47 0.23 0.00 0.00 176.35 179.56 3k2b n ASP 186 N -0.17 1.59 -4.06 2.29 10.43 -1.26 -4.43 116.55 120.95 3k2b n ASP 186 Ca -0.09 0.43 -0.09 0.00 2.57 0.00 0.00 54.79 57.62 3k2b n ASP 186 Cb 0.62 -1.14 -0.09 0.00 1.84 0.00 0.00 41.12 42.35 3k2b n ASP 186 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3k2b s ALA 187 N 7.27 0.47 0.27 2.24 0.00 -0.46 -4.98 121.76 126.56 3k2b s ALA 187 Ca 1.14 -1.18 -0.31 0.00 0.00 0.00 0.00 51.96 51.62 3k2b s ALA 187 Cb -1.05 0.62 -0.13 0.00 0.00 0.00 0.00 23.12 22.57 3k2b s ALA 187 CO 0.53 -0.48 1.49 0.43 0.00 0.00 0.00 175.76 177.73 3k2b n SER 188 N -0.04 3.24 -3.49 0.00 7.64 -1.26 -4.52 113.62 115.19 3k2b n SER 188 Ca -0.10 1.15 -0.14 0.00 1.01 0.00 0.00 58.87 60.79 3k2b n SER 188 Cb 0.63 -1.50 -0.04 0.00 -1.01 0.00 0.00 64.21 62.28 3k2b n SER 188 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3k2b s HIS 190 N -0.07 -0.56 -0.86 1.43 5.04 -1.26 -4.94 115.29 114.06 3k2b s HIS 190 Ca 0.66 0.71 0.26 0.00 -1.54 0.00 0.00 55.06 55.15 3k2b s HIS 190 Cb -0.58 0.48 1.00 0.00 0.04 0.00 0.00 32.58 33.52 3k2b s HIS 190 CO 0.50 -0.66 1.80 2.89 -2.34 0.00 0.00 174.74 176.93 3k2b n ARG 191 N 0.32 0.11 -3.60 2.88 1.85 -1.26 -4.27 116.66 112.69 3k2b n ARG 191 Ca -0.17 0.14 -0.40 0.00 -1.00 0.00 0.00 57.85 56.43 3k2b n ARG 191 Cb 0.60 -1.64 -0.08 0.00 -1.05 0.00 0.00 32.46 30.29 3k2b n ARG 191 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3k2b s ASP 192 N -3.63 5.65 0.61 2.89 -1.08 -1.26 -4.97 116.67 114.87 3k2b s ASP 192 Ca 0.11 -2.28 0.27 0.00 -0.52 0.00 0.00 52.55 50.13 3k2b s ASP 192 Cb 0.15 -1.97 1.08 0.00 -1.46 0.00 0.00 42.92 40.72 3k2b s ASP 192 CO 0.51 -0.57 1.48 -0.07 0.52 0.00 0.00 175.17 177.04 3k2b h LEU 193 N 7.93 0.00 0.16 -1.34 3.38 -1.99 0.24 115.31 123.69 3k2b h LEU 193 Ca -0.11 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.53 3k2b h LEU 193 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3k2b h LEU 193 CO 0.78 0.00 -1.69 0.03 0.09 0.00 0.00 178.44 177.65 3k2b h ARG 194 N 0.00 0.34 0.00 1.13 3.08 -1.93 -3.26 114.38 113.74 3k2b h ARG 194 Ca 0.39 -0.58 0.00 0.00 0.07 0.00 0.00 59.98 59.85 3k2b h ARG 194 Cb 2.35 0.22 0.00 0.00 0.08 0.00 0.00 29.97 32.62 3k2b h ARG 194 CO -0.00 1.24 0.00 0.54 -1.07 0.00 0.00 179.97 180.67 3k2b n ARG 195 N -3.53 0.04 0.19 0.04 1.74 0.76 -2.08 116.66 113.80 3k2b n ARG 195 Ca -0.22 0.19 0.14 0.00 -0.77 0.00 0.00 57.85 57.19 3k2b n ARG 195 Cb 1.07 -1.56 0.43 0.00 -1.02 0.00 0.00 32.46 31.38 3k2b n ARG 195 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k2b h ALA 196 N 2.62 1.00 -2.31 7.54 0.00 -1.31 -2.72 119.26 124.09 3k2b h ALA 196 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 3k2b h ALA 196 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3k2b h ALA 196 CO 0.00 0.00 0.20 1.03 0.00 0.00 0.00 179.25 180.48 3k2b s ARG 197 N -3.32 4.19 -0.80 0.00 1.81 -0.88 -1.35 118.95 118.59 3k2b s ARG 197 Ca 0.06 0.91 -0.33 0.00 -1.72 0.00 0.00 55.73 54.65 3k2b s ARG 197 Cb 0.09 -2.50 -0.19 0.00 -0.45 0.00 0.00 34.95 31.90 3k2b s ARG 197 CO 0.56 0.17 2.53 0.00 -0.68 0.00 0.00 175.30 177.88 3k2b n ALA 198 N -0.10 0.40 -0.20 2.13 0.00 -1.26 -4.35 120.51 117.13 3k2b n ALA 198 Ca 0.03 -0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.21 3k2b n ALA 198 Cb 0.53 -2.38 0.11 0.00 0.00 0.00 0.00 19.45 17.71 3k2b n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b h ALA 199 N 12.47 0.68 -0.19 0.00 0.00 -1.45 -2.20 119.26 128.58 3k2b h ALA 199 Ca -0.10 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3k2b h ALA 199 Cb 1.32 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.35 3k2b h ALA 199 CO 1.28 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 180.19 3k2b n ALA 200 N -2.67 2.57 0.00 0.00 0.00 -1.26 -3.71 120.51 115.44 3k2b n ALA 200 Ca 0.09 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.14 3k2b n ALA 200 Cb 0.34 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.79 3k2b n ALA 200 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k2b n LEU 201 N 0.10 0.00 -4.38 0.00 4.77 -0.85 -4.84 117.00 111.81 3k2b n LEU 201 Ca 0.07 -0.14 -0.19 0.00 -0.03 0.00 0.00 56.01 55.72 3k2b n LEU 201 Cb 0.25 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 3k2b n LEU 201 CO 0.06 0.00 -0.35 0.20 -1.33 0.00 0.00 177.39 175.97 3k2b s ASN 202 N -1.74 2.30 -0.28 -1.43 -0.87 -1.09 -5.04 114.94 106.79 3k2b s ASN 202 Ca -0.00 -1.20 -0.15 0.00 -1.57 0.00 0.00 52.86 49.93 3k2b s ASN 202 Cb 0.00 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.25 41.12 3k2b s ASN 202 CO 0.01 -0.43 0.40 -0.63 -2.57 0.00 0.00 177.10 173.88 3k2b s ILE 203 N -3.22 5.15 -0.30 0.60 1.01 -1.26 -4.10 121.20 119.09 3k2b s ILE 203 Ca 0.29 0.58 -0.04 0.00 0.00 0.00 0.00 60.65 61.48 3k2b s ILE 203 Cb 0.05 -3.74 0.04 0.00 0.01 0.00 0.00 42.46 38.82 3k2b s ILE 203 CO 0.10 0.12 0.03 -0.69 0.00 0.00 0.00 174.94 174.50 3k2b s VAL 204 N 2.12 3.31 0.11 2.92 1.01 0.32 -4.89 120.40 125.29 3k2b s VAL 204 Ca 0.16 -1.19 -0.31 0.00 0.00 0.00 0.00 61.98 60.64 3k2b s VAL 204 Cb -0.16 -2.84 -0.08 0.00 0.00 0.00 0.00 36.38 33.30 3k2b s VAL 204 CO 0.10 -0.07 1.43 -2.84 0.00 0.00 0.00 175.10 