#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b n LYS 0 N 0.00 -3.58 -1.96 0.00 4.81 -1.26 -4.91 118.16 111.26 3k2b n LYS 0 Ca 0.00 2.83 -0.41 0.00 -0.87 0.00 0.00 58.31 59.85 3k2b n LYS 0 Cb 0.00 -4.95 -0.02 0.00 0.02 0.00 0.00 35.03 30.08 3k2b n LYS 0 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3k2b s LEU 1 N -1.20 4.38 -0.16 3.14 1.02 -0.83 -4.75 118.68 120.27 3k2b s LEU 1 Ca -0.09 2.71 -0.29 0.00 0.02 0.00 0.00 54.13 56.47 3k2b s LEU 1 Cb 0.01 -3.62 -0.01 0.00 0.02 0.00 0.00 46.19 42.59 3k2b s LEU 1 CO 0.73 -0.75 1.17 -0.54 0.02 0.00 0.00 176.35 176.97 3k2b s LYS 2 N -0.18 4.28 0.05 1.70 1.02 -1.26 -2.23 119.74 123.11 3k2b s LYS 2 Ca 0.61 1.56 0.02 0.00 0.02 0.00 0.00 55.97 58.18 3k2b s LYS 2 Cb -0.43 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.16 3k2b s LYS 2 CO 0.42 -0.61 0.07 0.08 -0.92 0.00 0.00 175.35 174.39 3k2b s VAL 3 N 3.08 4.52 -0.03 3.17 1.01 0.10 -0.78 120.40 131.47 3k2b s VAL 3 Ca 0.51 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.87 3k2b s VAL 3 Cb -0.20 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.06 3k2b s VAL 3 CO 0.14 0.22 -0.11 0.00 0.00 0.00 0.00 175.10 175.34 3k2b s ALA 4 N -1.29 1.07 -0.27 5.51 0.00 -0.68 -0.83 121.76 125.27 3k2b s ALA 4 Ca 0.26 -0.43 -0.08 0.00 0.00 0.00 0.00 51.96 51.71 3k2b s ALA 4 Cb -0.12 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 3k2b s ALA 4 CO 0.18 0.17 0.10 0.42 0.00 0.00 0.00 175.76 176.63 3k2b s ILE 5 N 0.21 4.48 -0.41 0.00 1.01 -0.12 -0.21 121.20 126.17 3k2b s ILE 5 Ca -0.05 -0.19 -0.06 0.00 0.00 0.00 0.00 60.65 60.36 3k2b s ILE 5 Cb -0.10 -3.14 0.09 0.00 0.01 0.00 0.00 42.46 39.32 3k2b s ILE 5 CO 0.01 0.27 0.21 0.21 0.00 0.00 0.00 174.94 175.65 3k2b s ASN 6 N 1.63 5.39 0.00 3.58 2.47 0.30 -0.65 114.94 127.66 3k2b s ASN 6 Ca 0.06 -1.75 0.00 0.00 0.42 0.00 0.00 52.86 51.59 3k2b s ASN 6 Cb -0.16 -1.89 0.00 0.00 -1.45 0.00 0.00 41.25 37.76 3k2b s ASN 6 CO 0.05 -0.53 0.00 0.61 -3.72 0.00 0.00 177.10 173.51 3k2b n GLY 7 N 4.74 0.74 1.99 1.21 0.00 0.88 0.49 105.19 115.24 3k2b n GLY 7 Ca -0.07 -0.69 -0.01 0.00 0.00 0.00 0.00 46.02 45.26 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 0.00 0.00 1.61 7.35 -1.24 -3.81 117.46 121.37 3k2b n PHE 8 Ca 0.00 -0.32 0.00 0.00 -0.76 0.00 0.00 57.45 56.37 3k2b n PHE 8 Cb 0.00 -0.43 0.00 0.00 0.35 0.00 0.00 39.48 39.40 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 2.12 0.79 0.12 7.13 0.00 -1.26 -4.30 105.19 109.79 3k2b n GLY 9 Ca 0.03 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.18 -0.49 1.61 2.47 -1.91 -0.06 114.38 115.82 3k2b h ARG 10 Ca 0.00 0.01 -0.11 0.00 -1.26 0.00 0.00 59.98 58.62 3k2b h ARG 10 Cb 0.00 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.34 3k2b h ARG 10 CO 0.00 0.18 -0.14 0.82 0.56 0.00 0.00 179.97 181.38 3k2b h ILE 11 N -0.56 1.27 -0.08 2.04 1.08 -1.90 0.16 117.51 119.52 3k2b h ILE 11 Ca -0.02 -1.28 0.01 0.00 -0.39 0.00 0.00 64.86 63.18 3k2b h ILE 11 Cb 0.44 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 3k2b h ILE 11 CO 0.03 0.44 0.01 1.23 -0.69 0.00 0.00 178.15 179.18 3k2b h GLY 12 N 0.94 0.08 1.50 5.37 0.00 -1.65 0.24 103.07 109.56 3k2b h GLY 12 Ca 0.12 -0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.28 3k2b h GLY 12 CO 0.05 -0.00 -0.62 3.21 0.00 0.00 0.00 176.54 179.18 3k2b h ARG 13 N 0.04 0.51 -0.37 4.80 3.08 -0.88 -2.72 114.38 118.85 3k2b h ARG 13 Ca 0.03 -0.36 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 3k2b h ARG 13 Cb 0.03 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3k2b h ARG 13 CO -0.05 0.97 -0.26 -0.91 -1.07 0.00 0.00 179.97 178.66 3k2b h ASN 14 N 0.38 0.78 -0.33 7.04 2.35 -0.51 -2.51 115.58 122.77 3k2b h ASN 14 Ca -0.01 -0.29 0.03 0.00 -0.55 0.00 0.00 56.30 55.48 3k2b h ASN 14 Cb 1.18 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.31 3k2b h ASN 14 CO 0.11 1.00 0.15 0.15 -1.65 0.00 0.00 177.43 177.19 3k2b h PHE 15 N 0.65 0.27 -0.87 1.19 3.57 -0.42 0.27 116.94 121.61 3k2b h PHE 15 Ca 0.08 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.60 3k2b h PHE 15 Cb 0.77 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.40 3k2b h PHE 15 CO 0.04 0.14 0.56 1.25 -2.23 0.00 0.00 178.31 178.07 3k2b h LEU 16 N 0.31 1.01 -0.42 0.59 6.46 -1.33 0.63 115.31 122.56 3k2b h LEU 16 Ca 0.14 -0.04 -0.18 0.00 -0.12 0.00 0.00 57.88 57.69 3k2b h LEU 16 Cb 0.07 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 39.75 3k2b h LEU 16 CO -0.11 0.74 -0.61 0.03 -0.62 0.00 0.00 178.44 177.87 3k2b h ARG 17 N 1.18 0.60 0.30 1.25 3.08 -0.99 0.34 114.38 120.15 3k2b h ARG 17 Ca 0.32 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3k2b h ARG 17 Cb -0.12 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3k2b h ARG 17 CO -0.07 1.03 -0.14 0.00 -1.07 0.00 0.00 179.97 179.72 3k2b h TRP 18 N -0.49 -0.16 -0.93 0.00 7.01 -0.88 -2.06 115.95 118.45 3k2b h TRP 18 Ca -0.04 0.01 0.26 0.00 2.11 0.00 0.00 58.89 61.23 3k2b h TRP 18 Cb 0.37 0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.47 3k2b h TRP 18 CO -0.03 -0.11 0.65 1.25 -2.79 0.00 0.00 178.44 177.41 3k2b h HIS 18 N -0.06 0.16 -0.00 2.65 2.76 -0.73 0.33 115.15 120.25 3k2b h HIS 18 Ca 0.07 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 3k2b h HIS 18 Cb 0.16 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.08 3k2b h HIS 18 CO -0.19 0.03 -0.11 0.41 -1.30 0.00 0.00 177.93 176.77 3k2b n GLY 19 N -1.66 -0.82 3.85 5.26 0.00 -0.72 -4.89 105.19 106.21 3k2b n GLY 19 Ca 0.20 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.40 3.60 -0.07 1.61 1.81 0.12 -5.06 118.95 118.56 3k2b s ARG 20 Ca 0.30 0.90 0.04 0.00 -1.72 0.00 0.00 55.73 55.26 3k2b s ARG 20 Cb 0.20 -2.08 -0.02 0.00 -0.45 0.00 0.00 34.95 32.60 3k2b s ARG 20 CO 0.46 -0.56 -0.20 0.15 -0.68 0.00 0.00 175.30 174.47 3k2b s LYS 21 N -4.64 2.66 -0.99 3.54 1.02 -1.26 -4.74 119.74 115.34 3k2b s LYS 21 Ca 0.58 -0.80 -0.05 0.00 0.02 0.00 0.00 55.97 55.72 3k2b s LYS 21 Cb -0.12 -2.31 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 3k2b s LYS 21 CO 0.44 0.44 0.87 -3.47 -0.92 0.00 0.00 175.35 172.71 3k2b n ASP 22 N 2.82 -6.72 -4.78 2.83 2.03 -1.26 -4.99 116.55 106.49 3k2b n ASP 22 Ca -0.17 -0.61 -0.38 0.00 0.52 0.00 0.00 54.79 54.15 3k2b n ASP 22 Cb 0.52 -5.14 -0.06 0.00 -0.72 0.00 0.00 41.12 35.72 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3k2b s SER 23 N -3.33 6.71 0.00 1.67 0.15 -1.26 -4.94 113.70 112.70 3k2b s SER 23 Ca 0.39 0.85 0.28 0.00 0.70 0.00 0.00 55.95 58.17 3k2b s SER 23 Cb -0.05 -2.25 1.70 0.00 -1.71 0.00 0.00 66.02 63.71 3k2b s SER 23 CO 0.73 0.19 2.04 -2.65 1.20 0.00 0.00 173.24 174.75 3k2b n PRO 24 N 2.66 0.89 -4.17 5.44 -0.02 -1.26 -4.80 135.00 133.75 3k2b n PRO 24 Ca -0.12 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.09 3k2b n PRO 24 Cb 0.52 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.43 3k2b n PRO 24 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k2b s LEU 25 N -2.00 3.43 -0.22 2.45 1.43 -1.26 -1.97 118.68 120.54 3k2b s LEU 25 Ca 0.43 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 53.18 3k2b s LEU 25 Cb 0.20 -2.09 0.08 0.00 0.03 0.00 0.00 46.19 44.41 3k2b s LEU 25 CO 0.33 0.10 0.14 -0.62 0.23 0.00 0.00 176.35 176.53 3k2b s ASP 26 N -2.84 2.48 -0.34 2.29 2.15 -0.95 -4.93 116.67 114.53 3k2b s ASP 26 Ca 0.28 -0.76 -0.28 0.00 0.43 0.00 0.00 52.55 52.22 3k2b s ASP 26 Cb -0.10 -0.11 0.02 0.00 -0.30 0.00 0.00 42.92 42.43 3k2b s ASP 26 CO 0.19 -0.38 1.05 -0.63 -0.17 0.00 0.00 175.17 175.24 3k2b s ILE 27 N 2.18 4.50 -0.06 4.11 1.01 -1.26 0.01 121.20 131.69 3k2b s ILE 27 Ca 0.06 1.62 0.09 0.00 0.00 0.00 0.00 60.65 62.41 3k2b s ILE 27 Cb -0.16 -4.41 0.14 0.00 0.01 0.00 0.00 42.46 38.04 3k2b s ILE 27 CO -0.20 -0.52 1.02 2.30 0.00 0.00 0.00 174.94 177.54 3k2b n ILE 28 N 5.94 1.11 -3.62 2.92 -5.35 -0.01 -4.82 119.36 115.54 3k2b n ILE 28 Ca 0.11 -1.29 -0.12 0.00 -0.27 0.00 0.00 62.75 61.18 3k2b n ILE 28 Cb 0.47 0.21 -0.07 0.00 -1.74 0.00 0.00 39.64 38.51 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 -1.57 -1.87 -0.03 -1.28 0.00 -1.20 -2.57 121.76 113.23 3k2b s ALA 29 Ca 0.15 1.86 0.03 0.00 0.00 0.00 0.00 51.96 54.00 3k2b s ALA 29 Cb 0.13 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 22.13 3k2b s ALA 29 CO 0.01 -0.30 -0.11 0.42 0.00 0.00 0.00 175.76 175.79 3k2b s ILE 30 N 0.04 0.95 -0.06 0.00 1.01 -0.04 -0.95 121.20 122.15 3k2b s ILE 30 Ca 0.00 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.23 3k2b s ILE 30 Cb -0.04 -0.84 0.02 0.00 0.01 0.00 0.00 42.46 41.60 3k2b s ILE 30 CO -0.01 0.29 -0.10 0.21 0.00 0.00 0.00 174.94 175.34 3k2b s ASN 31 N 0.25 1.58 0.00 3.58 2.47 0.17 -0.40 114.94 122.58 3k2b s ASN 31 Ca -0.05 -0.25 0.00 0.00 0.42 0.00 0.00 52.86 52.98 3k2b s ASN 31 Cb -0.10 -0.72 0.00 0.00 -1.45 0.00 0.00 41.25 38.98 3k2b s ASN 31 CO 0.01 -0.00 0.00 -0.67 -3.72 0.00 0.00 177.10 172.72 3k2b n ASP 32 N 3.98 0.00 -1.25 -4.21 2.03 -1.22 -0.08 116.55 115.79 3k2b n ASP 32 Ca -0.23 -0.77 0.01 0.00 0.52 0.00 0.00 54.79 54.32 3k2b n ASP 32 Cb 0.51 0.00 0.25 0.00 -0.72 0.00 0.00 41.12 41.16 3k2b n ASP 32 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3k2b n THR 33 N 0.00 2.54 -0.00 5.18 -2.24 -1.26 -3.68 114.28 114.82 3k2b n THR 33 Ca 0.00 -2.08 -0.00 0.00 -2.27 0.00 0.00 64.05 59.70 3k2b n THR 33 Cb 0.00 -0.30 -0.01 0.00 -2.10 0.00 0.00 70.33 67.92 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 -0.63 -0.05 0.33 3.38 0.00 -1.26 -5.08 105.19 101.89 3k2b n GLY 34 Ca 0.30 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.35 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 2.74 -2.03 0.55 -0.02 0.00 -1.26 -4.21 105.19 100.96 3k2b n GLY 36 Ca -0.01 -1.41 0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 0.04 0.00 1.61 2.07 -1.85 -2.73 116.25 115.08 3k2b h VAL 37 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 3k2b h VAL 37 Cb 0.31 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 3k2b h VAL 37 CO 0.01 0.00 0.00 1.17 0.02 0.00 0.00 177.57 178.77 3k2b n LYS 38 N -3.43 0.00 0.06 1.57 4.81 -1.26 -1.97 118.16 117.94 3k2b n LYS 38 Ca 0.26 0.36 -0.11 0.00 -0.87 0.00 0.00 58.31 57.94 3k2b n LYS 38 Cb 1.53 -1.34 -0.05 0.00 0.02 0.00 0.00 35.03 35.20 3k2b n LYS 38 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3k2b h GLN 39 N 0.00 -0.35 -1.00 1.64 7.50 -1.67 -3.01 115.11 118.23 3k2b h GLN 39 Ca 0.00 0.02 0.12 0.00 0.50 0.00 0.00 58.65 59.29 3k2b h GLN 39 Cb 0.00 0.08 -0.14 0.00 0.05 0.00 0.00 27.48 27.47 3k2b h GLN 39 CO 0.00 -0.23 -0.50 0.00 -1.50 0.00 0.00 178.83 176.60 3k2b h ALA 40 N 0.50 -0.23 0.05 3.87 0.00 -1.56 0.15 119.26 122.03 3k2b h ALA 40 Ca 0.06 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3k2b h ALA 40 Cb 0.43 1.21 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3k2b h ALA 40 CO -0.20 -0.81 -0.02 1.03 0.00 0.00 0.00 179.25 179.25 3k2b h SER 41 N -0.00 -0.05 -0.57 0.00 0.87 -1.37 -2.88 113.55 109.54 3k2b h SER 41 Ca 0.24 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3k2b h SER 41 Cb 0.50 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 3k2b h SER 41 CO -0.96 0.20 0.35 -0.74 -0.53 0.00 0.00 176.83 175.14 3k2b h HIS 42 N -0.31 0.74 0.00 2.24 6.17 -1.26 -2.80 115.15 119.93 3k2b h HIS 42 