#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b s LYS 0 N 0.00 4.00 0.17 0.00 1.02 -1.26 -5.04 119.74 118.63 3k2b s LYS 0 Ca 0.00 0.58 -0.30 0.00 0.02 0.00 0.00 55.97 56.26 3k2b s LYS 0 Cb 0.00 -2.67 -0.08 0.00 -0.52 0.00 0.00 37.83 34.56 3k2b s LYS 0 CO 0.00 0.31 1.27 -0.51 -0.92 0.00 0.00 175.35 175.50 3k2b s LEU 1 N -2.54 4.42 -0.17 3.17 1.02 -0.90 -4.82 118.68 118.85 3k2b s LEU 1 Ca 0.47 2.30 -0.23 0.00 0.02 0.00 0.00 54.13 56.69 3k2b s LEU 1 Cb -0.13 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.46 3k2b s LEU 1 CO 0.19 -0.48 0.72 -0.54 0.02 0.00 0.00 176.35 176.26 3k2b s LYS 2 N 0.06 4.27 -0.09 1.70 1.02 -1.26 -0.79 119.74 124.65 3k2b s LYS 2 Ca 0.56 0.81 0.02 0.00 0.02 0.00 0.00 55.97 57.39 3k2b s LYS 2 Cb -0.35 -3.56 -0.02 0.00 -0.52 0.00 0.00 37.83 33.38 3k2b s LYS 2 CO 0.36 -0.24 -0.14 0.08 -0.92 0.00 0.00 175.35 174.49 3k2b s VAL 3 N 1.89 3.05 -0.01 3.17 1.01 -1.00 -0.52 120.40 128.00 3k2b s VAL 3 Ca 0.34 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.68 3k2b s VAL 3 Cb -0.16 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 3k2b s VAL 3 CO 0.12 0.56 -0.20 0.00 0.00 0.00 0.00 175.10 175.58 3k2b s ALA 4 N -0.22 2.46 -0.26 5.51 0.00 -0.16 -1.56 121.76 127.53 3k2b s ALA 4 Ca 0.01 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 50.83 3k2b s ALA 4 Cb -0.13 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.26 3k2b s ALA 4 CO 0.03 0.55 -0.02 0.42 0.00 0.00 0.00 175.76 176.74 3k2b s ILE 5 N -0.75 3.23 -0.41 0.00 1.01 -0.34 0.17 121.20 124.10 3k2b s ILE 5 Ca 0.12 -0.88 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3k2b s ILE 5 Cb -0.10 -2.63 0.05 0.00 0.01 0.00 0.00 42.46 39.79 3k2b s ILE 5 CO 0.01 0.19 0.28 0.21 0.00 0.00 0.00 174.94 175.63 3k2b s ASN 6 N 1.39 5.88 0.00 3.58 2.47 -0.01 -0.97 114.94 127.28 3k2b s ASN 6 Ca 0.01 -1.18 0.00 0.00 0.42 0.00 0.00 52.86 52.12 3k2b s ASN 6 Cb -0.17 -2.08 0.00 0.00 -1.45 0.00 0.00 41.25 37.56 3k2b s ASN 6 CO -0.02 -0.49 0.00 0.61 -3.72 0.00 0.00 177.10 173.47 3k2b n GLY 7 N 5.06 0.32 2.54 1.21 0.00 -0.39 0.24 105.19 114.16 3k2b n GLY 7 Ca -0.11 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 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 0.32 2.51 -0.24 1.61 7.35 -1.25 -4.00 117.46 123.77 3k2b n PHE 8 Ca 0.00 -2.62 0.00 0.00 -0.76 0.00 0.00 57.45 54.07 3k2b n PHE 8 Cb 0.00 -1.60 0.00 0.00 0.35 0.00 0.00 39.48 38.23 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 1.11 1.80 0.23 7.13 0.00 -1.26 -4.61 105.19 109.58 3k2b n GLY 9 Ca 0.57 -1.75 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.48 -0.11 1.61 2.47 -1.93 -0.66 114.38 115.29 3k2b h ARG 10 Ca 0.00 0.03 -0.11 0.00 -1.26 0.00 0.00 59.98 58.65 3k2b h ARG 10 Cb 0.00 0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 3k2b h ARG 10 CO 0.00 -0.18 -0.41 0.82 0.56 0.00 0.00 179.97 180.76 3k2b h ILE 11 N -0.75 1.31 0.24 2.04 1.08 -1.91 -0.99 117.51 118.53 3k2b h ILE 11 Ca -0.05 -1.52 -0.01 0.00 -0.39 0.00 0.00 64.86 62.89 3k2b h ILE 11 Cb 0.51 1.68 0.00 0.00 -3.07 0.00 0.00 36.82 35.95 3k2b h ILE 11 CO 0.08 0.45 -0.11 1.23 -0.69 0.00 0.00 178.15 179.11 3k2b h GLY 12 N 1.22 -0.33 2.00 5.37 0.00 -1.68 -1.36 103.07 108.28 3k2b h GLY 12 Ca 0.02 0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.39 3k2b h GLY 12 CO 0.06 -0.12 -0.38 3.21 0.00 0.00 0.00 176.54 179.31 3k2b h ARG 13 N -0.43 0.00 -0.11 4.80 3.08 -1.04 -2.42 114.38 118.25 3k2b h ARG 13 Ca -0.03 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.86 3k2b h ARG 13 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 3k2b h ARG 13 CO 0.05 0.38 -0.61 -0.91 -1.07 0.00 0.00 179.97 177.82 3k2b h ASN 14 N 0.00 0.43 -0.42 7.04 2.35 -1.11 -2.74 115.58 121.13 3k2b h ASN 14 Ca -0.00 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.49 3k2b h ASN 14 Cb 0.79 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 3k2b h ASN 14 CO 0.05 0.93 0.21 0.15 -1.65 0.00 0.00 177.43 177.12 3k2b h PHE 15 N 0.28 0.59 0.14 1.19 3.57 -0.77 0.74 116.94 122.68 3k2b h PHE 15 Ca -0.01 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 3k2b h PHE 15 Cb 1.13 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.69 3k2b h PHE 15 CO 0.03 0.48 -0.07 1.25 -2.23 0.00 0.00 178.31 177.77 3k2b h LEU 16 N 0.54 -0.16 -2.13 0.59 6.46 -1.44 -0.41 115.31 118.75 3k2b h LEU 16 Ca 0.14 -0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 3k2b h LEU 16 Cb 0.10 0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 3k2b h LEU 16 CO -0.02 0.10 -0.05 0.03 -0.62 0.00 0.00 178.44 177.88 3k2b h ARG 17 N -0.42 0.00 0.25 1.25 3.08 -1.42 0.32 114.38 117.43 3k2b h ARG 17 Ca -0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3k2b h ARG 17 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3k2b h ARG 17 CO 0.03 0.05 -0.12 0.00 -1.07 0.00 0.00 179.97 178.86 3k2b h TRP 18 N -0.93 0.24 -0.48 0.00 7.01 -0.43 -1.16 115.95 120.19 3k2b h TRP 18 Ca -0.03 0.04 0.09 0.00 2.11 0.00 0.00 58.89 61.09 3k2b h TRP 18 Cb 0.49 -0.00 -0.07 0.00 -2.10 0.00 0.00 29.16 27.47 3k2b h TRP 18 CO 0.05 -0.05 0.03 1.25 -2.79 0.00 0.00 178.44 176.94 3k2b h HIS 18 N 0.27 0.03 0.00 2.65 2.76 -0.45 0.36 115.15 120.77 3k2b h HIS 18 Ca 0.35 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.56 3k2b h HIS 18 Cb 0.56 0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.57 3k2b h HIS 18 CO -0.25 -0.07 0.00 0.41 -1.30 0.00 0.00 177.93 176.71 3k2b n GLY 19 N -1.30 -0.65 3.82 5.26 0.00 -0.47 -4.82 105.19 107.03 3k2b n GLY 19 Ca 0.05 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.00 2.63 -0.39 1.61 1.81 0.12 -5.03 118.95 117.70 3k2b s ARG 20 Ca 0.25 0.83 -0.05 0.00 -1.72 0.00 0.00 55.73 55.04 3k2b s ARG 20 Cb 0.11 -1.96 0.09 0.00 -0.45 0.00 0.00 34.95 32.74 3k2b s ARG 20 CO 0.19 -1.28 0.18 0.15 -0.68 0.00 0.00 175.30 173.86 3k2b s LYS 21 N -5.09 2.32 -0.74 3.54 3.01 -1.26 -4.65 119.74 116.87 3k2b s LYS 21 Ca 0.59 -1.57 -0.00 0.00 -1.01 0.00 0.00 55.97 53.98 3k2b s LYS 21 Cb -0.14 -3.58 0.00 0.00 -1.01 0.00 0.00 37.83 33.10 3k2b s LYS 21 CO 0.55 -0.94 0.62 -0.25 0.51 0.00 0.00 175.35 175.84 3k2b n ASP 22 N 4.73 -2.19 -4.69 2.83 8.00 -1.26 -4.93 116.55 119.03 3k2b n ASP 22 Ca -0.07 -0.38 -0.44 0.00 0.71 0.00 0.00 54.79 54.61 3k2b n ASP 22 Cb 0.42 -3.33 -0.04 0.00 -0.02 0.00 0.00 41.12 38.15 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3k2b n SER 23 N -2.24 3.61 -0.01 -2.24 2.88 -1.26 -4.80 113.62 109.57 3k2b n SER 23 Ca -0.17 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 