173.73 3k2b s PRO 205 N 1.33 4.29 -0.05 2.72 0.02 -1.26 0.22 135.00 142.27 3k2b s PRO 205 Ca -0.03 2.12 -0.06 0.00 0.02 0.00 0.00 61.00 63.05 3k2b s PRO 205 Cb -0.19 -3.29 0.01 0.00 0.02 0.00 0.00 34.50 31.05 3k2b s PRO 205 CO -0.00 -0.49 0.16 -0.08 -0.33 0.00 0.00 177.00 176.25 3k2b s THR 206 N 1.35 0.01 0.49 0.99 -1.32 0.31 -4.80 115.64 112.67 3k2b s THR 206 Ca 0.66 -0.07 -0.20 0.00 -1.21 0.00 0.00 61.69 60.87 3k2b s THR 206 Cb -0.37 -0.25 -0.08 0.00 -1.51 0.00 0.00 72.50 70.28 3k2b s THR 206 CO 0.30 -0.04 1.04 -0.94 -2.21 0.00 0.00 174.62 172.77 3k2b s SER 207 N -0.05 6.32 0.13 8.08 1.04 -1.26 0.15 113.70 128.10 3k2b s SER 207 Ca -0.01 1.90 0.01 0.00 0.48 0.00 0.00 55.95 58.32 3k2b s SER 207 Cb -0.02 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 3k2b s SER 207 CO 0.00 -0.80 0.00 0.28 0.98 0.00 0.00 173.24 173.71 3k2b s THR 208 N -2.04 0.44 0.00 2.02 -1.32 -1.26 -4.78 115.64 108.70 3k2b s THR 208 Ca 0.67 -1.93 0.00 0.00 -1.21 0.00 0.00 61.69 59.22 3k2b s THR 208 Cb -0.16 -1.95 0.00 0.00 -1.51 0.00 0.00 72.50 68.89 3k2b s THR 208 CO 0.21 -0.61 0.46 0.61 -2.21 0.00 0.00 174.62 173.08 3k2b n GLY 209 N -0.12 -1.28 0.29 6.08 0.00 -1.26 -4.75 105.19 104.15 3k2b n GLY 209 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.98 3k2b n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b h ALA 210 N 0.00 0.64 -0.42 4.61 0.00 -1.96 0.37 119.26 122.50 3k2b h ALA 210 Ca 0.00 0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.26 3k2b h ALA 210 Cb 0.01 0.55 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 3k2b h ALA 210 CO 0.00 -0.42 0.14 0.00 0.00 0.00 0.00 179.25 178.97 3k2b h ALA 211 N 1.78 0.50 0.00 0.00 0.00 -1.87 -0.21 119.26 119.47 3k2b h ALA 211 Ca 0.40 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.31 3k2b h ALA 211 Cb 0.66 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3k2b h ALA 211 CO -0.79 -0.25 -0.30 0.87 0.00 0.00 0.00 179.25 178.79 3k2b h LYS 212 N 0.30 0.00 -0.33 0.00 1.57 -0.97 -2.96 116.57 114.18 3k2b h LYS 212 Ca 0.20 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.87 3k2b h LYS 212 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3k2b h LYS 212 CO -0.21 0.30 -0.24 0.00 -0.57 0.00 0.00 179.45 178.73 3k2b h ALA 213 N 1.70 0.97 -0.39 3.86 0.00 0.13 -2.94 119.26 122.60 3k2b h ALA 213 Ca -0.00 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 54.63 3k2b h ALA 213 Cb 0.79 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 3k2b h ALA 213 CO 0.04 0.60 -0.23 0.28 0.00 0.00 0.00 179.25 179.94 3k2b h VAL 214 N 0.57 0.37 0.00 0.00 2.07 -1.05 0.47 116.25 118.66 3k2b h VAL 214 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3k2b h VAL 214 Cb 0.71 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3k2b h VAL 214 CO 0.05 0.00 0.47 0.00 0.02 0.00 0.00 177.57 178.11 3k2b h ALA 215 N 1.04 1.46 -0.16 1.67 0.00 -1.62 0.13 119.26 121.78 3k2b h ALA 215 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 3k2b h ALA 215 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3k2b h ALA 215 CO -0.49 -0.46 -0.38 -0.07 0.00 0.00 0.00 179.25 177.85 3k2b h LEU 216 N 0.00 0.61 0.00 0.00 3.38 -0.15 -2.59 115.31 116.56 3k2b h LEU 216 Ca 0.00 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.40 3k2b h LEU 216 Cb 0.93 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.51 3k2b h LEU 216 CO 0.00 1.07 -0.56 1.33 0.09 0.00 0.00 178.44 180.37 3k2b n VAL 217 N -4.30 0.12 -3.42 1.22 0.24 0.27 -4.37 118.33 108.09 3k2b n VAL 217 Ca -0.07 -0.10 -0.26 0.00 -2.04 0.00 0.00 64.34 61.86 3k2b n VAL 217 Cb 0.52 0.10 -0.10 0.00 -1.47 0.00 0.00 33.84 32.90 3k2b n VAL 217 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3k2b n LEU 218 N -1.73 0.34 -0.33 1.34 4.77 -0.06 -4.65 117.00 116.67 3k2b n LEU 218 Ca 0.05 -4.61 0.10 0.00 -0.03 0.00 0.00 56.01 51.52 3k2b n LEU 218 Cb 0.38 0.33 0.21 0.00 -2.33 0.00 0.00 43.42 42.01 3k2b n LEU 218 CO 0.36 1.90 0.75 -0.65 -1.33 0.00 0.00 177.39 178.42 3k2b h PRO 219 N 5.18 0.01 -0.47 3.23 0.11 -1.66 0.19 132.00 138.59 3k2b h PRO 219 Ca 0.21 -0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.45 3k2b h PRO 219 Cb 0.87 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3k2b h PRO 219 CO 0.46 0.01 0.78 -0.97 -0.21 0.00 0.00 178.00 178.07 3k2b h ASN 220 N 0.02 0.00 -0.53 -2.05 -1.24 -1.95 0.78 115.58 110.61 3k2b h ASN 220 Ca 0.52 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.53 3k2b h ASN 220 Cb 0.97 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.02 3k2b h ASN 220 CO -0.92 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 175.40 3k2b n LEU 221 N -3.20 3.10 -4.62 0.34 7.99 0.67 -4.96 117.00 116.33 3k2b n LEU 221 Ca 0.10 -1.56 -0.47 0.00 -0.01 0.00 0.00 56.01 54.07 3k2b n LEU 221 Cb 0.95 -0.40 -0.03 0.00 -0.11 0.00 0.00 43.42 43.83 3k2b n LEU 221 CO 0.19 0.71 0.82 0.29 -1.51 0.00 0.00 177.39 177.88 3k2b n LYS 222 N 1.02 1.52 -1.53 3.23 4.76 0.26 -1.34 118.16 126.09 3k2b n LYS 222 Ca 0.19 0.54 -0.15 0.00 -2.87 0.00 0.00 58.31 56.01 3k2b n LYS 222 Cb 0.52 -2.09 -0.06 0.00 -1.84 0.00 0.00 35.03 31.56 3k2b n LYS 222 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k2b