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.07 3k2b h HIS 42 Cb 0.28 -0.24 0.00 0.00 2.52 0.00 0.00 27.41 29.96 3k2b h HIS 42 CO 0.01 0.50 -0.11 1.28 0.71 0.00 0.00 177.93 180.32 3k2b n LEU 43 N -4.65 0.13 0.03 0.26 4.77 0.46 -1.61 117.00 116.38 3k2b n LEU 43 Ca 0.03 0.40 -0.11 0.00 -0.03 0.00 0.00 56.01 56.30 3k2b n LEU 43 Cb 0.05 -0.44 -0.13 0.00 -2.33 0.00 0.00 43.42 40.56 3k2b n LEU 43 CO 0.36 0.02 -0.28 0.25 -1.33 0.00 0.00 177.39 176.41 3k2b h LEU 44 N 0.00 0.12 0.07 2.23 5.85 -1.39 -3.37 115.31 118.81 3k2b h LEU 44 Ca 0.00 -0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.43 3k2b h LEU 44 Cb 0.51 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.51 3k2b h LEU 44 CO 0.00 1.15 -0.49 0.50 -0.34 0.00 0.00 178.44 179.26 3k2b h LYS 45 N 0.02 0.14 -5.13 1.25 1.63 -1.45 -3.40 116.57 109.63 3k2b h LYS 45 Ca -0.19 -0.24 -0.64 0.00 -0.85 0.00 0.00 60.65 58.73 3k2b h LYS 45 Cb 1.94 0.09 -0.21 0.00 -0.60 0.00 0.00 32.23 33.45 3k2b h LYS 45 CO 0.12 1.12 -0.62 0.71 -3.45 0.00 0.00 179.45 177.32 3k2b s TYR 46 N -2.33 3.11 -0.10 1.91 2.02 -0.63 -0.72 117.35 120.61 3k2b s TYR 46 Ca -0.17 -0.27 -0.03 0.00 -0.37 0.00 0.00 57.07 56.23 3k2b s TYR 46 Cb -0.01 -2.12 0.04 0.00 -0.40 0.00 0.00 41.96 39.48 3k2b s TYR 46 CO 0.75 -0.14 0.04 0.34 -1.57 0.00 0.00 175.55 174.97 3k2b s ASP 47 N 0.95 1.77 0.19 2.29 -1.08 -1.16 -4.54 116.67 115.09 3k2b s ASP 47 Ca 0.03 -0.24 0.14 0.00 -0.52 0.00 0.00 52.55 51.96 3k2b s ASP 47 Cb -0.14 -0.32 0.74 0.00 -1.46 0.00 0.00 42.92 41.74 3k2b s ASP 47 CO 0.02 -0.26 1.44 -1.20 0.52 0.00 0.00 175.17 175.69 3k2b n SER 48 N 5.21 0.36 -0.06 -0.34 7.64 -1.26 0.30 113.62 125.48 3k2b n SER 48 Ca -0.06 0.65 -0.08 0.00 1.01 0.00 0.00 58.87 60.39 3k2b n SER 48 Cb 0.49 -0.70 -0.05 0.00 -1.01 0.00 0.00 64.21 62.94 3k2b n SER 48 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3k2b n THR 49 N -1.96 0.63 0.04 0.44 -1.04 -1.26 -4.73 114.28 106.40 3k2b n THR 49 Ca -0.00 -0.23 0.05 0.00 -2.04 0.00 0.00 64.05 61.83 3k2b n THR 49 Cb 0.05 -1.02 -0.07 0.00 -1.82 0.00 0.00 70.33 67.47 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 -2.94 0.66 0.00 -4.42 4.77 -1.18 -5.06 117.00 108.83 3k2b n LEU 50 Ca -0.20 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3k2b n LEU 50 Cb 0.70 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 3k2b n LEU 50 CO 0.09 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 3k2b n GLY 51 N 1.33 -2.82 3.69 -0.72 0.00 0.15 -4.89 105.19 101.93 3k2b n GLY 51 Ca -0.07 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.54 3.66 -0.01 -0.61 1.01 -1.26 -3.00 121.20 120.45 3k2b s ILE 52 Ca 0.00 1.03 -0.30 0.00 0.00 0.00 0.00 60.65 61.39 3k2b s ILE 52 Cb 0.00 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.74 3k2b s ILE 52 CO 0.00 -0.01 1.70 0.12 0.00 0.00 0.00 174.94 176.75 3k2b s PHE 53 N 2.50 1.99 -1.14 3.97 5.36 0.11 -4.87 117.98 125.88 3k2b s PHE 53 Ca 0.65 0.12 -0.11 0.00 -0.96 0.00 0.00 56.93 56.64 3k2b s PHE 53 Cb -0.32 -3.98 -0.07 0.00 -0.34 0.00 0.00 43.02 38.31 3k2b s PHE 53 CO 0.27 -4.12 2.31 -3.47 -1.46 0.00 0.00 175.22 168.75 3k2b n ASP 54 N 6.78 5.36 -3.68 6.13 -0.08 -1.26 -4.79 116.55 125.01 3k2b n ASP 54 Ca 0.17 -2.51 -0.12 0.00 -1.51 0.00 0.00 54.79 50.82 3k2b n ASP 54 Cb 0.42 -1.29 -0.06 0.00 2.34 0.00 0.00 41.12 42.53 3k2b n ASP 54 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3k2b s ALA 55 N 3.35 -0.94 -0.86 -1.67 0.00 -1.26 -5.09 121.76 115.29 3k2b s ALA 55 Ca 0.51 0.24 -0.25 0.00 0.00 0.00 0.00 51.96 52.46 3k2b s ALA 55 Cb 0.13 0.36 0.03 0.00 0.00 0.00 0.00 23.12 23.65 3k2b s ALA 55 CO -0.02 -0.46 1.40 -0.51 0.00 0.00 0.00 175.76 176.17 3k2b s ASP 56 N -2.05 6.23 -0.19 0.00 -0.00 -1.26 -4.91 116.67 114.49 3k2b s ASP 56 Ca -0.05 -0.84 -0.09 0.00 -0.00 0.00 0.00 52.55 51.57 3k2b s ASP 56 Cb -0.01 -2.56 -0.04 0.00 -0.00 0.00 0.00 42.92 40.31 3k2b s ASP 56 CO -0.03 -1.76 0.09 -0.69 -0.00 0.00 0.00 175.17 172.79 3k2b s VAL 57 N 5.72 5.06 -0.13 -1.27 1.01 -1.26 -1.87 120.40 127.65 3k2b s VAL 57 Ca 0.42 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 3k2b s VAL 57 Cb -0.05 -3.29 0.12 0.00 0.00 0.00 0.00 36.38 33.15 3k2b s VAL 57 CO 0.04 0.45 0.93 -1.59 0.00 0.00 0.00 175.10 174.93 3k2b s LYS 58 N 0.37 0.70 0.58 2.72 -2.85 -1.03 -5.02 119.74 115.21 3k2b s LYS 58 Ca 0.05 0.12 -0.19 0.00 -1.00 0.00 0.00 55.97 54.96 3k2b s LYS 58 Cb -0.12 0.33 -0.04 0.00 -2.06 0.00 0.00 37.83 35.94 3k2b s LYS 58 CO -0.01 -0.23 1.17 -1.25 0.10 0.00 0.00 175.35 175.13 3k2b s PRO 59 N -1.31 3.10 -0.26 1.78 0.04 -1.26 -0.45 135.00 136.63 3k2b s PRO 59 Ca -0.03 1.70 -0.00 0.00 0.04 0.00 0.00 61.00 62.71 3k2b s PRO 59 Cb -0.00 -1.96 0.08 0.00 0.04 0.00 0.00 34.50 32.65 3k2b s PRO 59 CO 0.02 -1.07 0.02 0.45 0.04 0.00 0.00 177.00 176.46 3k2b s SER 60 N -1.76 3.81 0.53 6.66 0.15 0.12 -4.69 113.70 118.53 3k2b s SER 60 Ca 0.74 -1.34 0.00 0.00 0.70 0.00 0.00 55.95 56.05 3k2b s SER 60 Cb -0.27 -1.02 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 3k2b s SER 60 CO 0.31 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.05 3k2b n GLY 60 N 4.75 -0.95 1.21 9.45 0.00 -1.26 -2.73 105.19 115.66 3k2b n GLY 60 Ca -0.07 -1.14 0.08 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.63 3.53 -0.30 1.61 1.02 -1.26 -4.47 120.64 120.15 3k2b n GLU 61 Ca 0.00 -2.87 0.00 0.00 -0.02 0.00 0.00 57.16 54.27 3k2b n GLU 61 Cb 0.00 -1.91 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 3k2b n GLU 61 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3k2b n THR 62 N 0.04 0.04 -3.83 2.62 5.66 -1.25 -4.74 114.28 112.82 3k2b n THR 62 Ca 0.23 -0.05 -0.05 0.00 -3.05 0.00 0.00 64.05 61.12 3k2b n THR 62 Cb 0.94 0.68 0.01 0.00 -1.55 0.00 0.00 70.33 70.40 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3k2b s ALA 63 N -0.06 -1.31 0.08 1.79 0.00 -1.11 -0.57 121.76 120.58 3k2b s ALA 63 Ca 0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 51.96 51.60 3k2b s ALA 63 Cb 0.00 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 3k2b s ALA 63 CO 0.00 -1.03 -0.02 0.96 0.00 0.00 0.00 175.76 175.67 3k2b s ILE 64 N -2.64 0.26 -0.11 0.00 -4.36 -0.10 -0.70 121.20 113.55 3k2b s ILE 64 Ca 0.17 -1.85 0.03 0.00 -0.26 0.00 0.00 60.65 58.74 3k2b s ILE 64 Cb -0.03 -1.66 0.01 0.00 1.25 0.00 0.00 42.46 42.02 3k2b s ILE 64 CO 0.07 -0.86 -0.20 -0.94 0.24 0.00 0.00 174.94 173.24 3k2b s SER 65 N -2.97 2.80 -0.33 4.36 1.04 0.40 0.30 113.70 119.30 3k2b s SER 65 Ca 0.11 -0.51 0.01 0.00 0.48 0.00 0.00 55.95 56.05 3k2b s SER 65 Cb 0.08 -1.28 0.09 0.00 0.10 0.00 0.00 66.02 65.00 3k2b s SER 65 CO -0.07 0.09 0.05 -0.69 0.98 0.00 0.00 173.24 173.61 3k2b s VAL 66 N 0.64 2.58 -1.26 5.02 1.01 -0.37 -2.46 120.40 125.55 3k2b s VAL 66 Ca -0.13 -2.02 -0.03 0.00 0.00 0.00 0.00 61.98 59.80 3k2b s VAL 66 Cb -0.16 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.48 3k2b s VAL 66 CO 0.03 -0.45 1.03 0.47 0.00 0.00 0.00 175.10 176.19 3k2b n ASP 67 N 4.41 -3.29 0.00 3.32 8.00 -0.78 -2.33 116.55 125.88 3k2b n ASP 67 Ca -0.03 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.86 3k2b n ASP 67 Cb 0.42 -5.01 0.00 0.00 -0.02 0.00 0.00 41.12 36.51 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 -1.42 1.90 3.62 0.44 0.00 -1.26 -4.95 105.19 103.51 3k2b n GLY 68 Ca -0.20 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 3.53 -0.03 1.61 2.20 -0.98 -4.92 119.74 121.16 3k2b s LYS 69 Ca 0.00 1.79 -0.24 0.00 -0.36 0.00 0.00 55.97 57.16 3k2b s LYS 69 Cb 0.00 -4.18 -0.04 0.00 -1.51 0.00 0.00 37.83 32.10 3k2b s LYS 69 CO 0.00 -1.62 0.73 0.42 -0.36 0.00 0.00 175.35 174.52 3k2b s ILE 70 N 6.38 4.94 -0.11 5.43 1.01 -1.26 -1.24 121.20 136.35 3k2b s ILE 70 Ca 0.83 1.53 0.02 0.00 0.00 0.00 0.00 60.65 63.03 3k2b s ILE 70 Cb -0.28 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.13 3k2b s ILE 70 CO 0.33 0.29 -0.15 -0.51 0.00 0.00 0.00 174.94 174.90 3k2b s ILE 71 N 0.52 1.50 0.66 2.92 2.07 0.15 -4.90 121.20 124.11 3k2b s ILE 71 Ca 0.38 -0.64 -0.17 0.00 -1.41 0.00 0.00 60.65 58.81 3k2b s ILE 71 Cb -0.19 -1.37 -0.02 0.00 0.13 0.00 0.00 42.46 41.02 3k2b s ILE 71 CO 0.20 0.44 1.09 0.00 -1.91 0.00 0.00 174.94 174.76 3k2b n GLN 72 N 4.19 0.84 -3.67 3.50 3.00 -1.06 -0.92 117.38 123.26 3k2b n GLN 72 Ca -0.19 0.34 -0.29 0.00 -0.01 0.00 0.00 57.00 56.84 3k2b n GLN 72 Cb 0.51 -2.32 -0.13 0.00 0.00 0.00 0.00 30.24 28.30 3k2b n GLN 72 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3k2b s VAL 73 N -1.56 1.03 0.59 5.09 1.01 0.27 -0.86 120.40 125.96 3k2b s VAL 73 Ca 0.78 -2.08 -0.00 0.00 0.00 0.00 0.00 61.98 60.67 3k2b s VAL 73 Cb -0.38 -1.74 0.05 0.00 0.00 0.00 0.00 36.38 34.31 3k2b s VAL 73 CO 0.45 -0.85 0.84 0.68 0.00 0.00 0.00 175.10 176.21 3k2b s VAL 74 N 0.83 2.55 -0.48 2.92 -7.23 0.46 -4.55 120.40 114.89 3k2b s VAL 74 Ca 0.16 -0.59 0.06 0.00 -1.81 0.00 0.00 61.98 59.80 3k2b s VAL 74 Cb -0.22 -2.96 0.19 0.00 0.56 0.00 0.00 36.38 33.95 3k2b s VAL 74 CO -0.06 0.00 0.62 -0.24 -0.31 0.00 0.00 175.10 175.11 3k2b n SER 75 N -2.49 -2.50 -3.75 4.85 2.88 -1.26 -3.45 113.62 107.90 3k2b n SER 75 Ca 0.09 -2.77 -0.21 0.00 -1.33 0.00 0.00 58.87 54.64 3k2b n SER 75 Cb 0.60 1.04 -0.17 0.00 -0.75 0.00 0.00 64.21 64.93 3k2b n SER 75 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 3k2b s ASN 76 N 0.47 1.25 0.00 -3.46 2.47 -1.24 -4.93 114.94 109.49 3k2b s ASN 76 Ca 0.31 -0.02 0.10 0.00 0.42 0.00 0.00 52.86 53.67 3k2b s ASN 76 Cb 0.03 -0.31 0.60 0.00 -1.45 0.00 0.00 41.25 40.12 3k2b s ASN 76 CO -0.10 -0.20 1.02 0.54 -3.72 0.00 0.00 177.10 174.64 3k2b n ARG 77 N 5.03 0.42 -3.94 0.43 1.74 -1.26 -4.33 116.66 114.73 3k2b n ARG 77 Ca -0.09 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.69 3k2b n ARG 77 Cb 0.50 -1.38 -0.15 0.00 -1.02 0.00 0.00 32.46 30.42 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 -1.90 4.48 0.32 0.55 2.47 -1.26 -4.99 114.94 114.60 3k2b s ASN 78 Ca 0.15 -2.36 0.12 0.00 0.42 0.00 0.00 52.86 51.19 3k2b s ASN 78 Cb 0.07 -1.49 1.01 0.00 -1.45 0.00 0.00 41.25 39.38 3k2b s ASN 78 CO 0.12 -0.34 1.44 -2.65 -3.72 0.00 0.00 177.10 171.95 3k2b n PRO 79 N 3.97 -0.06 -0.35 0.43 -0.02 -1.26 0.24 135.00 137.95 3k2b n PRO 79 Ca 0.04 1.31 0.25 0.00 -2.02 0.00 0.00 63.50 63.08 3k2b n PRO 79 Cb 0.39 -2.23 0.52 0.00 -0.02 0.00 0.00 33.50 32.16 3k2b n PRO 79 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3k2b h SER 80 N 0.00 0.44 -0.36 2.55 0.02 -1.95 0.17 113.55 114.42 3k2b h SER 80 Ca 0.68 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.73 3k2b h SER 80 Cb 1.67 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 64.25 3k2b h SER 80 CO -0.77 0.02 0.02 0.18 -1.14 0.00 0.00 176.83 175.13 3k2b n LEU 81 N -4.71 3.94 -4.83 5.07 4.77 0.14 -4.59 117.00 116.79 3k2b n LEU 81 Ca 0.28 -2.00 -0.35 0.00 -0.03 0.00 0.00 56.01 53.92 3k2b n LEU 81 Cb 0.98 -0.62 -0.06 0.00 -2.33 0.00 0.00 43.42 41.39 3k2b n LEU 81 CO 0.22 0.49 0.45 -0.76 -1.33 0.00 0.00 177.39 176.46 3k2b s LEU 82 N -1.68 4.21 0.00 2.23 1.43 0.60 -4.94 118.68 120.52 3k2b s LEU 82 Ca 0.33 1.41 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 3k2b s LEU 82 Cb 0.25 -3.85 0.00 0.00 0.03 0.00 0.00 46.19 42.62 3k2b s LEU 82 CO 0.09 -0.09 1.05 -0.81 0.23 0.00 0.00 176.35 176.83 3k2b n PRO 83 N 0.23 0.66 