3k2b n SER 23 Cb 0.60 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 3k2b n SER 23 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3k2b n PRO 24 N 3.94 0.81 -4.52 -1.46 -0.02 -1.26 -4.76 135.00 127.74 3k2b n PRO 24 Ca 0.17 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.40 3k2b n PRO 24 Cb 0.32 -1.00 -0.10 0.00 -0.02 0.00 0.00 33.50 32.70 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 -0.99 2.68 -0.30 2.45 1.43 -1.26 -2.13 118.68 120.56 3k2b s LEU 25 Ca 0.00 -1.15 -0.02 0.00 -1.03 0.00 0.00 54.13 51.93 3k2b s LEU 25 Cb 0.00 -1.00 0.12 0.00 0.03 0.00 0.00 46.19 45.34 3k2b s LEU 25 CO 0.00 -0.15 0.23 -0.62 0.23 0.00 0.00 176.35 176.04 3k2b s ASP 26 N -3.57 2.46 -0.15 2.29 2.15 0.03 -4.84 116.67 115.04 3k2b s ASP 26 Ca 0.32 -1.12 -0.29 0.00 0.43 0.00 0.00 52.55 51.88 3k2b s ASP 26 Cb 0.01 0.11 -0.05 0.00 -0.30 0.00 0.00 42.92 42.69 3k2b s ASP 26 CO 0.16 -0.39 1.96 -0.63 -0.17 0.00 0.00 175.17 176.09 3k2b s ILE 27 N 2.11 3.22 -0.07 4.11 1.09 -1.26 -2.37 121.20 128.02 3k2b s ILE 27 Ca 0.10 0.25 0.01 0.00 -1.10 0.00 0.00 60.65 59.91 3k2b s ILE 27 Cb -0.15 -3.23 0.00 0.00 -1.06 0.00 0.00 42.46 38.01 3k2b s ILE 27 CO -0.30 -0.10 0.30 2.30 -0.10 0.00 0.00 174.94 177.04 3k2b n ILE 28 N 6.72 0.00 -3.65 2.92 -5.35 -0.60 -4.84 119.36 114.55 3k2b n ILE 28 Ca 0.24 -0.49 -0.15 0.00 -0.27 0.00 0.00 62.75 62.07 3k2b n ILE 28 Cb 0.44 1.01 -0.08 0.00 -1.74 0.00 0.00 39.64 39.27 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 -0.52 -1.31 0.11 -1.28 0.00 -1.18 -1.54 121.76 116.04 3k2b s ALA 29 Ca 0.01 1.02 0.06 0.00 0.00 0.00 0.00 51.96 53.05 3k2b s ALA 29 Cb 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 3k2b s ALA 29 CO 0.02 -0.30 -0.15 0.42 0.00 0.00 0.00 175.76 175.75 3k2b s ILE 30 N -0.86 1.31 -0.09 0.00 1.01 0.26 -1.20 121.20 121.63 3k2b s ILE 30 Ca -0.09 -1.61 -0.06 0.00 0.00 0.00 0.00 60.65 58.89 3k2b s ILE 30 Cb -0.03 -1.43 0.04 0.00 0.01 0.00 0.00 42.46 41.05 3k2b s ILE 30 CO 0.06 -0.35 0.22 0.21 0.00 0.00 0.00 174.94 175.08 3k2b s ASN 31 N -2.26 -0.23 -0.29 3.58 2.47 -0.14 -0.99 114.94 117.08 3k2b s ASN 31 Ca 0.06 0.46 -0.27 0.00 0.42 0.00 0.00 52.86 53.53 3k2b s ASN 31 Cb -0.06 0.38 0.19 0.00 -1.45 0.00 0.00 41.25 40.31 3k2b s ASN 31 CO 0.03 -0.13 1.41 -0.62 -3.72 0.00 0.00 177.10 174.06 3k2b s ASP 32 N 0.87 -0.03 -0.28 -4.21 -1.08 -1.15 -1.27 116.67 109.52 3k2b s ASP 32 Ca -0.06 0.05 -0.27 0.00 -0.52 0.00 0.00 52.55 51.75 3k2b s ASP 32 Cb -0.08 0.04 -0.29 0.00 -1.46 0.00 0.00 42.92 41.14 3k2b s ASP 32 CO -0.05 -0.02 1.70 0.35 0.52 0.00 0.00 175.17 177.67 3k2b n THR 33 N 0.94 0.67 0.00 1.71 -2.24 -1.26 -3.58 114.28 110.52 3k2b n THR 33 Ca -0.04 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 3k2b n THR 33 Cb 0.58 -2.10 0.00 0.00 -2.10 0.00 0.00 70.33 66.71 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 4.79 0.00 5.94 3.38 0.00 -1.26 -5.12 105.19 112.91 3k2b n GLY 34 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 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 -0.06 -2.03 0.17 -0.02 0.00 -1.23 -4.26 105.19 97.76 3k2b n GLY 36 Ca 0.00 -1.52 -0.03 0.00 0.00 0.00 0.00 46.02 44.47 3k2b n GLY 36 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3k2b h VAL 37 N 0.00 1.38 -0.09 1.61 -1.51 -1.88 -2.83 116.25 112.92 3k2b h VAL 37 Ca 0.00 -1.87 0.04 0.00 -1.23 0.00 0.00 66.70 63.64 3k2b h VAL 37 Cb 0.00 1.95 -0.06 0.00 -2.13 0.00 0.00 31.29 31.05 3k2b h VAL 37 CO 0.00 0.55 -0.40 0.50 -1.23 0.00 0.00 177.57 176.99 3k2b h LYS 38 N 0.12 -0.47 0.30 5.19 3.64 -1.97 -0.90 116.57 122.48 3k2b h LYS 38 Ca -0.00 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3k2b h LYS 38 Cb 1.01 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 3k2b h LYS 38 CO 0.08 -0.32 -0.14 1.96 -2.27 0.00 0.00 179.45 178.76 3k2b h GLN 39 N -0.49 -0.38 -1.13 1.90 7.50 -1.74 -2.68 115.11 118.09 3k2b h GLN 39 Ca 0.07 0.03 0.42 0.00 0.50 0.00 0.00 58.65 59.66 3k2b h GLN 39 Cb 0.62 0.09 -0.16 0.00 0.05 0.00 0.00 27.48 28.08 3k2b h GLN 39 CO -0.36 -0.19 0.67 0.00 -1.50 0.00 0.00 178.83 177.44 3k2b h ALA 40 N -0.98 2.36 0.00 3.87 0.00 -1.53 -0.72 119.26 122.26 3k2b h ALA 40 Ca -0.04 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3k2b h ALA 40 Cb 0.37 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3k2b h ALA 40 CO 0.07 -1.07 -0.05 1.03 0.00 0.00 0.00 179.25 179.23 3k2b h SER 41 N 0.08 0.00 -0.67 0.00 0.87 -1.24 -3.23 113.55 109.36 3k2b h SER 41 Ca 0.83 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 61.51 3k2b h SER 41 Cb 2.31 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 64.18 3k2b h SER 41 CO -0.62 0.51 0.20 -0.74 -0.53 0.00 0.00 176.83 175.65 3k2b h HIS 42 N -0.97 0.34 0.00 2.24 6.17 -1.07 -1.50 115.15 120.35 3k2b h HIS 42 Ca 0.00 0.04 -0.01 0.00 0.71 0.00 0.00 60.37 61.11 3k2b h HIS 42 Cb 0.05 -0.05 -0.00 0.00 2.52 0.00 0.00 27.41 29.93 3k2b h HIS 42 CO -0.02 0.01 -0.03 -0.07 0.71 0.00 0.00 177.93 178.52 3k2b h LEU 43 N 0.34 0.00 0.00 0.26 3.38 -1.33 -0.97 115.31 116.99 3k2b h LEU 43 Ca 0.36 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.23 3k2b h LEU 43 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3k2b h LEU 43 CO -0.41 0.03 -0.72 0.25 0.09 0.00 0.00 178.44 177.68 3k2b h LEU 44 N 0.00 0.00 0.12 1.67 5.85 -1.30 -3.34 115.31 118.30 3k2b h LEU 44 Ca -0.00 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.38 3k2b h LEU 44 Cb 0.60 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3k2b h LEU 44 CO 0.00 0.44 -1.82 0.50 -0.34 0.00 0.00 178.44 177.23 3k2b h LYS 45 N 0.00 0.26 -5.08 1.25 1.63 -1.09 -3.39 116.57 110.15 3k2b h LYS 45 Ca -0.04 -0.44 -0.66 0.00 -0.85 0.00 0.00 60.65 58.66 3k2b h LYS 45 Cb 1.37 0.16 -0.29 0.00 -0.60 0.00 0.00 32.23 32.88 3k2b h LYS 45 CO 0.05 1.12 -0.76 0.71 -3.45 0.00 0.00 179.45 177.12 3k2b s TYR 46 N -2.58 2.89 -0.11 1.91 2.02 -0.40 -1.23 117.35 119.85 3k2b s TYR 46 Ca -0.16 -1.01 -0.02 0.00 -0.37 0.00 0.00 57.07 55.51 3k2b s TYR 46 Cb 0.07 -2.01 0.04 0.00 -0.40 0.00 0.00 41.96 39.65 3k2b s TYR 46 CO 0.81 -0.53 0.01 0.34 -1.57 0.00 0.00 175.55 174.61 3k2b s ASP 47 N 1.21 2.02 0.64 2.29 -1.08 -0.97 -4.54 116.67 116.24 3k2b s ASP 47 Ca 0.02 -0.32 0.40 0.00 -0.52 0.00 0.00 52.55 52.13 3k2b s ASP 47 Cb -0.14 -0.51 2.23 0.00 -1.46 0.00 0.00 42.92 43.04 3k2b s ASP 47 CO -0.03 -0.22 2.33 0.28 0.52 0.00 0.00 175.17 178.04 3k2b h SER 48 N 8.29 0.00 0.00 -0.34 0.02 -1.95 0.18 113.55 119.76 3k2b h SER 48 Ca -0.19 