#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b n LEU 1 N 0.00 0.00 -4.44 -0.35 0.00 -1.22 -4.86 117.00 106.14 3k2b n LEU 1 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 56.01 55.45 3k2b n LEU 1 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.33 3k2b n LEU 1 CO 0.00 0.00 1.66 0.29 0.00 0.00 0.00 177.39 179.34 3k2b n LYS 2 N 0.00 0.65 -4.46 1.96 5.02 -1.25 -2.83 118.16 117.25 3k2b n LYS 2 Ca 0.00 0.20 -0.33 0.00 -2.02 0.00 0.00 58.31 56.16 3k2b n LYS 2 Cb 0.00 -2.01 -0.10 0.00 -0.02 0.00 0.00 35.03 32.90 3k2b n LYS 2 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3k2b s VAL 3 N 5.95 3.83 -0.14 -0.18 1.01 0.67 -1.86 120.40 129.69 3k2b s VAL 3 Ca 1.11 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.49 3k2b s VAL 3 Cb -1.16 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 32.60 3k2b s VAL 3 CO 0.60 0.47 -0.13 0.00 0.00 0.00 0.00 175.10 176.03 3k2b s ALA 4 N -0.95 1.75 -0.38 5.51 0.00 -0.91 -0.41 121.76 126.37 3k2b s ALA 4 Ca 0.16 -0.82 -0.22 0.00 0.00 0.00 0.00 51.96 51.08 3k2b s ALA 4 Cb -0.11 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.03 3k2b s ALA 4 CO 0.06 -0.33 0.74 0.42 0.00 0.00 0.00 175.76 176.65 3k2b s ILE 5 N 1.42 4.77 -0.34 0.00 1.01 -0.38 -0.82 121.20 126.85 3k2b s ILE 5 Ca 0.03 0.69 -0.13 0.00 0.00 0.00 0.00 60.65 61.23 3k2b s ILE 5 Cb -0.13 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.13 3k2b s ILE 5 CO -0.09 -0.46 0.25 0.21 0.00 0.00 0.00 174.94 174.86 3k2b s ASN 6 N 1.88 6.07 0.00 3.58 2.47 0.91 -1.82 114.94 128.03 3k2b s ASN 6 Ca 0.29 -0.43 0.00 0.00 0.42 0.00 0.00 52.86 53.13 3k2b s ASN 6 Cb -0.13 -2.14 0.00 0.00 -1.45 0.00 0.00 41.25 37.52 3k2b s ASN 6 CO 0.17 -0.25 0.00 0.61 -3.72 0.00 0.00 177.10 173.91 3k2b n GLY 7 N 5.10 -0.76 1.93 1.21 0.00 -0.65 -0.46 105.19 111.56 3k2b n GLY 7 Ca -0.12 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 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 0.11 0.35 -0.20 1.61 7.35 -1.26 -3.97 117.46 121.44 3k2b n PHE 8 Ca 0.00 -1.47 0.00 0.00 -0.76 0.00 0.00 57.45 55.22 3k2b n PHE 8 Cb 0.00 -1.24 0.00 0.00 0.35 0.00 0.00 39.48 38.59 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 1.85 0.69 0.46 7.13 0.00 -1.26 -4.40 105.19 109.65 3k2b n GLY 9 Ca 0.32 -1.59 -0.18 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.94 0.40 1.61 2.47 -1.92 0.44 114.38 116.44 3k2b h ARG 10 Ca 0.00 0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 3k2b h ARG 10 Cb 0.00 0.21 -0.00 0.00 -1.65 0.00 0.00 29.97 28.53 3k2b h ARG 10 CO 0.00 -0.63 -0.22 0.82 0.56 0.00 0.00 179.97 180.51 3k2b h ILE 11 N -0.97 0.55 -0.77 2.04 1.08 -1.91 0.46 117.51 117.99 3k2b h ILE 11 Ca -0.06 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.53 3k2b h ILE 11 Cb 0.82 0.55 -0.13 0.00 -3.07 0.00 0.00 36.82 34.99 3k2b h ILE 11 CO 0.00 0.00 -0.36 1.23 -0.69 0.00 0.00 178.15 178.33 3k2b h GLY 12 N -0.57 -0.03 1.81 5.37 0.00 -1.66 1.22 103.07 109.20 3k2b h GLY 12 Ca -0.05 0.47 -0.16 0.00 0.00 0.00 0.00 47.33 47.60 3k2b h GLY 12 CO 0.07 -0.20 -0.70 3.21 0.00 0.00 0.00 176.54 178.92 3k2b h ARG 13 N -0.09 0.19 -0.19 4.80 3.08 -0.72 -2.59 114.38 118.84 3k2b h ARG 13 Ca 0.28 -0.15 -0.14 0.00 0.07 0.00 0.00 59.98 60.04 3k2b h ARG 13 Cb 0.57 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 3k2b h ARG 13 CO -0.82 0.81 -0.48 -0.91 -1.07 0.00 0.00 179.97 177.50 3k2b h ASN 14 N 0.13 0.55 0.41 7.04 2.35 0.17 -2.95 115.58 123.28 3k2b h ASN 14 Ca -0.02 -0.27 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 3k2b h ASN 14 Cb 1.24 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.45 3k2b h ASN 14 CO 0.10 0.95 -0.22 0.15 -1.65 0.00 0.00 177.43 176.76 3k2b h PHE 15 N 0.41 -0.58 -0.00 1.19 3.57 0.16 -1.92 116.94 119.77 3k2b h PHE 15 Ca 0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3k2b h PHE 15 Cb 0.99 0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 3k2b h PHE 15 CO 0.04 -0.35 0.00 1.25 -2.23 0.00 0.00 178.31 177.02 3k2b h LEU 16 N -0.59 0.00 0.19 0.59 6.46 -1.46 -1.29 115.31 119.21 3k2b h LEU 16 Ca -0.05 0.00 -0.33 0.00 -0.12 0.00 0.00 57.88 57.37 3k2b h LEU 16 Cb 0.47 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.41 3k2b h LEU 16 CO 0.07 0.00 -1.61 0.03 -0.62 0.00 0.00 178.44 176.31 3k2b h ARG 17 N 0.00 0.39 -0.18 1.25 3.08 -1.32 -2.04 114.38 115.57 3k2b h ARG 17 Ca 0.00 -0.67 -0.01 0.00 0.07 0.00 0.00 59.98 59.37 3k2b h ARG 17 Cb 0.00 0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3k2b h ARG 17 CO -0.00 1.30 0.08 0.00 -1.07 0.00 0.00 179.97 180.28 3k2b h TRP 18 N 0.15 -0.44 -0.89 0.00 7.01 -1.36 -1.01 115.95 119.42 3k2b h TRP 18 Ca 0.06 -0.01 0.26 0.00 2.11 0.00 0.00 58.89 61.31 3k2b h TRP 18 Cb 0.12 0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 27.29 3k2b h TRP 18 CO -0.03 -0.27 0.78 1.25 -2.79 0.00 0.00 178.44 177.39 3k2b h HIS 18 N -0.45 0.00 0.00 2.65 2.76 -1.22 0.57 115.15 119.47 3k2b h HIS 18 Ca -0.04 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.08 3k2b h HIS 18 Cb 0.36 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 3k2b h HIS 18 CO -0.07 0.00 -0.36 0.78 -1.30 0.00 0.00 177.93 176.98 3k2b h GLY 19 N 0.00 0.00 -4.82 5.26 0.00 -0.61 -3.46 103.07 99.45 3k2b h GLY 19 Ca 0.42 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 47.23 3k2b h GLY 19 CO -0.00 0.00 1.03 0.50 0.00 0.00 0.00 176.54 178.06 3k2b s ARG 20 N -3.11 4.15 0.64 4.80 1.81 0.20 -4.89 118.95 122.55 3k2b s ARG 20 Ca 0.05 2.53 0.41 0.00 -1.72 0.00 0.00 55.73 57.00 3k2b s ARG 20 Cb 0.07 -3.36 2.17 0.00 -0.45 0.00 0.00 34.95 33.38 3k2b s ARG 20 CO 0.72 -0.76 2.29 0.87 -0.68 0.00 0.00 175.30 177.73 3k2b h LYS 21 N 7.71 0.00 0.00 3.54 6.56 -1.88 -3.38 116.57 129.12 3k2b h LYS 21 Ca -0.44 0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 59.02 3k2b h LYS 21 Cb 1.21 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 32.74 3k2b h LYS 21 CO 0.94 0.01 -0.15 -3.47 -2.06 0.00 0.00 179.45 174.72 3k2b n ASP 22 N -3.16 -1.74 -4.77 0.86 4.64 -1.26 -5.16 116.55 105.96 3k2b n ASP 22 Ca -0.02 -2.37 -0.37 0.00 -1.38 0.00 0.00 54.79 50.64 3k2b n ASP 22 Cb 0.12 1.23 -0.03 0.00 -1.04 0.00 0.00 41.12 41.39 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 3k2b s SER 23 N -0.67 6.72 0.00 1.67 0.15 -1.26 -4.91 113.70 115.41 3k2b s SER 23 Ca 0.25 2.15 0.16 0.00 0.70 0.00 0.00 55.95 59.21 3k2b s SER 23 Cb 0.25 -2.60 0.75 0.00 -1.71 0.00 0.00 66.02 62.71 3k2b s SER 23 CO -0.14 -0.52 1.51 -0.81 1.20 0.00 0.00 173.24 174.48 3k2b n PRO 24 N 0.09 1.30 -4.12 5.44 -0.04 -1.26 -4.36 135.00 132.04 3k2b n PRO 24 Ca 0.04 -0.45 -0.34 0.00 -0.04 0.00 0.00 63.50 62.71 3k2b n PRO 24 Cb 0.48 -1.28 -0.10 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.43 3.69 -0.29 1.53 1.43 -1.26 -3.06 118.68 119.29 3k2b s LEU 25 Ca 0.25 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.41 3k2b s LEU 25 Cb 0.12 -1.92 0.09 0.00 0.03 0.00 0.00 46.19 44.51 3k2b s LEU 25 CO 0.19 0.20 0.03 -0.62 0.23 0.00 0.00 176.35 176.38 3k2b s ASP 26 N 0.20 4.15 -0.18 2.29 2.15 -1.13 -4.62 116.67 119.53 3k2b s ASP 26 Ca 0.03 -1.61 -0.29 0.00 0.43 0.00 0.00 52.55 51.11 3k2b s ASP 26 Cb -0.13 -1.18 -0.02 0.00 -0.30 0.00 0.00 42.92 41.30 3k2b s ASP 26 CO 0.01 -0.34 1.37 -0.63 -0.17 0.00 0.00 175.17 175.40 3k2b s ILE 27 N 1.35 4.09 -0.53 4.11 1.01 -1.26 -0.24 121.20 129.73 3k2b s ILE 27 Ca 0.05 1.30 0.08 0.00 0.00 0.00 0.00 60.65 62.07 3k2b s ILE 27 Cb -0.18 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 3k2b s ILE 27 CO -0.13 -0.20 0.43 2.30 0.00 0.00 0.00 174.94 177.33 3k2b n ILE 28 N 5.65 0.00 -3.61 2.92 -5.35 0.45 -4.81 119.36 114.61 3k2b n ILE 28 Ca 0.15 -0.35 -0.15 0.00 -0.27 0.00 0.00 62.75 62.13 3k2b n ILE 28 Cb 0.45 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.32 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 -1.53 -1.74 0.00 -1.28 0.00 -1.22 -1.55 121.76 114.44 3k2b s ALA 29 Ca 0.05 1.82 0.05 0.00 0.00 0.00 0.00 51.96 53.88 3k2b s ALA 29 Cb 0.06 -0.88 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 3k2b s ALA 29 CO 0.28 -0.34 -0.16 0.42 0.00 0.00 0.00 175.76 175.96 3k2b s ILE 30 N 0.00 2.94 -0.30 0.00 -1.09 0.63 -1.25 121.20 122.13 3k2b s ILE 30 Ca -0.03 -0.97 -0.03 0.00 -2.23 0.00 0.00 60.65 57.40 3k2b s ILE 30 Cb -0.04 -2.20 0.10 0.00 -1.58 0.00 0.00 42.46 38.74 3k2b s ILE 30 CO 0.03 0.45 0.12 0.21 -1.23 0.00 0.00 174.94 174.52 3k2b s ASN 31 N -1.13 3.72 0.28 3.58 2.47 -0.76 -0.07 114.94 123.03 3k2b s ASN 31 Ca 0.14 -1.43 0.07 0.00 0.42 0.00 0.00 52.86 52.06 3k2b s ASN 31 Cb -0.11 -0.54 -0.06 0.00 -1.45 0.00 0.00 41.25 39.10 3k2b s ASN 31 CO 0.03 -0.43 -0.06 -0.62 -3.72 0.00 0.00 177.10 172.30 3k2b s ASP 32 N 1.91 2.81 -0.27 -4.21 2.15 -1.15 -1.63 116.67 116.28 3k2b s ASP 32 Ca 0.09 -1.18 -0.00 0.00 0.43 0.00 0.00 52.55 51.89 3k2b s ASP 32 Cb -0.17 -0.18 0.23 0.00 -0.30 0.00 0.00 42.92 42.51 3k2b s ASP 32 CO -0.32 -0.32 1.86 0.35 -0.17 0.00 0.00 175.17 176.56 3k2b n THR 33 N -0.59 2.53 -2.69 1.71 -2.24 -1.26 -4.17 114.28 107.57 3k2b n THR 33 Ca -0.05 -1.39 -0.07 0.00 -2.27 0.00 0.00 64.05 60.26 3k2b n THR 33 Cb 0.63 -1.19 0.08 0.00 -2.10 0.00 0.00 70.33 67.75 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 0.24 1.48 1.07 3.38 0.00 -1.26 -5.08 105.19 105.01 3k2b n GLY 34 Ca 0.28 -0.66 0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.44 -1.75 0.16 -0.02 0.00 -1.26 -4.14 105.19 97.73 3k2b n GLY 36 Ca 0.02 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.26 1.32 0.25 1.61 2.07 -1.87 -3.08 116.25 115.30 3k2b h VAL 37 Ca -0.08 -1.30 0.01 0.00 0.82 0.00 0.00 66.70 66.14 3k2b h VAL 37 Cb 1.03 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 3k2b h VAL 37 CO 0.04 0.39 -0.46 0.11 0.02 0.00 0.00 177.57 177.67 3k2b h LYS 38 N 0.14 -0.76 -0.07 1.57 1.57 -1.95 0.69 116.57 117.76 3k2b h LYS 38 Ca 0.04 0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 3k2b h LYS 38 Cb 0.69 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 3k2b h LYS 38 CO 0.04 -0.51 0.15 0.37 -0.57 0.00 0.00 179.45 178.93 3k2b h GLN 39 N -0.79 0.00 0.05 3.15 4.15 -1.72 -0.65 115.11 119.29 3k2b h GLN 39 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 3k2b h GLN 39 Cb 0.76 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3k2b h GLN 39 CO -0.19 0.00 -0.02 0.00 -1.93 0.00 0.00 178.83 176.69 3k2b h ALA 40 N 1.77 -0.06 -0.05 3.38 0.00 -0.90 -2.38 119.26 121.02 3k2b h ALA 40 Ca 0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3k2b h ALA 40 Cb 0.33 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3k2b h ALA 40 CO -0.00 -0.17 0.02 1.03 0.00 0.00 0.00 179.25 180.13 3k2b h SER 41 N -0.80 0.06 0.32 0.00 0.87 -0.24 -2.57 113.55 111.19 3k2b h SER 41 Ca -0.01 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.37 3k2b h SER 41 Cb 0.66 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 3k2b h SER 41 CO 0.01 0.22 -0.39 -0.74 -0.53 0.00 0.00 176.83 175.40 3k2b h HIS 42 N -0.09 -1.10 -0.56 2.24 6.17 -1.27 -1.38 115.15 119.15 3k2b h HIS 42 Ca 0.02 0.01 0.16 0.00 0.71 0.00 0.00 60.37 61.27 3k2b h HIS 42 Cb 0.18 0.44 -0.02 0.00 2.52 0.00 0.00 27.41 30.52 3k2b h HIS 42 CO -0.02 -0.51 0.47 -0.07 0.71 0.00 0.00 177.93 178.52 3k2b h LEU 43 N -0.73 0.00 -0.03 0.26 3.38 -1.48 -0.71 115.31 116.00 3k2b h LEU 