0.06 1.29 -0.04 -1.26 -4.47 135.00 131.46 3k2b n PRO 83 Ca 0.01 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.34 3k2b n PRO 83 Cb 0.52 -1.17 -0.08 0.00 -0.04 0.00 0.00 33.50 32.73 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 1.47 -0.09 -0.83 0.54 -0.00 -1.92 -1.60 115.95 113.51 3k2b h TRP 84 Ca 0.00 -0.00 0.12 0.00 -0.00 0.00 0.00 58.89 59.01 3k2b h TRP 84 Cb 0.66 0.03 -0.06 0.00 -0.00 0.00 0.00 29.16 29.79 3k2b h TRP 84 CO 0.19 0.11 0.54 1.57 -0.00 0.00 0.00 178.44 180.85 3k2b h LYS 85 N -0.28 0.67 0.05 0.49 -0.00 -1.47 -0.79 116.57 115.23 3k2b h LYS 85 Ca -0.01 -0.04 -0.25 0.00 -0.00 0.00 0.00 60.65 60.35 3k2b h LYS 85 Cb 0.24 -0.15 -0.02 0.00 -0.00 0.00 0.00 32.23 32.30 3k2b h LYS 85 CO 0.02 0.45 -1.20 1.05 -0.00 0.00 0.00 179.45 179.76 3k2b h GLU 86 N 0.69 0.11 0.00 0.07 4.11 -1.85 -3.24 114.58 114.47 3k2b h GLU 86 Ca 0.40 -0.18 0.00 0.00 0.07 0.00 0.00 59.36 59.65 3k2b h GLU 86 Cb 0.58 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3k2b h GLU 86 CO -0.16 1.02 0.00 1.28 0.07 0.00 0.00 179.01 181.22 3k2b n LEU 87 N -3.38 0.33 -1.66 3.06 4.77 -0.61 -4.91 117.00 114.60 3k2b n LEU 87 Ca -0.06 0.54 -0.11 0.00 -0.03 0.00 0.00 56.01 56.34 3k2b n LEU 87 Cb 0.99 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 41.66 3k2b n LEU 87 CO 0.49 -0.11 0.02 0.61 -1.33 0.00 0.00 177.39 177.07 3k2b n GLY 88 N 1.28 0.11 3.68 -0.72 0.00 -0.35 -4.94 105.19 104.24 3k2b n GLY 88 Ca 0.06 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.89 3.17 -0.11 -0.61 -1.09 -0.99 -4.65 121.20 114.04 3k2b s ILE 89 Ca 0.17 0.49 -0.07 0.00 -2.23 0.00 0.00 60.65 59.01 3k2b s ILE 89 Cb -0.07 -3.32 -0.02 0.00 -1.58 0.00 0.00 42.46 37.46 3k2b s ILE 89 CO 0.21 -0.02 -0.14 0.47 -1.23 0.00 0.00 174.94 174.24 3k2b n ASP 90 N 6.17 1.34 -4.40 3.58 8.00 0.04 -3.26 116.55 128.01 3k2b n ASP 90 Ca 0.17 0.53 -0.30 0.00 0.71 0.00 0.00 54.79 55.89 3k2b n ASP 90 Cb 0.41 -0.77 -0.14 0.00 -0.02 0.00 0.00 41.12 40.60 3k2b n ASP 90 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3k2b s ILE 91 N -1.94 2.48 -0.16 0.53 -1.16 -1.11 -0.44 121.20 119.41 3k2b s ILE 91 Ca -0.11 -1.31 0.01 0.00 -0.51 0.00 0.00 60.65 58.72 3k2b s ILE 91 Cb 0.02 -2.02 0.00 0.00 0.61 0.00 0.00 42.46 41.07 3k2b s ILE 91 CO 0.17 0.33 -0.17 -0.69 -2.81 0.00 0.00 174.94 171.77 3k2b s VAL 92 N -0.88 2.48 -0.61 4.00 1.01 0.37 -1.69 120.40 125.08 3k2b s VAL 92 Ca 0.13 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 61.07 3k2b s VAL 92 Cb -0.10 -2.04 0.07 0.00 0.00 0.00 0.00 36.38 34.32 3k2b s VAL 92 CO 0.04 0.52 0.85 -0.63 0.00 0.00 0.00 175.10 175.88 3k2b s ILE 93 N 0.90 4.54 -0.70 2.22 -1.09 0.70 -1.03 121.20 126.73 3k2b s ILE 93 Ca -0.04 -0.47 -0.24 0.00 -2.23 0.00 0.00 60.65 57.67 3k2b s ILE 93 Cb -0.15 -4.56 0.05 0.00 -1.58 0.00 0.00 42.46 36.22 3k2b s ILE 93 CO -0.02 -1.24 1.10 -0.70 -1.23 0.00 0.00 174.94 172.85 3k2b s GLU 94 N 3.49 3.15 -0.25 2.79 2.56 -0.68 -0.54 118.70 129.23 3k2b s GLU 94 Ca 0.19 -0.61 0.10 0.00 0.00 0.00 0.00 54.97 54.66 3k2b s GLU 94 Cb -0.19 -4.23 0.45 0.00 2.00 0.00 0.00 34.13 32.16 3k2b s GLU 94 CO 0.10 -1.96 1.19 0.41 -0.56 0.00 0.00 175.26 174.45 3k2b n GLY 95 N 5.37 5.43 0.10 -1.50 0.00 0.18 -1.65 105.19 113.13 3k2b n GLY 95 Ca -0.00 -2.02 0.06 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.79 0.86 -1.33 2.61 -2.24 -1.04 -4.58 114.28 107.77 3k2b n THR 96 Ca 0.31 -0.61 -0.10 0.00 -2.27 0.00 0.00 64.05 61.38 3k2b n THR 96 Cb 0.87 -0.51 -0.04 0.00 -2.10 0.00 0.00 70.33 68.55 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 1.28 1.10 0.00 3.38 0.00 -1.26 -4.83 105.19 104.86 3k2b n GLY 97 Ca -0.05 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.77 0.00 -3.14 1.61 0.24 -1.26 -4.84 118.33 108.18 3k2b n VAL 98 Ca -0.10 -0.18 -0.25 0.00 -2.04 0.00 0.00 64.34 61.77 3k2b n VAL 98 Cb 0.34 1.37 -0.05 0.00 -1.47 0.00 0.00 33.84 34.02 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 -0.15 2.94 -1.25 6.34 3.72 -1.26 -4.92 117.46 122.88 3k2b n PHE 99 Ca 0.00 -3.98 -0.09 0.00 -0.05 0.00 0.00 57.45 53.33 3k2b n PHE 99 Cb 0.09 -0.49 0.22 0.00 -0.94 0.00 0.00 39.48 38.37 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 0.30 2.81 -4.28 -4.37 0.24 -1.26 -3.57 118.33 108.20 3k2b n VAL 100 Ca 0.29 -2.17 -0.15 0.00 -2.04 0.00 0.00 64.34 60.27 3k2b n VAL 100 Cb 0.45 -0.37 -0.10 0.00 -1.47 0.00 0.00 33.84 32.35 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 -1.78 0.86 0.09 -1.34 1.47 -1.26 -0.13 116.67 114.58 3k2b s ASP 101 Ca 0.50 -1.41 -0.25 0.00 1.18 0.00 0.00 52.55 52.58 3k2b s ASP 101 Cb 0.43 0.26 -0.13 0.00 -0.34 0.00 0.00 42.92 43.14 3k2b s ASP 101 CO 0.07 -0.79 1.70 0.03 0.68 0.00 0.00 175.17 176.86 3k2b h ARG 102 N 2.45 -0.22 -0.71 2.11 3.08 -1.93 0.40 114.38 119.55 3k2b h ARG 102 Ca -0.37 0.02 0.18 0.00 0.07 0.00 0.00 59.98 59.87 3k2b h ARG 102 Cb 1.25 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.31 3k2b h ARG 102 CO 0.57 -0.15 0.49 1.05 -1.07 0.00 0.00 179.97 180.87 3k2b h GLU 103 N -0.23 0.19 0.00 0.04 4.11 -1.98 0.50 114.58 117.21 3k2b h GLU 103 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 3k2b h GLU 103 Cb 0.21 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3k2b h GLU 103 CO -0.01 0.13 0.00 0.41 0.07 0.00 0.00 179.01 179.60 3k2b n GLY 104 N -1.60 0.34 0.30 1.06 0.00 -0.82 -3.87 105.19 100.60 3k2b n GLY 104 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 3k2b n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b h ALA 105 N -2.00 1.16 -1.33 4.61 0.00 -0.90 0.11 119.26 120.91 3k2b h ALA 105 Ca 0.00 0.24 0.42 0.00 0.00 0.00 0.00 54.91 55.56 3k2b h ALA 105 Cb 0.00 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 18.04 3k2b h ALA 105 CO 0.00 -0.47 0.88 0.78 0.00 0.00 0.00 179.25 180.45 3k2b h GLY 106 N 0.17 1.05 0.31 0.00 0.00 -0.16 0.39 103.07 104.83 3k2b h GLY 106 Ca 0.53 -0.11 0.23 0.00 0.00 0.00 0.00 47.33 47.98 3k2b h GLY 106 CO -0.68 -0.29 0.60 0.50 0.00 0.00 0.00 176.54 176.68 3k2b h LYS 107 N 0.12 0.09 -0.18 4.80 1.57 -0.88 0.39 116.57 122.48 3k2b h LYS 107 Ca 0.78 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 59.43 3k2b h LYS 107 Cb 2.51 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 34.79 3k2b h LYS 107 CO -0.32 0.06 -0.40 0.45 -0.57 0.00 0.00 179.45 178.66 3k2b h HIS 108 N 0.09 0.48 0.04 -1.35 3.86 -0.39 -1.56 115.15 116.32 3k2b h HIS 108 Ca 0.42 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3k2b h HIS 108 Cb 1.50 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.87 3k2b h HIS 108 CO -0.00 0.75 -0.02 0.82 0.86 0.00 0.00 177.93 180.34 3k2b h ILE 109 N 0.34 1.36 0.00 2.45 5.03 -0.48 -1.27 117.51 124.94 3k2b h ILE 109 Ca 0.03 -1.45 0.00 0.00 -0.12 0.00 0.00 64.86 63.32 3k2b h ILE 109 Cb 0.86 2.30 0.00 0.00 -3.03 0.00 0.00 36.82 36.94 3k2b h ILE 109 CO 0.07 0.36 0.34 -0.33 -0.68 0.00 0.00 178.15 177.90 3k2b h GLU 110 N -0.71 0.00 -0.17 2.37 5.08 -0.69 0.62 114.58 121.07 3k2b h GLU 110 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3k2b h GLU 110 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 3k2b h GLU 110 CO 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.02 3k2b n ALA 111 N -1.70 2.42 0.00 3.43 0.00 -0.60 -4.99 120.51 119.08 3k2b n ALA 111 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.62 3k2b n ALA 111 Cb 0.37 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.15 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 1.11 2.07 3.76 0.00 0.00 0.22 -1.45 105.19 110.90 3k2b n GLY 112 Ca 0.13 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.37 2.79 -0.06 4.61 0.00 -0.51 -4.56 121.76 123.67 3k2b s ALA 113 Ca 0.00 1.13 -0.18 0.00 0.00 0.00 0.00 51.96 52.91 3k2b s ALA 113 Cb 0.00 -3.48 -0.30 0.00 0.00 0.00 0.00 23.12 19.33 3k2b s ALA 113 CO 0.00 -1.11 0.77 0.87 0.00 0.00 0.00 175.76 176.30 3k2b h LYS 114 N 1.49 0.32 -4.89 0.00 1.79 -1.22 -3.35 116.57 110.71 3k2b h LYS 114 Ca -0.50 -0.55 -0.29 0.00 -2.18 0.00 0.00 60.65 57.13 3k2b h LYS 114 Cb 1.28 0.20 -0.16 0.00 -1.58 0.00 0.00 32.23 31.98 3k2b h LYS 114 CO 0.58 1.26 -0.71 0.15 -1.08 0.00 0.00 179.45 179.64 3k2b s LYS 115 N -2.48 0.91 -0.04 3.15 1.02 0.42 -4.83 119.74 117.88 3k2b s LYS 115 Ca -0.15 -1.30 0.02 0.00 0.02 0.00 0.00 55.97 54.55 3k2b s LYS 115 Cb 0.03 -0.45 0.02 0.00 -0.52 0.00 0.00 37.83 36.90 3k2b s LYS 115 CO 0.83 0.05 -0.07 0.08 -0.92 0.00 0.00 175.35 175.31 3k2b s VAL 116 N -3.09 0.69 -0.33 3.17 1.01 -0.09 -0.48 120.40 121.29 3k2b s VAL 116 Ca 0.11 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.87 3k2b s VAL 116 Cb 0.01 -0.67 0.09 0.00 0.00 0.00 0.00 36.38 35.81 3k2b s VAL 116 CO -0.01 0.25 0.04 -0.63 0.00 0.00 0.00 175.10 174.75 3k2b s ILE 117 N 0.72 2.59 -0.32 2.22 1.01 -0.20 -0.67 121.20 126.55 3k2b s ILE 117 Ca -0.11 -1.99 -0.29 0.00 0.00 0.00 0.00 60.65 58.26 3k2b s ILE 117 Cb -0.14 -2.74 0.00 0.00 0.01 0.00 0.00 42.46 39.60 3k2b s ILE 117 CO 0.01 -0.43 1.35 -0.63 0.00 0.00 0.00 174.94 175.25 3k2b s ILE 118 N 1.05 4.05 0.00 2.92 1.01 0.94 -1.68 121.20 129.48 3k2b s ILE 118 Ca 0.04 1.16 -0.04 0.00 0.00 0.00 0.00 60.65 61.81 3k2b s ILE 118 Cb -0.20 -4.13 -0.16 0.00 0.01 0.00 0.00 42.46 37.97 3k2b s ILE 118 CO -0.05 -0.53 2.55 0.35 0.00 0.00 0.00 174.94 177.26 3k2b n THR 119 N 6.44 2.06 -3.58 2.92 -2.24 -0.66 -1.72 114.28 117.50 3k2b n THR 119 Ca 0.15 -0.97 0.02 0.00 -2.27 0.00 0.00 64.05 60.99 3k2b n THR 119 Cb 0.47 -1.78 -0.00 0.00 -2.10 0.00 0.00 70.33 66.92 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 1.37 -2.40 0.56 6.98 0.00 -1.24 -4.96 121.76 122.07 3k2b s ALA 120 Ca 0.40 0.98 -0.21 0.00 0.00 0.00 0.00 51.96 53.13 3k2b s ALA 120 Cb 0.19 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 3k2b s ALA 120 CO 0.00 -1.00 1.35 -2.14 0.00 0.00 0.00 175.76 173.97 3k2b s PRO 121 N -2.15 3.08 0.17 0.00 0.02 -1.25 -3.99 135.00 130.86 3k2b s PRO 121 Ca 0.14 2.21 -0.02 0.00 0.02 0.00 0.00 61.00 63.35 3k2b s PRO 121 Cb 0.06 -2.21 -0.05 0.00 0.02 0.00 0.00 34.50 32.33 3k2b s PRO 121 CO -0.06 -1.23 0.36 0.20 -0.33 0.00 0.00 177.00 175.95 3k2b s GLY 122 N -1.01 1.96 0.15 0.52 0.00 -1.26 -4.93 107.32 102.74 3k2b s GLY 122 Ca 0.73 -0.76 -0.24 0.00 0.00 0.00 0.00 44.72 44.44 3k2b s GLY 122 CO 0.47 -0.71 0.74 0.54 0.00 0.00 0.00 173.10 174.14 3k2b s LYS 122 N -3.05 4.51 4.35 2.90 1.02 0.81 -4.78 119.74 125.50 3k2b s LYS 122 Ca 0.39 1.09 0.00 0.00 0.02 0.00 0.00 55.97 57.46 3k2b s LYS 122 Cb -0.12 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 3k2b s LYS 122 CO 0.28 0.58 0.00 0.41 -0.92 0.00 0.00 175.35 175.70 3k2b n GLY 123 N 1.62 0.34 2.46 -3.33 0.00 -1.26 -4.16 105.19 100.86 3k2b n GLY 123 Ca -0.06 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 3k2b n GLY 123 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k2b n ASP 124 N 4.58 6.41 -4.73 1.61 9.92 -1.26 -5.01 116.55 128.06 3k2b n ASP 124 Ca 0.00 -3.78 -0.41 0.00 -0.53 0.00 0.00 54.79 50.07 3k2b n ASP 124 Cb 0.00 -0.75 -0.04 0.00 -0.64 0.00 0.00 41.12 39.69 3k2b n ASP 124 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3k2b s ILE 125 N -5.00 4.00 -0.21 0.53 1.01 -1.26 -4.92 121.20 115.34 3k2b s ILE 125 Ca 0.55 1.61 -0.31 0.00 0.00 0.00 0.00 60.65 62.49 3k2b s ILE 125 Cb 0.44 -4.03 