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.30 3k2b h SER 48 Cb 1.12 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.60 3k2b h SER 48 CO 0.29 0.00 -2.51 0.41 -1.14 0.00 0.00 176.83 173.89 3k2b n THR 49 N -3.29 1.53 0.08 -2.27 -1.04 -1.26 -4.73 114.28 103.30 3k2b n THR 49 Ca -0.03 -0.37 -0.23 0.00 -2.04 0.00 0.00 64.05 61.38 3k2b n THR 49 Cb 0.08 -1.89 -0.15 0.00 -1.82 0.00 0.00 70.33 66.55 3k2b n THR 49 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3k2b h LEU 50 N -1.00 0.64 0.00 -4.42 3.38 -1.98 -3.50 115.31 108.42 3k2b h LEU 50 Ca -0.69 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.36 3k2b h LEU 50 Cb 1.60 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3k2b h LEU 50 CO -0.42 1.67 0.00 0.61 0.09 0.00 0.00 178.44 180.39 3k2b n GLY 51 N 1.76 -0.09 3.73 0.83 0.00 0.64 -5.00 105.19 107.05 3k2b n GLY 51 Ca -0.20 -2.26 -0.41 0.00 0.00 0.00 0.00 46.02 43.15 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 0.00 4.43 -0.21 -0.61 1.01 -1.26 -2.28 121.20 122.29 3k2b s ILE 52 Ca 0.00 2.06 -0.29 0.00 0.00 0.00 0.00 60.65 62.42 3k2b s ILE 52 Cb 0.00 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 38.13 3k2b s ILE 52 CO 0.00 0.35 1.49 0.12 0.00 0.00 0.00 174.94 176.90 3k2b s PHE 53 N -0.20 2.34 -1.28 3.97 5.36 -0.37 -4.91 117.98 122.89 3k2b s PHE 53 Ca 0.46 0.65 -0.19 0.00 -0.96 0.00 0.00 56.93 56.88 3k2b s PHE 53 Cb -0.24 -3.88 0.04 0.00 -0.34 0.00 0.00 43.02 38.61 3k2b s PHE 53 CO 0.30 -2.58 1.78 -3.47 -1.46 0.00 0.00 175.22 169.79 3k2b n ASP 54 N 7.78 4.59 -3.63 6.13 4.64 -1.26 -4.73 116.55 130.07 3k2b n ASP 54 Ca 0.17 -2.88 -0.03 0.00 -1.38 0.00 0.00 54.79 50.67 3k2b n ASP 54 Cb 0.45 -1.75 -0.01 0.00 -1.04 0.00 0.00 41.12 38.77 3k2b n ASP 54 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3k2b s ALA 55 N 5.45 -1.98 -0.46 -1.67 0.00 -1.26 -5.12 121.76 116.72 3k2b s ALA 55 Ca 0.57 0.82 -0.21 0.00 0.00 0.00 0.00 51.96 53.14 3k2b s ALA 55 Cb 0.03 0.33 0.03 0.00 0.00 0.00 0.00 23.12 23.51 3k2b s ALA 55 CO 0.09 -0.88 0.69 -0.51 0.00 0.00 0.00 175.76 175.15 3k2b s ASP 56 N -2.69 6.32 -0.58 0.00 -0.00 -1.26 -4.90 116.67 113.56 3k2b s ASP 56 Ca 0.11 -0.40 0.01 0.00 -0.00 0.00 0.00 52.55 52.27 3k2b s ASP 56 Cb 0.01 -2.33 0.15 0.00 -0.00 0.00 0.00 42.92 40.74 3k2b s ASP 56 CO -0.03 -0.86 0.36 -0.69 -0.00 0.00 0.00 175.17 173.95 3k2b s VAL 57 N 2.95 3.09 0.03 -1.27 1.01 -1.24 -0.76 120.40 124.21 3k2b s VAL 57 Ca 0.23 -3.26 0.08 0.00 0.00 0.00 0.00 61.98 59.02 3k2b s VAL 57 Cb -0.14 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 3k2b s VAL 57 CO 0.18 -0.85 -0.22 -1.59 0.00 0.00 0.00 175.10 172.62 3k2b s LYS 58 N -0.31 1.54 0.90 2.72 -2.85 -0.72 -4.90 119.74 116.12 3k2b s LYS 58 Ca 0.18 -0.95 -0.13 0.00 -1.00 0.00 0.00 55.97 54.07 3k2b s LYS 58 Cb -0.22 -1.64 0.03 0.00 -2.06 0.00 0.00 37.83 33.93 3k2b s LYS 58 CO -0.02 0.43 0.47 -2.30 0.10 0.00 0.00 175.35 174.03 3k2b n PRO 59 N 1.96 -0.17 -3.19 1.78 -0.02 -1.26 -0.02 135.00 134.08 3k2b n PRO 59 Ca -0.17 -0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.10 3k2b n PRO 59 Cb 0.53 -1.89 -0.05 0.00 -0.02 0.00 0.00 33.50 32.07 3k2b n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3k2b n SER 60 N -1.27 0.97 0.00 2.55 2.88 0.16 -4.47 113.62 114.44 3k2b n SER 60 Ca 0.08 -2.95 0.00 0.00 -1.33 0.00 0.00 58.87 54.67 3k2b n SER 60 Cb 0.53 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 3k2b n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3k2b n GLY 60 N 0.73 0.67 0.31 0.46 0.00 -1.26 -4.08 105.19 102.02 3k2b n GLY 60 Ca 0.24 -1.98 0.20 0.00 0.00 0.00 0.00 46.02 44.48 3k2b n GLY 60 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3k2b h GLU 61 N 0.00 0.00 -2.01 1.61 4.39 -2.02 -3.28 114.58 113.27 3k2b h GLU 61 Ca 0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 3k2b h GLU 61 Cb 0.00 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.25 3k2b h GLU 61 CO 0.00 0.00 -1.18 2.41 -1.16 0.00 0.00 179.01 179.08 3k2b n THR 62 N -2.92 -0.15 0.00 1.13 -1.04 -1.26 -4.72 114.28 105.32 3k2b n THR 62 Ca -0.03 -4.57 0.00 0.00 -2.04 0.00 0.00 64.05 57.42 3k2b n THR 62 Cb 0.11 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3k2b n ALA 63 N 0.35 0.00 -2.41 2.41 0.00 -1.24 -3.34 120.51 116.28 3k2b n ALA 63 Ca 0.25 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.51 3k2b n ALA 63 Cb 0.65 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.99 3k2b n ALA 63 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3k2b s ILE 64 N -2.00 1.41 -0.14 0.00 -5.25 -0.67 0.37 121.20 114.92 3k2b s ILE 64 Ca 0.00 -1.90 0.02 0.00 -0.99 0.00 0.00 60.65 57.78 3k2b s ILE 64 Cb 0.00 -1.72 0.01 0.00 2.95 0.00 0.00 42.46 43.70 3k2b s ILE 64 CO 0.00 -0.51 -0.20 -0.55 -1.79 0.00 0.00 174.94 171.89 3k2b s SER 65 N -2.79 3.30 -0.32 4.36 0.15 0.97 -0.94 113.70 118.43 3k2b s SER 65 Ca 0.14 -0.55 0.03 0.00 0.70 0.00 0.00 55.95 56.27 3k2b s SER 65 Cb -0.03 -1.48 0.09 0.00 -1.71 0.00 0.00 66.02 62.90 3k2b s SER 65 CO 0.03 0.09 0.03 -0.69 1.20 0.00 0.00 173.24 173.90 3k2b s VAL 66 N 0.77 2.12 -1.29 4.45 1.01 0.87 -1.76 120.40 126.57 3k2b s VAL 66 Ca -0.07 -2.14 -0.03 0.00 0.00 0.00 0.00 61.98 59.74 3k2b s VAL 66 Cb -0.16 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.72 3k2b s VAL 66 CO -0.00 -0.51 0.98 0.47 0.00 0.00 0.00 175.10 176.03 3k2b n ASP 67 N 4.34 -3.12 0.00 3.32 9.92 0.06 -2.23 116.55 128.83 3k2b n ASP 67 Ca 0.01 -0.66 0.00 0.00 -0.53 0.00 0.00 54.79 53.61 3k2b n ASP 67 Cb 0.42 -4.78 0.00 0.00 -0.64 0.00 0.00 41.12 36.12 3k2b n ASP 67 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3k2b n GLY 68 N -1.48 2.95 3.78 0.44 0.00 -1.26 -5.01 105.19 104.61 3k2b n GLY 68 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 3k2b n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k2b s LYS 69 N -0.21 4.60 -0.10 1.61 1.02 -0.95 -5.05 119.74 120.67 3k2b s LYS 69 Ca 0.00 1.26 -0.02 0.00 0.02 0.00 0.00 55.97 57.23 3k2b s LYS 69 Cb 0.00 -3.04 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 3k2b s LYS 69 CO 0.00 0.42 0.00 0.42 -0.92 0.00 0.00 175.35 175.28 3k2b s ILE 70 N -1.39 4.29 -0.09 2.17 1.09 -1.26 -0.09 121.20 125.93 3k2b s ILE 70 Ca 0.43 -0.25 0.02 0.00 -1.10 0.00 0.00 60.65 59.75 3k2b s ILE 70 Cb -0.21 -2.82 0.02 0.00 -1.06 0.00 0.00 42.46 38.39 3k2b s ILE 70 CO 0.26 0.58 -0.12 -0.63 -0.10 0.00 0.00 174.94 174.94 3k2b s ILE 71 N -0.67 1.20 0.01 2.92 1.01 -0.11 -4.85 121.20 120.70 3k2b s ILE 71 Ca 0.11 -0.48 