43 Ca -0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 3k2b h LEU 43 Cb 0.65 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.42 3k2b h LEU 43 CO -0.09 0.00 -0.80 0.25 0.09 0.00 0.00 178.44 177.90 3k2b h LEU 44 N 0.00 0.75 -0.49 1.67 5.85 -1.04 -3.34 115.31 118.71 3k2b h LEU 44 Ca 0.27 -0.72 -0.15 0.00 0.84 0.00 0.00 57.88 58.12 3k2b h LEU 44 Cb 1.20 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 3k2b h LEU 44 CO -0.00 1.37 -0.37 0.50 -0.34 0.00 0.00 178.44 179.59 3k2b h LYS 45 N 0.21 0.83 -5.16 1.25 1.63 -0.04 -3.41 116.57 111.88 3k2b h LYS 45 Ca -0.09 -0.42 -0.67 0.00 -0.85 0.00 0.00 60.65 58.62 3k2b h LYS 45 Cb 1.47 0.01 -0.31 0.00 -0.60 0.00 0.00 32.23 32.79 3k2b h LYS 45 CO 0.16 1.06 -0.81 0.71 -3.45 0.00 0.00 179.45 177.12 3k2b s TYR 46 N -4.38 2.78 -0.14 1.91 2.02 -0.77 -0.55 117.35 118.22 3k2b s TYR 46 Ca -0.10 -1.13 -0.02 0.00 -0.37 0.00 0.00 57.07 55.46 3k2b s TYR 46 Cb 0.12 -1.90 0.04 0.00 -0.40 0.00 0.00 41.96 39.82 3k2b s TYR 46 CO 0.86 -0.53 0.00 0.34 -1.57 0.00 0.00 175.55 174.66 3k2b s ASP 47 N 0.92 2.40 0.44 2.29 -1.08 -1.14 -4.64 116.67 115.85 3k2b s ASP 47 Ca -0.03 -0.51 0.18 0.00 -0.52 0.00 0.00 52.55 51.66 3k2b s ASP 47 Cb -0.15 -0.61 1.10 0.00 -1.46 0.00 0.00 42.92 41.80 3k2b s ASP 47 CO -0.02 -0.24 1.90 0.28 0.52 0.00 0.00 175.17 177.62 3k2b h SER 48 N 8.25 0.35 0.20 -0.34 0.02 -1.95 0.71 113.55 120.80 3k2b h SER 48 Ca -0.20 0.03 -0.35 0.00 -0.84 0.00 0.00 61.79 60.43 3k2b h SER 48 Cb 1.12 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.57 3k2b h SER 48 CO 0.33 0.17 -2.08 0.41 -1.14 0.00 0.00 176.83 174.52 3k2b n THR 49 N -4.47 1.58 -0.03 -2.27 -1.04 -1.26 -4.53 114.28 102.25 3k2b n THR 49 Ca 0.16 -0.74 -0.11 0.00 -2.04 0.00 0.00 64.05 61.32 3k2b n THR 49 Cb 0.60 -1.14 -0.14 0.00 -1.82 0.00 0.00 70.33 67.84 3k2b n THR 49 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3k2b n LEU 50 N -3.12 1.05 0.00 -4.42 4.77 -1.09 -5.05 117.00 109.14 3k2b n LEU 50 Ca -0.29 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 3k2b n LEU 50 Cb 1.07 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.16 3k2b n LEU 50 CO 0.41 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 3k2b n GLY 51 N 1.67 0.57 3.69 -0.72 0.00 0.25 -4.93 105.19 105.72 3k2b n GLY 51 Ca -0.22 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.25 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 -1.12 3.47 -0.41 -0.61 1.01 -1.26 -2.87 121.20 119.42 3k2b s ILE 52 Ca 0.00 0.90 -0.28 0.00 0.00 0.00 0.00 60.65 61.27 3k2b s ILE 52 Cb 0.00 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 3k2b s ILE 52 CO 0.00 0.00 1.92 0.12 0.00 0.00 0.00 174.94 176.99 3k2b s PHE 53 N 2.37 1.63 -0.73 3.97 5.36 0.29 -4.92 117.98 125.95 3k2b s PHE 53 Ca 0.67 0.76 -0.26 0.00 -0.96 0.00 0.00 56.93 57.14 3k2b s PHE 53 Cb -0.34 -4.04 -0.06 0.00 -0.34 0.00 0.00 43.02 38.24 3k2b s PHE 53 CO 0.28 -2.86 2.09 0.34 -1.46 0.00 0.00 175.22 173.61 3k2b s ASP 54 N 7.47 4.81 0.00 6.13 -1.08 -1.26 -4.70 116.67 128.04 3k2b s ASP 54 Ca 0.81 0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.87 3k2b s ASP 54 Cb -0.20 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 3k2b s ASP 54 CO 0.30 -2.89 0.00 0.00 0.52 0.00 0.00 175.17 173.09 3k2b n ALA 55 N 14.90 0.00 -3.44 3.66 0.00 -1.26 -5.09 120.51 129.27 3k2b n ALA 55 Ca 0.35 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.54 3k2b n ALA 55 Cb 0.49 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.83 3k2b n ALA 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k2b s ASP 56 N 2.00 2.52 -0.95 0.00 1.01 -1.26 -4.92 116.67 115.06 3k2b s ASP 56 Ca 0.00 -1.87 -0.02 0.00 0.71 0.00 0.00 52.55 51.37 3k2b s ASP 56 Cb 0.00 -0.11 0.28 0.00 1.01 0.00 0.00 42.92 44.10 3k2b s ASP 56 CO 0.00 -0.31 1.19 0.52 0.21 0.00 0.00 175.17 176.77 3k2b n VAL 57 N 4.28 4.27 -4.34 -1.27 0.31 -1.26 -0.64 118.33 119.67 3k2b n VAL 57 Ca 0.09 -5.62 -0.35 0.00 -0.01 0.00 0.00 64.34 58.46 3k2b n VAL 57 Cb 0.40 -2.17 -0.09 0.00 -0.91 0.00 0.00 33.84 31.07 3k2b n VAL 57 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3k2b s LYS 58 N -2.41 3.05 0.27 5.55 -2.85 -1.23 -4.77 119.74 117.34 3k2b s LYS 58 Ca 0.33 -0.39 -0.30 0.00 -1.00 0.00 0.00 55.97 54.61 3k2b s LYS 58 Cb 0.04 -2.83 -0.10 0.00 -2.06 0.00 0.00 37.83 32.89 3k2b s LYS 58 CO 0.03 0.69 1.37 -1.25 0.10 0.00 0.00 175.35 176.29 3k2b s PRO 59 N -0.83 4.32 -0.80 1.78 0.04 -1.26 -1.53 135.00 136.72 3k2b s PRO 59 Ca 0.13 2.23 -0.02 0.00 0.04 0.00 0.00 61.00 63.37 3k2b s PRO 59 Cb -0.11 -3.11 0.20 0.00 0.04 0.00 0.00 34.50 31.51 3k2b s PRO 59 CO 0.02 -0.31 0.66 0.45 0.04 0.00 0.00 177.00 177.86 3k2b s SER 60 N 0.08 5.75 0.00 6.66 0.15 -0.11 -4.77 113.70 121.46 3k2b s SER 60 Ca 0.55 -3.40 0.00 0.00 0.70 0.00 0.00 55.95 53.80 3k2b s SER 60 Cb -0.40 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 3k2b s SER 60 CO 0.46 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.25 3k2b n GLY 60 N 2.77 -0.12 0.80 9.45 0.00 -1.25 -3.95 105.19 112.88 3k2b n GLY 60 Ca 0.17 -1.90 0.08 0.00 0.00 0.00 0.00 46.02 44.37 3k2b n GLY 60 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k2b n GLU 61 N -0.23 2.02 -0.84 1.61 1.02 -1.26 -4.09 120.64 118.88 3k2b n GLU 61 Ca 0.00 -1.57 0.02 0.00 -0.02 0.00 0.00 57.16 55.59 3k2b n GLU 61 Cb 0.00 -1.37 0.02 0.00 -0.02 0.00 0.00 31.44 30.07 3k2b n GLU 61 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3k2b n THR 62 N 0.77 0.15 -3.61 2.62 -2.24 -1.26 -4.77 114.28 105.93 3k2b n THR 62 Ca 0.16 -0.55 -0.03 0.00 -2.27 0.00 0.00 64.05 61.36 3k2b n THR 62 Cb 0.39 0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 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 -0.22 -2.15 0.22 6.98 0.00 -1.25 -1.75 121.76 123.57 3k2b s ALA 63 Ca 0.14 1.57 0.09 0.00 0.00 0.00 0.00 51.96 53.76 3k2b s ALA 63 Cb 0.16 -0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 3k2b s ALA 63 CO -0.06 -0.65 -0.16 0.96 0.00 0.00 0.00 175.76 175.84 3k2b s ILE 64 N -2.28 1.93 -0.52 0.00 -4.36 0.53 -0.93 121.20 115.56 3k2b s ILE 64 Ca 0.11 -2.21 0.00 0.00 -0.26 0.00 0.00 60.65 58.29 3k2b s ILE 64 Cb 0.00 -2.07 0.14 0.00 1.25 0.00 0.00 42.46 41.77 3k2b s ILE 64 CO -0.04 -0.50 0.30 -0.55 0.24 0.00 0.00 174.94 174.39 3k2b s SER 65 N -3.25 4.91 -0.50 4.36 0.15 -0.58 0.24 113.70 119.03 3k2b s SER 65 Ca 0.23 -2.67 -0.23 0.00 0.70 0.00 0.00 55.95 53.98 3k2b s SER 65 Cb -0.03 -1.76 0.04 0.00 -1.71 0.00 0.00 66.02 62.56 3k2b s SER 65 CO 0.09 -0.36 0.84 -0.69 1.20 0.00 0.00 173.24 174.31 3k2b s VAL 66 N 0.20 4.56 -1.50 4.45 1.01 -0.74 -3.50 120.40 124.88 3k2b s VAL 66 Ca 0.15 0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.30 3k2b s VAL 66 Cb -0.22 -4.41 0.07 0.00 0.00 0.00 0.00 36.38 31.82 3k2b s VAL 66 CO -0.03 -0.89 0.94 -0.67 0.00 0.00 0.00 175.10 174.45 3k2b n ASP 67 N 6.97 -4.25 0.00 3.32 2.03 0.18 -3.03 116.55 121.77 3k2b n ASP 67 Ca 0.01 -0.79 0.00 0.00 0.52 0.00 0.00 54.79 54.54 3k2b n ASP 67 Cb 0.48 -3.91 0.00 0.00 -0.72 0.00 0.00 41.12 36.96 3k2b n ASP 67 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3k2b n GLY 68 N -1.69 2.11 3.22 0.27 0.00 -1.26 -4.95 105.19 102.89 3k2b n GLY 68 Ca -0.01 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.96 3k2b n GLY 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3k2b n LYS 69 N 0.00 -0.19 -4.00 1.61 4.81 -1.17 -4.90 118.16 114.33 3k2b n LYS 69 Ca 0.00 -0.03 -0.30 0.00 -0.87 0.00 0.00 58.31 57.11 3k2b n LYS 69 Cb 0.00 -1.46 -0.16 0.00 0.02 0.00 0.00 35.03 33.43 3k2b n LYS 69 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3k2b s ILE 70 N -2.21 1.53 -0.19 3.15 1.01 -1.26 -1.79 121.20 121.44 3k2b s ILE 70 Ca 0.49 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 60.38 3k2b s ILE 70 Cb -0.19 -1.50 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3k2b s ILE 70 CO 0.74 0.37 0.03 -0.63 0.00 0.00 0.00 174.94 175.45 3k2b s ILE 71 N 1.49 4.35 0.56 2.92 1.01 0.14 -4.93 121.20 126.73 3k2b s ILE 71 Ca 0.03 -0.19 -0.19 0.00 0.00 0.00 0.00 60.65 60.31 3k2b s ILE 71 Cb -0.14 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.32 3k2b s ILE 71 CO -0.10 0.45 1.11 -1.10 0.00 0.00 0.00 174.94 175.30 3k2b s GLN 72 N 0.64 3.32 -0.30 2.79 -1.52 -0.59 -0.35 119.66 123.64 3k2b s GLN 72 Ca 0.01 1.53 -0.01 0.00 -1.95 0.00 0.00 55.36 54.94 3k2b s GLN 72 Cb -0.14 -2.01 0.10 0.00 -0.22 0.00 0.00 33.01 30.74 3k2b s GLN 72 CO 0.02 -0.86 0.09 0.08 -0.25 0.00 0.00 175.29 174.37 3k2b s VAL 73 N -1.92 0.91 0.68 1.09 1.01 -0.72 -0.27 120.40 121.18 3k2b s VAL 73 Ca 0.71 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 61.33 3k2b s VAL 73 Cb -0.22 -1.67 0.12 0.00 0.00 0.00 0.00 36.38 34.61 3k2b s VAL 73 CO 0.29 -0.64 0.94 0.54 0.00 0.00 0.00 175.10 176.22 3k2b s VAL 74 N 1.61 2.11 -0.31 2.92 0.11 0.90 -4.47 120.40 123.27 3k2b s VAL 74 Ca 0.09 -0.74 0.05 0.00 -2.93 0.00 0.00 61.98 58.45 3k2b s VAL 74 Cb -0.17 -2.37 0.18 0.00 -1.53 0.00 0.00 36.38 32.49 3k2b s VAL 74 CO -0.24 0.00 0.53 -0.55 -3.33 0.00 0.00 175.10 171.51 3k2b s SER 75 N -4.73 -0.83 -0.13 3.54 0.15 -1.26 -2.92 113.70 107.51 3k2b s SER 75 Ca 0.65 -0.23 -0.07 0.00 0.70 0.00 0.00 55.95 57.00 3k2b s SER 75 Cb -0.05 1.65 0.05 0.00 -1.71 0.00 0.00 66.02 65.96 3k2b s SER 75 CO 0.43 -0.30 0.32 0.21 1.20 0.00 0.00 173.24 175.11 3k2b s ASN 76 N 2.52 -0.38 0.00 5.45 3.84 -1.26 -4.97 114.94 120.14 3k2b s ASN 76 Ca 0.11 0.69 0.19 0.00 0.21 0.00 0.00 52.86 54.07 3k2b s ASN 76 Cb -0.10 0.59 0.93 0.00 -0.55 0.00 0.00 41.25 42.11 3k2b s ASN 76 CO -0.23 -0.17 1.59 -2.11 -2.79 0.00 0.00 177.10 173.38 3k2b n ARG 77 N 4.13 0.22 -4.14 0.43 1.85 -1.26 -4.59 116.66 113.30 3k2b n ARG 77 Ca -0.23 0.12 -0.34 0.00 -1.00 0.00 0.00 57.85 56.40 3k2b n ARG 77 Cb 0.54 -1.50 -0.15 0.00 -1.05 0.00 0.00 32.46 30.30 3k2b n ARG 77 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3k2b s ASN 78 N -2.66 3.53 0.16 2.89 3.84 -1.26 -5.01 114.94 116.44 3k2b s ASN 78 Ca 0.16 -0.55 -0.13 0.00 0.21 0.00 0.00 52.86 52.55 3k2b s ASN 78 Cb 0.13 -1.56 0.05 0.00 -0.55 0.00 0.00 41.25 39.32 3k2b s ASN 78 CO 0.30 0.01 1.72 -0.65 -2.79 0.00 0.00 177.10 175.69 3k2b h PRO 79 N 7.87 0.81 -1.19 0.43 0.11 -1.90 -2.85 132.00 135.28 3k2b h PRO 79 Ca -0.42 -0.14 0.34 0.00 0.11 0.00 0.00 66.00 65.88 3k2b h PRO 79 Cb 1.15 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 3k2b h PRO 79 CO 0.62 0.70 0.82 0.77 -0.21 0.00 0.00 178.00 180.70 3k2b h SER 80 N 0.74 0.17 0.06 -2.05 0.02 -1.90 0.48 113.55 111.08 3k2b h SER 80 Ca 0.18 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3k2b h SER 80 Cb 0.19 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3k2b h SER 80 CO -0.02 0.01 -0.03 0.18 -1.14 0.00 0.00 176.83 175.84 3k2b n LEU 81 N -4.37 0.79 -4.73 5.07 4.77 -1.08 -4.80 117.00 112.65 3k2b n LEU 81 Ca 0.28 -0.23 -0.41 0.00 -0.03 0.00 0.00 56.01 55.61 3k2b n LEU 81 Cb 1.18 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 42.20 3k2b n LEU 81 CO 0.34 0.13 0.84 -0.76 -1.33 0.00 0.00 177.39 176.61 3k2b s LEU 82 N -2.10 4.44 -0.99 2.23 1.43 0.17 -4.92 118.68 118.94 3k2b s LEU 82 Ca 0.39 2.08 -0.07 0.00 -1.03 0.00 0.00 54.13 55.51 3k2b s LEU 82 Cb 0.21 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 3k2b s LEU 82 CO 0.38 -0.33 2.19 -0.81 0.23 