n GLY 223 N 1.98 1.28 0.00 0.72 0.00 -1.26 -4.80 105.19 103.11 3k2b n GLY 223 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.22 3k2b n GLY 223 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k2b n LYS 224 N -2.08 1.55 -4.29 1.61 5.02 -0.45 -5.00 118.16 114.52 3k2b n LYS 224 Ca -0.15 -0.06 -0.21 0.00 -2.02 0.00 0.00 58.31 55.87 3k2b n LYS 224 Cb 0.51 -1.23 -0.13 0.00 -0.02 0.00 0.00 35.03 34.17 3k2b n LYS 224 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3k2b s LEU 225 N -3.25 2.25 0.34 -0.35 1.43 -1.26 0.50 118.68 118.34 3k2b s LEU 225 Ca 0.00 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 3k2b s LEU 225 Cb 0.10 -0.66 -0.00 0.00 0.03 0.00 0.00 46.19 45.65 3k2b s LEU 225 CO 0.57 0.00 0.43 0.21 0.23 0.00 0.00 176.35 177.79 3k2b s ASN 226 N -1.57 1.12 0.00 2.29 3.84 -1.15 -4.28 114.94 115.18 3k2b s ASN 226 Ca 0.02 -1.56 0.00 0.00 0.21 0.00 0.00 52.86 51.53 3k2b s ASN 226 Cb -0.09 0.64 0.00 0.00 -0.55 0.00 0.00 41.25 41.25 3k2b s ASN 226 CO 0.02 -1.25 0.00 0.61 -2.79 0.00 0.00 177.10 173.70 3k2b n GLY 227 N -0.58 -1.03 3.34 1.21 0.00 -1.26 -0.96 105.19 105.91 3k2b n GLY 227 Ca 0.02 -1.12 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 3k2b n GLY 227 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k2b s ILE 228 N -2.00 0.05 0.16 -0.61 -4.36 -0.66 -4.52 121.20 109.25 3k2b s ILE 228 Ca 0.00 -1.53 0.11 0.00 -0.26 0.00 0.00 60.65 58.97 3k2b s ILE 228 Cb 0.00 -2.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.65 3k2b s ILE 228 CO 0.00 -0.22 -0.25 0.00 0.24 0.00 0.00 174.94 174.71 3k2b s ALA 229 N -4.01 2.46 -0.20 2.27 0.00 0.12 -2.06 121.76 120.33 3k2b s ALA 229 Ca 0.22 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 3k2b s ALA 229 Cb 0.04 -0.37 0.06 0.00 0.00 0.00 0.00 23.12 22.84 3k2b s ALA 229 CO 0.04 0.49 -0.02 -0.51 0.00 0.00 0.00 175.76 175.76 3k2b s LEU 230 N -2.33 1.81 -0.07 0.00 1.43 0.69 -0.53 118.68 119.68 3k2b s LEU 230 Ca 0.17 -0.92 -0.28 0.00 -1.03 0.00 0.00 54.13 52.07 3k2b s LEU 230 Cb -0.09 -0.89 -0.02 0.00 0.03 0.00 0.00 46.19 45.22 3k2b s LEU 230 CO 0.08 -0.25 0.92 -0.13 0.23 0.00 0.00 176.35 177.20 3k2b s ARG 231 N 1.63 4.45 0.33 1.70 1.81 0.13 -0.68 118.95 128.33 3k2b s ARG 231 Ca -0.03 1.27 0.07 0.00 -1.72 0.00 0.00 55.73 55.32 3k2b s ARG 231 Cb -0.17 -3.50 -0.07 0.00 -0.45 0.00 0.00 34.95 30.76 3k2b s ARG 231 CO -0.07 -0.17 -0.02 0.14 -0.68 0.00 0.00 175.30 174.50 3k2b s VAL 232 N 1.51 1.74 -0.17 3.52 -7.23 0.09 0.12 120.40 119.98 3k2b s VAL 232 Ca 0.46 -2.08 -0.04 0.00 -1.81 0.00 0.00 61.98 58.51 3k2b s VAL 232 Cb -0.19 -2.70 -0.15 0.00 0.56 0.00 0.00 36.38 33.91 3k2b s VAL 232 CO 0.21 -0.14 2.40 -2.65 -0.31 0.00 0.00 175.10 174.60 3k2b n PRO 233 N -0.74 1.41 -4.50 4.82 -0.02 -1.26 -2.77 135.00 131.94 3k2b n PRO 233 Ca -0.05 -0.77 -0.30 0.00 -2.02 0.00 0.00 63.50 60.37 3k2b n PRO 233 Cb 0.65 -1.92 -0.13 0.00 -0.02 0.00 0.00 33.50 32.08 3k2b n PRO 233 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3k2b s THR 234 N 2.01 2.49 -1.37 3.45 -4.23 -1.26 -4.99 115.64 111.74 3k2b s THR 234 Ca 0.42 -1.53 0.27 0.00 -1.18 0.00 0.00 61.69 59.67 3k2b s THR 234 Cb 0.18 -2.09 0.27 0.00 1.34 0.00 0.00 72.50 72.20 3k2b s THR 234 CO -0.01 0.18 1.71 -0.81 -0.54 0.00 0.00 174.62 175.15 3k2b n PRO 235 N 1.12 0.39 -3.61 3.99 -0.04 -1.26 -1.50 135.00 134.10 3k2b n PRO 235 Ca -0.17 -0.16 -0.07 0.00 -0.04 0.00 0.00 63.50 63.06 3k2b n PRO 235 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 3k2b n PRO 235 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3k2b s ASN 236 N -2.72 -0.23 0.00 3.54 2.47 -1.26 -4.72 114.94 112.02 3k2b s ASN 236 Ca 0.21 0.27 0.00 0.00 0.42 0.00 0.00 52.86 53.75 3k2b s ASN 236 Cb 0.19 0.21 0.00 0.00 -1.45 0.00 0.00 41.25 40.20 3k2b s ASN 236 CO 0.55 -0.20 0.00 0.52 -3.72 0.00 0.00 177.10 174.25 3k2b n VAL 237 N 0.72 -0.83 -4.36 -5.21 0.31 -1.26 -4.89 118.33 102.82 3k2b n VAL 237 Ca -0.06 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.08 3k2b n VAL 237 Cb 0.58 -0.83 -0.10 0.00 -0.91 0.00 0.00 33.84 32.58 3k2b n VAL 237 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3k2b s SER 238 N -0.21 1.93 -0.00 4.52 0.01 0.32 -3.81 113.70 116.45 3k2b s SER 238 Ca 0.00 -1.27 0.02 0.00 1.31 0.00 0.00 55.95 56.01 3k2b s SER 238 Cb 0.00 -0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.22 3k2b s SER 238 CO 0.00 -0.55 -0.08 0.54 0.41 0.00 0.00 173.24 173.56 3k2b s VAL 239 N -3.41 0.61 -0.08 3.43 0.11 -0.22 -1.25 120.40 119.60 3k2b s VAL 239 Ca 0.32 -0.35 -0.01 0.00 -2.93 0.00 0.00 61.98 59.01 3k2b s VAL 239 Cb 0.07 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 34.37 3k2b s VAL 239 CO 0.11 0.16 -0.04 0.68 -3.33 0.00 0.00 175.10 172.69 3k2b s VAL 240 N -0.20 3.99 -0.36 2.04 -7.23 0.31 -0.51 120.40 118.44 3k2b s VAL 240 Ca 0.03 -0.37 0.03 0.00 -1.81 0.00 0.00 61.98 59.86 3k2b s VAL 240 Cb -0.03 -2.66 0.10 0.00 0.56 0.00 0.00 36.38 34.36 3k2b s VAL 240 CO -0.00 0.60 0.08 -0.62 -0.31 0.00 0.00 175.10 174.85 3k2b s ASP 241 N -0.80 4.61 -0.21 4.85 2.15 0.60 -1.11 116.67 126.78 3k2b s ASP 241 Ca 0.12 -2.19 -0.10 0.00 0.43 0.00 0.00 52.55 50.81 