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 3k2b s ILE 71 Cb -0.12 -1.12 -0.06 0.00 0.01 0.00 0.00 42.46 41.17 3k2b s ILE 71 CO 0.02 0.38 1.49 -1.10 0.00 0.00 0.00 174.94 175.73 3k2b s GLN 72 N 0.98 4.25 -0.67 2.79 -1.52 -0.59 -1.67 119.66 123.23 3k2b s GLN 72 Ca -0.08 2.07 -0.07 0.00 -1.95 0.00 0.00 55.36 55.33 3k2b s GLN 72 Cb -0.15 -3.63 0.17 0.00 -0.22 0.00 0.00 33.01 29.19 3k2b s GLN 72 CO -0.00 -0.65 0.53 0.08 -0.25 0.00 0.00 175.29 175.00 3k2b s VAL 73 N 2.66 4.40 0.73 1.09 1.01 -1.21 0.89 120.40 129.97 3k2b s VAL 73 Ca 0.67 -2.64 -0.06 0.00 0.00 0.00 0.00 61.98 59.95 3k2b s VAL 73 Cb -0.33 -3.81 0.09 0.00 0.00 0.00 0.00 36.38 32.32 3k2b s VAL 73 CO 0.28 -0.91 1.04 0.68 0.00 0.00 0.00 175.10 176.18 3k2b s VAL 74 N 0.21 2.24 -0.50 2.92 -7.23 -0.17 -4.59 120.40 113.29 3k2b s VAL 74 Ca 0.16 -0.31 0.07 0.00 -1.81 0.00 0.00 61.98 60.08 3k2b s VAL 74 Cb -0.18 -2.93 0.19 0.00 0.56 0.00 0.00 36.38 34.02 3k2b s VAL 74 CO -0.05 0.00 0.67 -0.55 -0.31 0.00 0.00 175.10 174.86 3k2b s SER 75 N -4.60 -1.00 -0.02 4.85 0.15 -1.26 -2.92 113.70 108.91 3k2b s SER 75 Ca 0.63 -1.92 -0.00 0.00 0.70 0.00 0.00 55.95 55.35 3k2b s SER 75 Cb -0.09 1.53 0.03 0.00 -1.71 0.00 0.00 66.02 65.78 3k2b s SER 75 CO 0.45 -0.07 0.04 0.21 1.20 0.00 0.00 173.24 175.07 3k2b s ASN 76 N 0.77 0.32 0.46 5.45 3.04 -1.26 -4.90 114.94 118.82 3k2b s ASN 76 Ca 0.30 0.05 0.21 0.00 0.04 0.00 0.00 52.86 53.46 3k2b s ASN 76 Cb 0.00 -0.09 1.10 0.00 -1.54 0.00 0.00 41.25 40.73 3k2b s ASN 76 CO -0.07 -0.16 1.95 0.03 -3.04 0.00 0.00 177.10 175.81 3k2b h ARG 77 N 7.55 0.00 -4.88 0.43 3.08 -1.98 -3.40 114.38 115.19 3k2b h ARG 77 Ca -0.38 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 58.98 3k2b h ARG 77 Cb 1.12 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.99 3k2b h ARG 77 CO 0.41 0.22 0.43 1.21 -1.07 0.00 0.00 179.97 181.16 3k2b s ASN 78 N -6.50 6.37 0.59 7.04 3.84 -1.26 -4.94 114.94 120.09 3k2b s ASN 78 Ca -0.02 -1.64 0.31 0.00 0.21 0.00 0.00 52.86 51.72 3k2b s ASN 78 Cb 0.13 -2.35 1.23 0.00 -0.55 0.00 0.00 41.25 39.72 3k2b s ASN 78 CO 0.65 -1.12 1.53 -0.65 -2.79 0.00 0.00 177.10 174.72 3k2b h PRO 79 N 9.03 0.00 0.00 0.43 0.11 -1.93 0.32 132.00 139.96 3k2b h PRO 79 Ca -0.12 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.97 3k2b h PRO 79 Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3k2b h PRO 79 CO 1.09 0.00 -0.11 0.77 -0.21 0.00 0.00 178.00 179.53 3k2b h SER 80 N 0.00 0.00 -0.95 -2.05 0.02 -1.93 -3.07 113.55 105.58 3k2b h SER 80 Ca 0.49 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.92 3k2b h SER 80 Cb 2.54 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 64.79 3k2b h SER 80 CO -0.01 0.11 0.62 0.18 -1.14 0.00 0.00 176.83 176.60 3k2b n LEU 81 N -3.34 6.67 -4.80 5.07 4.77 0.11 -4.54 117.00 120.94 3k2b n LEU 81 Ca -0.01 -3.72 -0.35 0.00 -0.03 0.00 0.00 56.01 51.90 3k2b n LEU 81 Cb 0.31 -0.84 -0.07 0.00 -2.33 0.00 0.00 43.42 40.49 3k2b n LEU 81 CO 0.30 1.13 -0.23 -0.76 -1.33 0.00 0.00 177.39 176.49 3k2b s LEU 82 N -3.37 4.04 0.00 2.23 1.43 -1.16 -4.96 118.68 116.89 3k2b s LEU 82 Ca 0.57 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.97 3k2b s LEU 82 Cb 0.48 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.63 3k2b s LEU 82 CO 0.09 0.36 0.17 -2.65 0.23 0.00 0.00 176.35 174.55 3k2b n PRO 83 N 1.81 0.10 -0.08 1.29 -0.02 -1.26 -4.35 135.00 132.49 3k2b n PRO 83 Ca -0.18 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.19 3k2b n PRO 83 Cb 0.54 -1.45 -0.05 0.00 -0.02 0.00 0.00 33.50 32.52 3k2b n PRO 83 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3k2b h TRP 84 N 3.04 0.49 -0.29 6.00 -0.00 -1.92 0.16 115.95 123.44 3k2b h TRP 84 Ca 0.00 -0.11 -0.11 0.00 -0.00 0.00 0.00 58.89 58.67 3k2b h TRP 84 Cb 0.10 -0.12 -0.00 0.00 -0.00 0.00 0.00 29.16 29.14 3k2b h TRP 84 CO 0.31 0.68 -0.27 -0.22 -0.00 0.00 0.00 178.44 178.94 3k2b h LYS 85 N 0.17 0.69 0.00 0.49 3.64 -1.07 -0.66 116.57 119.82 3k2b h LYS 85 Ca 0.06 -0.36 -0.03 0.00 -1.27 0.00 0.00 60.65 59.05 3k2b h LYS 85 Cb 0.52 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 3k2b h LYS 85 CO 0.02 0.97 -0.15 1.49 -2.27 0.00 0.00 179.45 179.51 3k2b h GLU 86 N 0.43 0.00 -0.21 1.90 4.22 -1.81 -2.33 114.58 116.78 3k2b h GLU 86 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.49 3k2b h GLU 86 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3k2b h GLU 86 CO 0.07 0.15 0.00 1.28 -2.18 0.00 0.00 179.01 178.32 3k2b n LEU 87 N -3.93 3.08 -3.53 1.64 4.77 0.55 -4.98 117.00 114.60 3k2b n LEU 87 Ca -0.02 -1.28 -0.19 0.00 -0.03 0.00 0.00 56.01 54.49 3k2b n LEU 87 Cb 0.24 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.28 3k2b n LEU 87 CO 0.33 0.61 0.07 0.61 -1.33 0.00 0.00 177.39 177.67 3k2b n GLY 88 N 1.29 -0.36 3.72 -0.72 0.00 -0.67 -4.95 105.19 103.49 3k2b n GLY 88 Ca 0.15 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.44 4.55 -0.21 -0.61 -1.09 -0.34 -4.69 121.20 115.36 3k2b s ILE 89 Ca 0.06 1.90 -0.16 0.00 -2.23 0.00 0.00 60.65 60.22 3k2b s ILE 89 Cb -0.03 -4.22 -0.12 0.00 -1.58 0.00 0.00 42.46 36.52 3k2b s ILE 89 CO 0.75 0.19 -0.11 0.47 -1.23 0.00 0.00 174.94 175.02 3k2b n ASP 90 N 3.57 1.88 -4.19 3.58 8.00 0.33 -3.04 116.55 126.67 3k2b n ASP 90 Ca 0.06 0.44 -0.31 0.00 0.71 0.00 0.00 54.79 55.69 3k2b n ASP 90 Cb 0.49 -0.87 -0.17 0.00 -0.02 0.00 0.00 41.12 40.55 3k2b n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k2b s ILE 91 N -2.45 1.90 -0.12 0.53 1.01 -0.49 -0.98 121.20 120.60 3k2b s ILE 91 Ca -0.28 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.41 3k2b s ILE 91 Cb 0.07 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 3k2b s ILE 91 CO 0.46 0.53 -0.02 -0.69 0.00 0.00 0.00 174.94 175.21 3k2b s VAL 92 N 0.35 4.08 -0.52 2.92 1.01 0.09 -0.98 120.40 127.33 3k2b s VAL 92 Ca -0.17 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.33 3k2b s VAL 92 Cb -0.17 -2.74 0.11 0.00 0.00 0.00 0.00 36.38 33.57 3k2b s VAL 92 CO 0.08 0.55 0.50 -0.63 0.00 0.00 0.00 175.10 175.59 3k2b s ILE 93 N -0.30 5.16 -0.69 2.22 1.09 0.13 -0.02 121.20 128.79 3k2b s ILE 93 Ca 0.06 -1.26 -0.27 0.00 -1.10 0.00 0.00 60.65 58.08 3k2b s ILE 93 Cb -0.12 -4.29 0.03 0.00 -1.06 0.00 0.00 42.46 37.02 3k2b s ILE 93 CO 0.02 -0.81 1.23 -0.70 -0.10 0.00 0.00 174.94 174.59 3k2b s GLU 94 N 1.78 3.28 -0.16 2.79 -6.30 -0.08 -0.83 118.70 119.18 3k2b s GLU 94 Ca 0.05 -0.14 0.14 0.00 -2.50 0.00 0.00 54.97 52.52 3k2b s GLU 94 Cb -0.27 -4.13 0.37 0.00 0.00 0.00 0.00 34.13 30.09 3k2b s GLU 