0.00 0.00 176.35 178.00 3k2b n PRO 83 N 2.92 2.23 -0.04 1.29 -0.04 -1.26 -4.60 135.00 135.50 3k2b n PRO 83 Ca 0.05 -1.55 -0.11 0.00 -0.04 0.00 0.00 63.50 61.85 3k2b n PRO 83 Cb 0.46 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 31.32 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 6.23 -0.03 -0.54 0.54 -0.00 -1.91 -3.01 115.95 117.23 3k2b h TRP 84 Ca 0.53 -0.00 0.02 0.00 -0.00 0.00 0.00 58.89 59.44 3k2b h TRP 84 Cb 0.19 0.01 -0.03 0.00 -0.00 0.00 0.00 29.16 29.33 3k2b h TRP 84 CO 1.93 0.67 0.34 0.87 -0.00 0.00 0.00 178.44 182.24 3k2b h LYS 85 N -0.94 0.65 0.00 0.49 1.57 -1.77 0.89 116.57 117.46 3k2b h LYS 85 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3k2b h LYS 85 Cb 0.71 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3k2b h LYS 85 CO 0.00 0.43 0.00 0.93 -0.57 0.00 0.00 179.45 180.25 3k2b h GLU 86 N 0.67 0.00 0.00 3.15 3.07 -1.88 -1.64 114.58 117.95 3k2b h GLU 86 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 3k2b h GLU 86 Cb -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 3k2b h GLU 86 CO -0.08 0.00 -0.62 1.28 -1.40 0.00 0.00 179.01 178.20 3k2b n LEU 87 N -2.34 0.18 -2.72 1.33 7.99 -0.61 -5.05 117.00 115.77 3k2b n LEU 87 Ca -0.01 -0.33 -0.04 0.00 -0.01 0.00 0.00 56.01 55.62 3k2b n LEU 87 Cb 0.10 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.43 3k2b n LEU 87 CO 0.14 0.04 0.17 0.61 -1.51 0.00 0.00 177.39 176.84 3k2b n GLY 88 N 1.49 -0.86 3.84 -0.72 0.00 0.30 -5.01 105.19 104.23 3k2b n GLY 88 Ca 0.00 0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.12 5.41 -0.25 -0.61 1.09 -0.98 -4.57 121.20 118.17 3k2b s ILE 89 Ca 0.14 0.32 -0.13 0.00 -1.10 0.00 0.00 60.65 59.88 3k2b s ILE 89 Cb -0.02 -3.47 -0.15 0.00 -1.06 0.00 0.00 42.46 37.76 3k2b s ILE 89 CO 0.56 0.57 -0.17 0.47 -0.10 0.00 0.00 174.94 176.27 3k2b n ASP 90 N 2.26 1.95 -3.93 3.58 8.00 -0.78 -3.16 116.55 124.48 3k2b n ASP 90 Ca -0.18 0.29 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 3k2b n ASP 90 Cb 0.54 -0.81 -0.17 0.00 -0.02 0.00 0.00 41.12 40.67 3k2b n ASP 90 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3k2b s ILE 91 N -2.48 0.97 -0.33 0.53 -4.36 -1.23 0.12 121.20 114.41 3k2b s ILE 91 Ca -0.35 -0.30 -0.09 0.00 -0.26 0.00 0.00 60.65 59.64 3k2b s ILE 91 Cb 0.12 -0.96 0.01 0.00 1.25 0.00 0.00 42.46 42.88 3k2b s ILE 91 CO 0.54 0.34 0.16 -0.69 0.24 0.00 0.00 174.94 175.53 3k2b s VAL 92 N 1.35 4.41 -0.38 8.37 1.01 -0.21 -2.15 120.40 132.80 3k2b s VAL 92 Ca -0.02 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 3k2b s VAL 92 Cb -0.14 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.89 3k2b s VAL 92 CO -0.04 -0.07 1.49 -0.63 0.00 0.00 0.00 175.10 175.85 3k2b s ILE 93 N 1.55 3.83 -1.18 2.22 1.09 -0.00 -2.35 121.20 126.36 3k2b s ILE 93 Ca 0.03 0.86 -0.15 0.00 -1.10 0.00 0.00 60.65 60.29 3k2b s ILE 93 Cb -0.18 -4.07 0.16 0.00 -1.06 0.00 0.00 42.46 37.31 3k2b s ILE 93 CO 0.05 -0.64 1.43 -0.70 -0.10 0.00 0.00 174.94 174.98 3k2b s GLU 94 N 4.99 4.03 -0.79 2.79 2.56 -1.03 -0.07 118.70 131.18 3k2b s GLU 94 Ca 0.65 -2.44 0.02 0.00 0.00 0.00 0.00 54.97 53.20 3k2b s GLU 94 Cb -0.16 -5.09 0.31 0.00 2.00 0.00 0.00 34.13 31.19 3k2b s GLU 94 CO 0.32 -1.81 1.20 0.41 -0.56 0.00 0.00 175.26 174.82 3k2b n GLY 95 N 4.37 5.45 0.00 -1.50 0.00 0.39 -2.59 105.19 111.32 3k2b n GLY 95 Ca 0.36 -2.72 0.01 0.00 0.00 0.00 0.00 46.02 43.67 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 0.37 0.04 0.00 2.61 -2.24 -1.24 -4.31 114.28 109.52 3k2b n THR 96 Ca 0.33 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 3k2b n THR 96 Cb 0.35 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 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 2.48 2.18 0.06 3.38 0.00 -1.26 -4.89 105.19 107.14 3k2b n GLY 97 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 3k2b n GLY 97 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k2b h VAL 98 N 0.00 0.00 -0.60 1.61 2.07 -1.94 -3.42 116.25 113.96 3k2b h VAL 98 Ca 0.00 -0.94 -0.70 0.00 0.82 0.00 0.00 66.70 65.88 3k2b h VAL 98 Cb 0.00 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.70 3k2b h VAL 98 CO 0.00 0.00 2.55 0.49 0.02 0.00 0.00 177.57 180.63 3k2b n PHE 99 N -4.51 4.08 -0.55 1.57 3.72 -1.26 -4.69 117.46 115.82 3k2b n PHE 99 Ca -0.05 -2.93 0.08 0.00 -0.05 0.00 0.00 57.45 54.49 3k2b n PHE 99 Cb 0.20 -2.53 0.25 0.00 -0.94 0.00 0.00 39.48 36.46 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 5.52 1.63 -4.21 -4.37 0.24 -1.26 -3.86 118.33 112.02 3k2b n VAL 100 Ca 0.49 -1.31 -0.12 0.00 -2.04 0.00 0.00 64.34 61.36 3k2b n VAL 100 Cb 0.42 0.17 -0.10 0.00 -1.47 0.00 0.00 33.84 32.86 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 -1.23 1.16 0.18 -1.34 -4.77 -1.26 -1.60 116.67 107.81 3k2b s ASP 101 Ca 0.38 -1.10 -0.23 0.00 -3.30 0.00 0.00 52.55 48.30 3k2b s ASP 101 Cb 0.25 0.11 0.09 0.00 -1.09 0.00 0.00 42.92 42.29 3k2b s ASP 101 CO 0.17 -0.53 1.58 0.03 0.70 0.00 0.00 175.17 177.12 3k2b h ARG 102 N 2.81 -0.17 -0.74 2.11 3.08 -1.92 0.67 114.38 120.22 3k2b h ARG 102 Ca -0.36 0.01 0.12 0.00 0.07 0.00 0.00 59.98 59.82 3k2b h ARG 102 Cb 1.19 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 31.19 3k2b h ARG 102 CO 0.63 -0.12 0.33 0.93 -1.07 0.00 0.00 179.97 180.68 3k2b h GLU 103 N -0.18 0.50 0.05 0.04 3.07 -1.98 0.27 114.58 116.35 3k2b h GLU 103 Ca 0.22 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3k2b h GLU 103 Cb 0.56 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 3k2b h GLU 103 CO -0.70 0.33 -0.03 0.78 -1.40 0.00 0.00 179.01 178.00 3k2b h GLY 104 N 0.52 -0.08 -0.12 -3.84 0.00 -1.55 -3.32 103.07 94.67 3k2b h GLY 104 Ca 0.39 0.03 0.30 0.00 0.00 0.00 0.00 47.33 48.05 3k2b h GLY 104 CO -0.34 -0.03 0.77 0.00 0.00 0.00 0.00 176.54 176.94 3k2b h ALA 105 N -1.66 2.97 -0.26 3.60 0.00 0.26 -1.85 119.26 122.31 3k2b h ALA 105 Ca -0.01 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3k2b h ALA 105 Cb 0.06 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3k2b h ALA 105 CO 0.01 -1.31 0.07 0.78 0.00 0.00 0.00 179.25 178.80 3k2b h GLY 106 N 0.00 0.30 -1.87 0.00 0.00 -0.56 -2.72 103.07 98.22 3k2b h GLY 106 Ca 0.49 -0.03 0.55 0.00 0.00 0.00 0.00 47.33 48.34 3k2b h GLY 106 CO -0.01 0.01 1.33 0.28 0.00 0.00 0.00 176.54 178.15 3k2b n LYS 107 N -5.07 -0.00 0.06 4.80 5.02 -0.69 0.10 118.16 122.37 3k2b n LYS 107 Ca -0.01 1.09 -0.13 0.00 -2.02 0.00 0.00 58.31 57.24 3k2b n LYS 107 Cb 0.10 -2.45 -0.09 0.00 -0.02 0.00 0.00 35.03 32.57 3k2b n LYS 107 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k2b h HIS 108 N 0.00 -0.12 -0.04 2.13 3.86 -1.67 -2.80 115.15 116.51 3k2b h HIS 108 Ca 0.92 -0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 60.00 3k2b h HIS 108 Cb 3.60 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 32.09 3k2b h HIS 108 CO -0.00 0.19 -0.55 0.82 0.86 0.00 0.00 177.93 179.24 3k2b h ILE 109 N -0.43 1.38 0.00 2.45 2.04 0.58 -2.74 117.51 120.79 3k2b h ILE 109 Ca -0.01 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 63.97 3k2b h ILE 109 Cb 0.36 1.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3k2b h ILE 109 CO 0.02 0.55 0.00 1.21 0.00 0.00 0.00 178.15 179.93 3k2b n GLU 110 N -3.90 0.83 -0.15 2.37 2.13 0.25 -2.85 120.64 119.32 3k2b n GLU 110 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3k2b n GLU 110 Cb 0.57 -1.12 0.00 0.00 0.27 0.00 0.00 31.44 31.15 3k2b n GLU 110 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3k2b n ALA 111 N 0.52 1.11 0.00 4.31 0.00 -1.04 -4.88 120.51 120.53 3k2b n ALA 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3k2b n ALA 111 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 0.00 0.68 2.95 0.00 0.00 -1.13 -2.76 105.19 104.92 3k2b n GLY 112 Ca 0.00 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 3k2b n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b n ALA 113 N 0.00 -2.73 0.73 4.61 0.00 -1.15 -4.64 120.51 117.33 3k2b n ALA 113 Ca 0.00 0.24 0.08 0.00 0.00 0.00 0.00 53.44 53.76 3k2b n ALA 113 Cb 0.00 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 3k2b n ALA 113 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3k2b n LYS 114 N 1.03 1.66 -3.65 0.00 5.02 -0.72 -3.84 118.16 117.66 3k2b n LYS 114 Ca 0.13 -0.79 -0.11 0.00 -2.02 0.00 0.00 58.31 55.52 3k2b n LYS 114 Cb 0.29 -1.28 -0.08 0.00 -0.02 0.00 0.00 35.03 33.94 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 -1.95 0.72 -0.02 1.97 2.20 0.31 -4.84 119.74 118.13 3k2b s LYS 115 Ca 0.13 1.04 0.07 0.00 -0.36 0.00 0.00 55.97 56.86 3k2b s LYS 115 Cb 0.13 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.68 3k2b s LYS 115 CO 0.42 -0.12 -0.24 0.08 -0.36 0.00 0.00 175.35 175.13 3k2b s VAL 116 N 0.98 1.92 -0.50 4.02 1.01 -0.75 -1.04 120.40 126.03 3k2b s VAL 116 Ca -0.05 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.92 3k2b s VAL 116 Cb -0.05 -1.60 0.13 0.00 0.00 0.00 0.00 36.38 34.86 3k2b s VAL 116 CO -0.09 0.54 0.25 -0.63 0.00 0.00 0.00 175.10 175.17 3k2b s ILE 117 N -0.51 2.75 0.06 2.22 1.01 -0.99 -1.98 121.20 123.77 3k2b s ILE 117 Ca 0.07 -3.04 -0.31 0.00 0.00 0.00 0.00 60.65 57.38 3k2b s ILE 117 Cb -0.10 -2.90 -0.08 0.00 0.01 0.00 0.00 42.46 39.38 3k2b s ILE 117 CO -0.00 -0.77 1.73 -0.63 0.00 0.00 0.00 174.94 175.27 3k2b s ILE 118 N 0.02 2.99 -0.17 2.92 1.01 -0.16 -2.48 121.20 125.33 3k2b s ILE 118 Ca 0.16 0.36 -0.03 0.00 0.00 0.00 0.00 60.65 61.14 3k2b s ILE 118 Cb -0.24 -3.23 -0.00 0.00 0.01 0.00 0.00 42.46 39.00 3k2b s ILE 118 CO -0.02 -0.01 2.57 0.35 0.00 0.00 0.00 174.94 177.83 3k2b n THR 119 N 4.92 2.71 -3.76 2.92 -2.24 -1.07 -1.85 114.28 115.91 3k2b n THR 119 Ca 0.17 -1.53 0.02 0.00 -2.27 0.00 0.00 64.05 60.45 3k2b n THR 119 Cb 0.40 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.03 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 -0.54 -2.39 0.80 6.98 0.00 -1.19 -4.92 121.76 120.50 3k2b s ALA 120 Ca 0.36 0.47 -0.15 0.00 0.00 0.00 0.00 51.96 52.65 3k2b s ALA 120 Cb 0.22 0.56 0.01 0.00 0.00 0.00 0.00 23.12 23.91 3k2b s ALA 120 CO -0.04 -1.10 0.68 -2.30 0.00 0.00 0.00 175.76 173.00 3k2b n PRO 121 N -0.66 0.14 -4.92 0.00 -0.02 -1.23 -4.17 135.00 124.13 3k2b n PRO 121 Ca -0.04 0.10 -0.31 0.00 -2.02 0.00 0.00 63.50 61.23 3k2b n PRO 121 Cb 0.61 -2.01 -0.14 0.00 -0.02 0.00 0.00 33.50 31.95 3k2b n PRO 121 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3k2b s GLY 122 N -1.77 1.46 0.37 -1.23 0.00 -1.26 -4.85 107.32 100.03 3k2b s GLY 122 Ca 0.66 -1.14 -0.27 0.00 0.00 0.00 0.00 44.72 43.96 3k2b s GLY 122 CO 0.58 -0.99 1.30 0.54 0.00 0.00 0.00 173.10 174.53 3k2b s LYS 122 N -1.04 4.16 0.15 2.90 -0.14 -0.62 -4.82 119.74 120.33 3k2b s LYS 122 Ca 0.12 2.18 0.00 0.00 -1.36 0.00 0.00 55.97 56.91 3k2b s LYS 122 Cb -0.10 -2.91 0.00 0.00 -1.68 0.00 0.00 37.83 33.14 3k2b s LYS 122 CO 0.02 -0.33 0.00 0.41 -0.76 0.00 0.00 175.35 174.69 3k2b n GLY 123 N 0.72 1.54 3.56 -3.33 0.00 -1.26 -4.17 105.19 102.25 3k2b n GLY 123 Ca 0.02 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.00 4.99 -0.29 1.61 3.84 -1.26 -4.90 116.67 116.66 3k2b s ASP 124 Ca 0.00 0.83 -0.13 0.00 -0.00 0.00 0.00 52.55 53.25 3k2b s ASP 124 Cb 0.00 -2.52 0.11 0.00 -1.38 0.00 0.00 42.92 39.13 3k2b s ASP 124 CO 0.00 -2.50 0.70 -0.51 -0.00 0.00 0.00 175.17 172.86 3k2b s ILE 125 N 10.13 -0.47 -0.27 2.11 1.10 -1.26 -4.93 121.20 127.62 3k2b s ILE 125 Ca 0.83 0.00 -0.37 0.00 -0.51 0.00 0.00 60.65 60.60 3k2b s ILE 125 Cb -0.17 -1.00 -0.13 0.00 0.15 0.00 0.00 42.46 41.32 3k2b s ILE 125 CO 0.25 0.00 1.97 -2.65 -2.11 0.00 0.00 174.94 172.40 3k2b n PRO 126 N 4.82 1.35 -4.70 3.50 -0.02 -1.26 -4.83 135.00 133.86 3k2b n PRO 126 Ca -0.16 0.45 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 3k2b n PRO 126 Cb 0.54 -2.38 -0.12 0.00 -0.02 0.00 0.00 33.50 31.52 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 5.33 3.50 -0.03 3.45 2.01 -1.26 -0.37 115.64 128.27 3k2b s THR 127 Ca 1.02 -0.55 -0.02 0.00 0.31 0.00 0.00 61.69 62.45 3k2b s THR 127 Cb -0.89 -2.42 0.02 0.00 0.01 0.00 0.00 72.50 69.21 3k2b s THR 127 CO 0.55 0.59 0.06 -0.31 -0.69 0.00 0.00 174.62 174.82 3k2b s TYR 128 N -0.64 -0.05 -0.24 4.92 2.02 -0.21 -4.82 117.35 118.33 3k2b s TYR 128 Ca 0.09 0.19 0.02 0.00 -0.37 0.00 0.00 57.07 57.01 3k2b s TYR 128 Cb -0.11 -0.05 0.05 0.00 -0.40 0.00 0.00 41.96 41.44 3k2b s TYR 128 CO 0.02 -0.06 -0.12 0.08 -1.57 0.00 0.00 175.55 173.89 3k2b s VAL 129 N 0.44 2.07 0.06 0.71 1.01 -1.26 -4.16 120.40 119.27 3k2b s VAL 129 Ca -0.03 -1.44 -0.34 0.00 0.00 0.00 0.00 61.98 60.16 3k2b s VAL 129 Cb -0.05 -2.13 -0.13 0.00 0.00 0.00 0.00 36.38 34.07 3k2b s VAL 129 CO -0.02 0.08 1.68 0.52 0.00 0.00 0.00 175.10 177.37 3k2b n VAL 130 N 4.50 0.22 -0.16 2.92 0.31 -1.26 -1.43 118.33 123.43 3k2b n VAL 130 Ca -0.15 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3k2b n VAL 130 Cb 0.44 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 3k2b n VAL 130 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k2b n GLY 131 N 3.75 0.59 0.18 2.92 0.00 -1.26 -4.87 105.19 106.50 3k2b n GLY 131 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.01 0.00 -1.91 1.61 0.31 -0.52 -4.93 118.33 110.88 3k2b n VAL 132 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 3k2b n VAL 132 Cb 0.00 -0.36 -0.05 0.00 -0.91 0.00 0.00 33.84 32.52 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 -2.13 -0.67 0.27 4.52 2.04 -1.08 -4.94 115.26 113.27 3k2b n ASN 133 Ca 0.00 -1.53 0.16 0.00 -0.44 0.00 0.00 54.58 52.77 3k2b n ASN 133 Cb 0.27 0.20 0.63 0.00 -2.53 0.00 0.00 39.78 38.34 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 1.01 -0.22 -2.53 0.00 -1.92 -2.87 119.26 112.73 3k2b h ALA 134 Ca -0.38 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 3k2b h ALA 134 Cb 1.19 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3k2b h ALA 134 CO -0.20 0.05 -0.32 -0.44 0.00 0.00 0.00 179.25 178.35 3k2b h ASP 135 N 0.00 0.47 0.01 0.00 3.45 -1.92 -2.75 116.42 115.68 3k2b h ASP 135 Ca -0.00 -0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.28 3k2b h ASP 135 Cb 0.57 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.21 3k2b h ASP 135 CO 0.01 0.76 0.00 0.00 -1.57 0.00 0.00 179.24 178.44 3k2b n ALA 136 N -2.49 1.39 -2.08 3.45 0.00 -1.08 -4.66 120.51 115.05 3k2b n ALA 136 Ca -0.01 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 3k2b n ALA 136 Cb 0.45 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 3k2b n ALA 136 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3k2b s TYR 137 N -2.31 2.08 -0.09 0.00 5.04 -1.04 -5.00 117.35 116.03 3k2b s TYR 137 Ca 0.02 0.43 -0.02 0.00 -2.44 0.00 0.00 57.07 55.06 3k2b s TYR 137 Cb 0.01 -3.92 -0.03 0.00 0.35 0.00 0.00 41.96 38.36 3k2b s TYR 137 CO 0.02 -3.25 0.02 -1.54 -1.34 0.00 0.00 175.55 169.45 3k2b s SER 138 N 3.84 5.37 0.05 4.32 1.04 -1.26 -4.96 113.70 122.10 3k2b s SER 138 Ca 0.72 0.18 0.03 0.00 0.48 0.00 0.00 55.95 57.36 3k2b s SER 138 Cb -0.28 -1.55 0.16 0.00 0.10 0.00 0.00 66.02 64.45 3k2b s SER 138 CO 0.28 0.38 1.02 1.57 0.98 0.00 0.00 173.24 177.47 3k2b n HIS 139 N 2.14 0.10 0.22 5.02 -0.00 -1.26 -0.99 115.22 120.45 3k2b n HIS 139 Ca -0.19 0.05 0.06 0.00 0.46 0.00 0.00 57.72 58.11 3k2b n HIS 139 Cb 0.54 -0.50 0.55 0.00 -0.12 0.00 0.00 29.99 30.46 3k2b n HIS 139 CO 0.00 0.00 0.00 0.22 0.46 0.00 0.00 176.34 177.02 3k2b h ASP 140 N 0.00 0.04 -2.60 0.26 1.82 -1.93 -3.42 116.42 110.58 3k2b h ASP 140 Ca 0.00 -0.00 -0.56 0.00 -0.39 0.00 0.00 57.03 56.08 3k2b h ASP 140 Cb 0.18 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.17 3k2b h ASP 140 CO 0.00 0.12 1.17 -1.61 -1.61 0.00 0.00 179.24 177.31 3k2b s GLU 141 N -4.88 3.84 0.04 0.28 0.41 -0.16 -4.88 118.70 113.35 3k2b s GLU 141 Ca -0.05 1.92 0.10 0.00 -0.41 0.00 0.00 54.97 56.53 3k2b s GLU 141 Cb 0.16 -4.08 -0.21 0.00 -1.78 0.00 0.00 34.13 28.23 3k2b s GLU 141 CO 0.69 -1.25 0.95 -1.00 -0.49 0.00 0.00 175.26 174.16 3k2b h PRO 142 N 10.94 0.00 -4.63 0.39 0.13 -1.88 -3.46 132.00 133.48 3k2b h PRO 142 Ca -0.37 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.38 3k2b h PRO 142 Cb 1.18 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.02 3k2b h PRO 142 CO 0.98 0.70 -0.77 0.42 -0.23 0.00 0.00 178.00 179.10 3k2b s ILE 143 N -2.67 0.64 0.06 -3.56 -1.09 -1.26 -1.81 121.20 111.50 3k2b s ILE 143 Ca -0.02 -0.37 -0.12 0.00 -2.23 0.00 0.00 60.65 57.91 3k2b s ILE 143 Cb 0.09 -0.54 0.01 0.00 -1.58 0.00 0.00 42.46 40.44 3k2b s ILE 143 CO 0.82 0.16 0.26 0.27 -1.23 0.00 0.00 174.94 175.22 3k2b s ILE 144 N -0.23 0.10 0.00 2.92 -4.36 -0.84 -4.24 121.20 114.55 3k2b s ILE 144 Ca 0.03 -0.83 0.05 0.00 -0.26 0.00 0.00 60.65 59.64 3k2b s ILE 144 Cb -0.03 -1.02 -0.03 0.00 1.25 0.00 0.00 42.46 42.62 3k2b s ILE 144 CO -0.00 -0.46 -0.13 -0.55 0.24 0.00 0.00 174.94 174.04 3k2b s SER 145 N -2.28 4.15 -0.19 4.36 0.15 0.51 -0.98 113.70 119.43 3k2b s SER 145 Ca -0.03 -0.26 0.15 0.00 0.70 0.00 0.00 55.95 56.51 3k2b s SER 145 Cb 0.00 -0.84 0.76 0.00 -1.71 0.00 0.00 66.02 64.23 3k2b s SER 145 CO -0.06 0.29 1.66 -3.20 1.20 0.00 0.00 173.24 173.14 3k2b n ASN 146 N 1.77 5.21 0.00 5.45 5.15 -0.77 -1.04 115.26 131.03 3k2b n ASN 146 Ca -0.16 -2.73 0.00 0.00 -0.60 0.00 0.00 54.58 51.09 3k2b n ASN 146 Cb 0.52 -0.64 0.00 0.00 -0.53 0.00 0.00 39.78 39.13 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 0.78 0.00 -2.56 5.20 0.00 -1.26 -4.79 120.51 117.88 3k2b n ALA 147 Ca 0.26 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 3k2b n ALA 147 Cb 1.06 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.42 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 4.09 0.49 0.00 1.04 -1.26 -3.17 113.70 110.89 3k2b s SER 148 Ca 0.00 -0.82 0.30 0.00 0.48 0.00 0.00 55.95 55.91 3k2b s SER 148 Cb 0.00 -0.59 1.40 0.00 0.10 0.00 0.00 66.02 66.93 3k2b s SER 148 CO 0.00 0.02 1.79 0.00 0.98 0.00 0.00 173.24 176.03 3k2b h THR 150 N 0.14 1.51 -0.56 0.00 2.02 -1.95 -3.14 112.91 110.92 3k2b h THR 150 Ca 0.58 -2.52 0.00 0.00 0.77 0.00 0.00 66.41 65.24 3k2b h THR 150 Cb 2.00 3.17 -0.03 0.00 -1.74 0.00 0.00 68.15 71.55 3k2b h THR 150 CO -0.12 0.71 0.36 0.74 0.37 0.00 0.00 175.52 177.58 3k2b h THR 151 N -0.34 1.15 0.00 3.16 2.02 -1.53 0.34 112.91 117.70 3k2b h THR 151 Ca -0.14 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.73 3k2b h THR 151 Cb 1.64 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3k2b h THR 151 CO 0.15 0.15 0.00 0.59 0.37 0.00 0.00 175.52 176.79 3k2b n ASN 152 N -4.44 0.06 -0.10 4.18 4.13 -0.50 -0.22 115.26 118.37 3k2b n ASN 152 Ca 0.05 0.51 -0.11 0.00 1.68 0.00 0.00 54.58 56.71 3k2b n ASN 152 Cb 0.06 -0.53 -0.12 0.00 -1.54 0.00 0.00 39.78 37.65 3k2b n ASN 152 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3k2b h LEU 154 N 0.00 0.56 -0.33 0.00 5.85 -0.21 -3.37 115.31 117.82 3k2b h LEU 154 Ca -0.48 -0.82 0.01 0.00 0.84 0.00 0.00 57.88 57.43 3k2b h LEU 154 Cb 1.96 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.79 3k2b h LEU 154 CO -0.01 1.32 0.19 0.00 -0.34 0.00 0.00 178.44 179.60 3k2b h ALA 155 N 0.25 0.41 0.07 1.25 0.00 -0.83 -1.70 119.26 118.72 3k2b h ALA 155 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3k2b h ALA 155 Cb 1.48 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 3k2b h ALA 155 CO 0.14 -0.16 -0.14 -1.35 0.00 0.00 0.00 179.25 177.74 3k2b h PRO 156 N 0.40 -0.22 0.00 0.00 0.11 -1.78 -2.27 132.00 128.24 3k2b h PRO 156 Ca 0.13 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3k2b h PRO 156 Cb -0.01 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.15 3k2b h PRO 156 CO -0.06 -0.15 0.00 1.97 -0.21 0.00 0.00 178.00 179.56 3k2b n PHE 157 N -3.21 0.24 0.13 0.65 1.16 -1.24 -2.02 117.46 113.17 3k2b n PHE 157 Ca -0.03 0.09 -0.01 0.00 -1.87 0.00 0.00 57.45 55.64 3k2b n PHE 157 Cb 0.12 -0.65 0.09 0.00 -1.61 0.00 0.00 39.48 37.43 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 1.27 0.23 1.97 2.07 -1.09 -2.47 116.25 118.24 3k2b h VAL 158 Ca 0.00 -2.40 -0.01 0.00 0.82 0.00 0.00 66.70 65.10 3k2b h VAL 158 Cb 0.34 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 3k2b h VAL 158 CO 0.00 0.64 -0.11 0.50 0.02 0.00 0.00 177.57 178.62 3k2b h LYS 159 N 0.00 -0.30 -0.94 1.57 3.64 -0.81 -2.46 116.57 117.27 3k2b h LYS 159 Ca -0.01 0.02 0.22 0.00 -1.27 0.00 0.00 60.65 59.62 3k2b h LYS 159 Cb 1.32 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 33.14 3k2b h LYS 159 CO 0.08 0.07 0.62 0.28 -2.27 0.00 0.00 179.45 178.24 3k2b h VAL 160 N -0.81 0.64 -0.05 2.00 2.07 -1.51 0.12 116.25 118.71 3k2b h VAL 160 Ca -0.03 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 3k2b h VAL 160 Cb 0.51 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3k2b h VAL 160 CO 0.05 0.07 -0.09 -0.07 0.02 0.00 0.00 177.57 177.55 3k2b h LEU 161 N 0.38 0.16 -0.54 2.57 3.38 -1.40 -2.47 115.31 117.40 3k2b h LEU 161 Ca 0.50 -0.55 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 3k2b h LEU 161 Cb 1.28 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 3k2b h LEU 161 CO -0.19 0.69 0.06 -0.78 0.09 0.00 0.00 178.44 178.30 3k2b h ASP 162 N -0.35 0.89 0.77 -0.43 3.58 -0.84 0.82 116.42 120.87 3k2b h ASP 162 Ca 0.00 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.17 3k2b h ASP 162 Cb 0.66 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.47 3k2b h ASP 162 CO 0.02 0.94 0.00 1.56 -2.88 0.00 0.00 179.24 178.88 3k2b h GLN 163 N 0.80 0.00 0.00 0.28 4.20 -0.85 -0.27 115.11 119.27 3k2b h GLN 163 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3k2b h GLN 163 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 3k2b h GLN 163 CO 0.02 0.00 -0.68 1.63 -0.67 0.00 0.00 178.83 179.13 3k2b n LYS 164 N -3.02 2.93 0.00 1.46 5.02 -0.93 -4.81 118.16 118.81 3k2b n LYS 164 Ca -0.00 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3k2b n LYS 164 Cb 0.25 -0.88 0.00 0.00 -0.02 0.00 0.00 35.03 34.37 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 -1.36 0.00 -2.50 2.13 3.01 0.28 -4.97 117.46 114.05 3k2b n PHE 165 Ca -0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 3k2b n PHE 165 Cb 0.08 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 3k2b n PHE 165 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k2b n GLY 166 N 0.00 -5.60 3.64 1.37 0.00 -0.11 -2.20 105.19 102.29 3k2b n GLY 166 Ca 0.00 1.07 -0.43 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.64 4.02 -0.06 -0.61 1.01 -1.26 -2.16 121.20 121.50 3k2b s ILE 167 Ca -0.16 1.19 -0.16 0.00 0.00 0.00 0.00 60.65 61.52 3k2b s ILE 167 Cb 0.01 -3.92 -0.11 0.00 0.01 0.00 0.00 42.46 38.45 3k2b s ILE 167 CO 0.44 -0.27 0.62 0.40 0.00 0.00 0.00 174.94 176.13 3k2b