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 3k2b s ILE 125 CO -0.15 0.22 2.14 -2.65 0.00 0.00 0.00 174.94 174.50 3k2b n PRO 126 N 2.93 1.82 -3.80 2.79 -0.02 -1.26 -4.74 135.00 132.72 3k2b n PRO 126 Ca 0.05 0.55 -0.37 0.00 -2.02 0.00 0.00 63.50 61.71 3k2b n PRO 126 Cb 0.47 -2.90 -0.06 0.00 -0.02 0.00 0.00 33.50 30.99 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 7.01 5.42 0.03 3.45 2.01 -1.26 -1.00 115.64 131.30 3k2b s THR 127 Ca 1.01 0.33 0.02 0.00 0.31 0.00 0.00 61.69 63.35 3k2b s THR 127 Cb -0.55 -3.46 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 3k2b s THR 127 CO 0.43 0.60 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.58 3k2b s TYR 128 N -0.93 0.55 -0.22 4.92 2.02 0.03 -4.80 117.35 118.92 3k2b s TYR 128 Ca 0.16 -0.45 -0.02 0.00 -0.37 0.00 0.00 57.07 56.39 3k2b s TYR 128 Cb -0.13 -0.34 0.07 0.00 -0.40 0.00 0.00 41.96 41.16 3k2b s TYR 128 CO 0.05 -0.10 0.03 0.08 -1.57 0.00 0.00 175.55 174.04 3k2b s VAL 129 N -1.23 0.77 0.09 0.71 1.01 -1.26 -4.02 120.40 116.47 3k2b s VAL 129 Ca -0.10 -0.81 -0.35 0.00 0.00 0.00 0.00 61.98 60.72 3k2b s VAL 129 Cb -0.09 -1.27 -0.15 0.00 0.00 0.00 0.00 36.38 34.87 3k2b s VAL 129 CO 0.00 -0.25 1.52 0.52 0.00 0.00 0.00 175.10 176.89 3k2b n VAL 130 N 4.95 0.06 0.00 2.92 0.31 -1.26 -0.56 118.33 124.75 3k2b n VAL 130 Ca -0.09 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 3k2b n VAL 130 Cb 0.46 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 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 3.19 1.72 0.01 2.92 0.00 -1.26 -4.82 105.19 106.96 3k2b n GLY 131 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.00 0.18 -1.33 1.61 0.31 0.28 -4.89 118.33 112.48 3k2b n VAL 132 Ca 0.00 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3k2b n VAL 132 Cb 0.00 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 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 -2.37 0.00 0.13 4.52 2.04 -0.65 -4.92 115.26 114.00 3k2b n ASN 133 Ca -0.05 -0.67 0.20 0.00 -0.44 0.00 0.00 54.58 53.62 3k2b n ASN 133 Cb 0.57 0.00 0.75 0.00 -2.53 0.00 0.00 39.78 38.58 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 2.01 0.00 -2.53 0.00 -1.90 0.47 119.26 117.31 3k2b h ALA 134 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3k2b h ALA 134 Cb 0.38 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3k2b h ALA 134 CO 0.00 -0.60 -0.05 0.38 0.00 0.00 0.00 179.25 178.98 3k2b h ASP 135 N 0.00 0.00 0.66 0.00 3.04 -1.93 -1.45 116.42 116.74 3k2b h ASP 135 Ca 0.17 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 3k2b h ASP 135 Cb 1.01 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.30 3k2b h ASP 135 CO -0.00 0.05 0.00 0.00 -2.04 0.00 0.00 179.24 177.25 3k2b n ALA 136 N -2.19 2.15 -1.58 4.15 0.00 0.17 -4.87 120.51 118.34 3k2b n ALA 136 Ca -0.02 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.92 3k2b n ALA 136 Cb 0.19 -1.39 0.02 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.41 0.77 -5.03 0.00 9.36 -0.55 -5.01 117.16 115.31 3k2b n TYR 137 Ca 0.08 0.54 -0.29 0.00 3.32 0.00 0.00 57.90 61.55 3k2b n TYR 137 Cb 0.24 -2.17 -0.17 0.00 -0.63 0.00 0.00 39.34 36.62 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 -0.86 2.63 0.65 2.98 0.15 -1.26 -5.04 113.70 112.96 3k2b s SER 138 Ca 0.65 -0.45 0.30 0.00 0.70 0.00 0.00 55.95 57.15 3k2b s SER 138 Cb -0.54 -0.98 1.65 0.00 -1.71 0.00 0.00 66.02 64.43 3k2b s SER 138 CO 0.56 0.16 1.94 1.12 1.20 0.00 0.00 173.24 178.21 3k2b h HIS 139 N 6.50 0.00 -0.94 3.44 2.07 -1.95 -2.22 115.15 122.05 3k2b h HIS 139 Ca -0.27 0.00 -0.46 0.00 -2.85 0.00 0.00 60.37 56.79 3k2b h HIS 139 Cb 1.20 0.00 -0.28 0.00 2.57 0.00 0.00 27.41 30.90 3k2b h HIS 139 CO 0.46 0.00 0.59 -0.40 -3.07 0.00 0.00 177.93 175.50 3k2b n ASP 140 N -3.03 3.89 -4.16 3.10 3.85 -1.26 -4.78 116.55 114.16 3k2b n ASP 140 Ca -0.01 -3.51 -0.37 0.00 -0.71 0.00 0.00 54.79 50.19 3k2b n ASP 140 Cb 0.40 -0.82 -0.11 0.00 -1.35 0.00 0.00 41.12 39.24 3k2b n ASP 140 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3k2b s GLU 141 N -3.16 2.19 0.13 0.11 2.02 -0.84 -4.99 118.70 114.17 3k2b s GLU 141 Ca 0.55 -1.69 -0.19 0.00 0.02 0.00 0.00 54.97 53.66 3k2b s GLU 141 Cb 0.46 -3.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.05 3k2b s GLU 141 CO 0.11 -1.02 1.78 -1.00 0.02 0.00 0.00 175.26 175.16 3k2b h PRO 142 N 8.14 0.32 -5.09 0.39 0.13 -1.88 -3.42 132.00 130.59 3k2b h PRO 142 Ca -0.16 -0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 64.28 3k2b h PRO 142 Cb 1.06 -0.07 -0.33 0.00 0.13 0.00 0.00 31.00 31.79 3k2b h PRO 142 CO 0.71 0.21 -0.83 0.42 -0.23 0.00 0.00 178.00 178.28 3k2b s ILE 143 N -6.17 2.40 0.16 -3.56 1.09 -1.26 -0.91 121.20 112.95 3k2b s ILE 143 Ca -0.13 -0.84 0.06 0.00 -1.10 0.00 0.00 60.65 58.64 3k2b s ILE 143 Cb 0.09 -2.02 -0.04 0.00 -1.06 0.00 0.00 42.46 39.43 3k2b s ILE 143 CO 0.70 0.52 -0.12 0.27 -0.10 0.00 0.00 174.94 176.21 3k2b s ILE 144 N 1.17 1.34 0.00 2.92 -4.36 0.15 -4.08 121.20 118.35 3k2b s ILE 144 Ca 0.02 -2.04 0.08 0.00 -0.26 0.00 0.00 60.65 58.44 3k2b s ILE 144 Cb -0.14 -1.84 -0.02 0.00 1.25 0.00 0.00 42.46 41.71 3k2b s ILE 144 CO -0.07 -0.65 -0.23 -0.55 0.24 0.00 0.00 174.94 173.67 3k2b s SER 145 N -3.08 3.32 -0.20 4.36 0.15 -0.17 -0.04 113.70 118.03 3k2b s SER 145 Ca 0.17 -0.46 0.09 0.00 0.70 0.00 0.00 55.95 56.45 3k2b s SER 145 Cb 0.00 -0.43 0.60 0.00 -1.71 0.00 0.00 66.02 64.48 3k2b s SER 145 CO 0.03 0.30 1.48 -3.20 1.20 0.00 0.00 173.24 173.04 3k2b n ASN 146 N 2.13 4.42 -1.00 5.45 5.15 -0.70 -0.79 115.26 129.92 3k2b n ASN 146 Ca -0.16 -2.78 0.08 0.00 -0.60 0.00 0.00 54.58 51.11 3k2b n ASN 146 Cb 0.52 -0.66 -0.02 0.00 -0.53 0.00 0.00 39.78 39.09 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 0.28 -1.71 -1.95 5.20 0.00 -1.26 -4.81 120.51 116.28 3k2b n ALA 147 Ca 0.25 0.18 -0.27 0.00 0.00 0.00 0.00 53.44 53.60 3k2b n ALA 147 Cb 1.03 -0.57 0.12 0.00 0.00 0.00 0.00 19.45 20.03 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 -5.01 4.11 0.15 0.00 1.04 -1.26 -3.73 113.70 109.00 3k2b s SER 148 Ca 0.00 0.18 -0.06 0.00 0.48 0.00 0.00 55.95 56.56 3k2b s SER 148 Cb 0.00 -0.55 -0.01 0.00 0.10 0.00 0.00 66.02 65.55 3k2b s SER 148 CO 0.00 -2.06 1.40 0.00 0.98 0.00 0.00 173.24 173.56 3k2b h THR 150 N 0.39 1.27 -0.76 0.00 2.02 -1.96 -2.13 112.91 111.74 3k2b h THR 150 Ca -0.03 -1.38 -0.02 0.00 0.77 0.00 0.00 66.41 65.75 3k2b h THR 150 Cb 1.32 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 68.84 3k2b h THR 150 CO 0.14 0.48 0.41 0.74 0.37 0.00 0.00 175.52 177.66 3k2b h THR 151 N 0.84 1.23 0.00 3.16 2.02 -1.87 0.21 112.91 118.49 3k2b h THR 151 Ca 0.11 -0.58 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 3k2b h THR 151 Cb 0.80 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 3k2b h THR 151 CO 0.07 0.26 -0.19 0.78 0.37 0.00 0.00 175.52 176.81 3k2b h ASN 152 N 1.05 0.00 0.04 4.18 4.21 -1.21 0.44 115.58 124.29 3k2b h ASN 152 Ca 0.27 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.77 3k2b h ASN 152 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 3k2b h ASN 152 CO -0.04 0.19 -0.02 0.00 -1.29 0.00 0.00 177.43 176.26 3k2b h LEU 154 N -0.93 0.75 -0.43 0.00 5.85 -0.48 -3.32 115.31 116.74 3k2b h LEU 154 Ca -0.01 -0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.57 3k2b h LEU 154 Cb 0.62 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 3k2b h LEU 154 CO 0.01 0.78 -0.09 0.00 -0.34 0.00 0.00 178.44 178.80 3k2b h ALA 155 N 0.99 0.30 -0.86 1.25 0.00 -0.29 -2.06 119.26 118.59 3k2b h ALA 155 Ca 0.16 0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.30 3k2b h ALA 155 Cb 0.33 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 3k2b h ALA 155 CO 0.00 -0.44 0.53 -1.35 0.00 0.00 0.00 179.25 177.99 3k2b h PRO 156 N 0.01 0.91 0.00 0.00 0.11 -1.72 -1.04 132.00 130.27 3k2b h PRO 156 Ca 0.21 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3k2b h PRO 156 Cb 0.31 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.22 3k2b h PRO 156 CO -0.43 0.60 -0.76 1.97 -0.21 0.00 0.00 178.00 179.17 3k2b n PHE 157 N -4.64 0.33 0.08 0.65 1.16 -1.14 -3.14 117.46 110.76 3k2b n PHE 157 Ca 0.13 0.10 -0.09 0.00 -1.87 0.00 0.00 57.45 55.71 3k2b n PHE 157 Cb 0.20 -0.48 -0.01 0.00 -1.61 0.00 0.00 39.48 37.58 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 1.48 -0.65 1.97 2.07 -1.15 -1.73 116.25 118.24 3k2b h VAL 158 Ca 0.00 -2.57 -0.01 0.00 0.82 0.00 0.00 66.70 64.94 3k2b h VAL 158 Cb 0.69 2.44 -0.03 0.00 -1.52 0.00 0.00 31.29 32.87 3k2b h VAL 158 CO 0.00 0.75 0.39 0.50 0.02 0.00 0.00 177.57 179.23 3k2b h LYS 159 N 0.13 0.89 -0.10 1.57 3.64 -1.19 -1.49 116.57 120.01 3k2b h LYS 159 Ca -0.05 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 3k2b h LYS 159 Cb 1.50 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 33.13 3k2b h LYS 159 CO 0.14 0.64 -0.05 0.28 -2.27 0.00 0.00 179.45 178.19 3k2b h VAL 160 N 0.89 1.32 -0.43 2.00 2.07 -1.46 -2.27 116.25 118.37 3k2b h VAL 160 Ca 0.23 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.71 3k2b h VAL 160 Cb -0.01 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 3k2b h VAL 160 CO -0.04 0.30 0.23 -0.07 0.02 0.00 0.00 177.57 178.01 3k2b h LEU 161 N -0.14 0.36 -0.53 2.57 3.38 -1.16 0.58 115.31 120.37 3k2b h LEU 161 Ca 0.02 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 3k2b h LEU 161 Cb 0.50 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3k2b h LEU 161 CO 0.01 0.26 -0.23 -0.78 0.09 0.00 0.00 178.44 177.79 3k2b h ASP 162 N 0.47 0.96 -0.26 -0.43 3.58 -1.33 0.44 116.42 119.85 3k2b h ASP 162 Ca 0.18 -0.37 -0.03 0.00 0.42 0.00 0.00 57.03 57.23 3k2b h ASP 162 Cb 0.05 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 3k2b h ASP 162 CO -0.10 1.15 0.06 -0.61 -2.88 0.00 0.00 179.24 176.86 3k2b h GLN 163 N 0.81 0.43 0.00 0.28 4.15 -1.10 0.35 115.11 120.02 3k2b h GLN 163 Ca 0.10 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3k2b h GLN 163 Cb 0.80 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.44 3k2b h GLN 163 CO 0.07 0.53 -0.94 -0.22 -1.93 0.00 0.00 178.83 176.33 3k2b h LYS 164 N 0.25 0.00 0.00 1.69 3.11 -0.82 -3.41 116.57 117.39 3k2b h LYS 164 Ca 0.08 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.92 3k2b h LYS 164 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 3k2b h LYS 164 CO 0.00 0.00 -0.08 1.19 -2.81 0.00 0.00 179.45 177.75 3k2b n PHE 165 N -2.68 0.00 -1.59 1.91 3.72 0.15 -4.94 117.46 114.03 3k2b n PHE 165 Ca 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.39 3k2b n PHE 165 Cb 0.55 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.08 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 0.32 -3.63 3.59 1.37 0.00 0.11 -1.47 105.19 105.49 3k2b n GLY 166 Ca 0.00 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.17 4.39 -0.05 -0.61 1.01 -1.26 -0.89 121.20 123.61 3k2b s ILE 167 Ca -0.04 1.06 -0.25 0.00 0.00 0.00 0.00 60.65 61.42 3k2b s ILE 167 Cb 0.00 -4.48 -0.23 0.00 0.01 0.00 0.00 42.46 37.76 3k2b s ILE 167 CO 0.11 -0.83 1.05 0.40 0.00 0.00 0.00 174.94 175.67 3k2b h ILE 168 N 6.08 1.54 -1.92 2.92 2.04 -1.28 -3.49 117.51 123.40 3k2b h ILE 168 Ca -0.23 -1.83 0.10 0.00 1.00 0.00 0.00 64.86 63.90 3k2b h ILE 168 Cb 1.07 2.69 -0.19 0.00 -0.74 0.00 0.00 36.82 