94 CO 0.05 -1.99 1.19 0.41 0.02 0.00 0.00 175.26 174.94 3k2b n GLY 95 N 5.28 4.39 0.08 -1.50 0.00 0.14 -1.54 105.19 112.03 3k2b n GLY 95 Ca 0.04 -1.15 -0.05 0.00 0.00 0.00 0.00 46.02 44.86 3k2b n GLY 95 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k2b h THR 96 N 1.72 1.44 -0.05 2.61 1.35 -1.75 -3.43 112.91 114.80 3k2b h THR 96 Ca -0.03 -3.10 -0.02 0.00 -0.55 0.00 0.00 66.41 62.71 3k2b h THR 96 Cb 1.12 2.70 -0.01 0.00 -1.73 0.00 0.00 68.15 70.24 3k2b h THR 96 CO 0.01 0.82 -0.02 0.61 -0.25 0.00 0.00 175.52 176.69 3k2b n GLY 97 N 1.36 0.49 0.87 5.82 0.00 -1.26 -4.88 105.19 107.59 3k2b n GLY 97 Ca -0.02 -0.47 0.01 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.92 0.00 -2.51 1.61 0.24 -1.26 -4.78 118.33 108.71 3k2b n VAL 98 Ca -0.01 -0.37 -0.01 0.00 -2.04 0.00 0.00 64.34 61.91 3k2b n VAL 98 Cb 0.06 0.68 0.04 0.00 -1.47 0.00 0.00 33.84 33.14 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 0.18 -0.23 1.65 6.34 3.72 -1.26 -4.91 117.46 122.95 3k2b n PHE 99 Ca 0.02 -1.25 0.15 0.00 -0.05 0.00 0.00 57.45 56.32 3k2b n PHE 99 Cb 0.86 0.44 0.73 0.00 -0.94 0.00 0.00 39.48 40.58 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 -0.46 0.00 -3.97 -4.37 0.24 -1.26 -3.27 118.33 105.24 3k2b n VAL 100 Ca -0.08 -0.07 -0.32 0.00 -2.04 0.00 0.00 64.34 61.82 3k2b n VAL 100 Cb 0.88 -0.15 -0.05 0.00 -1.47 0.00 0.00 33.84 33.04 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 -2.21 6.09 0.21 -1.34 -4.77 -1.26 -1.21 116.67 112.19 3k2b s ASP 101 Ca 0.38 0.23 -0.12 0.00 -3.30 0.00 0.00 52.55 49.74 3k2b s ASP 101 Cb 0.21 -1.83 0.28 0.00 -1.09 0.00 0.00 42.92 40.48 3k2b s ASP 101 CO 0.41 0.23 1.64 -0.09 0.70 0.00 0.00 175.17 178.06 3k2b h ARG 102 N 3.61 0.06 -0.31 2.11 2.43 -1.26 0.26 114.38 121.27 3k2b h ARG 102 Ca -0.48 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.66 3k2b h ARG 102 Cb 1.18 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 3k2b h ARG 102 CO 0.69 0.04 0.07 1.49 -1.51 0.00 0.00 179.97 180.74 3k2b h GLU 103 N 0.06 0.45 0.01 0.20 4.81 -1.96 -0.45 114.58 117.70 3k2b h GLU 103 Ca 0.32 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.36 3k2b h GLU 103 Cb 0.51 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 29.82 3k2b h GLU 103 CO -0.59 0.43 -0.46 0.78 -0.73 0.00 0.00 179.01 178.44 3k2b h GLY 104 N 0.69 0.33 2.00 1.92 0.00 -1.41 -3.26 103.07 103.34 3k2b h GLY 104 Ca 0.11 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 3k2b h GLY 104 CO -0.00 0.53 -0.20 0.00 0.00 0.00 0.00 176.54 176.87 3k2b h ALA 105 N 0.27 1.33 0.00 3.60 0.00 -0.42 -2.60 119.26 121.44 3k2b h ALA 105 Ca -0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3k2b h ALA 105 Cb 1.21 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3k2b h ALA 105 CO 0.09 0.25 -0.19 0.78 0.00 0.00 0.00 179.25 180.18 3k2b h GLY 106 N 1.01 0.00 0.56 0.00 0.00 -1.12 -2.97 103.07 100.55 3k2b h GLY 106 Ca -0.00 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.48 3k2b h GLY 106 CO 0.03 0.00 0.55 0.50 0.00 0.00 0.00 176.54 177.62 3k2b h LYS 107 N 0.00 0.55 -0.46 4.80 1.57 -1.51 0.16 116.57 121.69 3k2b h LYS 107 Ca -0.00 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 3k2b h LYS 107 Cb 0.64 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 3k2b h LYS 107 CO 0.03 0.36 0.11 0.45 -0.57 0.00 0.00 179.45 179.83 3k2b h HIS 108 N 0.57 0.70 -0.08 -1.35 3.86 -1.71 -1.38 115.15 115.76 3k2b h HIS 108 Ca 0.42 -0.05 -0.23 0.00 -1.16 0.00 0.00 60.37 59.35 3k2b h HIS 108 Cb 0.80 -0.21 0.01 0.00 1.06 0.00 0.00 27.41 29.07 3k2b h HIS 108 CO -0.00 0.60 -0.85 0.82 0.86 0.00 0.00 177.93 179.36 3k2b h ILE 109 N 0.67 1.32 0.00 2.45 2.04 -0.88 -2.16 117.51 120.95 3k2b h ILE 109 Ca 0.15 -2.13 -0.02 0.00 1.00 0.00 0.00 64.86 63.85 3k2b h ILE 109 Cb 0.25 2.15 -0.00 0.00 -0.74 0.00 0.00 36.82 38.48 3k2b h ILE 109 CO -0.00 0.66 -0.11 -0.33 0.00 0.00 0.00 178.15 178.36 3k2b h GLU 110 N 0.41 0.00 -0.04 2.37 5.08 -0.69 -2.09 114.58 119.62 3k2b h GLU 110 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3k2b h GLU 110 Cb 1.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.72 3k2b h GLU 110 CO 0.16 0.11 0.00 0.00 -1.00 0.00 0.00 179.01 178.29 3k2b n ALA 111 N -2.50 2.60 0.00 3.43 0.00 -0.56 -4.92 120.51 118.56 3k2b n ALA 111 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3k2b n ALA 111 Cb 0.19 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.02 3.74 3.59 0.00 0.00 -0.78 -0.64 105.19 112.11 3k2b n GLY 112 Ca 0.18 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.11 0.67 4.61 0.00 -0.83 -4.44 120.51 120.41 3k2b n ALA 113 Ca 0.00 0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.79 3k2b n ALA 113 Cb 0.00 -2.03 -0.05 0.00 0.00 0.00 0.00 19.45 17.37 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 0.27 0.22 -3.67 0.00 5.02 -1.16 -4.00 118.16 114.83 3k2b n LYS 114 Ca 0.10 -0.04 -0.14 0.00 -2.02 0.00 0.00 58.31 56.21 3k2b n LYS 114 Cb 0.38 -1.54 -0.07 0.00 -0.02 0.00 0.00 35.03 33.79 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 -3.16 0.85 -0.02 1.97 2.20 -0.15 -4.78 119.74 116.64 3k2b s LYS 115 Ca 0.04 -0.18 0.01 0.00 -0.36 0.00 0.00 55.97 55.47 3k2b s LYS 115 Cb 0.15 0.38 0.02 0.00 -1.51 0.00 0.00 37.83 36.88 3k2b s LYS 115 CO 0.84 -0.27 -0.00 0.08 -0.36 0.00 0.00 175.35 175.64 3k2b s VAL 116 N -1.79 0.17 -0.28 4.02 1.01 -0.26 -0.74 120.40 122.54 3k2b s VAL 116 Ca -0.10 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 3k2b s VAL 116 Cb -0.02 -0.24 0.05 0.00 0.00 0.00 0.00 36.38 36.16 3k2b s VAL 116 CO 0.03 0.12 -0.04 -0.63 0.00 0.00 0.00 175.10 174.58 3k2b s ILE 117 N 0.77 2.77 -0.21 2.22 1.01 0.98 -2.21 121.20 126.53 3k2b s ILE 117 Ca -0.08 -1.35 -0.29 0.00 0.00 0.00 0.00 60.65 58.93 3k2b s ILE 117 Cb -0.11 -2.55 -0.00 0.00 0.01 0.00 0.00 42.46 39.81 3k2b s ILE 117 CO -0.01 -0.01 1.15 -0.63 0.00 0.00 0.00 174.94 175.44 3k2b s ILE 118 N 1.24 4.47 0.00 2.92 1.01 0.10 -0.90 121.20 130.02 3k2b s ILE 118 Ca -0.05 1.76 0.00 0.00 0.00 0.00 0.00 60.65 62.36 3k2b s ILE 118 Cb -0.19 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.11 3k2b s ILE 118 CO -0.03 -0.20 1.31 0.35 0.00 0.00 0.00 174.94 176.37 3k2b n THR 119 N 5.43 1.31 -3.83 2.92 -2.24 -0.59 -1.36 114.28 115.93 3k2b n THR 119 Ca 0.13 -0.16 -0.06 0.00 -2.27 0.00 0.00 64.05 61.69 3k2b n THR 119 Cb 0.46 -1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 67.51 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 0.02 -1.35 0.37 6.98 0.00 -1.21 -4.87 