h ILE 168 N 5.80 0.47 -3.69 2.92 2.04 -0.66 -3.49 117.51 120.91 3k2b h ILE 168 Ca -0.29 -1.02 -0.07 0.00 1.00 0.00 0.00 64.86 64.48 3k2b h ILE 168 Cb 1.12 0.82 -0.12 0.00 -0.74 0.00 0.00 36.82 37.90 3k2b h ILE 168 CO 1.00 0.13 -0.20 -1.59 0.00 0.00 0.00 178.15 177.49 3k2b s LYS 169 N -2.94 1.23 -0.05 2.37 -2.85 -1.21 -4.90 119.74 111.40 3k2b s LYS 169 Ca -0.09 -1.07 -0.29 0.00 -1.00 0.00 0.00 55.97 53.52 3k2b s LYS 169 Cb 0.00 0.43 0.07 0.00 -2.06 0.00 0.00 37.83 36.26 3k2b s LYS 169 CO 0.32 -0.48 0.65 0.20 0.10 0.00 0.00 175.35 176.14 3k2b s GLY 170 N -2.93 -0.54 0.14 0.59 0.00 0.08 -1.11 107.32 103.54 3k2b s GLY 170 Ca 0.14 1.23 0.09 0.00 0.00 0.00 0.00 44.72 46.18 3k2b s GLY 170 CO -0.01 0.89 -0.21 -1.08 0.00 0.00 0.00 173.10 172.69 3k2b s THR 171 N -1.19 1.90 -0.11 0.90 -1.32 0.22 -2.85 115.64 113.19 3k2b s THR 171 Ca -0.11 -1.77 -0.09 0.00 -1.21 0.00 0.00 61.69 58.50 3k2b s THR 171 Cb -0.01 -1.79 0.03 0.00 -1.51 0.00 0.00 72.50 69.23 3k2b s THR 171 CO 0.09 -0.15 0.29 -0.32 -2.21 0.00 0.00 174.62 172.33 3k2b s MET 172 N -2.35 0.32 -0.03 7.08 0.00 0.12 -0.99 119.30 123.45 3k2b s MET 172 Ca 0.13 0.44 0.02 0.00 0.00 0.00 0.00 55.69 56.28 3k2b s MET 172 Cb -0.08 0.12 0.01 0.00 0.00 0.00 0.00 34.83 34.87 3k2b s MET 172 CO 0.06 -0.06 -0.10 0.99 0.00 0.00 0.00 175.02 175.91 3k2b s THR 173 N 0.37 0.86 -0.24 10.11 2.01 -0.93 -2.13 115.64 125.69 3k2b s THR 173 Ca -0.02 -0.38 -0.01 0.00 0.31 0.00 0.00 61.69 61.59 3k2b s THR 173 Cb -0.03 -0.77 0.03 0.00 0.01 0.00 0.00 72.50 71.73 3k2b s THR 173 CO -0.01 0.27 -0.09 0.28 -0.69 0.00 0.00 174.62 174.38 3k2b s THR 174 N 0.31 2.72 -0.80 -0.82 -1.32 -1.02 0.47 115.64 115.18 3k2b s THR 174 Ca -0.06 -1.02 -0.23 0.00 -1.21 0.00 0.00 61.69 59.18 3k2b s THR 174 Cb -0.10 -2.35 0.07 0.00 -1.51 0.00 0.00 72.50 68.61 3k2b s THR 174 CO 0.01 0.25 1.15 -0.89 -2.21 0.00 0.00 174.62 172.93 3k2b s THR 175 N 1.31 4.22 -0.08 5.08 2.01 0.10 0.53 115.64 128.82 3k2b s THR 175 Ca 0.01 -0.56 -0.00 0.00 0.31 0.00 0.00 61.69 61.45 3k2b s THR 175 Cb -0.16 -4.82 -0.03 0.00 0.01 0.00 0.00 72.50 67.50 3k2b s THR 175 CO -0.06 -1.64 -0.04 -2.28 -0.69 0.00 0.00 174.62 169.92 3k2b s HIS 176 N 4.24 3.03 0.51 4.92 5.04 -0.27 -0.95 115.29 131.82 3k2b s HIS 176 Ca 0.31 0.09 -0.22 0.00 -1.54 0.00 0.00 55.06 53.70 3k2b s HIS 176 Cb -0.09 -1.74 -0.06 0.00 0.04 0.00 0.00 32.58 30.72 3k2b s HIS 176 CO 0.03 0.38 1.29 -1.12 -2.34 0.00 0.00 174.74 172.98 3k2b s SER 177 N -0.83 5.63 1.06 9.88 0.01 -1.22 -0.34 113.70 127.89 3k2b s SER 177 Ca 0.13 2.59 -0.12 0.00 1.31 0.00 0.00 55.95 59.86 3k2b s SER 177 Cb -0.11 -2.62 0.23 0.00 0.21 0.00 0.00 66.02 63.72 3k2b s SER 177 CO 0.02 -1.31 1.06 -0.72 0.41 0.00 0.00 173.24 172.70 3k2b s TYR 178 N -1.39 1.69 0.13 2.43 -0.85 -0.61 -4.74 117.35 114.00 3k2b s TYR 178 Ca 0.68 1.20 -0.09 0.00 -0.52 0.00 0.00 57.07 58.34 3k2b s TYR 178 Cb -0.36 -3.17 -0.00 0.00 0.38 0.00 0.00 41.96 38.81 3k2b s TYR 178 CO 0.43 -3.34 0.25 0.95 -1.52 0.00 0.00 175.55 172.32 3k2b s THR 179 N -2.67 0.10 0.44 -3.49 -4.23 -1.26 -4.73 115.64 99.80 3k2b s THR 179 Ca 0.67 -1.26 0.24 0.00 -1.18 0.00 0.00 61.69 60.15 3k2b s THR 179 Cb -0.22 -1.59 0.35 0.00 1.34 0.00 0.00 72.50 72.38 3k2b s THR 179 CO 0.61 -0.45 1.00 0.61 -0.54 0.00 0.00 174.62 175.85 3k2b n GLY 180 N -0.15 -0.60 0.23 3.99 0.00 -1.26 0.23 105.19 107.62 3k2b n GLY 180 Ca -0.11 0.33 0.04 0.00 0.00 0.00 0.00 46.02 46.28 3k2b n GLY 180 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3k2b h ASP 181 N 0.00 0.07 -3.98 1.61 -0.00 -1.97 -3.44 116.42 108.71 3k2b h ASP 181 Ca 0.44 -0.01 -0.45 0.00 -0.00 0.00 0.00 57.03 57.01 3k2b h ASP 181 Cb 2.32 -0.02 -0.02 0.00 -0.00 0.00 0.00 39.33 41.62 3k2b h ASP 181 CO -0.00 0.24 0.28 -1.10 -0.00 0.00 0.00 179.24 178.65 3k2b s GLN 182 N -4.66 4.16 0.26 0.28 -0.21 0.13 -4.93 119.66 114.69 3k2b s GLN 182 Ca -0.04 0.99 -0.21 0.00 0.02 0.00 0.00 55.36 56.12 3k2b s GLN 182 Cb 0.16 -2.24 -0.09 0.00 1.00 0.00 0.00 33.01 31.83 3k2b s GLN 182 CO 0.71 0.01 0.79 1.03 -2.12 0.00 0.00 175.29 175.71 3k2b s ARG 183 N -3.16 4.33 0.14 2.91 1.81 -0.92 -4.92 118.95 119.14 3k2b s ARG 183 Ca 0.60 0.99 -0.11 0.00 -1.72 0.00 0.00 55.73 55.49 3k2b s ARG 183 Cb -0.09 -2.83 -0.02 0.00 -0.45 0.00 0.00 34.95 31.56 3k2b s ARG 183 CO 0.15 0.34 1.51 1.25 -0.68 0.00 0.00 175.30 177.87 3k2b h LEU 184 N 3.27 0.98 -8.30 2.53 5.85 -1.90 -0.99 115.31 116.76 3k2b h LEU 184 Ca -0.48 -0.43 -0.29 0.00 0.84 0.00 0.00 57.88 57.53 3k2b h LEU 184 Cb 1.19 -0.27 -0.19 0.00 0.37 0.00 0.00 40.66 41.75 3k2b h LEU 184 CO 0.65 1.20 -0.73 -0.76 -0.34 0.00 0.00 178.44 178.46 3k2b s LEU 185 N -9.01 2.33 -0.46 2.25 1.43 -1.26 -3.91 118.68 110.06 3k2b s LEU 185 Ca -0.11 -0.69 -0.43 0.00 -1.03 0.00 0.00 54.13 51.87 3k2b s LEU 185 Cb 0.11 -0.21 -0.17 0.00 0.03 0.00 0.00 46.19 45.95 3k2b s LEU 185 CO 0.87 -0.25 2.04 0.47 0.23 0.00 0.00 176.35 179.71 3k2b n ASP 186 N 0.99 1.19 -3.79 2.29 9.92 -1.25 -4.57 116.55 121.33 3k2b n ASP 186 Ca -0.19 0.73 -0.11 0.00 -0.53 0.00 0.00 54.79 54.69 3k2b n ASP 186 Cb 0.56 -0.98 -0.08 0.00 -0.64 0.00 0.00 41.12 39.99 3k2b n ASP 186 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3k2b s ALA 187 N 5.63 -0.53 0.32 2.24 0.00 -0.67 -4.98 121.76 123.77 3k2b s ALA 187 Ca 1.14 -0.15 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 3k2b s ALA 187 Cb -1.35 0.33 -0.15 0.00 0.00 0.00 0.00 23.12 21.95 3k2b s ALA 187 CO 0.65 -0.41 0.55 0.43 0.00 0.00 0.00 175.76 176.99 3k2b n SER 188 N 0.56 -0.91 -3.59 0.00 7.64 -1.26 -4.52 113.62 111.54 3k2b n SER 188 Ca -0.18 1.02 -0.10 0.00 1.01 0.00 0.00 58.87 60.61 3k2b n SER 188 Cb 0.60 -1.05 -0.05 0.00 -1.01 0.00 0.00 64.21 62.69 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 -1.27 -0.38 0.22 1.43 5.04 -1.26 -4.90 115.29 114.17 3k2b s HIS 190 Ca 0.62 0.71 -0.08 0.00 -1.54 0.00 0.00 55.06 54.77 3k2b s HIS 190 Cb -0.74 0.44 0.28 0.00 0.04 0.00 0.00 32.58 32.60 3k2b s HIS 190 CO 0.59 -0.32 1.83 0.00 -2.34 0.00 0.00 174.74 174.50 3k2b h ARG 191 N 2.82 0.81 -4.97 2.88 2.47 -1.97 -3.36 114.38 113.06 3k2b h ARG 191 Ca -0.20 -0.05 -0.68 0.00 -1.26 0.00 0.00 59.98 57.79 3k2b h ARG 191 Cb 1.16 -0.18 -0.18 0.00 -1.65 0.00 0.00 29.97 29.12 3k2b h ARG 191 CO 0.28 0.53 -0.01 0.34 0.56 0.00 0.00 179.97 181.67 3k2b s ASP 192 N -5.69 6.23 0.47 7.04 -1.08 -1.26 -4.94 116.67 117.43 3k2b s ASP 192 Ca -0.13 -0.82 0.22 0.00 -0.52 0.00 0.00 52.55 51.30 3k2b s ASP 192 Cb 0.17 -2.28 1.18 0.00 -1.46 0.00 0.00 42.92 40.53 3k2b s ASP 192 CO 0.77 -0.81 1.62 -0.07 0.52 0.00 0.00 175.17 177.20 3k2b h LEU 193 N 9.54 0.00 0.05 -1.34 3.38 -2.00 0.90 115.31 125.85 3k2b h LEU 193 Ca -0.27 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.37 3k2b h LEU 193 Cb 1.10 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 3k2b h LEU 193 CO 0.92 0.00 -1.89 0.54 0.09 0.00 0.00 178.44 178.11 3k2b n ARG 194 N -2.44 0.69 0.00 1.13 5.12 -1.26 -3.81 116.66 116.09 3k2b n ARG 194 Ca -0.01 0.27 0.13 0.00 -1.93 0.00 0.00 57.85 56.30 3k2b n ARG 194 Cb 0.30 -1.74 0.70 0.00 -1.16 0.00 0.00 32.46 30.57 3k2b n ARG 194 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3k2b n ARG 195 N -3.23 0.56 0.15 5.56 1.74 0.26 -2.94 116.66 118.76 3k2b n ARG 195 Ca -0.25 0.03 0.08 0.00 -0.77 0.00 0.00 57.85 56.94 3k2b n ARG 195 Cb 1.05 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 31.05 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 3.40 0.74 -2.44 7.54 0.00 -1.52 -2.44 119.26 124.53 3k2b h ALA 196 Ca 0.00 -0.21 -0.48 0.00 0.00 0.00 0.00 54.91 54.22 3k2b h ALA 196 Cb 0.14 0.02 0.04 0.00 0.00 0.00 0.00 17.79 17.99 3k2b h ALA 196 CO 0.00 0.25 0.40 1.03 0.00 0.00 0.00 179.25 180.94 3k2b s ARG 197 N -3.16 3.63 -0.65 0.00 1.81 -1.15 -1.67 118.95 117.75 3k2b s ARG 197 Ca 0.03 1.47 -0.31 0.00 -1.72 0.00 0.00 55.73 55.20 3k2b s ARG 197 Cb 0.07 -2.07 -0.14 0.00 -0.45 0.00 0.00 34.95 32.37 3k2b s ARG 197 CO 0.74 -0.59 2.46 0.00 -0.68 0.00 0.00 175.30 177.23 3k2b n ALA 198 N -1.08 0.65 -0.23 2.13 0.00 -1.26 -4.28 120.51 116.43 3k2b n ALA 198 Ca 0.10 -0.45 -0.01 0.00 0.00 0.00 0.00 53.44 53.09 3k2b n ALA 198 Cb 0.52 -2.66 0.06 0.00 0.00 0.00 0.00 19.45 17.37 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 14.70 0.34 0.00 0.00 0.00 -1.29 -1.54 119.26 131.47 3k2b h ALA 199 Ca -0.17 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3k2b h ALA 199 Cb 1.30 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3k2b h ALA 199 CO 1.21 -0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.98 3k2b n ALA 200 N -3.18 2.54 0.26 0.00 0.00 -1.26 -3.54 120.51 115.33 3k2b n ALA 200 Ca 0.08 -0.17 0.05 0.00 0.00 0.00 0.00 53.44 53.40 3k2b n ALA 200 Cb 0.36 -1.47 -0.07 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.08 0.26 -4.46 0.00 4.77 -0.61 -4.75 117.00 111.13 3k2b n LEU 201 Ca 0.20 -0.26 -0.22 0.00 -0.03 0.00 0.00 56.01 55.69 3k2b n LEU 201 Cb 0.14 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 3k2b n LEU 201 CO 0.18 0.07 -0.34 0.20 -1.33 0.00 0.00 177.39 176.17 3k2b s ASN 202 N -2.61 2.84 -0.45 -1.43 -0.87 -1.04 -5.04 114.94 106.35 3k2b s ASN 202 Ca 0.00 -1.25 -0.14 0.00 -1.57 0.00 0.00 52.86 49.91 3k2b s ASN 202 Cb 0.08 -0.18 0.06 0.00 -0.02 0.00 0.00 41.25 41.19 3k2b s ASN 202 CO 0.45 -0.40 0.34 -0.63 -2.57 0.00 0.00 177.10 174.29 3k2b s ILE 203 N -3.02 4.96 -0.39 0.60 1.01 -1.26 -3.99 121.20 119.11 3k2b s ILE 203 Ca 0.32 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3k2b s ILE 203 Cb 0.05 -3.94 0.03 0.00 0.01 0.00 0.00 42.46 38.62 3k2b s ILE 203 CO 0.13 -0.51 0.23 -0.69 0.00 0.00 0.00 174.94 174.11 3k2b s VAL 204 N 1.59 4.66 0.08 2.92 1.01 0.26 -4.89 120.40 126.02 3k2b s VAL 204 Ca 0.04 -0.91 -0.31 0.00 0.00 0.00 0.00 61.98 60.80 3k2b s VAL 204 Cb -0.23 -3.64 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 3k2b s VAL 204 CO 0.06 -0.30 1.59 -2.84 0.00 0.00 0.00 175.10 173.62 3k2b s PRO 205 N 1.56 4.22 -0.03 2.72 0.02 -1.26 -0.78 135.00 141.45 3k2b s PRO 205 Ca 0.02 2.27 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 3k2b s PRO 205 Cb -0.20 -3.51 0.01 0.00 0.02 0.00 0.00 34.50 30.82 3k2b s PRO 205 CO 0.07 -0.68 0.08 -0.08 -0.33 0.00 0.00 177.00 176.06 3k2b s THR 206 N 2.31 -0.02 0.77 0.99 -1.32 -0.45 -4.82 115.64 113.11 3k2b s THR 206 Ca 0.71 0.06 -0.11 0.00 -1.21 0.00 0.00 61.69 61.14 3k2b s THR 206 Cb -0.39 -0.13 0.05 0.00 -1.51 0.00 0.00 72.50 70.52 3k2b s THR 206 CO 0.31 0.02 1.08 -0.94 -2.21 0.00 0.00 174.62 172.89 3k2b s SER 207 N 0.35 4.73 0.13 8.08 1.04 -1.26 -0.83 113.70 125.94 3k2b s SER 207 Ca -0.03 1.46 -0.16 0.00 0.48 0.00 0.00 55.95 57.70 3k2b s SER 207 Cb -0.04 -2.24 0.03 0.00 0.10 0.00 0.00 66.02 63.88 3k2b s SER 207 CO -0.01 -1.84 0.41 0.28 0.98 0.00 0.00 173.24 173.06 3k2b s THR 208 N -3.09 0.07 -0.19 2.02 -1.32 -1.26 -4.78 115.64 107.08 3k2b s THR 208 Ca 0.60 -0.61 -0.19 0.00 -1.21 0.00 0.00 61.69 60.28 3k2b s THR 208 Cb -0.15 -1.21 -0.20 0.00 -1.51 0.00 0.00 72.50 69.43 3k2b s THR 208 CO 0.55 -0.30 0.24 1.23 -2.21 0.00 0.00 174.62 174.12 3k2b h GLY 209 N 2.36 0.05 0.00 6.08 0.00 -1.98 -3.43 103.07 106.16 3k2b h GLY 209 Ca -0.34 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3k2b h GLY 209 CO 0.46 0.12 0.00 0.00 0.00 0.00 0.00 176.54 177.12 3k2b n ALA 