3k2b s ASP 241 Cb -0.11 -1.53 -0.05 0.00 -0.30 0.00 0.00 42.92 40.93 3k2b s ASP 241 CO 0.02 -0.37 0.14 -0.22 -0.17 0.00 0.00 175.17 174.57 3k2b s LEU 242 N 0.85 4.19 -0.19 -1.34 2.96 -0.32 -1.64 118.68 123.20 3k2b s LEU 242 Ca 0.12 0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 3k2b s LEU 242 Cb -0.20 -2.10 0.03 0.00 0.50 0.00 0.00 46.19 44.42 3k2b s LEU 242 CO -0.09 0.16 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.22 3k2b s VAL 243 N 0.49 2.07 0.08 1.68 1.01 -0.11 -1.18 120.40 124.43 3k2b s VAL 243 Ca 0.08 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.09 3k2b s VAL 243 Cb -0.12 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 3k2b s VAL 243 CO -0.01 0.46 -0.16 0.68 0.00 0.00 0.00 175.10 176.08 3k2b s VAL 244 N 1.27 1.24 -0.17 2.92 -7.23 0.16 -0.48 120.40 118.10 3k2b s VAL 244 Ca 0.03 -1.34 -0.10 0.00 -1.81 0.00 0.00 61.98 58.76 3k2b s VAL 244 Cb -0.14 -1.17 -0.05 0.00 0.56 0.00 0.00 36.38 35.59 3k2b s VAL 244 CO -0.12 -0.18 0.17 -1.58 -0.31 0.00 0.00 175.10 173.08 3k2b s GLN 245 N -1.74 4.04 0.36 4.82 0.74 0.00 -0.26 119.66 127.62 3k2b s GLN 245 Ca -0.00 -0.13 0.08 0.00 0.05 0.00 0.00 55.36 55.36 3k2b s GLN 245 Cb -0.10 -3.37 -0.07 0.00 1.10 0.00 0.00 33.01 30.57 3k2b s GLN 245 CO 0.03 0.40 -0.05 0.14 -0.55 0.00 0.00 175.29 175.26 3k2b s VAL 246 N 0.05 2.01 -0.04 1.34 -7.23 0.22 -0.53 120.40 116.22 3k2b s VAL 246 Ca 0.11 -2.11 -0.05 0.00 -1.81 0.00 0.00 61.98 58.11 3k2b s VAL 246 Cb -0.12 -2.74 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 3k2b s VAL 246 CO 0.01 -0.14 0.31 0.28 -0.31 0.00 0.00 175.10 175.25 3k2b h SER 247 N 1.98 -0.16 -2.39 4.85 0.02 -0.47 -3.44 113.55 113.93 3k2b h SER 247 Ca -0.42 0.01 -0.58 0.00 -0.84 0.00 0.00 61.79 59.95 3k2b h SER 247 Cb 1.24 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 3k2b h SER 247 CO 0.73 0.11 1.36 -0.75 -1.14 0.00 0.00 176.83 177.15 3k2b s LYS 248 N -2.15 3.27 0.40 3.45 2.20 -1.05 -4.95 119.74 120.91 3k2b s LYS 248 Ca -0.03 1.70 -0.26 0.00 -0.36 0.00 0.00 55.97 57.02 3k2b s LYS 248 Cb 0.00 -4.27 -0.11 0.00 -1.51 0.00 0.00 37.83 31.95 3k2b s LYS 248 CO 0.08 -1.94 1.28 1.63 -0.36 0.00 0.00 175.35 176.05 3k2b n LYS 249 N 8.54 2.01 -2.01 4.03 5.02 -1.26 -4.87 118.16 129.62 3k2b n LYS 249 Ca 0.26 0.71 -0.03 0.00 -2.02 0.00 0.00 58.31 57.23 3k2b n LYS 249 Cb 0.46 -2.38 -0.00 0.00 -0.02 0.00 0.00 35.03 33.09 3k2b n LYS 249 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3k2b n THR 250 N -0.03 0.00 -3.99 -0.18 5.66 0.73 -5.01 114.28 111.46 3k2b n THR 250 Ca 0.06 -0.39 -0.08 0.00 -3.05 0.00 0.00 64.05 60.59 3k2b n THR 250 Cb 0.39 0.28 -0.10 0.00 -1.55 0.00 0.00 70.33 69.35 3k2b n THR 250 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3k2b s PHE 251 N -5.61 0.32 0.23 1.09 -0.71 -1.26 -4.56 117.98 107.47 3k2b s PHE 251 Ca 0.06 -0.71 -0.18 0.00 -1.04 0.00 0.00 56.93 55.06 3k2b s PHE 251 Cb -0.01 -0.23 0.23 0.00 -1.21 0.00 0.00 43.02 41.81 3k2b s PHE 251 CO 0.05 -0.36 1.55 0.00 -1.34 0.00 0.00 175.22 175.11 3k2b n ALA 252 N 0.59 -0.13 -0.23 1.99 0.00 -1.26 -1.08 120.51 120.38 3k2b n ALA 252 Ca -0.18 0.99 0.06 0.00 0.00 0.00 0.00 53.44 54.31 3k2b n ALA 252 Cb 0.59 -0.44 0.31 0.00 0.00 0.00 0.00 19.45 19.91 3k2b n ALA 252 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3k2b h GLU 253 N 0.00 0.84 -0.06 0.00 3.07 -1.95 -0.73 114.58 115.75 3k2b h GLU 253 Ca 0.34 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.14 3k2b h GLU 253 Cb 0.59 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.31 3k2b h GLU 253 CO -0.99 0.56 -0.01 1.49 -1.40 0.00 0.00 179.01 178.66 3k2b h GLU 254 N 0.86 0.11 -0.26 2.33 4.81 -1.53 -0.15 114.58 120.76 3k2b h GLU 254 Ca 0.35 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.60 3k2b h GLU 254 Cb 0.25 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 3k2b h GLU 254 CO -0.12 0.43 -0.10 0.28 -0.73 0.00 0.00 179.01 178.76 3k2b h VAL 255 N -0.22 0.66 -0.68 0.32 2.07 -1.10 0.26 116.25 117.56 3k2b h VAL 255 Ca 0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.55 3k2b h VAL 255 Cb 0.39 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 3k2b h VAL 255 CO 0.00 0.00 0.45 0.78 0.02 0.00 0.00 177.57 178.82 3k2b h ASN 256 N -0.05 0.76 -0.59 0.57 -0.26 -1.04 -0.91 115.58 114.05 3k2b h ASN 256 Ca 0.13 -0.02 -0.05 0.00 -0.56 0.00 0.00 56.30 55.81 3k2b h ASN 256 Cb 0.26 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.30 3k2b h ASN 256 CO -0.30 0.55 0.18 0.00 -1.06 0.00 0.00 177.43 176.80 3k2b h ALA 257 N 1.58 0.77 -0.59 -0.83 0.00 0.35 -1.36 119.26 119.19 3k2b h ALA 257 Ca 0.25 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3k2b h ALA 257 Cb -0.07 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 3k2b h ALA 257 CO -0.06 0.44 0.32 0.00 0.00 0.00 0.00 179.25 179.95 3k2b h ALA 258 N 1.05 0.77 -0.41 0.00 0.00 0.81 -1.86 119.26 119.63 3k2b h ALA 258 Ca 0.19 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3k2b h ALA 258 Cb 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3k2b h ALA 258 CO -0.01 0.00 0.13 0.74 0.00 0.00 0.00 179.25 180.11 3k2b h PHE 259 N 0.62 0.66 -0.72 0.00 0.04 -0.83 -1.83 116.94 