39.65 3k2b h ILE 168 CO 1.06 0.50 0.53 -1.59 0.00 0.00 0.00 178.15 178.64 3k2b s LYS 169 N -3.27 0.70 0.23 2.37 -2.85 -1.22 -4.87 119.74 110.84 3k2b s LYS 169 Ca -0.16 -0.08 -0.22 0.00 -1.00 0.00 0.00 55.97 54.51 3k2b s LYS 169 Cb 0.01 0.33 0.04 0.00 -2.06 0.00 0.00 37.83 36.15 3k2b s LYS 169 CO 0.73 -0.27 0.67 0.20 0.10 0.00 0.00 175.35 176.77 3k2b s GLY 170 N -1.85 -0.32 0.12 0.59 0.00 0.07 -0.63 107.32 105.30 3k2b s GLY 170 Ca 0.02 0.04 0.05 0.00 0.00 0.00 0.00 44.72 44.82 3k2b s GLY 170 CO -0.04 0.02 -0.11 -1.08 0.00 0.00 0.00 173.10 171.89 3k2b s THR 171 N -3.84 1.13 0.01 0.90 -1.32 -0.10 -2.98 115.64 109.44 3k2b s THR 171 Ca 0.07 -1.75 -0.04 0.00 -1.21 0.00 0.00 61.69 58.75 3k2b s THR 171 Cb -0.04 -1.52 -0.01 0.00 -1.51 0.00 0.00 72.50 69.43 3k2b s THR 171 CO -0.02 -0.55 0.07 -0.32 -2.21 0.00 0.00 174.62 171.59 3k2b s MET 172 N -2.94 0.43 -0.05 7.08 0.00 -0.27 -1.75 119.30 121.80 3k2b s MET 172 Ca 0.09 -0.53 -0.02 0.00 0.00 0.00 0.00 55.69 55.23 3k2b s MET 172 Cb -0.02 0.17 0.03 0.00 0.00 0.00 0.00 34.83 35.01 3k2b s MET 172 CO 0.01 -0.09 0.06 0.99 0.00 0.00 0.00 175.02 175.99 3k2b s THR 173 N -1.58 -0.11 -0.34 10.11 2.01 -0.17 -1.13 115.64 124.43 3k2b s THR 173 Ca -0.14 0.41 -0.08 0.00 0.31 0.00 0.00 61.69 62.19 3k2b s THR 173 Cb -0.08 -0.17 0.03 0.00 0.01 0.00 0.00 72.50 72.30 3k2b s THR 173 CO -0.00 0.16 0.13 0.28 -0.69 0.00 0.00 174.62 174.50 3k2b s THR 174 N 2.17 4.00 -0.63 -0.82 -1.32 -0.67 0.00 115.64 118.37 3k2b s THR 174 Ca 0.05 -1.02 -0.27 0.00 -1.21 0.00 0.00 61.69 59.24 3k2b s THR 174 Cb -0.12 -3.23 0.03 0.00 -1.51 0.00 0.00 72.50 67.67 3k2b s THR 174 CO -0.03 -0.16 1.19 -0.89 -2.21 0.00 0.00 174.62 172.51 3k2b s THR 175 N 1.45 3.98 0.07 5.08 2.01 -0.30 -1.39 115.64 126.54 3k2b s THR 175 Ca -0.00 0.66 0.05 0.00 0.31 0.00 0.00 61.69 62.71 3k2b s THR 175 Cb -0.19 -4.76 -0.04 0.00 0.01 0.00 0.00 72.50 67.52 3k2b s THR 175 CO 0.04 -1.47 -0.04 -2.28 -0.69 0.00 0.00 174.62 170.18 3k2b s HIS 176 N 5.05 2.91 0.76 4.92 2.46 -0.35 -1.73 115.29 129.30 3k2b s HIS 176 Ca 0.39 -0.05 -0.12 0.00 0.47 0.00 0.00 55.06 55.74 3k2b s HIS 176 Cb -0.08 -1.53 0.05 0.00 -0.13 0.00 0.00 32.58 30.89 3k2b s HIS 176 CO 0.21 0.45 1.12 -1.12 -2.47 0.00 0.00 174.74 172.93 3k2b s SER 177 N -2.08 4.39 0.47 9.88 0.01 -1.24 -0.75 113.70 124.37 3k2b s SER 177 Ca 0.23 2.01 -0.20 0.00 1.31 0.00 0.00 55.95 59.30 3k2b s SER 177 Cb -0.11 -2.55 -0.10 0.00 0.21 0.00 0.00 66.02 63.47 3k2b s SER 177 CO 0.15 -2.12 0.98 -0.72 0.41 0.00 0.00 173.24 171.94 3k2b s TYR 178 N -2.57 3.28 0.48 2.43 -0.85 -0.79 -4.69 117.35 114.65 3k2b s TYR 178 Ca 0.66 1.57 0.02 0.00 -0.52 0.00 0.00 57.07 58.79 3k2b s TYR 178 Cb -0.21 -2.88 -0.02 0.00 0.38 0.00 0.00 41.96 39.23 3k2b s TYR 178 CO 0.51 -0.33 0.02 0.95 -1.52 0.00 0.00 175.55 175.17 3k2b s THR 179 N -2.26 1.20 -1.35 -3.49 -4.23 -1.26 -4.73 115.64 99.51 3k2b s THR 179 Ca 0.62 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.18 3k2b s THR 179 Cb -0.11 -2.30 0.07 0.00 1.34 0.00 0.00 72.50 71.51 3k2b s THR 179 CO 0.19 0.00 1.00 0.61 -0.54 0.00 0.00 174.62 175.89 3k2b n GLY 180 N -1.18 -0.47 0.21 3.99 0.00 -1.26 -1.94 105.19 104.54 3k2b n GLY 180 Ca -0.16 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 -3.54 1.61 3.58 -1.99 -3.45 116.42 112.63 3k2b h ASP 181 Ca 0.00 0.00 -0.48 0.00 0.42 0.00 0.00 57.03 56.97 3k2b h ASP 181 Cb 0.05 0.00 0.05 0.00 1.72 0.00 0.00 39.33 41.15 3k2b h ASP 181 CO 0.00 0.03 0.13 -1.10 -2.88 0.00 0.00 179.24 175.42 3k2b s GLN 182 N -3.21 3.09 0.13 0.28 -0.21 -0.82 -4.96 119.66 113.95 3k2b s GLN 182 Ca 0.06 -0.00 -0.06 0.00 0.02 0.00 0.00 55.36 55.38 3k2b s GLN 182 Cb 0.05 -2.32 -0.06 0.00 1.00 0.00 0.00 33.01 31.68 3k2b s GLN 182 CO 0.68 -0.54 0.38 1.03 -2.12 0.00 0.00 175.29 174.73 3k2b s ARG 183 N -4.89 3.65 0.02 2.91 1.81 -1.08 -4.94 118.95 116.43 3k2b s ARG 183 Ca 0.52 -0.03 -0.25 0.00 -1.72 0.00 0.00 55.73 54.25 3k2b s ARG 183 Cb -0.10 -2.88 -0.17 0.00 -0.45 0.00 0.00 34.95 31.34 3k2b s ARG 183 CO 0.44 0.49 1.35 1.25 -0.68 0.00 0.00 175.30 178.15 3k2b h LEU 184 N 3.04 -0.26 -8.79 2.53 5.85 -1.91 0.74 115.31 116.52 3k2b h LEU 184 Ca -0.47 -0.19 -0.54 0.00 0.84 0.00 0.00 57.88 57.52 3k2b h LEU 184 Cb 1.17 0.07 -0.19 0.00 0.37 0.00 0.00 40.66 42.08 3k2b h LEU 184 CO 0.71 0.06 -0.80 -0.76 -0.34 0.00 0.00 178.44 177.31 3k2b s LEU 185 N -9.60 2.39 -0.69 2.25 1.43 -1.26 -3.47 118.68 109.74 3k2b s LEU 185 Ca -0.15 -0.81 -0.38 0.00 -1.03 0.00 0.00 54.13 51.77 3k2b s LEU 185 Cb 0.03 -0.86 -0.20 0.00 0.03 0.00 0.00 46.19 45.19 3k2b s LEU 185 CO 0.59 0.00 2.32 0.47 0.23 0.00 0.00 176.35 179.96 3k2b n ASP 186 N 0.54 0.55 -1.51 2.29 9.92 -1.26 -4.48 116.55 122.61 3k2b n ASP 186 Ca -0.15 0.47 -0.04 0.00 -0.53 0.00 0.00 54.79 54.53 3k2b n ASP 186 Cb 0.56 -0.89 -0.02 0.00 -0.64 0.00 0.00 41.12 40.13 3k2b n ASP 186 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3k2b n ALA 187 N 8.55 0.14 -2.07 2.24 0.00 -0.59 -4.95 120.51 123.84 3k2b n ALA 187 Ca 0.58 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 3k2b n ALA 187 Cb -0.01 0.36 -0.03 0.00 0.00 0.00 0.00 19.45 19.77 3k2b n ALA 187 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3k2b s SER 188 N -1.54 6.77 -0.18 0.00 0.15 -1.26 -4.64 113.70 113.01 3k2b s SER 188 Ca 0.09 2.43 -0.28 0.00 0.70 0.00 0.00 55.95 58.89 3k2b s SER 188 Cb 0.00 -2.60 0.08 0.00 -1.71 0.00 0.00 66.02 61.80 3k2b s SER 188 CO 0.06 -0.67 0.76 -2.28 1.20 0.00 0.00 173.24 172.31 3k2b s HIS 190 N 0.85 -0.67 0.34 3.44 5.04 -1.26 -4.94 115.29 118.08 3k2b s HIS 190 Ca 0.64 1.43 0.03 0.00 -1.54 0.00 0.00 55.06 55.61 3k2b s HIS 190 Cb -0.39 0.35 0.60 0.00 0.04 0.00 0.00 32.58 33.19 3k2b s HIS 190 CO 0.33 -0.45 1.93 0.07 -2.34 0.00 0.00 174.74 174.28 3k2b h ARG 191 N 3.93 0.70 -5.44 2.88 0.11 -1.99 -3.38 114.38 111.19 3k2b h ARG 191 Ca -0.27 -0.09 -0.61 0.00 0.10 0.00 0.00 59.98 59.11 3k2b h ARG 191 Cb 1.15 -0.13 -0.12 0.00 1.11 0.00 0.00 29.97 31.99 3k2b h ARG 191 CO 0.21 0.57 -0.01 0.34 0.10 0.00 0.00 179.97 181.18 3k2b s ASP 192 N -6.61 6.50 0.00 0.08 -1.08 -1.26 -4.96 116.67 109.34 3k2b s ASP 192 Ca -0.09 0.60 0.19 0.00 -0.52 0.00 0.00 52.55 52.73 3k2b s ASP 192 Cb 0.16 -2.29 0.97 0.00 -1.46 0.00 0.00 42.92 40.30 3k2b s ASP 192 CO 0.77 -0.25 1.58 0.18 0.52 0.00 0.00 175.17 177.97 3k2b n LEU 193 N 5.23 0.00 -0.11 -1.34 4.77 -1.26 -2.17 117.00 122.12 3k2b n LEU 193 Ca -0.04 0.27 -0.22 0.00 -0.03 0.00 0.00 56.01 55.99 3k2b n LEU 193 Cb 0.50 -0.27 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 3k2b n LEU 193 CO 0.41 -0.10 -0.82 0.54 -1.33 0.00 0.00 177.39 176.09 3k2b n ARG 194 N -1.27 0.56 0.05 3.23 1.74 -1.26 -4.01 116.66 115.70 3k2b n ARG 194 Ca 0.09 0.44 0.05 0.00 -0.77 0.00 0.00 57.85 57.67 3k2b n ARG 194 Cb 0.15 -1.64 0.25 0.00 -1.02 0.00 0.00 32.46 30.20 3k2b n ARG 194 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k2b n ARG 195 N -4.40 0.05 0.13 5.56 1.74 -1.18 -1.00 116.66 117.57 3k2b n ARG 195 Ca -0.35 0.49 -0.01 0.00 -0.77 0.00 0.00 57.85 57.20 3k2b n ARG 195 Cb 0.69 -1.65 0.16 0.00 -1.02 0.00 0.00 32.46 30.63 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 2.11 0.94 -2.69 7.54 0.00 -1.57 -2.86 119.26 122.72 3k2b h ALA 196 Ca 0.00 -0.58 -0.52 0.00 0.00 0.00 0.00 54.91 53.82 3k2b h ALA 196 Cb 0.07 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.78 3k2b h ALA 196 CO 0.00 0.79 0.53 1.03 0.00 0.00 0.00 179.25 181.60 3k2b s ARG 197 N -3.55 4.53 -0.35 0.00 1.81 -0.18 -1.53 118.95 119.68 3k2b s ARG 197 Ca -0.01 1.84 -0.33 0.00 -1.72 0.00 0.00 55.73 55.52 3k2b s ARG 197 Cb 0.12 -3.23 -0.14 0.00 -0.45 0.00 0.00 34.95 31.25 3k2b s ARG 197 CO 0.76 -0.01 1.17 0.00 -0.68 0.00 0.00 175.30 176.55 3k2b n ALA 198 N 2.20 -0.80 -0.17 2.13 0.00 -1.26 -4.53 120.51 118.08 3k2b n ALA 198 Ca 0.03 0.32 -0.08 0.00 0.00 0.00 0.00 53.44 53.71 3k2b n ALA 198 Cb 0.45 -1.36 0.01 0.00 0.00 0.00 0.00 19.45 18.54 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 3.90 0.63 -0.42 0.00 0.00 -0.87 -3.24 119.26 119.26 3k2b h ALA 199 Ca -0.28 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.27 3k2b h ALA 199 Cb 0.97 -0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.44 3k2b h ALA 199 CO 0.70 0.25 0.26 0.00 0.00 0.00 0.00 179.25 180.46 3k2b n ALA 200 N -2.34 3.79 -1.10 0.00 0.00 -1.26 -3.64 120.51 115.97 3k2b n ALA 200 Ca 0.01 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.23 3k2b n ALA 200 Cb 0.16 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 -0.18 0.00 -4.05 0.00 4.77 -1.22 -4.87 117.00 111.46 3k2b n LEU 201 Ca 0.25 -0.03 -0.10 0.00 -0.03 0.00 0.00 56.01 56.10 3k2b n LEU 201 Cb 0.98 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 42.00 3k2b n LEU 201 CO 0.25 0.04 -0.07 0.20 -1.33 0.00 0.00 177.39 176.49 3k2b s ASN 202 N 0.00 0.08 -0.30 -1.43 -0.87 -1.24 -5.06 114.94 106.12 3k2b s ASN 202 Ca 0.00 -1.04 -0.09 0.00 -1.57 0.00 0.00 52.86 50.16 3k2b s ASN 202 Cb 0.00 0.43 -0.01 0.00 -0.02 0.00 0.00 41.25 41.66 3k2b s ASN 202 CO 0.00 -0.91 0.12 -0.63 -2.57 0.00 0.00 177.10 173.12 3k2b s ILE 203 N -4.03 4.43 -0.37 0.60 1.01 -1.26 -3.75 121.20 117.83 3k2b s ILE 203 Ca 0.24 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 3k2b s ILE 203 Cb 0.04 -3.23 0.08 0.00 0.01 0.00 0.00 42.46 39.35 3k2b s ILE 203 CO 0.05 0.11 0.14 -0.69 0.00 0.00 0.00 174.94 174.55 3k2b s VAL 204 N 1.59 3.35 0.52 2.92 1.01 0.14 -4.90 120.40 125.03 3k2b s VAL 204 Ca 0.04 -1.68 -0.23 0.00 0.00 0.00 0.00 61.98 60.12 3k2b s VAL 204 Cb -0.17 -3.12 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 3k2b s VAL 204 CO 0.05 -0.44 1.38 -2.84 0.00 0.00 0.00 175.10 173.25 3k2b s PRO 205 N 1.23 3.26 -0.25 2.72 0.02 -1.26 -1.26 135.00 139.47 3k2b s PRO 205 Ca 0.02 2.28 -0.26 0.00 0.02 0.00 0.00 61.00 63.07 3k2b s PRO 205 Cb -0.21 -2.35 0.10 0.00 0.02 0.00 0.00 34.50 32.06 3k2b s PRO 205 CO -0.02 -1.11 0.90 -0.08 -0.33 0.00 0.00 177.00 176.36 3k2b s THR 206 N -1.28 0.00 0.95 0.99 -1.32 -0.74 -4.69 115.64 109.55 3k2b s THR 206 Ca 0.69 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 61.06 3k2b s THR 206 Cb -0.41 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 69.74 3k2b s THR 206 CO 0.50 0.00 1.10 -0.94 -2.21 0.00 0.00 174.62 173.07 3k2b s SER 207 N 0.04 2.83 -0.17 8.08 1.04 -1.26 -1.52 113.70 122.74 3k2b s SER 207 Ca 0.01 1.83 -0.11 0.00 0.48 0.00 0.00 55.95 58.16 3k2b s SER 207 Cb -0.04 -2.41 0.06 0.00 0.10 0.00 0.00 66.02 63.72 3k2b s SER 207 CO -0.02 -3.10 0.42 0.28 0.98 0.00 0.00 173.24 171.81 3k2b s THR 208 N -2.71 -0.02 -0.32 2.02 -1.32 -1.26 -4.68 115.64 107.35 3k2b s THR 208 Ca 0.66 0.07 0.14 0.00 -1.21 0.00 0.00 61.69 61.35 3k2b s THR 208 Cb -0.21 -0.62 0.81 0.00 -1.51 0.00 0.00 72.50 70.97 3k2b s THR 208 CO 0.59 0.03 1.74 0.61 -2.21 0.00 0.00 174.62 175.38 3k2b n GLY 209 N 3.96 2.96 0.10 6.08 0.00 -1.26 -4.46 105.19 112.57 3k2b n GLY 209 Ca -0.21 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 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 4.03 -0.14 -0.91 4.61 0.00 -1.95 -0.91 119.26 123.98 3k2b h ALA 210 Ca 0.00 -0.16 0.21 0.00 0.00 0.00 0.00 54.91 54.95 3k2b h ALA 210 Cb 1.94 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 19.67 3k2b h ALA 210 CO 0.47 -0.43 