210 N -3.35 0.00 0.30 3.60 0.00 -1.26 0.65 120.51 120.45 3k2b n ALA 210 Ca -0.32 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 52.95 3k2b n ALA 210 Cb 0.75 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.11 3k2b n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b h ALA 211 N 0.00 -0.87 -0.12 0.00 0.00 -1.88 -1.93 119.26 114.46 3k2b h ALA 211 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3k2b h ALA 211 Cb 0.00 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3k2b h ALA 211 CO 0.00 -1.01 -0.12 0.87 0.00 0.00 0.00 179.25 178.99 3k2b h LYS 212 N -0.85 0.19 -0.80 0.00 1.57 -0.01 -2.51 116.57 114.16 3k2b h LYS 212 Ca -0.06 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 58.76 3k2b h LYS 212 Cb 0.70 -0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.92 3k2b h LYS 212 CO 0.04 0.32 0.47 0.00 -0.57 0.00 0.00 179.45 179.70 3k2b h ALA 213 N 1.70 1.11 -1.04 3.86 0.00 -1.02 0.06 119.26 123.93 3k2b h ALA 213 Ca 0.04 0.02 0.27 0.00 0.00 0.00 0.00 54.91 55.24 3k2b h ALA 213 Cb 0.33 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 3k2b h ALA 213 CO 0.02 0.14 0.68 0.28 0.00 0.00 0.00 179.25 180.37 3k2b h VAL 214 N 0.82 0.52 -0.80 0.00 2.07 -0.89 0.38 116.25 118.35 3k2b h VAL 214 Ca 0.37 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.86 3k2b h VAL 214 Cb 0.27 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.12 3k2b h VAL 214 CO -0.21 0.06 0.46 0.00 0.02 0.00 0.00 177.57 177.90 3k2b h ALA 215 N 1.59 1.12 -0.72 1.67 0.00 -1.09 0.22 119.26 122.05 3k2b h ALA 215 Ca 0.58 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.50 3k2b h ALA 215 Cb 1.58 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 3k2b h ALA 215 CO -0.25 0.10 0.39 -0.07 0.00 0.00 0.00 179.25 179.42 3k2b h LEU 216 N 0.78 0.91 0.00 0.00 3.38 -0.30 -0.53 115.31 119.56 3k2b h LEU 216 Ca 0.38 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3k2b h LEU 216 Cb 0.32 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3k2b h LEU 216 CO -0.23 0.75 -0.48 1.33 0.09 0.00 0.00 178.44 179.90 3k2b n VAL 217 N -4.47 0.31 -3.26 1.22 0.24 -0.87 -4.35 118.33 107.16 3k2b n VAL 217 Ca 0.06 -0.22 -0.25 0.00 -2.04 0.00 0.00 64.34 61.89 3k2b n VAL 217 Cb 0.10 -0.16 -0.08 0.00 -1.47 0.00 0.00 33.84 32.23 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 -2.00 -0.04 -0.36 1.34 4.77 0.71 -4.53 117.00 116.88 3k2b n LEU 218 Ca 0.04 -4.58 0.30 0.00 -0.03 0.00 0.00 56.01 51.74 3k2b n LEU 218 Cb 0.42 0.60 0.50 0.00 -2.33 0.00 0.00 43.42 42.60 3k2b n LEU 218 CO 0.35 2.00 0.90 -2.65 -1.33 0.00 0.00 177.39 176.65 3k2b n PRO 219 N 1.90 -0.02 0.00 3.23 -0.02 -0.23 -0.30 135.00 139.56 3k2b n PRO 219 Ca 0.24 0.87 0.02 0.00 -2.02 0.00 0.00 63.50 62.61 3k2b n PRO 219 Cb 0.51 -1.75 0.10 0.00 -0.02 0.00 0.00 33.50 32.34 3k2b n PRO 219 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3k2b n ASN 220 N -3.98 0.00 -0.03 2.55 5.15 -1.26 -2.42 115.26 115.27 3k2b n ASN 220 Ca 0.29 -0.76 0.00 0.00 -0.60 0.00 0.00 54.58 53.52 3k2b n ASN 220 Cb 1.16 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.41 3k2b n ASN 220 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3k2b n LEU 221 N -0.62 0.70 -4.57 1.20 7.99 0.59 -5.03 117.00 117.26 3k2b n LEU 221 Ca 0.02 -0.82 -0.46 0.00 -0.01 0.00 0.00 56.01 54.75 3k2b n LEU 221 Cb 0.01 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.30 3k2b n LEU 221 CO 0.02 0.17 0.56 1.17 -1.51 0.00 0.00 177.39 177.80 3k2b n LYS 222 N -0.34 1.17 -2.15 3.23 4.81 -1.01 -1.71 118.16 122.15 3k2b n LYS 222 Ca 0.00 0.41 -0.18 0.00 -0.87 0.00 0.00 58.31 57.68 3k2b n LYS 222 Cb 0.02 -1.78 -0.02 0.00 0.02 0.00 0.00 35.03 33.26 3k2b n LYS 222 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k2b n GLY 223 N 1.52 0.12 0.00 3.14 0.00 -1.26 -4.86 105.19 103.85 3k2b n GLY 223 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.66 0.85 -3.69 1.61 5.02 -0.70 -5.02 118.16 113.57 3k2b n LYS 224 Ca -0.20 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 55.89 3k2b n LYS 224 Cb 0.64 -0.79 -0.01 0.00 -0.02 0.00 0.00 35.03 34.85 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 -3.63 4.04 0.00 -0.35 1.43 -1.25 -0.74 118.68 118.18 3k2b s LEU 225 Ca 0.00 -0.14 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 3k2b s LEU 225 Cb 0.00 -2.72 0.04 0.00 0.03 0.00 0.00 46.19 43.54 3k2b s LEU 225 CO 0.00 -0.29 0.54 -3.20 0.23 0.00 0.00 176.35 173.63 3k2b n ASN 226 N -1.52 -0.66 0.00 2.29 5.15 -1.13 -4.49 115.26 114.89 3k2b n ASN 226 Ca -0.03 -1.25 0.00 0.00 -0.60 0.00 0.00 54.58 52.70 3k2b n ASN 226 Cb 0.58 1.05 0.00 0.00 -0.53 0.00 0.00 39.78 40.88 3k2b n ASN 226 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k2b n GLY 227 N -0.39 4.24 3.61 8.20 0.00 -1.25 0.11 105.19 119.72 3k2b n GLY 227 Ca 0.01 -1.49 -0.22 0.00 0.00 0.00 0.00 46.02 44.32 3k2b n GLY 227 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3k2b n ILE 228 N -1.95 0.00 -4.27 -0.61 -0.00 -0.91 -4.38 119.36 107.25 3k2b n ILE 228 Ca 0.00 -1.95 -0.23 0.00 -0.00 0.00 0.00 62.75 60.58 3k2b n ILE 228 Cb 0.00 -0.27 -0.12 0.00 -0.00 0.00 0.00 39.64 39.25 3k2b n ILE 228 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3k2b s ALA 229 N -2.70 1.70 -0.37 -1.28 0.00 -0.01 -2.45 121.76 116.66 3k2b s ALA 229 Ca 0.41 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3k2b s ALA 229 Cb -0.03 -0.22 0.11 0.00 0.00 0.00 0.00 23.12 22.98 3k2b s ALA 229 CO 0.26 0.32 0.11 -0.51 0.00 0.00 0.00 175.76 175.95 3k2b s LEU 230 N -1.92 3.75 0.13 0.00 1.43 0.19 -1.34 118.68 120.93 3k2b s LEU 230 Ca 0.05 -2.18 -0.31 0.00 -1.03 0.00 0.00 54.13 50.67 3k2b s LEU 230 Cb -0.10 -1.35 -0.08 0.00 0.03 0.00 0.00 46.19 44.70 3k2b s LEU 230 CO 0.04 -0.36 1.37 -0.13 0.23 0.00 0.00 176.35 177.50 3k2b s ARG 231 N 0.89 4.34 0.14 1.70 1.81 0.04 -1.11 118.95 126.76 3k2b s ARG 231 Ca 0.12 2.06 0.05 0.00 -1.72 0.00 0.00 55.73 56.24 3k2b s ARG 231 Cb -0.20 -3.24 -0.04 0.00 -0.45 0.00 0.00 34.95 31.02 3k2b s ARG 231 CO -0.11 -0.39 -0.10 0.14 -0.68 0.00 0.00 175.30 174.15 3k2b s VAL 232 N 0.87 1.17 0.00 3.52 -7.23 0.54 0.89 120.40 120.15 3k2b s VAL 232 Ca 0.63 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.78 3k2b s VAL 232 Cb -0.37 -1.79 0.00 0.00 0.56 0.00 0.00 36.38 34.78 3k2b s VAL 232 CO 0.32 -0.71 0.00 -2.65 -0.31 0.00 0.00 175.10 171.75 3k2b n PRO 233 N -0.10 0.00 -4.96 4.82 -0.02 -1.26 -2.51 135.00 130.98 3k2b n PRO 233 Ca -0.11 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.06 3k2b n PRO 233 Cb 0.60 -1.25 -0.14 0.00 -0.02 0.00 0.00 33.50 32.69 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 1.34 2.32 -1.10 3.45 -4.23 -1.26 -4.99 115.64 111.17 3k2b s THR 234 Ca 0.00 -1.23 0.28 0.00 -1.18 0.00 0.00 61.69 59.56 3k2b s THR 234 Cb 0.00 -1.89 0.22 0.00 1.34 0.00 0.00 72.50 72.16 3k2b s THR 234 CO 0.00 0.43 1.79 -0.81 -0.54 0.00 0.00 174.62 175.49 3k2b n PRO 235 N 1.94 0.10 -3.57 3.99 -0.04 -1.26 -1.58 135.00 134.58 3k2b n PRO 235 Ca -0.17 -0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.17 3k2b n PRO 235 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.92 -0.35 0.00 3.54 2.47 -1.26 -4.85 114.94 111.56 3k2b s ASN 236 Ca 0.16 0.33 0.00 0.00 0.42 0.00 0.00 52.86 53.77 3k2b s ASN 236 Cb 0.19 0.30 0.00 0.00 -1.45 0.00 0.00 41.25 40.29 3k2b s ASN 236 CO 0.57 -0.36 0.00 0.52 -3.72 0.00 0.00 177.10 174.10 3k2b n VAL 237 N 0.58 -0.70 -4.23 -5.21 0.31 -1.26 -4.87 118.33 102.95 3k2b n VAL 237 Ca -0.09 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.10 3k2b n VAL 237 Cb 0.58 -0.29 -0.10 0.00 -0.91 0.00 0.00 33.84 33.13 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 -1.12 0.46 -0.02 4.52 0.01 -0.35 -3.45 113.70 113.75 3k2b s SER 238 Ca 0.00 -1.38 0.00 0.00 1.31 0.00 0.00 55.95 55.88 3k2b s SER 238 Cb 0.00 0.31 0.03 0.00 0.21 0.00 0.00 66.02 66.57 3k2b s SER 238 CO 0.00 -0.80 0.03 0.54 0.41 0.00 0.00 173.24 173.42 3k2b s VAL 239 N -4.04 -0.04 -0.17 3.43 0.11 -0.12 -2.33 120.40 117.25 3k2b s VAL 239 Ca 0.38 0.21 -0.09 0.00 -2.93 0.00 0.00 61.98 59.54 3k2b s VAL 239 Cb 0.07 -0.10 -0.05 0.00 -1.53 0.00 0.00 36.38 34.78 3k2b s VAL 239 CO 0.12 0.10 0.14 0.68 -3.33 0.00 0.00 175.10 172.80 3k2b s VAL 240 N 1.07 5.44 -0.65 2.04 -7.23 -0.91 0.00 120.40 120.17 3k2b s VAL 240 Ca -0.09 0.21 -0.04 0.00 -1.81 0.00 0.00 61.98 60.25 3k2b s VAL 240 Cb -0.13 -3.45 0.17 0.00 0.56 0.00 0.00 36.38 33.53 3k2b s VAL 240 CO -0.03 0.51 0.48 -0.62 -0.31 0.00 0.00 175.10 175.13 3k2b s ASP 241 N -0.20 5.43 -0.08 4.85 2.15 0.18 -2.46 116.67 126.53 3k2b s ASP 241 Ca 0.11 -2.83 -0.19 0.00 0.43 0.00 0.00 52.55 50.07 3k2b s ASP 241 Cb -0.12 -1.90 -0.05 0.00 -0.30 0.00 0.00 42.92 40.56 3k2b s ASP 241 CO 0.01 -0.39 0.51 -0.22 -0.17 0.00 0.00 175.17 174.90 3k2b s LEU 242 N -0.03 4.33 -0.18 -1.34 2.96 -0.72 -2.18 118.68 121.51 3k2b s LEU 242 Ca 0.17 0.93 -0.00 0.00 -0.22 0.00 0.00 54.13 55.00 3k2b s LEU 242 Cb -0.19 -2.75 0.04 0.00 0.50 0.00 0.00 46.19 43.79 3k2b s LEU 242 CO -0.04 0.05 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.29 3k2b s VAL 243 N 0.26 1.29 0.11 1.68 1.01 -0.16 -1.05 120.40 123.55 3k2b s VAL 243 Ca 0.27 -0.81 0.07 0.00 0.00 0.00 0.00 61.98 61.52 3k2b s VAL 243 Cb -0.16 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 3k2b s VAL 243 CO 0.12 0.10 -0.18 0.68 0.00 0.00 0.00 175.10 175.82 3k2b s VAL 244 N 1.54 1.56 -0.32 2.92 -7.23 -0.32 0.73 120.40 119.28 3k2b s VAL 244 Ca -0.01 -1.60 -0.08 0.00 -1.81 0.00 0.00 61.98 58.48 3k2b s VAL 244 Cb -0.16 -1.52 0.01 0.00 0.56 0.00 0.00 36.38 35.27 3k2b s VAL 244 CO -0.08 -0.20 0.13 -1.58 -0.31 0.00 0.00 175.10 173.06 3k2b s GLN 245 N -2.17 3.05 0.43 4.82 0.74 -0.27 0.12 119.66 126.38 3k2b s GLN 245 Ca 0.07 -0.90 0.05 0.00 0.05 0.00 0.00 55.36 54.63 3k2b s GLN 245 Cb -0.08 -3.51 0.01 0.00 1.10 0.00 0.00 33.01 30.52 3k2b s GLN 245 CO 0.04 -0.51 0.61 0.14 -0.55 0.00 0.00 175.29 175.02 3k2b s VAL 246 N 1.53 3.43 -0.16 1.34 -7.23 -0.01 0.09 120.40 119.39 3k2b s VAL 246 Ca 0.03 -0.82 -0.07 0.00 -1.81 0.00 0.00 61.98 59.30 3k2b s VAL 246 Cb -0.18 -3.21 -0.23 0.00 0.56 0.00 0.00 36.38 33.32 3k2b s VAL 246 CO 0.04 -0.11 0.22 -1.54 -0.31 0.00 0.00 175.10 173.41 3k2b n SER 247 N -1.95 2.07 -4.56 4.85 3.41 -0.92 -4.74 113.62 111.78 3k2b n SER 247 Ca 0.04 0.17 -0.40 0.00 -0.26 0.00 0.00 58.87 58.42 3k2b n SER 247 Cb 0.59 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 3k2b n SER 247 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3k2b s LYS 248 N -2.53 2.95 0.10 4.33 2.20 -1.11 -4.94 119.74 120.73 3k2b s LYS 248 Ca -0.26 0.63 -0.35 0.00 -0.36 0.00 0.00 55.97 55.63 3k2b s LYS 248 Cb 0.07 -4.28 -0.18 0.00 -1.51 0.00 0.00 37.83 31.93 3k2b s LYS 248 CO 0.71 -2.36 0.94 1.63 -0.36 0.00 0.00 175.35 175.92 3k2b n LYS 249 N 8.95 0.30 -3.09 4.03 4.76 -1.26 -4.86 118.16 126.99 3k2b n LYS 249 Ca 0.17 0.11 -0.08 0.00 -2.87 0.00 0.00 58.31 55.64 3k2b n LYS 249 Cb 0.50 -1.47 -0.00 0.00 -1.84 0.00 0.00 35.03 32.22 3k2b n LYS 249 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 3k2b n THR 250 N 1.11 0.00 -4.07 -0.18 5.66 0.11 -5.00 114.28 111.90 3k2b n THR 250 Ca 0.18 -1.