114.88 3k2b h PHE 259 Ca 0.26 -0.07 0.02 0.00 2.80 0.00 0.00 57.97 60.98 3k2b h PHE 259 Cb 0.14 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.06 3k2b h PHE 259 CO -0.08 0.61 0.48 0.00 -0.60 0.00 0.00 178.31 178.71 3k2b h ARG 260 N 0.51 0.91 0.48 1.51 3.08 -0.88 0.60 114.38 120.59 3k2b h ARG 260 Ca 0.13 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 3k2b h ARG 260 Cb 0.26 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3k2b h ARG 260 CO -0.00 0.60 -0.23 -0.44 -1.07 0.00 0.00 179.97 178.83 3k2b h ASP 261 N 0.94 -0.55 -0.49 7.04 3.32 -1.06 -0.22 116.42 125.41 3k2b h ASP 261 Ca 0.27 -0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.36 3k2b h ASP 261 Cb -0.06 0.14 -0.08 0.00 0.22 0.00 0.00 39.33 39.55 3k2b h ASP 261 CO -0.07 -0.27 -0.03 0.28 -1.72 0.00 0.00 179.24 177.44 3k2b h SER 262 N -0.81 -0.26 -0.61 6.45 0.02 -0.76 0.37 113.55 117.96 3k2b h SER 262 Ca -0.07 0.12 0.12 0.00 -0.84 0.00 0.00 61.79 61.13 3k2b h SER 262 Cb 0.57 0.23 -0.10 0.00 0.14 0.00 0.00 62.40 63.24 3k2b h SER 262 CO 0.11 -0.09 0.03 0.00 -1.14 0.00 0.00 176.83 175.74 3k2b h ALA 263 N 1.45 0.63 0.00 3.77 0.00 0.47 -0.17 119.26 125.40 3k2b h ALA 263 Ca 0.25 0.17 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 3k2b h ALA 263 Cb 0.37 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3k2b h ALA 263 CO -0.43 -0.38 -0.66 0.93 0.00 0.00 0.00 179.25 178.71 3k2b h GLU 264 N 0.15 0.00 0.00 0.00 3.07 0.44 -2.77 114.58 115.47 3k2b h GLU 264 Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 3k2b h GLU 264 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 3k2b h GLU 264 CO -0.50 0.66 0.00 1.63 -1.40 0.00 0.00 179.01 179.41 3k2b n LYS 265 N -3.50 0.00 0.00 2.33 5.02 0.12 -4.61 118.16 117.52 3k2b n LYS 265 Ca -0.00 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.37 3k2b n LYS 265 Cb 0.72 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 36.07 3k2b n LYS 265 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3k2b n GLU 266 N 0.00 0.01 -0.16 1.97 0.00 -1.18 -2.88 120.64 118.41 3k2b n GLU 266 Ca 0.00 0.23 0.09 0.00 0.00 0.00 0.00 57.16 57.49 3k2b n GLU 266 Cb 0.00 -1.51 0.15 0.00 0.00 0.00 0.00 31.44 30.08 3k2b n GLU 266 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3k2b n LEU 267 N -1.53 2.41 -4.71 -1.84 4.77 -0.43 -4.99 117.00 110.69 3k2b n LEU 267 Ca 0.04 -3.22 -0.43 0.00 -0.03 0.00 0.00 56.01 52.37 3k2b n LEU 267 Cb 0.19 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 40.81 3k2b n LEU 267 CO 0.15 0.82 1.16 1.17 -1.33 0.00 0.00 177.39 179.36 3k2b n LYS 268 N -1.39 2.41 0.00 3.23 4.81 -1.04 -0.54 118.16 125.65 3k2b n LYS 268 Ca 0.16 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.46 3k2b n LYS 268 Cb 0.65 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 33.10 3k2b n LYS 268 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k2b n GLY 269 N 2.35 2.54 0.42 3.14 0.00 -1.26 -4.79 105.19 107.59 3k2b n GLY 269 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 3k2b n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k2b n ILE 270 N -2.00 0.77 -4.41 -0.61 2.08 0.30 -4.49 119.36 111.01 3k2b n ILE 270 Ca 0.00 -0.23 -0.30 0.00 0.56 0.00 0.00 62.75 62.79 3k2b n ILE 270 Cb 0.00 -1.48 -0.12 0.00 -0.75 0.00 0.00 39.64 37.29 3k2b n ILE 270 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3k2b s LEU 271 N -6.48 2.72 0.05 1.39 0.20 -0.66 -1.40 118.68 114.49 3k2b s LEU 271 Ca -0.19 -0.49 -0.08 0.00 0.69 0.00 0.00 54.13 54.06 3k2b s LEU 271 Cb 0.07 -1.58 -0.00 0.00 -0.43 0.00 0.00 46.19 44.25 3k2b s LEU 271 CO 0.27 0.21 0.17 -0.62 -0.29 0.00 0.00 176.35 176.08 3k2b s ASP 272 N -1.90 0.08 -0.14 3.68 3.68 0.12 -4.55 116.67 117.64 3k2b s ASP 272 Ca 0.17 -0.45 0.01 0.00 2.13 0.00 0.00 52.55 54.41 3k2b s ASP 272 Cb -0.11 0.28 0.02 0.00 -1.45 0.00 0.00 42.92 41.66 3k2b s ASP 272 CO 0.09 -0.57 -0.18 -0.69 0.13 0.00 0.00 175.17 173.95 3k2b s VAL 273 N -2.79 1.77 -0.26 1.11 1.01 -1.26 0.31 120.40 120.29 3k2b s VAL 273 Ca -0.03 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.09 3k2b s VAL 273 Cb -0.00 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 3k2b s VAL 273 CO -0.05 0.49 0.07 0.00 0.00 0.00 0.00 175.10 175.61 3k2b n ASP 275 N 4.91 5.24 -4.44 0.00 8.00 -1.26 -3.06 116.55 125.94 3k2b n ASP 275 Ca -0.16 -2.80 -0.29 0.00 0.71 0.00 0.00 54.79 52.25 3k2b n ASP 275 Cb 0.51 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.83 3k2b n ASP 275 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3k2b s GLU 276 N -2.51 1.69 -1.04 -1.24 2.02 -1.26 -4.95 118.70 111.40 3k2b s GLU 276 Ca 0.50 -1.21 -0.23 0.00 0.02 0.00 0.00 54.97 54.05 3k2b s GLU 276 Cb 0.37 -2.04 0.03 0.00 0.10 0.00 0.00 34.13 32.59 3k2b s GLU 276 CO 0.16 0.48 1.61 -1.25 0.02 0.00 0.00 175.26 176.27 3k2b s PRO 277 N -1.96 3.40 0.56 0.39 0.04 -1.26 -4.95 135.00 131.22 3k2b s PRO 277 Ca 0.16 -1.09 0.07 0.00 0.04 0.00 0.00 61.00 60.17 3k2b s PRO 277 Cb -0.10 -5.32 0.06 0.00 0.04 0.00 0.00 34.50 29.17 3k2b s PRO 277 CO 0.08 -2.52 0.52 -0.51 0.04 0.00 0.00 177.00 174.61 3k2b s LEU 278 N 6.10 2.76 0.22 -3.56 1.43 -1.26 -5.15 118.68 119.22 3k2b s LEU 278 