0.45 0.00 0.00 0.00 0.00 179.25 179.75 3k2b h ALA 211 N 0.40 1.47 0.00 0.00 0.00 -1.88 -0.46 119.26 118.80 3k2b h ALA 211 Ca -0.01 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3k2b h ALA 211 Cb 0.37 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3k2b h ALA 211 CO 0.02 -0.25 -0.90 0.36 0.00 0.00 0.00 179.25 178.48 3k2b n LYS 212 N -4.96 0.31 0.18 0.00 2.85 -1.21 -3.79 118.16 111.54 3k2b n LYS 212 Ca 0.22 0.03 0.03 0.00 -1.05 0.00 0.00 58.31 57.54 3k2b n LYS 212 Cb 0.61 -1.64 0.31 0.00 -0.65 0.00 0.00 35.03 33.67 3k2b n LYS 212 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3k2b h ALA 213 N 2.49 1.10 -0.80 0.58 0.00 0.36 -2.74 119.26 120.25 3k2b h ALA 213 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.60 3k2b h ALA 213 Cb 0.75 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 3k2b h ALA 213 CO 0.00 0.54 0.52 0.28 0.00 0.00 0.00 179.25 180.60 3k2b h VAL 214 N 0.00 0.98 0.00 0.00 2.07 -1.45 0.85 116.25 118.70 3k2b h VAL 214 Ca -0.00 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3k2b h VAL 214 Cb 0.87 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3k2b h VAL 214 CO 0.06 0.14 -0.02 0.00 0.02 0.00 0.00 177.57 177.77 3k2b h ALA 215 N 1.59 1.09 -0.36 1.67 0.00 -1.64 0.77 119.26 122.37 3k2b h ALA 215 Ca 0.36 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 3k2b h ALA 215 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3k2b h ALA 215 CO -0.13 0.02 -0.24 -0.07 0.00 0.00 0.00 179.25 178.83 3k2b h LEU 216 N 0.00 0.84 0.00 0.00 3.38 -0.95 -2.77 115.31 115.81 3k2b h LEU 216 Ca -0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3k2b h LEU 216 Cb 0.16 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3k2b h LEU 216 CO 0.00 1.09 -1.02 1.33 0.09 0.00 0.00 178.44 179.93 3k2b n VAL 217 N -4.23 0.04 -3.41 1.22 0.24 -0.78 -4.58 118.33 106.84 3k2b n VAL 217 Ca -0.02 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.34 61.90 3k2b n VAL 217 Cb 0.45 0.58 -0.10 0.00 -1.47 0.00 0.00 33.84 33.30 3k2b n VAL 217 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3k2b s LEU 218 N -3.38 1.46 0.32 1.34 1.43 0.20 -4.62 118.68 115.42 3k2b s LEU 218 Ca 0.06 -3.05 0.07 0.00 -1.03 0.00 0.00 54.13 50.18 3k2b s LEU 218 Cb 0.16 -0.46 0.91 0.00 0.03 0.00 0.00 46.19 46.82 3k2b s LEU 218 CO 0.83 -0.17 1.61 -0.65 0.23 0.00 0.00 176.35 178.19 3k2b h PRO 219 N 5.69 0.09 0.00 1.29 0.11 -1.72 -0.54 132.00 136.92 3k2b h PRO 219 Ca 0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.36 3k2b h PRO 219 Cb 0.91 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3k2b h PRO 219 CO 0.37 0.06 0.10 -1.71 -0.21 0.00 0.00 178.00 176.61 3k2b n ASN 220 N -5.32 0.00 -0.87 -2.05 5.15 -1.26 -0.53 115.26 110.38 3k2b n ASN 220 Ca 0.27 0.32 0.11 0.00 -0.60 0.00 0.00 54.58 54.67 3k2b n ASN 220 Cb 0.88 -0.32 0.09 0.00 -0.53 0.00 0.00 39.78 39.90 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 -1.30 2.83 -4.74 1.20 7.99 -0.21 -4.91 117.00 117.86 3k2b n LEU 221 Ca 0.00 -1.02 -0.42 0.00 -0.01 0.00 0.00 56.01 54.56 3k2b n LEU 221 Cb 0.10 -0.01 -0.02 0.00 -0.11 0.00 0.00 43.42 43.38 3k2b n LEU 221 CO 0.00 0.49 1.30 1.17 -1.51 0.00 0.00 177.39 178.83 3k2b n LYS 222 N 1.22 2.76 0.00 3.23 4.81 0.31 -2.27 118.16 128.22 3k2b n LYS 222 Ca 0.13 0.99 0.00 0.00 -0.87 0.00 0.00 58.31 58.55 3k2b n LYS 222 Cb 0.54 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.80 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 2.79 2.41 0.06 3.14 0.00 -1.26 -4.85 105.19 107.48 3k2b n GLY 223 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.89 0.24 -4.28 1.61 5.02 -0.96 -4.93 118.16 112.96 3k2b n LYS 224 Ca 0.00 0.10 -0.18 0.00 -2.02 0.00 0.00 58.31 56.21 3k2b n LYS 224 Cb 0.00 -1.68 -0.13 0.00 -0.02 0.00 0.00 35.03 33.20 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 -4.09 2.14 0.21 -0.35 1.43 -1.26 -0.75 118.68 116.01 3k2b s LEU 225 Ca 0.08 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 3k2b s LEU 225 Cb 0.14 -0.45 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 3k2b s LEU 225 CO 0.69 0.01 0.10 0.54 0.23 0.00 0.00 176.35 177.91 3k2b s ASN 226 N -0.91 0.66 0.03 2.29 2.20 -1.16 -4.20 114.94 113.86 3k2b s ASN 226 Ca -0.00 -1.35 -0.28 0.00 -0.94 0.00 0.00 52.86 50.29 3k2b s ASN 226 Cb -0.07 0.26 0.10 0.00 -2.00 0.00 0.00 41.25 39.55 3k2b s ASN 226 CO 0.01 -0.76 1.21 -0.83 -2.94 0.00 0.00 177.10 173.79 3k2b s GLY 227 N -3.21 -0.22 0.21 0.45 0.00 -1.26 -1.12 107.32 102.18 3k2b s GLY 227 Ca 0.35 0.25 -0.02 0.00 0.00 0.00 0.00 44.72 45.31 3k2b s GLY 227 CO 0.11 2.24 0.16 -0.26 0.00 0.00 0.00 173.10 175.35 3k2b s ILE 228 N -2.34 0.00 0.18 0.90 -5.25 -0.28 -4.48 121.20 109.93 3k2b s ILE 228 Ca 0.20 -1.95 0.08 0.00 -0.99 0.00 0.00 60.65 57.99 3k2b s ILE 228 Cb 0.01 -2.48 -0.04 0.00 2.95 0.00 0.00 42.46 42.90 3k2b s ILE 228 CO -0.01 0.00 -0.16 0.00 -1.79 0.00 0.00 174.94 172.98 3k2b s ALA 229 N -4.12 1.96 -0.26 2.27 0.00 -0.57 -1.68 121.76 119.36 3k2b s ALA 229 Ca 0.38 -1.56 -0.04 0.00 0.00 0.00 0.00 51.96 50.74 3k2b s ALA 229 Cb 0.06 -0.12 0.09 0.00 0.00 0.00 0.00 23.12 23.15 3k2b s ALA 229 CO 0.12 0.13 0.14 -0.51 0.00 0.00 0.00 175.76 175.64 3k2b s LEU 230 N -2.98 0.42 0.06 0.00 1.43 -0.49 -1.79 118.68 115.34 3k2b s LEU 230 Ca 0.18 -1.07 -0.31 0.00 -1.03 0.00 0.00 54.13 51.91 3k2b s LEU 230 Cb -0.03 -0.25 -0.06 0.00 0.03 0.00 0.00 46.19 45.89 3k2b s LEU 230 CO 0.06 -0.41 1.20 -0.13 0.23 0.00 0.00 176.35 177.30 3k2b s ARG 231 N 2.13 4.43 0.24 1.70 1.81 -0.39 -1.21 118.95 127.66 3k2b s ARG 231 Ca 0.07 1.78 0.09 0.00 -1.72 0.00 0.00 55.73 55.96 3k2b s ARG 231 Cb -0.16 -3.35 -0.05 0.00 -0.45 0.00 0.00 34.95 30.95 3k2b s ARG 231 CO -0.30 -0.26 -0.16 0.14 -0.68 0.00 0.00 175.30 174.04 3k2b s VAL 232 N 1.07 2.03 -0.06 3.52 -7.23 0.07 0.25 120.40 120.05 3k2b s VAL 232 Ca 0.59 -2.28 -0.01 0.00 -1.81 0.00 0.00 61.98 58.47 3k2b s VAL 232 Cb -0.30 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.45 3k2b s VAL 232 CO 0.29 -0.50 0.99 -2.65 -0.31 0.00 0.00 175.10 172.91 3k2b n PRO 233 N -0.49 0.30 -4.66 4.82 -0.02 -1.25 -3.03 135.00 130.67 3k2b n PRO 233 Ca -0.07 -0.30 -0.24 0.00 -2.02 0.00 0.00 63.50 60.87 3k2b n PRO 233 Cb 0.60 -1.73 -0.15 0.00 -0.02 0.00 0.00 33.50 32.21 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 3.37 1.39 0.22 3.45 -4.23 -1.26 -5.00 115.64 113.58 3k2b s THR 234 Ca 0.08 -0.92 0.11 0.00 -1.18 0.00 0.00 61.69 59.78 3k2b s THR 234 Cb 0.03 -1.19 -0.04 0.00 1.34 0.00 0.00 72.50 72.64 3k2b s THR 234 CO -0.00 0.25 1.56 1.55 -0.54 0.00 0.00 174.62 177.44 3k2b h PRO 235 N 5.30 0.00 -2.92 3.99 0.13 -1.86 -2.10 132.00 134.54 3k2b h PRO 235 Ca -0.39 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.70 3k2b h PRO 235 Cb 1.16 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.15 3k2b h PRO 235 CO 0.46 0.65 0.08 1.21 -0.23 0.00 0.00 178.00 180.18 3k2b s ASN 236 N -6.77 -0.45 0.00 1.44 2.47 -1.26 -4.65 114.94 105.72 3k2b s ASN 236 Ca -0.01 0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.33 3k2b s ASN 236 Cb 0.12 0.53 0.00 0.00 -1.45 0.00 0.00 41.25 40.45 3k2b s ASN 236 CO 0.76 -0.82 0.00 0.52 -3.72 0.00 0.00 177.10 173.84 3k2b n VAL 237 N 0.05 -0.66 -4.50 -5.21 0.31 -1.26 -4.88 118.33 102.19 3k2b n VAL 237 Ca -0.17 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 63.91 3k2b n VAL 237 Cb 0.62 -0.66 -0.09 0.00 -0.91 0.00 0.00 33.84 32.80 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 -0.60 2.64 -0.09 4.52 0.01 0.37 -3.69 113.70 116.85 3k2b s SER 238 Ca 0.00 -1.56 -0.08 0.00 1.31 0.00 0.00 55.95 55.62 3k2b s SER 238 Cb 0.00 0.30 0.03 0.00 0.21 0.00 0.00 66.02 66.56 3k2b s SER 238 CO 0.00 -0.82 0.24 0.54 0.41 0.00 0.00 173.24 173.62 3k2b s VAL 239 N -3.25 -0.01 -0.13 3.43 0.11 -0.71 -1.65 120.40 118.20 3k2b s VAL 239 Ca 0.28 0.02 -0.02 0.00 -2.93 0.00 0.00 61.98 59.32 3k2b s VAL 239 Cb 0.05 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.52 3k2b s VAL 239 CO 0.14 0.01 -0.05 0.68 -3.33 0.00 0.00 175.10 172.55 3k2b s VAL 240 N 0.29 3.84 -0.47 2.04 -7.23 -0.78 -1.15 120.40 116.94 3k2b s VAL 240 Ca -0.01 -0.39 -0.10 0.00 -1.81 0.00 0.00 61.98 59.67 3k2b s VAL 240 Cb -0.03 -2.65 0.12 0.00 0.56 0.00 0.00 36.38 34.38 3k2b s VAL 240 CO -0.01 0.53 0.35 -0.62 -0.31 0.00 0.00 175.10 175.04 3k2b s ASP 241 N -0.02 5.73 -0.15 4.85 -1.08 0.10 -2.59 116.67 123.50 3k2b s ASP 241 Ca 0.01 -1.88 -0.06 0.00 -0.52 0.00 0.00 52.55 50.10 3k2b s ASP 241 Cb -0.13 -2.02 -0.04 0.00 -1.46 0.00 0.00 42.92 39.27 3k2b s ASP 241 CO 0.03 -0.69 0.04 -0.22 0.52 0.00 0.00 175.17 174.84 3k2b s LEU 242 N 1.38 3.69 -0.12 -1.34 2.96 -0.31 -1.00 118.68 123.95 3k2b s LEU 242 Ca 0.05 0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 3k2b s LEU 242 Cb -0.26 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.54 3k2b s LEU 242 CO -0.00 0.23 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.46 3k2b s VAL 243 N 0.03 1.26 0.12 1.68 1.01 -0.72 -0.46 120.40 123.34 3k2b s VAL 243 Ca 0.04 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.62 3k2b s VAL 243 Cb -0.12 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3k2b s VAL 243 CO 0.01 0.41 -0.11 0.68 0.00 0.00 0.00 175.10 176.09 3k2b s VAL 244 N 1.51 1.11 -0.25 2.92 -7.23 0.17 -0.92 120.40 117.71 3k2b s VAL 244 Ca 0.03 -1.86 -0.07 0.00 -1.81 0.00 0.00 61.98 58.27 3k2b s VAL 244 Cb -0.13 -1.63 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 3k2b s VAL 244 CO -0.08 -0.63 0.05 -1.58 -0.31 0.00 0.00 175.10 172.55 3k2b s GLN 245 N -3.25 3.55 0.31 4.82 0.74 0.20 -0.47 119.66 125.57 3k2b s GLN 245 Ca 0.11 -0.54 0.05 0.00 0.05 0.00 0.00 55.36 55.04 3k2b s GLN 245 Cb -0.00 -3.28 -0.02 0.00 1.10 0.00 0.00 33.01 30.81 3k2b s GLN 245 CO 0.01 -0.22 0.46 0.14 -0.55 0.00 0.00 175.29 175.13 3k2b s VAL 246 N 1.58 4.51 -0.14 1.34 -7.23 -0.25 -0.79 120.40 119.43 3k2b s VAL 246 Ca 0.06 -0.92 -0.23 0.00 -1.81 0.00 0.00 61.98 59.08 3k2b s VAL 246 Cb -0.15 -3.59 -0.21 0.00 0.56 0.00 0.00 36.38 32.99 3k2b s VAL 246 CO 0.02 -0.25 0.60 0.28 -0.31 0.00 0.00 175.10 175.44 3k2b h SER 247 N 0.93 0.00 -3.40 4.85 0.02 0.13 -3.45 113.55 112.64 3k2b h SER 247 Ca -0.48 -0.79 -0.54 0.00 -0.84 0.00 0.00 61.79 59.14 3k2b h SER 247 Cb 1.25 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 3k2b h SER 247 CO 0.56 0.93 0.39 -0.75 -1.14 0.00 0.00 176.83 176.82 3k2b s LYS 248 N -2.11 4.55 0.23 3.45 2.20 -0.67 -5.01 119.74 122.37 3k2b s LYS 248 Ca -0.16 1.43 -0.30 0.00 -0.36 0.00 0.00 55.97 56.58 3k2b s LYS 248 Cb -0.02 -3.46 -0.09 0.00 -1.51 0.00 0.00 37.83 32.75 3k2b s LYS 248 CO 0.56 -0.07 1.27 0.15 -0.36 0.00 0.00 175.35 176.90 3k2b s LYS 249 N 1.07 4.43 0.14 4.03 1.02 -1.26 -4.86 119.74 124.30 3k2b s LYS 249 Ca 0.52 2.02 0.01 0.00 0.02 0.00 0.00 55.97 58.54 3k2b s LYS 249 Cb -0.21 -3.18 -0.00 0.00 -0.52 0.00 0.00 37.83 33.92 3k2b s LYS 249 CO 0.27 -0.16 0.16 -2.37 -0.92 0.00 0.00 175.35 172.34 3k2b n THR 250 N 2.11 0.00 -3.93 2.17 5.66 0.26 -5.02 114.28 115.53 3k2b n THR 250 Ca 0.04 -0.83 -0.09 0.00 -3.05 0.00 0.00 64.05 60.11 3k2b n THR 250 Cb 0.43 0.46 -0.09 0.00 -1.55 0.00 0.00 70.33 69.58 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 -3.46 0.20 0.19 1.09 -0.71 -1.26 -4.57 117.98 109.46 3k2b s PHE 251 