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.08 3k2b n THR 250 Cb 0.17 0.72 -0.08 0.00 -1.55 0.00 0.00 70.33 69.59 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 -3.91 0.69 0.00 1.09 -0.71 -1.26 -4.43 117.98 109.45 3k2b s PHE 251 Ca 0.16 -1.02 0.00 0.00 -1.04 0.00 0.00 56.93 55.03 3k2b s PHE 251 Cb -0.02 -0.24 0.00 0.00 -1.21 0.00 0.00 43.02 41.55 3k2b s PHE 251 CO 0.12 -0.70 0.73 0.00 -1.34 0.00 0.00 175.22 174.03 3k2b n ALA 252 N -0.23 0.00 0.25 1.99 0.00 -1.26 -2.05 120.51 119.21 3k2b n ALA 252 Ca -0.03 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.58 3k2b n ALA 252 Cb 0.64 0.37 0.84 0.00 0.00 0.00 0.00 19.45 21.30 3k2b n ALA 252 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3k2b h GLU 253 N 0.00 0.00 0.06 0.00 9.09 -1.97 -0.67 114.58 121.08 3k2b h GLU 253 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 3k2b h GLU 253 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3k2b h GLU 253 CO 0.00 0.00 -0.03 1.49 0.05 0.00 0.00 179.01 180.52 3k2b h GLU 254 N 0.00 -0.07 -0.66 1.06 4.81 -1.84 -0.78 114.58 117.10 3k2b h GLU 254 Ca 0.07 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.40 3k2b h GLU 254 Cb 0.67 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.99 3k2b h GLU 254 CO -0.00 0.39 0.27 0.28 -0.73 0.00 0.00 179.01 179.22 3k2b h VAL 255 N -0.56 0.77 -0.47 0.32 2.07 -0.77 -0.72 116.25 116.88 3k2b h VAL 255 Ca -0.01 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 3k2b h VAL 255 Cb 0.49 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 3k2b h VAL 255 CO 0.01 0.08 0.05 0.78 0.02 0.00 0.00 177.57 178.51 3k2b h ASN 256 N 0.46 0.78 -0.79 0.57 -0.26 -1.39 -1.99 115.58 112.96 3k2b h ASN 256 Ca 0.34 -0.28 0.09 0.00 -0.56 0.00 0.00 56.30 55.89 3k2b h ASN 256 Cb 0.42 -0.21 -0.07 0.00 -1.06 0.00 0.00 38.32 37.40 3k2b h ASN 256 CO -0.31 0.86 0.44 0.00 -1.06 0.00 0.00 177.43 177.36 3k2b h ALA 257 N 0.94 1.12 -0.37 -0.83 0.00 -0.21 0.68 119.26 120.59 3k2b h ALA 257 Ca 0.14 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3k2b h ALA 257 Cb 0.44 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3k2b h ALA 257 CO 0.02 0.07 0.16 0.00 0.00 0.00 0.00 179.25 179.49 3k2b h ALA 258 N 1.44 0.45 -0.62 0.00 0.00 -0.73 -2.01 119.26 117.79 3k2b h ALA 258 Ca 0.38 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 3k2b h ALA 258 Cb 0.35 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3k2b h ALA 258 CO -0.25 -0.22 0.21 0.74 0.00 0.00 0.00 179.25 179.73 3k2b h PHE 259 N 0.33 0.99 -0.85 0.00 0.04 -0.42 -2.94 116.94 114.09 3k2b h PHE 259 Ca 0.16 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 3k2b h PHE 259 Cb 0.11 -0.29 -0.04 0.00 2.20 0.00 0.00 35.95 37.93 3k2b h PHE 259 CO -0.12 0.80 0.49 0.00 -0.60 0.00 0.00 178.31 178.88 3k2b h ARG 260 N 0.89 1.16 0.04 1.51 3.08 -0.48 -0.01 114.38 120.56 3k2b h ARG 260 Ca 0.20 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 3k2b h ARG 260 Cb 0.26 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3k2b h ARG 260 CO -0.01 0.82 -0.02 -0.44 -1.07 0.00 0.00 179.97 179.26 3k2b h ASP 261 N 1.17 -0.04 -1.39 7.04 3.45 -1.26 -2.57 116.42 122.82 3k2b h ASP 261 Ca 0.30 0.00 0.42 0.00 0.43 0.00 0.00 57.03 58.18 3k2b h ASP 261 Cb -0.02 0.01 -0.10 0.00 -0.56 0.00 0.00 39.33 38.67 3k2b h ASP 261 CO -0.05 -0.03 0.95 0.28 -1.57 0.00 0.00 179.24 178.81 3k2b h SER 262 N -0.05 0.17 -0.92 6.45 0.02 -1.49 0.69 113.55 118.43 3k2b h SER 262 Ca -0.00 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.09 3k2b h SER 262 Cb 0.04 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 62.56 3k2b h SER 262 CO 0.01 -0.06 0.57 0.00 -1.14 0.00 0.00 176.83 176.21 3k2b h ALA 263 N 1.44 1.29 -0.42 3.77 0.00 -0.59 -0.09 119.26 124.66 3k2b h ALA 263 Ca 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.66 3k2b h ALA 263 Cb 2.60 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 20.15 3k2b h ALA 263 CO -0.23 0.30 0.00 -0.85 0.00 0.00 0.00 179.25 178.47 3k2b n GLU 264 N -4.60 3.87 0.00 0.00 0.28 0.24 -2.12 120.64 118.31 3k2b n GLU 264 Ca 0.14 -2.99 0.00 0.00 -0.16 0.00 0.00 57.16 54.15 3k2b n GLU 264 Cb 0.21 -2.04 0.00 0.00 1.43 0.00 0.00 31.44 31.04 3k2b n GLU 264 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3k2b n LYS 265 N 0.06 0.00 0.00 3.44 5.02 -0.87 -4.81 118.16 121.00 3k2b n LYS 265 Ca 0.24 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.62 3k2b n LYS 265 Cb 1.03 0.00 0.40 0.00 -0.02 0.00 0.00 35.03 36.44 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 0.05 -0.42 1.97 0.00 -1.22 -3.32 120.64 117.70 3k2b n GLU 266 Ca 0.00 0.18 0.06 0.00 0.00 0.00 0.00 57.16 57.40 3k2b n GLU 266 Cb 0.00 -1.50 0.11 0.00 0.00 0.00 0.00 31.44 30.05 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 -1.46 1.81 -4.74 -1.84 4.77 -0.10 -4.95 117.00 110.48 3k2b n LEU 267 Ca 0.05 -2.73 -0.41 0.00 -0.03 0.00 0.00 56.01 52.89 3k2b n LEU 267 Cb 0.20 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3k2b n LEU 267 CO 0.16 0.75 1.10 -0.75 -1.33 0.00 0.00 177.39 177.33 3k2b s LYS 268 N -2.08 4.27 0.00 3.23 2.20 -0.90 -0.52 119.74 125.94 3k2b s LYS 268 Ca 0.27 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 58.17 3k2b s LYS 268 Cb 0.25 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.46 3k2b s LYS 268 CO -0.02 -0.42 0.00 0.41 -0.36 0.00 0.00 175.35 174.96 3k2b n GLY 269 N 2.25 2.52 0.61 5.54 0.00 -1.26 -4.77 105.19 110.07 3k2b n GLY 269 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 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 0.87 -4.20 -0.61 2.08 -0.33 -4.29 119.36 110.88 3k2b n ILE 270 Ca 0.00 -0.06 -0.30 0.00 0.56 0.00 0.00 62.75 62.95 3k2b n ILE 270 Cb 0.00 -1.74 -0.09 0.00 -0.75 0.00 0.00 39.64 37.06 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 -6.87 3.14 0.02 1.39 0.20 0.32 -0.47 118.68 116.41 3k2b s LEU 271 Ca -0.17 -0.34 -0.12 0.00 0.69 0.00 0.00 54.13 54.19 3k2b s LEU 271 Cb 0.06 -1.92 0.01 0.00 -0.43 0.00 0.00 46.19 43.91 3k2b s LEU 271 CO 0.22 0.17 0.25 -0.62 -0.29 0.00 0.00 176.35 176.08 3k2b s ASP 272 N -2.27 -0.07 -0.18 3.68 3.68 -0.67 -4.65 116.67 116.18 3k2b s ASP 272 Ca 0.23 -0.16 -0.00 0.00 2.13 0.00 0.00 52.55 54.74 3k2b s ASP 272 Cb -0.11 0.30 0.01 0.00 -1.45 0.00 0.00 42.92 41.67 3k2b s ASP 272 CO 0.15 -0.51 -0.15 -0.69 0.13 0.00 0.00 175.17 174.10 3k2b s VAL 273 N -2.00 2.51 -0.23 1.11 1.01 -1.26 -0.34 120.40 121.19 3k2b s VAL 273 Ca -0.09 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 3k2b s VAL 273 Cb -0.03 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 3k2b s VAL 273 CO -0.00 0.51 0.05 0.00 0.00 0.00 0.00 175.10 175.65 3k2b n ASP 275 N 4.53 3.76 -4.54 0.00 8.00 -1.26 -1.30 116.55 125.75 3k2b n ASP 275 Ca -0.16 -3.43 -0.33 0.00 0.71 0.00 0.00 54.79 51.57 3k2b n ASP 275 Cb 0.52 -0.70 -0.12 0.00 -0.02 0.00 0.00 41.12 40.80 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 -3.11 2.68 -1.22 -1.24 0.41 -1.26 -4.94 118.70 110.03 3k2b s GLU 276 Ca 0.50 -0.60 -0.19 0.00 -0.41 0.00 0.00 54.97 54.27 3k2b s GLU 276 Cb 0.42 -2.52 -0.02 0.00 -1.78 0.00 0.00 34.13 30.24 3k2b s GLU 276 CO 0.08 0.64 1.91 -0.35 -0.49 0.00 0.00 175.26 177.05 3k2b n PRO 277 N 2.30 2.42 -3.37 0.39 -0.04 -1.26 -4.90 135.00 130.54 3k2b n PRO 277 Ca -0.18 -2.71 -0.22 0.00 -0.04 0.00 0.00 63.50 60.35 3k2b n PRO 277 Cb 0.53 -3.45 0.03 0.00 -0.04 0.00 0.00 33.50 30.57 3k2b n PRO 277 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k2b s LEU 278 N 5.41 2.99 0.11 1.53 1.43 -1.26 -5.15 118.68 123.75 3k2b s LEU 278 Ca 0.57 -0.97 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3k2b s LEU 278 Cb 0.06 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 3k2b s LEU 278 CO 0.07 -1.20 -0.09 0.68 0.23 0.00 0.00 176.35 176.05 3k2b s VAL 279 N -2.68 0.92 0.09 -1.59 -7.23 -1.26 -5.04 120.40 103.60 3k2b s VAL 279 Ca 0.51 -1.89 -0.08 0.00 -1.81 0.00 0.00 61.98 58.71 3k2b s VAL 279 Cb -0.04 -1.64 0.08 0.00 0.56 0.00 0.00 36.38 35.34 3k2b s VAL 279 CO 0.32 -0.74 0.63 -1.54 -0.31 0.00 0.00 175.10 173.46 3k2b n SER 280 N 0.08 -0.29 0.14 4.85 3.41 -1.26 0.66 113.62 121.21 3k2b n SER 280 Ca -0.13 0.71 0.17 0.00 -0.26 0.00 0.00 58.87 59.37 3k2b n SER 280 Cb 0.60 -0.16 0.74 0.00 -0.26 0.00 0.00 64.21 65.13 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 0.66 0.00 -3.33 3.04 -1.97 -0.59 116.25 114.05 3k2b h VAL 281 Ca 0.13 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.77 3k2b h VAL 281 Cb 0.24 0.82 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 3k2b h VAL 281 CO -0.40 0.00 -0.25 0.44 -1.01 0.00 0.00 177.57 176.35 3k2b h ASP 282 N 0.00 0.00 -0.38 3.17 3.32 -0.18 -2.73 116.42 119.62 3k2b h ASP 282 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3k2b h ASP 282 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3k2b h ASP 282 CO -0.00 0.25 0.00 0.49 -1.72 0.00 0.00 179.24 178.26 3k2b n PHE 283 N -3.89 0.90 -2.35 4.55 3.72 -0.23 -4.91 117.46 115.24 3k2b n PHE 283 Ca -0.02 -0.35 -0.42 0.00 -0.05 0.00 0.00 57.45 56.61 3k2b n PHE 283 Cb 0.33 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 3k2b n PHE 283 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3k2b s ARG 284 N -1.73 4.33 0.00 -1.08 0.52 -1.03 -3.01 118.95 116.94 3k2b s ARG 284 Ca 0.30 1.81 0.00 0.00 -0.52 0.00 0.00 55.73 57.32 3k2b s ARG 284 Cb 0.20 -3.53 0.00 0.00 0.52 0.00 0.00 34.95 32.13 3k2b s ARG 284 CO 0.14 -0.48 0.00 0.00 0.02 0.00 0.00 175.30 174.98 3k2b s SER 286 N -2.45 5.10 0.00 0.00 1.04 -1.17 -4.92 113.70 111.31 3k2b s SER 286 Ca 0.00 2.14 0.20 0.00 0.48 0.00 0.00 55.95 58.77 3k2b s SER 286 Cb 0.00 -2.57 0.40 0.00 0.10 0.00 0.00 66.02 63.95 3k2b s SER 286 CO 0.00 -1.64 1.34 0.47 0.98 0.00 0.00 173.24 174.39 3k2b n ASP 287 N -2.13 3.31 -4.67 7.02 8.00 -1.26 -3.72 116.55 123.09 3k2b n ASP 287 Ca 0.11 -1.94 -0.37 0.00 0.71 0.00 0.00 54.79 53.30 3k2b n ASP 287 Cb 0.51 -0.25 -0.09 0.00 -0.02 0.00 0.00 41.12 41.27 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 -1.30 3.35 0.35 1.24 0.40 -1.26 -4.68 117.98 116.08 3k2b s PHE 288 Ca 0.35 0.35 0.09 0.00 -0.60 0.00 0.00 56.93 57.12 3k2b s PHE 288 Cb 0.20 -2.32 0.81 0.00 0.51 0.00 0.00 43.02 42.22 3k2b s PHE 288 CO 0.28 0.08 1.87 0.77 0.70 0.00 0.00 175.22 178.92 3k2b h SER 289 N 7.34 0.66 -3.00 1.36 0.02 -1.02 -3.40 113.55 115.51 3k2b h SER 289 Ca -0.38 0.04 -0.26 0.00 -0.84 0.00 0.00 61.79 60.35 3k2b h SER 289 Cb 1.17 -0.09 -0.34 0.00 0.14 0.00 0.00 62.40 63.27 3k2b h SER 289 CO 0.69 0.34 -0.59 0.42 -1.14 0.00 0.00 176.83 176.54 3k2b s THR 290 N -5.68 -0.32 -0.31 -2.27 -4.23 -1.00 -4.14 115.64 97.69 3k2b s THR 290 Ca -0.10 0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 60.71 3k2b s THR 290 Cb 0.22 -0.35 0.05 0.00 1.34 0.00 0.00 72.50 73.75 3k2b s THR 290 CO 0.79 0.14 0.03 -0.89 -0.54 0.00 0.00 174.62 174.14 3k2b s THR 291 N 2.34 3.20 0.20 3.99 2.01 -0.21 -1.68 115.64 125.49 3k2b s THR 291 Ca 0.02 -1.33 -0.30 0.00 0.31 0.00 0.00 61.69 60.40 3k2b s THR 291 Cb -0.12 -2.84 -0.08 0.00 0.01 0.00 0.00 72.50 69.47 3k2b s THR 291 CO -0.07 -0.13 1.16 -0.63 -0.69 0.00 0.00 174.62 174.26 3k2b s ILE 292 N 1.29 3.62 -0.91 1.82 1.09 0.53 0.81 121.20 129.47 3k2b s ILE 292 Ca -0.04 1.41 -0.18 0.00 -1.10 0.00 0.00 60.65 60.73 3k2b s ILE 292 Cb -0.20 -3.90 0.14 0.00 -1.06 0.00 0.00 42.46 37.44 3k2b s ILE 292 CO -0.00 0.25 1.09 -0.62 -0.10 0.00 0.00 174.94 175.55 3k2b s ASP 293 N -0.07 