Ca 0.53 -1.17 0.05 0.00 -1.03 0.00 0.00 54.13 52.51 3k2b s LEU 278 Cb -0.01 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.91 3k2b s LEU 278 CO -0.05 -1.21 -0.06 0.68 0.23 0.00 0.00 176.35 175.94 3k2b s VAL 279 N -2.76 1.29 0.28 -1.59 -7.23 -1.26 -5.04 120.40 104.09 3k2b s VAL 279 Ca 0.41 -2.08 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 3k2b s VAL 279 Cb -0.03 -2.20 0.37 0.00 0.56 0.00 0.00 36.38 35.08 3k2b s VAL 279 CO 0.26 -0.46 1.40 -1.54 -0.31 0.00 0.00 175.10 174.44 3k2b n SER 280 N -0.39 -0.07 0.26 4.85 3.41 -1.26 -0.14 113.62 120.28 3k2b n SER 280 Ca -0.07 1.51 0.08 0.00 -0.26 0.00 0.00 58.87 60.14 3k2b n SER 280 Cb 0.62 -0.57 0.65 0.00 -0.26 0.00 0.00 64.21 64.65 3k2b n SER 280 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3k2b h VAL 281 N 0.00 0.96 0.00 -3.33 3.04 -1.96 -1.56 116.25 113.40 3k2b h VAL 281 Ca 0.56 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 66.09 3k2b h VAL 281 Cb 1.19 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 3k2b h VAL 281 CO -0.82 0.04 0.00 0.47 -1.01 0.00 0.00 177.57 176.25 3k2b n ASP 282 N -4.38 0.31 -0.99 3.17 8.00 0.80 -2.49 116.55 120.97 3k2b n ASP 282 Ca -0.03 0.58 0.12 0.00 0.71 0.00 0.00 54.79 56.18 3k2b n ASP 282 Cb 0.13 -0.65 0.14 0.00 -0.02 0.00 0.00 41.12 40.72 3k2b n ASP 282 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3k2b n PHE 283 N -1.85 0.12 -1.59 1.24 3.72 -0.59 -4.95 117.46 113.57 3k2b n PHE 283 Ca 0.02 -0.06 -0.38 0.00 -0.05 0.00 0.00 57.45 56.98 3k2b n PHE 283 Cb 0.17 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.76 3k2b n PHE 283 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3k2b n ARG 284 N 1.34 0.91 -1.35 -1.08 1.74 -1.04 -1.46 116.66 115.72 3k2b n ARG 284 Ca 0.15 0.35 -0.13 0.00 -0.77 0.00 0.00 57.85 57.45 3k2b n ARG 284 Cb 0.59 -2.07 -0.06 0.00 -1.02 0.00 0.00 32.46 29.91 3k2b n ARG 284 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k2b s SER 286 N -2.33 6.75 0.00 0.00 0.15 -0.53 -4.88 113.70 112.85 3k2b s SER 286 Ca 0.00 2.32 0.24 0.00 0.70 0.00 0.00 55.95 59.21 3k2b s SER 286 Cb 0.00 -2.57 1.05 0.00 -1.71 0.00 0.00 66.02 62.79 3k2b s SER 286 CO 0.00 -0.76 1.78 0.47 1.20 0.00 0.00 173.24 175.92 3k2b n ASP 287 N 5.01 0.00 -4.76 5.45 8.00 -1.26 -3.87 116.55 125.12 3k2b n ASP 287 Ca 0.14 0.46 -0.40 0.00 0.71 0.00 0.00 54.79 55.70 3k2b n ASP 287 Cb 0.42 -0.49 -0.06 0.00 -0.02 0.00 0.00 41.12 40.98 3k2b n ASP 287 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3k2b s PHE 288 N -2.97 3.91 0.13 1.24 0.08 -1.26 -4.88 117.98 114.22 3k2b s PHE 288 Ca 0.12 1.70 0.14 0.00 0.12 0.00 0.00 56.93 59.01 3k2b s PHE 288 Cb 0.16 -2.84 0.32 0.00 -0.57 0.00 0.00 43.02 40.09 3k2b s PHE 288 CO 0.44 0.46 1.57 1.03 -0.10 0.00 0.00 175.22 178.62 3k2b h SER 289 N 4.47 0.00 -3.53 1.36 0.87 -1.47 -3.43 113.55 111.82 3k2b h SER 289 Ca -0.46 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 59.82 3k2b h SER 289 Cb 1.20 0.00 -0.33 0.00 -0.44 0.00 0.00 62.40 62.83 3k2b h SER 289 CO 0.67 0.58 -0.71 -0.89 -0.53 0.00 0.00 176.83 175.95 3k2b s THR 290 N -3.32 -0.05 -0.10 2.23 2.01 -0.53 -3.96 115.64 111.91 3k2b s THR 290 Ca 0.01 0.19 -0.01 0.00 0.31 0.00 0.00 61.69 62.19 3k2b s THR 290 Cb 0.11 -0.10 0.03 0.00 0.01 0.00 0.00 72.50 72.54 3k2b s THR 290 CO 0.74 0.08 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.81 3k2b s THR 291 N 0.99 0.81 0.00 -0.82 2.01 -0.94 0.10 115.64 117.80 3k2b s THR 291 Ca -0.08 -0.17 -0.23 0.00 0.31 0.00 0.00 61.69 61.52 3k2b s THR 291 Cb -0.12 -0.89 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 3k2b s THR 291 CO -0.03 0.32 0.69 -0.63 -0.69 0.00 0.00 174.62 174.28 3k2b s ILE 292 N 1.79 4.86 -1.16 1.82 -1.09 0.15 -0.03 121.20 127.55 3k2b s ILE 292 Ca 0.05 1.46 -0.12 0.00 -2.23 0.00 0.00 60.65 59.81 3k2b s ILE 292 Cb -0.13 -4.04 0.21 0.00 -1.58 0.00 0.00 42.46 36.93 3k2b s ILE 292 CO -0.07 0.36 1.28 -0.62 -1.23 0.00 0.00 174.94 174.66 3k2b s ASP 293 N 0.09 7.16 0.35 3.58 -1.08 -0.53 -0.90 116.67 125.34 3k2b s ASP 293 Ca 0.36 -3.21 0.14 0.00 -0.52 0.00 0.00 52.55 49.32 3k2b s ASP 293 Cb -0.19 -2.32 1.13 0.00 -1.46 0.00 0.00 42.92 40.08 3k2b s ASP 293 CO 0.20 -0.56 1.60 0.77 0.52 0.00 0.00 175.17 177.69 3k2b h SER 294 N 7.01 0.15 0.00 -0.34 4.64 -1.84 0.37 113.55 123.55 3k2b h SER 294 Ca 0.25 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3k2b h SER 294 Cb 0.88 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3k2b h SER 294 CO 1.14 -0.35 0.00 -1.54 -0.87 0.00 0.00 176.83 175.21 3k2b n SER 295 N -5.27 0.00 -0.00 4.97 3.41 -1.26 -2.20 113.62 113.26 3k2b n SER 295 Ca 0.33 -0.94 0.08 0.00 -0.26 0.00 0.00 58.87 58.08 3k2b n SER 295 Cb 1.08 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.93 3k2b n SER 295 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k2b n LEU 296 N -0.91 0.62 -4.74 1.04 4.77 0.13 -4.97 117.00 112.93 3k2b n LEU 296 Ca 0.16 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.31 3k2b n LEU 296 Cb 0.07 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 3k2b n LEU 296 CO 0.12 0.15 1.23 -0.89 -1.33 0.00 0.00 177.39 176.67 3k2b s THR 297 N -2.60 2.25 0.07 -5.08 2.01 -0.93 -4.78 115.64 106.58 3k2b s THR 297 Ca 0.04 0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.25 3k2b s THR 297 Cb 0.12 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 3k2b s THR 297 CO 0.65 0.03 -0.06 -0.04 -0.69 0.00 0.00 174.62 174.51 3k2b s MET 298 N -0.06 0.70 -0.03 4.92 -1.94 -0.87 -4.86 119.30 117.15 3k2b s MET 298 Ca 0.65 -1.15 0.01 0.00 -1.71 0.00 0.00 55.69 53.49 3k2b s MET 298 Cb -0.46 -0.13 0.02 0.00 2.01 0.00 0.00 34.83 36.27 3k2b s MET 298 CO 0.43 -0.02 -0.01 0.08 -0.01 0.00 0.00 175.02 175.48 3k2b s VAL 299 N -3.06 0.25 -0.15 -6.03 1.01 -1.26 -1.29 120.40 109.87 3k2b s VAL 299 Ca 0.05 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.04 3k2b s VAL 299 Cb 0.02 -0.31 0.02 0.00 0.00 0.00 0.00 36.38 36.11 3k2b s VAL 299 CO -0.04 0.14 -0.17 -0.04 0.00 0.00 0.00 175.10 174.99 3k2b s MET 300 N 0.78 2.62 -0.88 2.72 -1.94 -0.17 -4.68 119.30 117.75 3k2b s MET 300 Ca -0.08 -0.69 -0.01 0.00 -1.71 0.00 0.00 55.69 53.20 3k2b s MET 300 Cb -0.11 -2.28 0.00 0.00 2.01 0.00 0.00 34.83 34.44 3k2b s MET 300 CO -0.01 -0.18 0.12 0.41 -0.01 0.00 0.00 175.02 175.35 3k2b n GLY 301 N 4.56 -0.03 4.42 -0.03 0.00 -1.26 -2.32 105.19 110.53 3k2b n GLY 301 Ca -0.19 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3k2b n GLY 301 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k2b n ASP 302 N -0.21 0.00 0.00 1.61 8.00 -1.26 -4.57 116.55 120.12 3k2b n ASP 302 Ca -0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 3k2b n ASP 302 Cb 0.58 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3k2b n ASP 302 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3k2b n ASP 303 N 0.44 0.90 -4.23 -2.24 5.68 -1.24 -0.19 116.55 115.67 3k2b n ASP 303 Ca 0.00 -1.28 -0.42 0.00 -0.50 0.00 0.00 54.79 52.59 3k2b n ASP 303 Cb 0.00 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 39.91 3k2b n ASP 303 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 3k2b s MET 304 N -0.28 2.76 -0.05 0.11 1.75 -0.98 -0.61 119.30 122.01 3k2b s MET 304 Ca 0.00 -1.98 -0.16 0.00 -1.25 0.00 0.00 55.69 52.31 3k2b s MET 304 Cb 0.00 -4.05 -0.05 0.00 2.84 0.00 0.00 34.83 33.57 3k2b s MET 304 CO 0.00 -1.23 0.41 0.08 -0.65 0.00 0.00 175.02 173.63 3k2b s VAL 305 N 1.00 5.09 -0.13 10.11 1.01 0.64 -1.00 120.40 137.14 3k2b s VAL 305 Ca 0.09 0.84 0.02 0.00 0.00 0.00 0.00 61.98 62.93 3k2b s VAL 305 Cb -0.23 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.43 3k2b s VAL 305 CO -0.02 0.50 -0.20 -0.75 0.00 0.00 0.00 175.10 174.62 3k2b s LYS 306 N -0.49 2.80 0.02 2.72 2.20 -0.41 -0.67 119.74 125.91 3k2b s LYS 306 Ca 0.24 -0.78 0.05 0.00 -0.36 0.00 0.00 55.97 55.12 3k2b s LYS 306 Cb -0.16 -2.27 -0.02 0.00 -1.51 0.00 0.00 37.83 33.87 3k2b s LYS 306 CO 0.12 -0.01 -0.16 0.08 -0.36 0.00 0.00 175.35 175.01 3k2b s VAL 307 N 0.82 1.31 -0.09 4.02 1.01 -0.33 -2.06 120.40 125.09 3k2b s VAL 307 Ca -0.08 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.05 3k2b s VAL 307 Cb -0.16 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 3k2b s VAL 307 CO -0.01 0.22 -0.22 -0.63 0.00 0.00 0.00 175.10 174.46 3k2b s ILE 308 N -0.61 2.32 0.01 2.22 1.09 -1.26 -1.17 121.20 123.80 3k2b s ILE 308 Ca 0.05 -0.95 0.02 0.00 -1.10 0.00 0.00 60.65 58.68 3k2b s ILE 308 Cb -0.07 -1.89 -0.01 0.00 -1.06 0.00 0.00 42.46 39.43 3k2b s ILE 308 CO 0.00 0.56 -0.07 0.00 -0.10 0.00 0.00 174.94 175.33 3k2b s ALA 309 N 0.08 0.58 0.11 9.38 0.00 -0.27 -1.46 121.76 130.19 3k2b s ALA 309 Ca -0.10 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.47 3k2b s ALA 309 Cb -0.16 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 3k2b s ALA 309 CO 0.06 0.10 0.19 -1.58 0.00 0.00 0.00 175.76 174.53 3k2b s TRP 310 N -0.47 3.38 -0.21 0.00 0.52 0.95 -0.53 118.94 122.58 3k2b s TRP 310 Ca -0.00 0.13 -0.27 0.00 0.02 0.00 0.00 56.10 55.98 3k2b s TRP 310 Cb -0.04 -1.66 0.07 0.00 -1.15 0.00 0.00 33.47 30.69 3k2b s TRP 310 CO 0.00 0.54 0.74 1.52 0.02 0.00 0.00 176.95 179.77 3k2b s TYR 311 N -1.60 -0.73 -0.93 -1.98 1.13 -0.38 -2.21 117.35 110.65 3k2b s TYR 311 Ca 0.33 1.64 -0.19 0.00 -1.41 0.00 0.00 57.07 57.44 3k2b s TYR 311 Cb -0.12 0.32 0.13 0.00 -1.10 0.00 0.00 41.96 41.19 3k2b s TYR 311 CO 0.26 -0.43 1.15 0.34 -2.51 0.00 0.00 175.55 174.36 3k2b s ASP 312 N -0.08 6.62 0.60 -0.18 -1.08 -1.26 -0.52 116.67 120.76 3k2b s ASP 312 Ca -0.03 -2.01 0.28 0.00 -0.52 0.00 0.00 52.55 50.28 3k2b s ASP 312 Cb -0.04 -2.41 1.45 0.00 -1.46 0.00 0.00 42.92 40.46 3k2b s ASP 312 CO 0.03 -1.09 1.86 -0.55 0.52 0.00 0.00 175.17 175.93 3k2b h ASN 313 N 8.89 0.00 0.00 -0.34 -1.07 -1.90 0.36 115.58 121.52 3k2b h ASN 313 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.53 3k2b h ASN 313 Cb 1.02 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.27 3k2b h ASN 313 CO 1.13 0.00 -0.38 -0.33 0.07 0.00 0.00 177.43 177.92 3k2b h GLU 314 N 0.00 0.00 -0.03 4.14 5.08 -1.98 -3.37 114.58 118.43 3k2b h GLU 314 Ca 0.19 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 3k2b h GLU 314 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3k2b h GLU 314 CO -0.00 0.00 -0.18 2.35 -1.00 0.00 0.00 179.01 180.18 3k2b h TRP 315 N -0.96 0.23 -0.48 4.33 2.91 -1.88 -2.69 115.95 117.41 3k2b h TRP 315 Ca 0.00 -0.11 0.06 0.00 1.13 0.00 0.00 58.89 59.97 3k2b h TRP 315 Cb 0.38 -0.03 -0.05 0.00 -0.51 0.00 0.00 29.16 28.94 3k2b h TRP 315 CO -0.16 0.83 0.19 0.78 -1.03 0.00 0.00 178.44 179.05 3k2b h GLY 316 N -0.43 0.64 0.95 2.65 0.00 -0.40 -1.92 103.07 104.56 3k2b h GLY 316 Ca -0.01 -0.11 0.01 0.00 0.00 0.00 0.00 47.33 47.21 3k2b h GLY 316 CO 0.04 0.04 0.25 -1.82 0.00 0.00 0.00 176.54 175.05 3k2b h TYR 317 N 0.38 0.47 0.00 5.60 3.20 -1.65 -2.34 116.97 122.63 3k2b h TYR 317 Ca 0.22 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.11 3k2b h TYR 317 Cb 0.20 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.32 3k2b h TYR 317 CO -0.14 0.28 0.00 0.77 -1.64 0.00 0.00 178.16 177.43 3k2b h SER 318 N 0.51 0.00 -0.03 -2.11 0.02 -1.08 -0.07 113.55 110.79 3k2b h SER 318 Ca 0.15 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.95 3k2b h SER 318 Cb -0.02 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.53 3k2b h SER 318 CO -0.06 0.00 -0.57 1.56 -1.14 0.00 0.00 176.83 176.62 3k2b h GLN 319 N 0.00 0.43 -0.29 3.45 1.08 -0.83 -2.23 115.11 116.73 3k2b h GLN 319 Ca 0.00 -0.43 0.02 0.00 -1.45 0.00 0.00 58.65 56.79 3k2b h GLN 319 Cb 0.29 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 3k2b h GLN 319 CO 0.00 1.09 0.19 0.00 -0.95 0.00 0.00 178.83 179.16 3k2b h ARG 320 N -0.05 0.31 -0.18 1.46 2.47 -0.84 0.22 114.38 117.77 3k2b h ARG 320 Ca -0.06 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.55 3k2b h ARG 320 Cb 1.27 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.52 3k2b h ARG 320 CO 0.11 0.20 -0.22 0.28 0.56 0.00 0.00 179.97 180.91 3k2b h VAL 321 N 0.32 1.34 -0.75 2.04 2.07 -0.97 -0.27 116.25 120.04 3k2b h VAL 321 Ca 0.11 -1.41 0.02 0.00 0.82 0.00 0.00 66.70 66.24 3k2b h VAL 321 Cb 0.06 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3k2b h VAL 321 CO -0.02 0.43 0.48 0.58 0.02 0.00 0.00 177.57 179.05 3k2b h VAL 322 N 0.11 1.15 0.50 2.57 2.07 -0.64 -1.57 116.25 120.43 3k2b h VAL 322 Ca 0.02 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3k2b h VAL 322 Cb 0.78 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3k2b h VAL 322 CO 0.05 0.18 -0.47 0.44 0.02 0.00 0.00 177.57 177.79 3k2b h ASP 323 N 0.97 -1.26 -0.78 0.57 3.32 -0.36 -0.45 116.42 118.41 3k2b h ASP 323 Ca 0.29 0.10 0.17 0.00 0.02 0.00 0.00 57.03 57.61 3k2b h ASP 323 Cb -0.05 0.41 -0.05 0.00 0.22 0.00 0.00 39.33 39.86 3k2b h ASP 323 CO -0.08 -0.64 0.53 0.25 -1.72 0.00 0.00 179.24 177.58 3k2b h LEU 324 N -0.96 0.32 -0.43 1.55 5.85 -0.82 0.20 115.31 121.02 3k2b h LEU 324 Ca -0.06 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.54 3k2b h LEU 324 Cb 0.83 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 3k2b h LEU 324 CO -0.05 0.15 -0.33 0.00 -0.34 0.00 0.00 178.44 177.88 3k2b h ALA 325 N 1.64 0.62 -0.48 1.25 0.00 -0.58 0.28 119.26 121.98 3k2b h ALA 325 Ca 0.39 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3k2b h ALA 325 Cb 1.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3k2b h ALA 325 CO -0.11 0.68 0.28 -0.44 0.00 0.00 0.00 179.25 179.66 3k2b h ASP 326 N 0.79 0.45 0.16 0.00 3.32 0.97 0.35 116.42 122.46 3k2b h ASP 326 Ca 0.08 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 3k2b h ASP 326 Cb 0.92 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 3k2b h ASP 326 CO 0.09 0.32 -0.11 0.40 -1.72 0.00 0.00 179.24 178.21 3k2b h ILE 327 N 0.56 0.75 -0.61 0.35 2.04 -0.90 0.40 117.51 120.11 3k2b h ILE 327 Ca 0.20 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.18 3k2b h ILE 327 Cb 0.03 0.75 -0.10 0.00 -0.74 0.00 0.00 36.82 36.76 3k2b h ILE 327 CO -0.09 0.00 -0.02 0.58 0.00 0.00 0.00 178.15 178.62 3k2b h VAL 328 N -0.28 0.49 -0.55 1.67 2.07 -0.18 0.57 116.25 120.04 3k2b h VAL 328 Ca -0.01 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3k2b h VAL 328 Cb 0.24 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3k2b h VAL 328 CO 0.00 0.02 0.36 0.00 0.02 0.00 0.00 177.57 177.97 3k2b h ALA 329 N 1.56 1.66 0.00 1.67 0.00 0.84 -1.87 119.26 123.12 3k2b h ALA 329 Ca 0.31 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3k2b h ALA 329 Cb 0.50 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3k2b h ALA 329 CO -0.53 0.30 -0.34 -0.97 0.00 0.00 0.00 179.25 177.71 3k2b h ASN 330 N 0.70 0.00 -0.41 0.00 -1.24 0.44 -3.08 115.58 111.99 3k2b h ASN 330 Ca 0.21 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.22 3k2b h ASN 330 Cb -0.01 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.04 3k2b h ASN 330 CO -0.05 0.34 0.00 0.59 -1.29 0.00 0.00 177.43 177.02 3k2b n ASN 331 N -3.74 4.42 -4.77 1.15 4.13 -0.23 -5.01 115.26 111.21 3k2b n ASN 331 Ca -0.01 -2.81 -0.41 0.00 1.68 0.00 0.00 54.58 53.03 3k2b n ASN 331 Cb 0.44 -0.56 -0.03 0.00 -1.54 0.00 0.00 39.78 38.09 3k2b n ASN 331 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 3k2b s TRP 332 N -2.49 3.21 0.00 3.10 -0.11 -1.01 -4.51 118.94 117.13 3k2b s TRP 332 Ca 0.45 1.49 0.00 0.00 1.22 0.00 0.00 56.10 59.26 3k2b s TRP 332 Cb 0.34 -3.56 0.00 0.00 -1.50 0.00 0.00 33.47 28.74 3k2b s TRP 332 CO 0.14 -1.48 0.49 1.63 -4.62 0.00 0.00 176.95 173.10