Ca 0.14 -0.49 -0.10 0.00 -1.04 0.00 0.00 56.93 55.44 3k2b s PHE 251 Cb 0.00 -0.14 0.27 0.00 -1.21 0.00 0.00 43.02 41.94 3k2b s PHE 251 CO 0.10 -0.36 1.18 0.00 -1.34 0.00 0.00 175.22 174.80 3k2b n ALA 252 N 0.82 0.05 -0.36 1.99 0.00 -1.26 -0.63 120.51 121.11 3k2b n ALA 252 Ca -0.19 0.79 -0.01 0.00 0.00 0.00 0.00 53.44 54.03 3k2b n ALA 252 Cb 0.58 -0.42 0.13 0.00 0.00 0.00 0.00 19.45 19.74 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 1.28 -0.66 0.00 3.07 -1.96 -2.29 114.58 114.02 3k2b h GLU 253 Ca 0.31 -0.08 -0.08 0.00 -0.50 0.00 0.00 59.36 59.02 3k2b h GLU 253 Cb 0.50 -0.29 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 3k2b h GLU 253 CO -0.76 0.85 0.11 1.49 -1.40 0.00 0.00 179.01 179.29 3k2b h GLU 254 N 1.32 1.09 0.33 2.33 4.81 -1.29 -1.68 114.58 121.49 3k2b h GLU 254 Ca 0.36 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3k2b h GLU 254 Cb -0.13 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.12 3k2b h GLU 254 CO -0.08 1.00 -0.16 0.28 -0.73 0.00 0.00 179.01 179.31 3k2b h VAL 255 N 1.02 0.68 -0.38 0.32 2.07 -1.17 -2.17 116.25 116.62 3k2b h VAL 255 Ca 0.20 -0.39 0.07 0.00 0.82 0.00 0.00 66.70 67.41 3k2b h VAL 255 Cb 0.43 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 31.02 3k2b h VAL 255 CO 0.01 0.08 -0.06 0.78 0.02 0.00 0.00 177.57 178.40 3k2b h ASN 256 N -0.67 -0.28 -0.82 0.57 -0.26 -1.39 -1.13 115.58 111.61 3k2b h ASN 256 Ca -0.05 0.10 0.16 0.00 -0.56 0.00 0.00 56.30 55.96 3k2b h ASN 256 Cb 0.47 0.21 -0.10 0.00 -1.06 0.00 0.00 38.32 37.84 3k2b h ASN 256 CO 0.08 -0.09 0.37 0.00 -1.06 0.00 0.00 177.43 176.72 3k2b h ALA 257 N 1.36 1.21 -0.78 -0.83 0.00 -1.23 0.16 119.26 119.16 3k2b h ALA 257 Ca 0.19 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 3k2b h ALA 257 Cb 0.28 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3k2b h ALA 257 CO -0.36 -0.18 0.47 0.00 0.00 0.00 0.00 179.25 179.17 3k2b h ALA 258 N 1.58 0.99 -0.12 0.00 0.00 -0.55 0.02 119.26 121.18 3k2b h ALA 258 Ca 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 3k2b h ALA 258 Cb 0.71 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3k2b h ALA 258 CO -0.41 0.46 0.05 0.74 0.00 0.00 0.00 179.25 180.09 3k2b h PHE 259 N 1.07 0.19 -0.89 0.00 0.04 -0.11 0.42 116.94 117.65 3k2b h PHE 259 Ca 0.28 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 61.08 3k2b h PHE 259 Cb -0.04 -0.06 -0.06 0.00 2.20 0.00 0.00 35.95 38.00 3k2b h PHE 259 CO -0.01 0.28 0.57 0.00 -0.60 0.00 0.00 178.31 178.55 3k2b h ARG 260 N 0.04 1.04 0.60 1.51 3.08 -0.76 1.08 114.38 120.97 3k2b h ARG 260 Ca 0.04 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 3k2b h ARG 260 Cb 0.17 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3k2b h ARG 260 CO -0.00 0.69 -0.44 -0.44 -1.07 0.00 0.00 179.97 178.70 3k2b h ASP 261 N 1.07 -1.15 -0.94 7.04 3.45 -0.49 -0.81 116.42 124.59 3k2b h ASP 261 Ca 0.37 0.08 0.06 0.00 0.43 0.00 0.00 57.03 57.97 3k2b h ASP 261 Cb 0.08 0.35 -0.06 0.00 -0.56 0.00 0.00 39.33 39.14 3k2b h ASP 261 CO -0.14 -0.64 0.60 0.28 -1.57 0.00 0.00 179.24 177.76 3k2b h SER 262 N -1.00 0.95 -0.85 6.45 0.02 -0.40 -1.61 113.55 117.12 3k2b h SER 262 Ca -0.07 0.01 0.18 0.00 -0.84 0.00 0.00 61.79 61.06 3k2b h SER 262 Cb 0.84 -0.19 -0.06 0.00 0.14 0.00 0.00 62.40 63.12 3k2b h SER 262 CO 0.03 0.61 0.56 0.00 -1.14 0.00 0.00 176.83 176.89 3k2b h ALA 263 N 1.43 2.13 -0.00 3.77 0.00 0.20 -0.06 119.26 126.72 3k2b h ALA 263 Ca 0.40 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3k2b h ALA 263 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3k2b h ALA 263 CO -0.17 -0.38 -0.49 0.39 0.00 0.00 0.00 179.25 178.60 3k2b n GLU 264 N -4.50 0.38 0.00 0.00 -0.58 -0.38 -3.56 120.64 111.99 3k2b n GLU 264 Ca 0.17 -0.25 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 3k2b n GLU 264 Cb 0.61 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 3k2b n GLU 264 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3k2b n LYS 265 N -1.10 0.00 0.12 3.49 4.81 -0.12 -4.80 118.16 120.56 3k2b n LYS 265 Ca 0.08 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.54 3k2b n LYS 265 Cb 0.35 0.00 0.37 0.00 0.02 0.00 0.00 35.03 35.77 3k2b n LYS 265 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 3k2b h GLU 266 N 0.00 0.22 -0.35 1.64 4.11 -1.79 -2.99 114.58 115.41 3k2b h GLU 266 Ca 0.00 -0.06 -0.04 0.00 0.07 0.00 0.00 59.36 59.33 3k2b h GLU 266 Cb 0.00 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3k2b h GLU 266 CO 0.00 0.39 0.02 1.28 0.07 0.00 0.00 179.01 180.77 3k2b n LEU 267 N -4.24 4.33 -4.68 3.06 4.77 -0.66 -4.99 117.00 114.59 3k2b n LEU 267 Ca -0.01 -3.12 -0.51 0.00 -0.03 0.00 0.00 56.01 52.35 3k2b n LEU 267 Cb 0.30 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.74 3k2b n LEU 267 CO 0.38 0.75 1.33 1.17 -1.33 0.00 0.00 177.39 179.69 3k2b n LYS 268 N -0.43 1.76 0.00 3.23 3.00 -1.13 0.19 118.16 124.78 3k2b n LYS 268 Ca 0.25 0.64 0.00 0.00 -0.00 0.00 0.00 58.31 59.21 3k2b n LYS 268 Cb 0.99 -2.41 0.00 0.00 0.00 0.00 0.00 35.03 33.62 3k2b n LYS 268 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2b n GLY 269 N 3.96 2.30 0.07 3.14 0.00 -1.26 -4.79 105.19 108.62 3k2b n GLY 269 Ca 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 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 0.85 -4.91 -0.61 -0.00 0.13 -4.51 119.36 108.31 3k2b n ILE 270 Ca 0.00 -0.39 -0.28 0.00 -0.00 0.00 0.00 62.75 62.07 3k2b n ILE 270 Cb 0.00 -0.91 -0.15 0.00 -0.00 0.00 0.00 39.64 38.58 3k2b n ILE 270 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 3k2b s LEU 271 N -5.53 2.13 0.06 1.39 2.96 0.39 -1.52 118.68 118.56 3k2b s LEU 271 Ca -0.15 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.22 3k2b s LEU 271 Cb 0.05 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 3k2b s LEU 271 CO 0.40 0.24 0.01 -0.62 -1.32 0.00 0.00 176.35 175.05 3k2b s ASP 272 N -1.00 0.43 -0.10 3.68 3.68 -0.05 -4.59 116.67 118.71 3k2b s ASP 272 Ca 0.10 -0.97 0.02 0.00 2.13 0.00 0.00 52.55 53.83 3k2b s ASP 272 Cb -0.09 0.23 0.01 0.00 -1.45 0.00 0.00 42.92 41.61 3k2b s ASP 272 CO 0.01 -0.63 -0.16 -0.69 0.13 0.00 0.00 175.17 173.83 3k2b s VAL 273 N -3.92 1.55 -0.21 1.11 1.01 -1.26 0.76 120.40 119.43 3k2b s VAL 273 Ca 0.08 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 3k2b s VAL 273 Cb 0.08 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 3k2b s VAL 273 CO -0.09 0.45 0.06 0.00 0.00 0.00 0.00 175.10 175.51 3k2b n ASP 275 N 4.24 2.09 -4.93 0.00 8.00 -1.26 -2.51 116.55 122.18 3k2b n ASP 275 Ca -0.16 -1.54 -0.29 0.00 0.71 0.00 0.00 54.79 53.50 3k2b n ASP 275 Cb 0.52 0.40 -0.04 0.00 -0.02 0.00 0.00 41.12 41.98 3k2b n ASP 275 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3k2b s GLU 276 N -2.42 3.44 -1.15 -1.24 -1.05 -1.26 -4.88 118.70 110.14 3k2b s GLU 276 Ca 0.20 -0.49 -0.23 0.00 -0.15 0.00 0.00 54.97 54.30 3k2b s GLU 276 Cb 0.18 -3.01 -0.07 0.00 -0.44 0.00 0.00 34.13 30.79 3k2b s GLU 276 CO 0.54 0.58 1.92 -1.25 0.95 0.00 0.00 175.26 177.99 3k2b s PRO 277 N -2.77 2.62 0.44 -4.83 0.04 -1.26 -4.94 135.00 124.29 3k2b s PRO 277 Ca 0.35 -1.09 0.08 0.00 0.04 0.00 0.00 61.00 60.38 3k2b s PRO 277 Cb -0.12 -5.24 0.02 0.00 0.04 0.00 0.00 34.50 29.20 3k2b s PRO 277 CO 0.28 -3.75 0.59 -0.51 0.04 0.00 0.00 177.00 173.65 3k2b s LEU 278 N 10.34 3.60 0.36 -3.56 1.43 -1.26 -5.14 118.68 124.46 3k2b s LEU 278 Ca 0.67 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 53.38 3k2b s LEU 278 Cb -0.01 -2.55 -0.07 0.00 0.03 0.00 0.00 46.19 43.59 3k2b s LEU 278 CO 0.10 -0.82 -0.02 0.68 0.23 0.00 0.00 176.35 176.53 3k2b s VAL 279 N -2.38 1.86 0.32 -1.59 -7.23 -1.26 -5.04 120.40 105.08 3k2b s VAL 279 Ca 0.56 -2.07 0.09 0.00 -1.81 0.00 0.00 61.98 58.74 3k2b s VAL 279 Cb -0.09 -2.79 0.32 0.00 0.56 0.00 0.00 36.38 34.38 3k2b s VAL 279 CO 0.34 -0.10 1.65 0.77 -0.31 0.00 0.00 175.10 177.45 3k2b h SER 280 N 1.97 0.27 -0.52 4.85 4.64 -1.98 -0.84 113.55 121.95 3k2b h SER 280 Ca -0.42 0.20 -0.05 0.00 -0.47 0.00 0.00 61.79 61.04 3k2b h SER 280 Cb 1.24 0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 63.51 3k2b h SER 280 CO 0.74 -0.15 0.15 1.62 -0.87 0.00 0.00 176.83 178.33 3k2b h VAL 281 N 0.27 1.23 0.00 0.95 3.04 -1.96 -2.18 116.25 117.59 3k2b h VAL 281 Ca 0.65 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 3k2b h VAL 281 Cb 1.43 0.63 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 3k2b h VAL 281 CO -0.64 0.31 0.17 0.44 -1.01 0.00 0.00 177.57 176.84 3k2b h ASP 282 N 0.84 0.00 -0.63 3.17 3.32 -1.55 -0.21 116.42 121.36 3k2b h ASP 282 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3k2b h ASP 282 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3k2b h ASP 282 CO -0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 3k2b n PHE 283 N -2.48 0.89 -2.26 4.55 3.72 -0.82 -4.94 117.46 116.13 3k2b n PHE 283 Ca -0.02 -0.43 -0.41 0.00 -0.05 0.00 0.00 57.45 56.54 3k2b n PHE 283 Cb 0.21 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 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 -1.23 4.43 -0.63 -1.08 0.52 -0.09 -2.87 118.95 118.00 3k2b s ARG 284 Ca 0.42 2.02 0.00 0.00 -0.52 0.00 0.00 55.73 57.66 3k2b s ARG 284 Cb 0.23 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.52 3k2b s ARG 284 CO 0.28 -0.15 0.00 0.00 0.02 0.00 0.00 175.30 175.45 3k2b s SER 286 N -2.91 7.06 0.00 0.00 0.15 -1.14 -4.89 113.70 111.97 3k2b s SER 286 Ca 0.00 1.81 0.26 0.00 0.70 0.00 0.00 55.95 58.72 3k2b s SER 286 Cb 0.00 -2.56 1.45 0.00 -1.71 0.00 0.00 66.02 63.20 3k2b s SER 286 CO 0.00 -0.57 1.90 0.47 1.20 0.00 0.00 173.24 176.24 3k2b n ASP 287 N 5.13 0.00 -4.84 5.45 8.00 -1.26 -4.02 116.55 125.01 3k2b n ASP 287 Ca 0.11 -0.51 -0.34 0.00 0.71 0.00 0.00 54.79 54.76 3k2b n ASP 287 Cb 0.46 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.38 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 -2.24 3.49 -0.15 1.24 0.40 -1.26 -4.83 117.98 114.64 3k2b s PHE 288 Ca 0.33 1.16 0.15 0.00 -0.60 0.00 0.00 56.93 57.98 3k2b s PHE 288 Cb 0.18 -2.47 0.01 0.00 0.51 0.00 0.00 43.02 41.24 3k2b s PHE 288 CO 0.34 0.25 1.27 0.77 0.70 0.00 0.00 175.22 178.55 3k2b h SER 289 N 2.84 0.00 -2.94 1.36 0.02 -1.55 -3.42 113.55 109.86 3k2b h SER 289 Ca -0.48 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.35 3k2b h SER 289 Cb 1.18 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 63.44 3k2b h SER 289 CO 0.66 0.52 -0.36 0.28 -1.14 0.00 0.00 176.83 176.79 3k2b s THR 290 N -2.96 -0.29 -0.25 -2.27 -1.32 -1.11 -3.79 115.64 103.66 3k2b s THR 290 Ca 0.02 0.14 0.02 0.00 -1.21 0.00 0.00 61.69 60.66 3k2b s THR 290 Cb 0.08 -0.60 0.06 0.00 -1.51 0.00 0.00 72.50 70.53 3k2b s THR 290 CO 0.76 0.06 -0.08 -0.89 -2.21 0.00 0.00 174.62 172.27 3k2b s THR 291 N 1.94 1.79 0.39 5.08 2.01 -0.69 -0.87 115.64 125.29 3k2b s THR 291 Ca -0.06 -1.40 -0.26 0.00 0.31 0.00 0.00 61.69 60.29 3k2b s THR 291 Cb -0.10 -2.00 -0.09 0.00 0.01 0.00 0.00 72.50 70.32 3k2b s THR 291 CO -0.12 -0.08 1.16 -0.63 -0.69 0.00 0.00 174.62 174.26 3k2b s ILE 292 N 1.27 3.21 -1.02 1.82 -1.09 0.23 -0.17 121.20 125.45 3k2b s ILE 292 Ca -0.07 1.03 -0.04 0.00 -2.23 0.00 0.00 60.65 59.33 3k2b s ILE 292 Cb -0.19 -3.58 0.28 0.00 -1.58 0.00 0.00 42.46 37.38 3k2b s ILE 292 CO -0.06 0.11 1.17 -0.67 -1.23 