121.76 121.71 3k2b s ALA 120 Ca 0.00 -0.19 -0.28 0.00 0.00 0.00 0.00 51.96 51.49 3k2b s ALA 120 Cb 0.00 0.79 -0.11 0.00 0.00 0.00 0.00 23.12 23.79 3k2b s ALA 120 CO 0.00 -1.04 1.45 -2.30 0.00 0.00 0.00 175.76 173.87 3k2b n PRO 121 N -0.47 2.56 -3.91 0.00 -0.02 -1.23 -3.93 135.00 128.01 3k2b n PRO 121 Ca -0.05 0.90 -0.21 0.00 -2.02 0.00 0.00 63.50 62.12 3k2b n PRO 121 Cb 0.59 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.46 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 -0.17 1.28 -0.04 -1.23 0.00 -1.26 -4.90 107.32 101.00 3k2b s GLY 122 Ca 0.54 -1.27 0.06 0.00 0.00 0.00 0.00 44.72 44.05 3k2b s GLY 122 CO 0.64 -1.28 -0.24 0.54 0.00 0.00 0.00 173.10 172.76 3k2b s LYS 122 N -4.00 2.24 0.00 2.90 1.02 -0.35 -4.95 119.74 116.61 3k2b s LYS 122 Ca 0.35 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.49 3k2b s LYS 122 Cb -0.09 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.23 3k2b s LYS 122 CO 0.29 0.41 0.00 0.41 -0.92 0.00 0.00 175.35 175.54 3k2b n GLY 123 N 2.82 -1.37 3.32 -3.33 0.00 -1.26 -0.76 105.19 104.61 3k2b n GLY 123 Ca -0.17 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.34 3k2b n GLY 123 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k2b n ASP 124 N 0.00 4.75 -3.99 1.61 2.03 -1.26 -4.87 116.55 114.82 3k2b n ASP 124 Ca 0.00 -2.92 -0.31 0.00 0.52 0.00 0.00 54.79 52.08 3k2b n ASP 124 Cb 0.00 -1.68 -0.16 0.00 -0.72 0.00 0.00 41.12 38.56 3k2b n ASP 124 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3k2b s ILE 125 N 3.31 1.68 0.46 5.18 -1.09 -1.26 -4.98 121.20 124.51 3k2b s ILE 125 Ca 0.50 -1.19 -0.25 0.00 -2.23 0.00 0.00 60.65 57.47 3k2b s ILE 125 Cb 0.06 -1.84 -0.08 0.00 -1.58 0.00 0.00 42.46 39.02 3k2b s ILE 125 CO 0.02 0.03 1.43 -2.84 -1.23 0.00 0.00 174.94 172.36 3k2b s PRO 126 N 1.35 3.63 -0.09 2.79 0.02 -1.25 -4.74 135.00 136.71 3k2b s PRO 126 Ca -0.04 2.43 0.02 0.00 0.02 0.00 0.00 61.00 63.42 3k2b s PRO 126 Cb -0.18 -2.63 -0.02 0.00 0.02 0.00 0.00 34.50 31.70 3k2b s PRO 126 CO -0.07 -0.86 -0.14 0.99 -0.33 0.00 0.00 177.00 176.59 3k2b s THR 127 N -1.20 3.03 0.06 0.99 2.01 -1.26 -1.40 115.64 117.86 3k2b s THR 127 Ca 0.62 -0.70 0.04 0.00 0.31 0.00 0.00 61.69 61.96 3k2b s THR 127 Cb -0.44 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 3k2b s THR 127 CO 0.56 0.56 -0.13 -0.31 -0.69 0.00 0.00 174.62 174.62 3k2b s TYR 128 N -0.22 1.08 -0.17 4.92 2.02 -0.37 -4.83 117.35 119.78 3k2b s TYR 128 Ca 0.01 -0.43 -0.04 0.00 -0.37 0.00 0.00 57.07 56.24 3k2b s TYR 128 Cb -0.13 -0.63 0.06 0.00 -0.40 0.00 0.00 41.96 40.86 3k2b s TYR 128 CO 0.03 0.02 0.07 0.08 -1.57 0.00 0.00 175.55 174.18 3k2b s VAL 129 N -1.15 0.11 0.16 0.71 1.01 -1.26 -4.23 120.40 115.75 3k2b s VAL 129 Ca -0.03 -0.27 -0.34 0.00 0.00 0.00 0.00 61.98 61.35 3k2b s VAL 129 Cb -0.09 -0.71 -0.14 0.00 0.00 0.00 0.00 36.38 35.44 3k2b s VAL 129 CO 0.02 -0.24 1.48 0.52 0.00 0.00 0.00 175.10 176.88 3k2b n VAL 130 N 5.21 0.21 0.00 2.92 0.31 -1.26 -0.63 118.33 125.08 3k2b n VAL 130 Ca -0.08 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 3k2b n VAL 130 Cb 0.48 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 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 2.96 2.23 0.17 2.92 0.00 -1.26 -4.81 105.19 107.39 3k2b n GLY 131 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 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 0.53 -1.33 1.61 0.31 0.19 -4.85 118.33 112.79 3k2b n VAL 132 Ca 0.00 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3k2b n VAL 132 Cb 0.00 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 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 -2.90 0.00 0.30 4.52 0.23 -0.50 -4.92 115.26 112.00 3k2b n ASN 133 Ca -0.17 -0.65 0.16 0.00 -0.53 0.00 0.00 54.58 53.39 3k2b n ASN 133 Cb 0.67 0.00 0.94 0.00 -2.08 0.00 0.00 39.78 39.30 3k2b n ASN 133 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3k2b h ALA 134 N 0.00 1.39 -0.48 -2.53 0.00 -1.90 0.14 119.26 115.88 3k2b h ALA 134 Ca 0.00 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.03 3k2b h ALA 134 Cb 0.65 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3k2b h ALA 134 CO 0.00 0.03 0.50 0.38 0.00 0.00 0.00 179.25 180.16 3k2b h ASP 135 N 0.00 0.00 0.29 0.00 2.03 -1.91 0.14 116.42 116.97 3k2b h ASP 135 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3k2b h ASP 135 Cb 0.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.57 3k2b h ASP 135 CO 0.00 0.00 -0.00 0.00 -1.03 0.00 0.00 179.24 178.21 3k2b n ALA 136 N -2.35 2.59 -0.98 4.15 0.00 0.50 -4.92 120.51 119.50 3k2b n ALA 136 Ca 0.09 -0.18 -0.33 0.00 0.00 0.00 0.00 53.44 53.02 3k2b n ALA 136 Cb 0.69 -1.50 0.12 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.13 0.26 -4.17 0.00 9.36 0.48 -5.03 117.16 116.93 3k2b n TYR 137 Ca 0.19 0.36 -0.19 0.00 3.32 0.00 0.00 57.90 61.57 3k2b n TYR 137 Cb 0.18 -1.98 -0.16 0.00 -0.63 0.00 0.00 39.34 36.75 3k2b n TYR 137 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 3k2b s SER 138 N -2.09 0.87 0.49 2.98 0.01 -1.26 -5.04 113.70 109.66 3k2b s SER 138 Ca 0.67 -0.12 0.27 0.00 1.31 0.00 0.00 55.95 58.08 3k2b s SER 138 Cb -0.27 -0.38 1.35 0.00 0.21 0.00 0.00 66.02 66.92 3k2b s SER 138 CO 0.57 -0.03 1.87 1.12 0.41 0.00 0.00 173.24 177.17 3k2b h HIS 139 N 6.99 0.21 -0.00 2.43 2.07 -1.96 -1.08 115.15 123.80 3k2b h HIS 139 Ca -0.38 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.15 3k2b h HIS 139 Cb 1.16 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 31.07 3k2b h HIS 139 CO 0.49 0.04 0.00 -0.40 -3.07 0.00 0.00 177.93 174.99 3k2b n ASP 140 N -4.36 0.68 -4.31 3.10 5.68 -1.26 -4.66 116.55 111.42 3k2b n ASP 140 Ca 0.20 -2.00 -0.40 0.00 -0.50 0.00 0.00 54.79 52.08 3k2b n ASP 140 Cb 0.90 -0.33 -0.11 0.00 -1.14 0.00 0.00 41.12 40.45 3k2b n ASP 140 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3k2b s GLU 141 N -1.36 2.70 0.17 0.11 2.02 -0.41 -4.98 118.70 116.95 3k2b s GLU 141 Ca 0.00 -1.27 -0.08 0.00 0.02 0.00 0.00 54.97 53.64 3k2b s GLU 141 Cb 0.00 -3.72 0.05 0.00 0.10 0.00 0.00 34.13 30.56 3k2b s GLU 141 CO 0.00 -0.82 1.53 -1.00 0.02 0.00 0.00 175.26 175.00 3k2b h PRO 142 N 8.40 0.87 -4.63 0.39 0.13 -1.86 -3.44 132.00 131.85 3k2b h PRO 142 Ca -0.24 -0.42 -0.59 0.00 -0.87 0.00 0.00 66.00 63.88 3k2b h PRO 142 Cb 1.09 -0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.86 3k2b h PRO 142 CO 0.70 1.06 -0.83 0.42 -0.23 0.00 0.00 178.00 179.13 3k2b s ILE 143 N -4.46 1.51 0.12 -3.56 1.01 -1.26 -1.10 121.20 113.45 