6.62 0.21 3.58 -1.08 0.97 -0.86 116.67 126.04 3k2b s ASP 293 Ca 0.51 -2.05 -0.17 0.00 -0.52 0.00 0.00 52.55 50.32 3k2b s ASP 293 Cb -0.32 -2.38 0.22 0.00 -1.46 0.00 0.00 42.92 38.98 3k2b s ASP 293 CO 0.37 -1.04 1.59 0.77 0.52 0.00 0.00 175.17 177.38 3k2b h SER 294 N 8.78 -1.02 0.17 -0.34 4.64 -1.48 -1.62 113.55 122.69 3k2b h SER 294 Ca 0.13 0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3k2b h SER 294 Cb 1.03 0.56 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 3k2b h SER 294 CO 1.08 -0.28 0.00 -1.54 -0.87 0.00 0.00 176.83 175.22 3k2b n SER 295 N -5.47 0.00 -0.66 4.97 3.41 -1.26 -2.04 113.62 112.57 3k2b n SER 295 Ca 0.08 0.28 0.12 0.00 -0.26 0.00 0.00 58.87 59.08 3k2b n SER 295 Cb 0.38 -0.35 0.06 0.00 -0.26 0.00 0.00 64.21 64.03 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 -1.35 2.35 -4.69 1.04 4.77 -0.61 -4.94 117.00 113.56 3k2b n LEU 296 Ca 0.03 -0.83 -0.42 0.00 -0.03 0.00 0.00 56.01 54.76 3k2b n LEU 296 Cb 0.07 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3k2b n LEU 296 CO 0.06 0.42 1.21 -0.89 -1.33 0.00 0.00 177.39 176.85 3k2b s THR 297 N -2.29 3.34 0.21 -5.08 2.01 -0.86 -4.72 115.64 108.24 3k2b s THR 297 Ca 0.23 0.79 0.08 0.00 0.31 0.00 0.00 61.69 63.10 3k2b s THR 297 Cb 0.19 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.14 3k2b s THR 297 CO 0.47 0.01 -0.15 -0.04 -0.69 0.00 0.00 174.62 174.21 3k2b s MET 298 N 2.33 1.35 -0.17 4.92 -1.94 -0.92 -4.85 119.30 120.00 3k2b s MET 298 Ca 0.68 -1.60 -0.04 0.00 -1.71 0.00 0.00 55.69 53.03 3k2b s MET 298 Cb -0.36 -1.16 0.09 0.00 2.01 0.00 0.00 34.83 35.40 3k2b s MET 298 CO 0.29 0.20 0.27 0.08 -0.01 0.00 0.00 175.02 175.86 3k2b s VAL 299 N -2.93 -0.43 -0.09 -6.03 1.01 -1.26 -2.00 120.40 108.68 3k2b s VAL 299 Ca 0.23 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.31 3k2b s VAL 299 Cb -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 3k2b s VAL 299 CO 0.07 -0.03 -0.09 -0.04 0.00 0.00 0.00 175.10 175.02 3k2b s MET 300 N 2.42 2.93 -1.75 2.72 -1.94 -0.68 -4.62 119.30 118.38 3k2b s MET 300 Ca 0.05 -0.59 0.00 0.00 -1.71 0.00 0.00 55.69 53.44 3k2b s MET 300 Cb -0.14 -2.61 0.00 0.00 2.01 0.00 0.00 34.83 34.10 3k2b s MET 300 CO -0.11 0.53 0.00 0.41 -0.01 0.00 0.00 175.02 175.84 3k2b n GLY 301 N 2.62 -0.13 4.56 -0.03 0.00 -1.26 -2.13 105.19 108.82 3k2b n GLY 301 Ca -0.18 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.71 0.00 -0.63 1.61 8.00 -1.26 -4.52 116.55 118.03 3k2b n ASP 302 Ca -0.23 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.33 3k2b n ASP 302 Cb 0.68 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.89 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 0.58 1.47 -4.06 -2.24 5.68 -1.23 0.07 116.55 116.83 3k2b n ASP 303 Ca 0.00 -2.99 -0.32 0.00 -0.50 0.00 0.00 54.79 50.98 3k2b n ASP 303 Cb 0.00 -0.40 -0.15 0.00 -1.14 0.00 0.00 41.12 39.42 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 -1.96 2.20 -0.13 0.11 1.75 -0.90 -0.83 119.30 119.53 3k2b s MET 304 Ca 0.30 -1.28 -0.02 0.00 -1.25 0.00 0.00 55.69 53.44 3k2b s MET 304 Cb 0.29 -2.83 -0.03 0.00 2.84 0.00 0.00 34.83 35.10 3k2b s MET 304 CO -0.05 -0.56 -0.06 0.08 -0.65 0.00 0.00 175.02 173.79 3k2b s VAL 305 N 1.15 3.76 -0.20 10.11 1.01 0.12 -1.69 120.40 134.66 3k2b s VAL 305 Ca -0.08 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.48 3k2b s VAL 305 Cb -0.19 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.59 3k2b s VAL 305 CO -0.06 0.53 -0.16 -0.75 0.00 0.00 0.00 175.10 174.67 3k2b s LYS 306 N 0.00 3.01 -0.03 2.72 2.20 -0.85 -1.17 119.74 125.62 3k2b s LYS 306 Ca -0.00 -0.83 0.06 0.00 -0.36 0.00 0.00 55.97 54.84 3k2b s LYS 306 Cb -0.13 -2.69 -0.01 0.00 -1.51 0.00 0.00 37.83 33.48 3k2b s LYS 306 CO 0.03 -0.24 -0.21 0.08 -0.36 0.00 0.00 175.35 174.65 3k2b s VAL 307 N 1.32 1.69 -0.17 4.02 1.01 -0.21 -2.17 120.40 125.88 3k2b s VAL 307 Ca 0.04 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 3k2b s VAL 307 Cb -0.14 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 3k2b s VAL 307 CO -0.10 0.48 -0.07 -0.63 0.00 0.00 0.00 175.10 174.77 3k2b s ILE 308 N -0.30 3.43 -0.03 2.22 1.09 -1.26 -1.76 121.20 124.58 3k2b s ILE 308 Ca 0.03 -0.51 0.03 0.00 -1.10 0.00 0.00 60.65 59.10 3k2b s ILE 308 Cb -0.10 -2.50 0.00 0.00 -1.06 0.00 0.00 42.46 38.80 3k2b s ILE 308 CO 0.01 0.48 -0.11 0.00 -0.10 0.00 0.00 174.94 175.22 3k2b s ALA 309 N 0.70 1.04 0.01 9.38 0.00 -1.03 -0.02 121.76 131.85 3k2b s ALA 309 Ca -0.04 -0.41 -0.07 0.00 0.00 0.00 0.00 51.96 51.44 3k2b s ALA 309 Cb -0.15 -0.38 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 3k2b s ALA 309 CO 0.02 0.17 0.27 -1.58 0.00 0.00 0.00 175.76 174.64 3k2b s TRP 310 N 0.20 3.58 -0.26 0.00 0.52 0.24 -2.13 118.94 121.09 3k2b s TRP 310 Ca -0.04 0.58 -0.21 0.00 0.02 0.00 0.00 56.10 56.45 3k2b s TRP 310 Cb -0.10 -2.00 0.07 0.00 -1.15 0.00 0.00 33.47 30.30 3k2b s TRP 310 CO 0.01 0.61 0.68 1.52 0.02 0.00 0.00 176.95 179.79 3k2b s TYR 311 N -1.31 -0.85 -0.71 -1.98 1.13 -0.98 -1.04 117.35 111.61 3k2b s TYR 311 Ca 0.28 1.92 -0.27 0.00 -1.41 0.00 0.00 57.07 57.59 3k2b s TYR 311 Cb -0.13 0.38 0.03 0.00 -1.10 0.00 0.00 41.96 41.14 3k2b s TYR 311 CO 0.16 -0.42 1.27 0.34 -2.51 0.00 0.00 175.55 174.39 3k2b s ASP 312 N 0.81 6.21 0.00 -0.18 -1.08 -1.26 -1.22 116.67 119.95 3k2b s ASP 312 Ca -0.04 -0.33 0.00 0.00 -0.52 0.00 0.00 52.55 51.66 3k2b s ASP 312 Cb -0.05 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.85 3k2b s ASP 312 CO -0.06 -1.77 0.90 -0.46 0.52 0.00 0.00 175.17 174.29 3k2b n ASN 313 N 9.22 0.00 -0.06 -0.34 6.94 -1.26 -2.15 115.26 127.62 3k2b n ASN 313 Ca 0.04 0.40 -0.12 0.00 -0.02 0.00 0.00 54.58 54.88 3k2b n ASN 313 Cb 0.49 -0.40 -0.04 0.00 -2.36 0.00 0.00 39.78 37.47 3k2b n ASN 313 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3k2b n GLU 314 N -1.40 0.31 0.08 -3.83 1.02 -1.26 -4.54 120.64 111.02 3k2b n GLU 314 Ca 0.00 0.13 -0.04 0.00 -0.02 0.00 0.00 57.16 57.24 3k2b n GLU 314 Cb 0.00 -1.04 -0.02 0.00 -0.02 0.00 0.00 31.44 30.37 3k2b n GLU 314 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 3k2b h TRP 315 N -0.55 -0.22 -0.88 -0.32 2.91 -1.91 -2.24 115.95 112.72 3k2b h TRP 315 Ca -0.25 -0.01 0.19 0.00 1.13 0.00 0.00 58.89 59.95 3k2b h TRP 315 Cb 1.06 0.07 -0.17 0.00 -0.51 0.00 0.00 29.16 29.62 3k2b h TRP 315 CO -0.12 -0.14 -0.17 0.78 -1.03 0.00 0.00 178.44 177.77 3k2b h GLY 316 N -0.63 0.74 0.88 2.65 0.00 -1.51 0.27 103.07 105.45 3k2b h GLY 316 Ca -0.02 0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 3k2b h GLY 316 CO 0.04 -0.35 0.02 -1.82 0.00 0.00 0.00 176.54 174.42 3k2b h TYR 317 N 0.01 0.06 -0.85 5.60 3.20 -1.68 -2.65 116.97 120.66 3k2b h TYR 317 Ca 0.45 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.47 3k2b h TYR 317 Cb 0.73 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.92 3k2b h TYR 317 CO -0.64 0.17 0.56 0.77 -1.64 0.00 0.00 178.16 177.38 3k2b h SER 318 N -0.07 0.54 -0.75 -2.11 0.02 0.03 -0.89 113.55 110.33 3k2b h SER 318 Ca 0.01 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3k2b h SER 318 Cb 0.13 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 3k2b h SER 318 CO -0.00 0.27 0.45 1.56 -1.14 0.00 0.00 176.83 177.96 3k2b h GLN 319 N 0.57 1.03 -0.39 3.45 1.08 -0.43 -1.26 115.11 119.15 3k2b h GLN 319 Ca 0.43 -0.10 -0.09 0.00 -1.45 0.00 0.00 58.65 57.44 3k2b h GLN 319 Cb 0.82 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 28.02 3k2b h GLN 319 CO -0.18 0.74 -0.13 0.00 -0.95 0.00 0.00 178.83 178.31 3k2b h ARG 320 N 1.03 0.71 -0.42 1.46 2.47 -1.02 -2.27 114.38 116.33 3k2b h ARG 320 Ca 0.27 -0.23 -0.06 0.00 -1.26 0.00 0.00 59.98 58.69 3k2b h ARG 320 Cb -0.02 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.22 3k2b h ARG 320 CO -0.05 0.81 0.00 0.28 0.56 0.00 0.00 179.97 181.57 3k2b h VAL 321 N 0.64 1.23 0.00 2.04 2.07 -0.70 0.72 116.25 122.25 3k2b h VAL 321 Ca 0.11 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3k2b h VAL 321 Cb 0.58 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3k2b h VAL 321 CO 0.04 0.32 0.00 0.52 0.02 0.00 0.00 177.57 178.47 3k2b n VAL 322 N -4.24 0.00 -0.06 2.57 0.31 -0.54 -2.10 118.33 114.28 3k2b n VAL 322 Ca 0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.27 3k2b n VAL 322 Cb 0.28 -0.42 -0.05 0.00 -0.91 0.00 0.00 33.84 32.74 3k2b n VAL 322 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3k2b n ASP 323 N -0.86 2.83 0.07 4.52 9.92 0.34 -3.74 116.55 129.63 3k2b n ASP 323 Ca 0.15 -0.03 0.09 0.00 -0.53 0.00 0.00 54.79 54.47 3k2b n ASP 323 Cb 0.07 -0.20 0.38 0.00 -0.64 0.00 0.00 41.12 40.73 3k2b n ASP 323 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 3k2b n LEU 324 N -2.92 0.33 0.06 0.64 7.94 0.23 0.47 117.00 123.75 3k2b n LEU 324 Ca -0.20 0.59 -0.23 0.00 -1.11 0.00 0.00 56.01 55.06 3k2b n LEU 324 Cb 0.70 -0.56 -0.15 0.00 0.53 0.00 0.00 43.42 43.95 3k2b n LEU 324 CO 0.10 -0.46 -0.54 0.00 -1.11 0.00 0.00 177.39 175.38 3k2b h ALA 325 N 2.32 0.16 -0.21 1.96 0.00 -1.61 -2.70 119.26 119.18 3k2b h ALA 325 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 3k2b h ALA 325 Cb 0.26 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3k2b h ALA 325 CO 0.00 1.01 0.14 -0.44 0.00 0.00 0.00 179.25 179.95 3k2b h ASP 326 N 0.06 0.25 0.07 0.00 5.19 -1.01 0.37 116.42 121.35 3k2b h ASP 326 Ca -0.34 -0.03 0.02 0.00 -0.62 0.00 0.00 57.03 56.06 3k2b h ASP 326 Cb 2.06 -0.06 -0.05 0.00 0.18 0.00 0.00 39.33 41.46 3k2b h ASP 326 CO 0.16 0.20 -0.45 0.40 -3.12 0.00 0.00 179.24 176.43 3k2b h ILE 327 N 0.27 0.11 0.09 0.35 1.08 -0.07 0.13 117.51 119.47 3k2b h ILE 327 Ca 0.08 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.55 3k2b h ILE 327 Cb -0.01 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 33.81 3k2b h ILE 327 CO -0.02 0.00 -0.37 0.58 -0.69 0.00 0.00 178.15 177.66 3k2b h VAL 328 N -0.65 0.00 -0.89 1.67 2.07 -1.08 -2.07 116.25 115.30 3k2b h VAL 328 Ca 0.02 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.71 3k2b h VAL 328 Cb 0.70 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.30 3k2b h VAL 328 CO -0.29 0.00 -0.28 0.00 0.02 0.00 0.00 177.57 177.02 3k2b h ALA 329 N -0.87 0.40 0.16 1.67 0.00 -0.02 -2.24 119.26 118.37 3k2b h ALA 329 Ca -0.01 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3k2b h ALA 329 Cb 0.53 0.78 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 3k2b h ALA 329 CO -0.19 -0.49 -0.35 -0.91 0.00 0.00 0.00 179.25 177.31 3k2b h ASN 330 N -0.02 -1.02 0.00 0.00 -0.26 -0.47 -2.71 115.58 111.10 3k2b h ASN 330 Ca 0.39 0.10 -0.12 0.00 -0.56 0.00 0.00 56.30 56.11 3k2b h ASN 330 Cb 0.63 0.37 -0.04 0.00 -1.06 0.00 0.00 38.32 38.21 3k2b h ASN 330 CO -0.92 -0.40 -0.12 0.59 -1.06 0.00 0.00 177.43 175.53 3k2b n ASN 331 N -4.46 3.74 -4.50 5.81 3.02 -0.82 -4.85 115.26 113.21 3k2b n ASN 331 Ca -0.06 -2.18 -0.43 0.00 -0.03 0.00 0.00 54.58 51.88 3k2b n ASN 331 Cb 0.29 -0.99 -0.08 0.00 -0.61 0.00 0.00 39.78 38.39 3k2b n ASN 331 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3k2b s TRP 332 N 1.45 3.14 -2.87 3.10 -0.11 -1.02 -4.48 118.94 118.15 3k2b s TRP 332 Ca 0.42 -0.25 0.25 0.00 1.22 0.00 0.00 56.10 57.74 3k2b s TRP 332 Cb 0.20 -3.02 0.41 0.00 -1.50 0.00 0.00 33.47 29.56 3k2b s TRP 332 CO 0.00 -0.74 1.39 1.63 -4.62 0.00 0.00 176.95 174.61