0.00 0.00 174.94 174.26 3k2b n ASP 293 N 0.17 5.50 -0.22 3.58 -0.08 -0.13 0.10 116.55 125.49 3k2b n ASP 293 Ca 0.04 -3.24 0.12 0.00 -1.51 0.00 0.00 54.79 50.20 3k2b n ASP 293 Cb 0.46 -1.22 0.23 0.00 2.34 0.00 0.00 41.12 42.94 3k2b n ASP 293 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3k2b n SER 294 N 1.90 -0.00 0.00 1.67 3.41 -1.05 -0.13 113.62 119.42 3k2b n SER 294 Ca 0.25 1.07 0.09 0.00 -0.26 0.00 0.00 58.87 60.02 3k2b n SER 294 Cb 0.36 -0.42 0.49 0.00 -0.26 0.00 0.00 64.21 64.38 3k2b n SER 294 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k2b n SER 295 N -4.73 0.00 0.01 4.04 3.41 -1.26 -2.52 113.62 112.56 3k2b n SER 295 Ca 0.17 -0.03 0.11 0.00 -0.26 0.00 0.00 58.87 58.86 3k2b n SER 295 Cb 0.57 -0.26 -0.13 0.00 -0.26 0.00 0.00 64.21 64.12 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 -1.26 0.23 -4.64 1.04 4.77 0.81 -4.96 117.00 112.99 3k2b n LEU 296 Ca 0.09 0.00 -0.48 0.00 -0.03 0.00 0.00 56.01 55.59 3k2b n LEU 296 Cb 0.14 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 3k2b n LEU 296 CO 0.14 -0.00 1.05 0.41 -1.33 0.00 0.00 177.39 177.66 3k2b n THR 297 N -2.24 0.11 -4.09 -5.08 -1.04 -1.05 -4.87 114.28 96.02 3k2b n THR 297 Ca -0.03 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.05 61.85 3k2b n THR 297 Cb 0.54 -1.23 -0.11 0.00 -1.82 0.00 0.00 70.33 67.71 3k2b n THR 297 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 3k2b s MET 298 N 0.60 0.60 -0.07 -2.82 -1.94 -0.68 -4.84 119.30 110.15 3k2b s MET 298 Ca 0.80 -0.97 -0.01 0.00 -1.71 0.00 0.00 55.69 53.79 3k2b s MET 298 Cb -0.79 -0.15 0.03 0.00 2.01 0.00 0.00 34.83 35.93 3k2b s MET 298 CO 0.43 -0.00 0.00 0.08 -0.01 0.00 0.00 175.02 175.52 3k2b s VAL 299 N -2.39 0.36 -0.27 -6.03 1.01 -1.26 -0.47 120.40 111.35 3k2b s VAL 299 Ca -0.02 0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 3k2b s VAL 299 Cb -0.03 -0.51 0.03 0.00 0.00 0.00 0.00 36.38 35.87 3k2b s VAL 299 CO -0.03 0.25 -0.04 -0.32 0.00 0.00 0.00 175.10 174.97 3k2b s MET 300 N 1.94 2.72 0.00 2.72 0.00 -0.48 -4.61 119.30 121.58 3k2b s MET 300 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 55.69 54.67 3k2b s MET 300 Cb -0.12 -3.06 0.00 0.00 0.00 0.00 0.00 34.83 31.65 3k2b s MET 300 CO -0.05 -0.47 0.00 0.41 0.00 0.00 0.00 175.02 174.91 3k2b n GLY 301 N 4.66 0.61 4.23 2.11 0.00 -1.26 -2.82 105.19 112.73 3k2b n GLY 301 Ca -0.15 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 1.69 0.00 0.00 1.61 8.00 -1.26 -4.52 116.55 122.07 3k2b n ASP 302 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3k2b n ASP 302 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 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 0.95 0.50 -4.28 -2.24 5.75 -1.26 -0.57 116.55 115.40 3k2b n ASP 303 Ca 0.00 -1.24 -0.44 0.00 -0.01 0.00 0.00 54.79 53.10 3k2b n ASP 303 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 3k2b n ASP 303 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3k2b s MET 304 N -0.24 3.09 0.07 0.11 1.75 -1.13 -1.09 119.30 121.87 3k2b s MET 304 Ca 0.00 -2.11 -0.21 0.00 -1.25 0.00 0.00 55.69 52.12 3k2b s MET 304 Cb 0.00 -4.22 -0.07 0.00 2.84 0.00 0.00 34.83 33.38 3k2b s MET 304 CO 0.00 -1.27 0.63 0.08 -0.65 0.00 0.00 175.02 173.80 3k2b s VAL 305 N 0.81 4.70 -0.18 10.11 1.01 0.38 -1.39 120.40 135.85 3k2b s VAL 305 Ca 0.11 1.34 0.01 0.00 0.00 0.00 0.00 61.98 63.44 3k2b s VAL 305 Cb -0.20 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.24 3k2b s VAL 305 CO -0.03 0.51 -0.13 -0.75 0.00 0.00 0.00 175.10 174.69 3k2b s LYS 306 N -0.84 2.29 0.12 2.72 2.20 0.38 -0.66 119.74 125.95 3k2b s LYS 306 Ca 0.31 -0.76 0.10 0.00 -0.36 0.00 0.00 55.97 55.26 3k2b s LYS 306 Cb -0.20 -2.34 -0.04 0.00 -1.51 0.00 0.00 37.83 33.74 3k2b s LYS 306 CO 0.20 -0.33 -0.24 0.08 -0.36 0.00 0.00 175.35 174.70 3k2b s VAL 307 N 1.40 2.01 -0.05 4.02 1.01 0.40 -1.68 120.40 127.50 3k2b s VAL 307 Ca 0.02 -1.66 0.02 0.00 0.00 0.00 0.00 61.98 60.36 3k2b s VAL 307 Cb -0.15 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.45 3k2b s VAL 307 CO -0.10 0.03 -0.10 -0.63 0.00 0.00 0.00 175.10 174.30 3k2b s ILE 308 N -1.10 0.96 -0.01 2.22 1.01 -1.26 -1.16 121.20 121.86 3k2b s ILE 308 Ca 0.11 -0.39 0.02 0.00 0.00 0.00 0.00 60.65 60.38 3k2b s ILE 308 Cb -0.10 -0.88 -0.00 0.00 0.01 0.00 0.00 42.46 41.48 3k2b s ILE 308 CO 0.05 0.31 -0.07 0.00 0.00 0.00 0.00 174.94 175.23 3k2b s ALA 309 N 0.59 0.60 0.31 9.38 0.00 -1.07 -0.95 121.76 130.62 3k2b s ALA 309 Ca -0.11 -0.28 0.06 0.00 0.00 0.00 0.00 51.96 51.62 3k2b s ALA 309 Cb -0.14 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 3k2b s ALA 309 CO 0.02 0.13 0.44 -1.58 0.00 0.00 0.00 175.76 174.78 3k2b s TRP 310 N -0.07 3.25 -0.25 0.00 0.52 0.77 -1.87 118.94 121.29 3k2b s TRP 310 Ca 0.01 -0.11 -0.27 0.00 0.02 0.00 0.00 56.10 55.76 3k2b s TRP 310 Cb -0.04 -1.85 0.14 0.00 -1.15 0.00 0.00 33.47 30.58 3k2b s TRP 310 CO -0.00 0.14 1.14 1.52 0.02 0.00 0.00 176.95 179.77 3k2b s TYR 311 N -2.12 -0.32 -0.75 -1.98 1.13 -0.66 -1.70 117.35 110.95 3k2b s TYR 311 Ca 0.41 0.70 -0.23 0.00 -1.41 0.00 0.00 57.07 56.54 3k2b s TYR 311 Cb -0.09 0.42 0.07 0.00 -1.10 0.00 0.00 41.96 41.26 3k2b s TYR 311 CO 0.31 -0.20 1.09 0.34 -2.51 0.00 0.00 175.55 174.58 3k2b s ASP 312 N -0.30 6.28 0.23 -0.18 -1.08 -1.26 -0.48 116.67 119.89 3k2b s ASP 312 Ca 0.03 -1.14 -0.07 0.00 -0.52 0.00 0.00 52.55 50.85 3k2b s ASP 312 Cb -0.03 -2.45 0.40 0.00 -1.46 0.00 0.00 42.92 39.37 3k2b s ASP 312 CO -0.06 -1.44 1.67 -0.55 0.52 0.00 0.00 175.17 175.30 3k2b h ASN 313 N 9.53 -0.16 0.00 -0.34 -1.07 -1.91 0.17 115.58 121.79 3k2b h ASN 313 Ca -0.16 0.16 0.00 0.00 0.07 0.00 0.00 56.30 56.37 3k2b h ASN 313 Cb 1.05 0.25 0.00 0.00 -2.07 0.00 0.00 38.32 37.56 3k2b h ASN 313 CO 1.21 -0.09 0.00 -0.62 0.07 0.00 0.00 177.43 177.99 3k2b n GLU 314 N -5.24 0.00 -0.29 4.14 1.02 -1.26 -3.04 120.64 115.97 3k2b n GLU 314 Ca 0.12 0.30 -0.05 0.00 -0.02 0.00 0.00 57.16 57.51 3k2b n GLU 314 Cb 0.43 -1.13 0.07 0.00 -0.02 0.00 0.00 31.44 30.78 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 0.00 1.06 0.34 -0.32 2.91 -1.93 -1.79 115.95 116.22 3k2b h TRP 315 Ca 0.00 -0.02 -0.02 0.00 1.13 0.00 0.00 58.89 59.98 3k2b h TRP 315 Cb 0.00 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.31 3k2b h TRP 315 CO 0.09 0.74 -0.16 0.78 -1.03 0.00 0.00 178.44 178.86 3k2b h GLY 316 N 1.08 -0.48 0.22 2.65 0.00 -0.80 -1.83 103.07 103.91 3k2b h GLY 316 Ca 0.28 0.18 0.09 0.00 0.00 0.00 0.00 47.33 47.87 3k2b h GLY 316 CO -0.05 -0.17 0.00 -1.82 0.00 0.00 0.00 176.54 174.50 3k2b h TYR 317 N -0.64 -0.02 -0.86 5.60 3.20 -1.48 -1.26 116.97 121.51 3k2b h TYR 317 Ca -0.05 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.92 3k2b h TYR 317 Cb 0.46 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 3k2b h TYR 317 CO -0.01 -0.10 0.56 0.77 -1.64 0.00 0.00 178.16 177.74 3k2b h SER 318 N 0.12 0.86 -0.82 -2.11 0.02 -1.23 -0.19 113.55 110.20 3k2b h SER 318 Ca 0.24 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 3k2b h SER 318 Cb 0.35 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 3k2b h SER 318 CO -0.39 0.56 0.46 1.56 -1.14 0.00 0.00 176.83 177.87 3k2b h GLN 319 N 0.98 1.15 0.00 3.45 1.08 -0.36 -0.39 115.11 121.02 3k2b h GLN 319 Ca 0.36 -0.13 -0.07 0.00 -1.45 0.00 0.00 58.65 57.37 3k2b h GLN 319 Cb 0.17 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 3k2b h GLN 319 CO -0.13 0.84 -0.31 0.00 -0.95 0.00 0.00 178.83 178.28 3k2b h ARG 320 N 1.16 0.00 -0.20 1.46 2.47 -0.57 -1.39 114.38 117.30 3k2b h ARG 320 Ca 0.29 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.81 3k2b h ARG 320 Cb 0.02 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.35 3k2b h ARG 320 CO -0.05 0.31 -0.69 0.28 0.56 0.00 0.00 179.97 180.39 3k2b h VAL 321 N 0.00 1.28 -0.22 2.04 2.07 0.38 -0.50 116.25 121.29 3k2b h VAL 321 Ca -0.00 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.63 3k2b h VAL 321 Cb 0.76 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 3k2b h VAL 321 CO 0.04 0.60 0.11 0.58 0.02 0.00 0.00 177.57 178.92 3k2b h VAL 322 N 0.58 1.13 -0.93 2.57 2.07 -0.82 -1.50 116.25 119.34 3k2b h VAL 322 Ca -0.03 -0.37 0.10 0.00 0.82 0.00 0.00 66.70 67.22 3k2b h VAL 322 Cb 1.30 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 31.96 3k2b h VAL 322 CO 0.14 0.13 0.57 0.44 0.02 0.00 0.00 177.57 178.87 3k2b h ASP 323 N 0.24 0.84 0.16 0.57 3.32 -1.11 0.16 116.42 120.60 3k2b h ASP 323 Ca 0.08 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.04 3k2b h ASP 323 Cb 0.10 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 3k2b h ASP 323 CO -0.01 0.48 -0.46 0.25 -1.72 0.00 0.00 179.24 177.77 3k2b h LEU 324 N 0.94 0.39 -0.56 1.55 5.85 -0.77 -1.01 115.31 121.71 3k2b h LEU 324 Ca 0.45 -0.18 -0.16 0.00 0.84 0.00 0.00 57.88 58.83 3k2b h LEU 324 Cb 0.39 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3k2b h LEU 324 CO -0.24 0.80 -0.55 0.00 -0.34 0.00 0.00 178.44 178.10 3k2b h ALA 325 N 1.22 0.74 0.04 1.25 0.00 -0.26 -0.14 119.26 122.12 3k2b h ALA 325 Ca 0.02 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3k2b h ALA 325 Cb 0.93 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3k2b h ALA 325 CO 0.08 0.69 -0.02 -0.44 0.00 0.00 0.00 179.25 179.56 3k2b h ASP 326 N 0.38 -0.05 -0.58 0.00 3.32 -0.45 0.12 116.42 119.16 3k2b h ASP 326 Ca 0.01 -0.18 0.10 0.00 0.02 0.00 0.00 57.03 56.98 3k2b h ASP 326 Cb 1.08 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 40.56 3k2b h ASP 326 CO 0.10 0.15 0.14 0.40 -1.72 0.00 0.00 179.24 178.30 3k2b h ILE 327 N -0.25 0.68 -0.43 0.35 2.04 -1.01 0.81 117.51 119.71 3k2b h ILE 327 Ca -0.01 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3k2b h ILE 327 Cb 0.22 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 3k2b h ILE 327 CO 0.01 0.05 0.19 0.58 0.00 0.00 0.00 178.15 178.98 3k2b h VAL 328 N 0.28 1.19 0.00 1.67 2.07 -0.82 -2.62 116.25 118.02 3k2b h VAL 328 Ca 0.30 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3k2b h VAL 328 Cb 0.42 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3k2b h VAL 328 CO -0.37 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.43 3k2b n ALA 329 N -2.30 1.71 1.13 1.67 0.00 0.01 -2.70 120.51 120.03 3k2b n ALA 329 Ca 0.00 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.64 3k2b n ALA 329 Cb 0.13 -1.39 0.21 0.00 0.00 0.00 0.00 19.45 18.40 3k2b n ALA 329 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3k2b n ASN 330 N -2.23 1.28 -1.85 0.00 5.03 0.17 -3.85 115.26 113.81 3k2b n ASN 330 Ca 0.02 -1.03 -0.13 0.00 0.87 0.00 0.00 54.58 54.32 3k2b n ASN 330 Cb 0.24 0.31 0.06 0.00 -1.02 0.00 0.00 39.78 39.38 3k2b n ASN 330 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3k2b n ASN 331 N -0.60 3.57 -4.55 6.41 3.02 -1.10 -5.02 115.26 117.00 3k2b n ASN 331 Ca 0.10 -3.42 -0.41 0.00 -0.03 0.00 0.00 54.58 50.82 3k2b n ASN 331 Cb 0.38 -0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 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 -3.38 2.29 -2.30 3.10 -0.11 -1.23 -4.50 118.94 112.82 3k2b s TRP 332 Ca 0.44 -0.07 0.30 0.00 1.22 0.00 0.00 56.10 57.98 3k2b s TRP 332 Cb 0.39 -4.62 1.39 0.00 -1.50 0.00 0.00 33.47 29.12 3k2b s TRP 332 CO -0.00 -2.07 1.94 1.17 -4.62 0.00 0.00 176.95 173.36