3k2b s ILE 143 Ca -0.10 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 59.98 3k2b s ILE 143 Cb 0.12 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 3k2b s ILE 143 CO 0.86 0.45 -0.09 0.27 0.00 0.00 0.00 174.94 176.43 3k2b s ILE 144 N 1.45 0.97 -0.02 2.92 -4.36 -0.94 -3.90 121.20 117.33 3k2b s ILE 144 Ca 0.04 -1.89 0.03 0.00 -0.26 0.00 0.00 60.65 58.57 3k2b s ILE 144 Cb -0.13 -1.64 -0.03 0.00 1.25 0.00 0.00 42.46 41.91 3k2b s ILE 144 CO -0.09 -0.72 -0.07 -0.55 0.24 0.00 0.00 174.94 173.74 3k2b s SER 145 N -2.90 4.59 0.00 4.36 0.15 -0.49 -0.73 113.70 118.69 3k2b s SER 145 Ca 0.12 -0.12 0.21 0.00 0.70 0.00 0.00 55.95 56.85 3k2b s SER 145 Cb 0.01 -1.08 0.55 0.00 -1.71 0.00 0.00 66.02 63.79 3k2b s SER 145 CO -0.01 0.30 1.47 -3.20 1.20 0.00 0.00 173.24 173.00 3k2b n ASN 146 N 1.75 3.37 -0.12 5.45 5.15 -0.46 -1.23 115.26 129.16 3k2b n ASN 146 Ca -0.16 -1.98 0.00 0.00 -0.60 0.00 0.00 54.58 51.84 3k2b n ASN 146 Cb 0.53 -0.38 0.00 0.00 -0.53 0.00 0.00 39.78 39.40 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 1.36 0.00 -2.76 5.20 0.00 -1.25 -4.79 120.51 118.27 3k2b n ALA 147 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.43 3k2b n ALA 147 Cb 0.55 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.95 3k2b n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k2b s SER 148 N -4.00 5.27 0.55 0.00 1.04 -1.26 -3.30 113.70 112.00 3k2b s SER 148 Ca 0.00 -0.36 0.25 0.00 0.48 0.00 0.00 55.95 56.32 3k2b s SER 148 Cb 0.00 -1.24 1.46 0.00 0.10 0.00 0.00 66.02 66.34 3k2b s SER 148 CO 0.00 -0.05 2.05 0.00 0.98 0.00 0.00 173.24 176.21 3k2b h THR 150 N 0.00 1.55 -0.10 0.00 2.02 -1.97 -3.07 112.91 111.34 3k2b h THR 150 Ca 0.16 -3.08 -0.11 0.00 0.77 0.00 0.00 66.41 64.14 3k2b h THR 150 Cb 0.70 2.84 -0.01 0.00 -1.74 0.00 0.00 68.15 69.94 3k2b h THR 150 CO -0.00 0.90 -0.44 0.74 0.37 0.00 0.00 175.52 177.09 3k2b h THR 151 N 0.06 1.32 0.00 3.16 2.02 -1.72 -0.22 112.91 117.54 3k2b h THR 151 Ca -0.09 -1.59 -0.05 0.00 0.77 0.00 0.00 66.41 65.45 3k2b h THR 151 Cb 1.85 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 69.98 3k2b h THR 151 CO 0.18 0.47 -0.24 0.78 0.37 0.00 0.00 175.52 177.08 3k2b h ASN 152 N 0.20 0.00 0.19 4.18 4.21 -1.51 0.47 115.58 123.33 3k2b h ASN 152 Ca 0.02 0.00 -0.34 0.00 1.21 0.00 0.00 56.30 57.19 3k2b h ASN 152 Cb 0.86 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.07 3k2b h ASN 152 CO 0.07 0.24 -1.66 0.00 -1.29 0.00 0.00 177.43 174.79 3k2b h LEU 154 N 0.06 -0.17 -0.68 0.00 5.85 -0.96 -3.38 115.31 116.03 3k2b h LEU 154 Ca -0.32 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.15 3k2b h LEU 154 Cb 2.07 0.04 -0.12 0.00 0.37 0.00 0.00 40.66 43.02 3k2b h LEU 154 CO 0.18 0.39 -0.37 0.00 -0.34 0.00 0.00 178.44 178.31 3k2b h ALA 155 N -0.33 -0.06 -0.35 1.25 0.00 -0.26 -1.13 119.26 118.38 3k2b h ALA 155 Ca -0.02 0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.14 3k2b h ALA 155 Cb 0.52 0.87 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 3k2b h ALA 155 CO 0.03 -0.70 -0.36 -1.35 0.00 0.00 0.00 179.25 176.88 3k2b h PRO 156 N -0.14 -0.29 -0.00 0.00 0.11 -1.74 -0.57 132.00 129.37 3k2b h PRO 156 Ca 0.25 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.38 3k2b h PRO 156 Cb 0.56 0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.74 3k2b h PRO 156 CO -0.75 -0.20 -0.18 1.97 -0.21 0.00 0.00 178.00 178.64 3k2b n PHE 157 N -5.42 0.00 0.10 0.65 1.16 -1.06 -2.90 117.46 109.98 3k2b n PHE 157 Ca -0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.43 3k2b n PHE 157 Cb 0.34 -0.25 -0.14 0.00 -1.61 0.00 0.00 39.48 37.82 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 0.39 1.51 0.30 1.97 2.07 -0.59 -1.77 116.25 120.13 3k2b h VAL 158 Ca 0.00 -3.10 -0.01 0.00 0.82 0.00 0.00 66.70 64.41 3k2b h VAL 158 Cb 0.42 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 33.11 3k2b h VAL 158 CO 0.00 0.90 -0.19 0.50 0.02 0.00 0.00 177.57 178.80 3k2b h LYS 159 N 0.06 -0.45 0.36 1.57 3.64 -0.99 0.77 116.57 121.53 3k2b h LYS 159 Ca -0.13 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 3k2b h LYS 159 Cb 1.95 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.87 3k2b h LYS 159 CO 0.19 -0.30 -0.22 0.28 -2.27 0.00 0.00 179.45 177.13 3k2b h VAL 160 N -0.47 0.54 -0.57 2.00 2.07 -1.56 -0.68 116.25 117.58 3k2b h VAL 160 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.59 3k2b h VAL 160 Cb 0.39 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.63 3k2b h VAL 160 CO 0.03 0.00 0.12 -0.07 0.02 0.00 0.00 177.57 177.67 3k2b h LEU 161 N -0.55 -0.00 0.43 2.57 3.38 -1.20 -0.97 115.31 118.97 3k2b h LEU 161 Ca -0.04 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3k2b h LEU 161 Cb 0.45 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3k2b h LEU 161 CO 0.04 0.01 -0.20 -0.78 0.09 0.00 0.00 178.44 177.60 3k2b h ASP 162 N 0.25 -0.49 -0.30 -0.43 3.58 -0.69 -0.09 116.42 118.24 3k2b h ASP 162 Ca 0.30 -0.10 0.07 0.00 0.42 0.00 0.00 57.03 57.71 3k2b h ASP 162 Cb 0.43 0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.53 3k2b h ASP 162 CO -0.38 -0.14 -0.22 -0.61 -2.88 0.00 0.00 179.24 175.00 3k2b h GLN 163 N -0.86 -0.19 0.00 0.28 4.15 -0.95 0.61 115.11 118.15 3k2b h GLN 163 Ca -0.06 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3k2b h GLN 163 Cb 0.56 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.29 3k2b h GLN 163 CO 0.10 -0.13 -0.17 0.87 -1.93 0.00 0.00 178.83 177.57 3k2b h LYS 164 N -0.20 0.00 0.00 1.69 1.79 -1.24 -3.40 116.57 115.21 3k2b h LYS 164 Ca 0.16 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 3k2b h LYS 164 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 3k2b h LYS 164 CO -0.42 0.00 -0.20 1.19 -1.08 0.00 0.00 179.45 178.94 3k2b n PHE 165 N -2.50 0.00 -1.77 -1.35 3.72 -0.06 -4.95 117.46 110.54 3k2b n PHE 165 Ca 0.04 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.44 3k2b n PHE 165 Cb 0.47 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.00 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 0.57 -3.30 3.61 1.37 0.00 0.21 -1.01 105.19 106.64 3k2b n GLY 166 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.30 3.98 -0.03 -0.61 1.01 -1.26 0.16 121.20 124.16 3k2b s ILE 167 Ca -0.03 1.03 -0.09 0.00 0.00 0.00 0.00 60.65 61.56 3k2b s ILE 167 Cb 0.00 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.19 3k2b s ILE 167 CO 0.19 -0.72 0.51 0.40 0.00 0.00 0.00 174.94 175.32 3k2b h ILE 168 N 6.33 0.00 -3.22 2.92 2.04 -1.22 -3.48 117.51 120.87 3k2b h ILE 168 Ca -0.27 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 3k2b h ILE 168 Cb 1.10 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.07 3k2b h ILE 168 CO 1.08 0.00 0.07 -1.59 0.00 0.00 0.00 178.15 177.70 3k2b s LYS 169 N -2.71 1.29 0.09 2.37 0.00 -1.23 -4.81 119.74 114.74 3k2b s LYS 169 Ca -0.05 -0.72 -0.27 0.00 0.00 0.00 0.00 55.97 54.93 3k2b s LYS 169 Cb 0.00 0.53 0.08 0.00 0.00 0.00 0.00 37.83 38.45 3k2b s LYS 169 CO 0.15 -0.55 1.03 0.20 0.00 0.00 0.00 175.35 176.18 3k2b s GLY 170 N -2.82 -0.29 0.28 0.59 0.00 -0.94 -0.43 107.32 103.69 3k2b s GLY 170 Ca 0.05 0.37 0.08 0.00 0.00 0.00 0.00 44.72 45.22 3k2b s GLY 170 CO -0.08 0.07 -0.09 -1.08 0.00 0.00 0.00 173.10 171.92 3k2b s THR 171 N -3.06 1.84 -0.05 0.90 -1.32 -0.21 -2.90 115.64 110.83 3k2b s THR 171 Ca 0.12 -2.18 -0.16 0.00 -1.21 0.00 0.00 61.69 58.25 3k2b s THR 171 Cb 0.00 -2.39 0.03 0.00 -1.51 0.00 0.00 72.50 68.63 3k2b s THR 171 CO -0.00 -0.35 0.38 -0.32 -2.21 0.00 0.00 174.62 172.11 3k2b s MET 172 N -3.67 0.66 -0.05 7.08 0.00 0.53 -1.71 119.30 122.14 3k2b s MET 172 Ca 0.29 0.05 -0.00 0.00 0.00 0.00 0.00 55.69 56.03 3k2b s MET 172 Cb 0.02 0.30 0.03 0.00 0.00 0.00 0.00 34.83 35.18 3k2b s MET 172 CO 0.12 -0.17 -0.01 0.99 0.00 0.00 0.00 175.02 175.95 3k2b s THR 173 N -0.92 0.31 -0.32 10.11 2.01 0.73 -1.79 115.64 125.78 3k2b s THR 173 Ca -0.10 0.06 -0.08 0.00 0.31 0.00 0.00 61.69 61.89 3k2b s THR 173 Cb -0.04 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 72.07 3k2b s THR 173 CO 0.04 0.20 0.11 0.28 -0.69 0.00 0.00 174.62 174.56 3k2b s THR 174 N 1.32 4.08 -0.71 -0.82 -1.32 -0.84 0.44 115.64 117.79 3k2b s THR 174 Ca -0.05 -0.79 -0.27 0.00 -1.21 0.00 0.00 61.69 59.36 3k2b s THR 174 Cb -0.13 -3.17 0.03 0.00 -1.51 0.00 0.00 72.50 67.71 3k2b s THR 174 CO -0.02 -0.03 1.31 -0.89 -2.21 0.00 0.00 174.62 172.78 3k2b s THR 175 N 1.50 3.73 0.02 5.08 2.01 -0.14 -1.18 115.64 126.65 3k2b s THR 175 Ca 0.02 0.46 0.00 0.00 0.31 0.00 0.00 61.69 62.48 3k2b s THR 175 Cb -0.18 -4.81 -0.04 0.00 0.01 0.00 0.00 72.50 67.48 3k2b s THR 175 CO 0.04 -1.71 0.09 -2.28 -0.69 0.00 0.00 174.62 170.07 3k2b s HIS 176 N 5.89 3.28 0.42 4.92 2.46 0.79 -1.66 115.29 131.39 3k2b s HIS 176 Ca 0.39 0.18 -0.24 0.00 0.47 0.00 0.00 55.06 55.86 3k2b s HIS 176 Cb -0.08 -1.71 -0.08 0.00 -0.13 0.00 0.00 32.58 30.57 3k2b s HIS 176 CO 0.17 0.55 1.13 0.45 -2.47 0.00 0.00 174.74 174.57 3k2b s SER 177 N -1.94 6.49 0.79 9.88 0.15 -1.24 -0.00 113.70 127.83 3k2b s SER 177 Ca 0.25 2.24 -0.12 0.00 0.70 0.00 0.00 55.95 59.03 3k2b s SER 177 Cb -0.12 -2.60 0.07 0.00 -1.71 0.00 0.00 66.02 61.66 3k2b s SER 177 CO 0.17 -0.69 1.14 -0.72 1.20 0.00 0.00 173.24 174.33 3k2b s TYR 178 N -1.52 2.14 0.39 3.44 -0.85 -0.39 -4.76 117.35 115.80 3k2b s TYR 178 Ca 0.59 1.65 0.04 0.00 -0.52 0.00 0.00 57.07 58.83 3k2b s TYR 178 Cb -0.28 -3.26 -0.05 0.00 0.38 0.00 0.00 41.96 38.75 3k2b s TYR 178 CO 0.34 -2.31 0.05 0.95 -1.52 0.00 0.00 175.55 173.06 3k2b s THR 179 N -2.52 1.24 -2.00 -3.49 -4.23 -1.26 -4.68 115.64 98.69 3k2b s THR 179 Ca 0.67 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.30 3k2b s THR 179 Cb -0.22 -2.64 0.35 0.00 1.34 0.00 0.00 72.50 71.33 3k2b s THR 179 CO 0.52 0.00 1.18 0.61 -0.54 0.00 0.00 174.62 176.39 3k2b n GLY 180 N -0.90 -0.52 0.07 3.99 0.00 -1.26 -2.47 105.19 104.10 3k2b n GLY 180 Ca -0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 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 -4.48 1.61 3.58 -1.98 -3.46 116.42 111.69 3k2b h ASP 181 Ca 0.00 0.00 -0.47 0.00 0.42 0.00 0.00 57.03 56.98 3k2b h ASP 181 Cb 0.00 0.00 0.11 0.00 1.72 0.00 0.00 39.33 41.16 3k2b h ASP 181 CO 0.00 0.98 0.38 -1.10 -2.88 0.00 0.00 179.24 176.62 3k2b s GLN 182 N -2.70 1.86 0.23 0.28 -0.21 -1.03 -4.97 119.66 113.13 3k2b s GLN 182 Ca 0.00 0.23 -0.00 0.00 0.02 0.00 0.00 55.36 55.61 3k2b s GLN 182 Cb 0.10 -1.93 -0.04 0.00 1.00 0.00 0.00 33.01 32.14 3k2b s GLN 182 CO 0.82 -1.69 0.43 1.03 -2.12 0.00 0.00 175.29 173.76 3k2b s ARG 183 N -5.45 3.52 0.03 2.91 1.81 -0.88 -4.96 118.95 115.93 3k2b s ARG 183 Ca 0.62 -0.35 -0.17 0.00 -1.72 0.00 0.00 55.73 54.11 3k2b s ARG 183 Cb -0.12 -2.80 -0.25 0.00 -0.45 0.00 0.00 34.95 31.33 3k2b s ARG 183 CO 0.51 0.35 1.11 1.25 -0.68 0.00 0.00 175.30 177.83 3k2b h LEU 184 N 1.71 0.70 -8.63 2.53 5.85 -1.91 0.46 115.31 116.03 3k2b h LEU 184 Ca -0.49 -0.78 -0.42 0.00 0.84 0.00 0.00 57.88 57.03 3k2b h LEU 184 Cb 1.20 -0.22 -0.18 0.00 0.37 0.00 0.00 40.66 41.83 3k2b h LEU 184 CO 0.66 1.40 -0.76 -0.76 -0.34 0.00 0.00 178.44 178.64 3k2b s LEU 185 N -8.15 2.41 -0.47 2.25 1.43 -1.26 -3.81 118.68 111.08 3k2b s LEU 185 Ca -0.12 -0.82 -0.44 0.00 -1.03 0.00 0.00 54.13 51.73 3k2b s LEU 185 Cb 0.05 -0.57 -0.18 0.00 0.03 0.00 0.00 46.19 45.51 3k2b s LEU 185 CO 0.87 -0.14 1.98 0.47 0.23 0.00 0.00 176.35 179.76 3k2b n ASP 186 N 0.50 1.08 -3.64 2.29 9.92 -1.26 -4.52 116.55 120.92 3k2b n ASP 186 Ca -0.15 0.82 -0.11 0.00 -0.53 0.00 0.00 54.79 54.82 3k2b n ASP 186 Cb 0.57 -0.94 -0.05 0.00 -0.64 0.00 0.00 41.12 40.06 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 5.17 -0.94 0.34 2.24 0.00 -0.00 -4.96 121.76 123.60 3k2b s ALA 187 Ca 1.14 0.01 -0.27 0.00 0.00 0.00 0.00 51.96 52.84 3k2b s ALA 187 Cb -1.42 0.63 -0.13 0.00 0.00 0.00 0.00 23.12 22.20 3k2b s ALA 187 CO 0.69 -0.61 1.02 -1.13 0.00 0.00 0.00 175.76 175.73 3k2b n SER 188 N -0.09 1.34 -3.52 0.00 3.41 -1.26 -4.41 113.62 109.09 3k2b n SER 188 Ca -0.16 1.13 -0.13 0.00 -0.26 0.00 0.00 58.87 59.44 3k2b n SER 188 Cb 0.63 -1.32 -0.04 0.00 -0.26 0.00 0.00 64.21 63.22 3k2b n SER 188 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3k2b s HIS 190 N -1.14 -0.50 0.30 7.33 5.04 -1.26 -4.91 115.29 120.15 3k2b s HIS 190 Ca 0.60 0.71 0.01 0.00 -1.54 0.00 0.00 55.06 54.84 3k2b s HIS 190 Cb -0.64 0.46 0.47 0.00 0.04 0.00 0.00 32.58 32.91 3k2b s HIS 190 CO 0.59 -0.55 1.82 0.07 -2.34 0.00 0.00 174.74 174.33 3k2b h ARG 191 N 2.56 0.65 -5.19 2.88 -0.00 -1.99 -3.38 114.38 109.91 3k2b h ARG 191 Ca -0.24 -0.16 -0.64 0.00 -0.00 0.00 0.00 59.98 58.94 3k2b h ARG 191 Cb 1.19 -0.08 -0.15 0.00 -0.00 0.00 0.00 29.97 30.92 3k2b h ARG 191 CO 0.35 0.67 -0.14 0.34 -0.00 0.00 0.00 179.97 181.19 3k2b s ASP 192 N -6.69 6.29 0.00 0.08 -1.08 -1.26 -4.95 116.67 109.06 3k2b s ASP 192 Ca -0.08 0.12 0.13 0.00 -0.52 0.00 0.00 52.55 52.19 3k2b s ASP 192 Cb 0.15 -2.24 0.58 0.00 -1.46 0.00 0.00 42.92 39.95 3k2b s ASP 192 CO 0.79 -0.34 1.37 0.18 0.52 0.00 0.00 175.17 177.69 3k2b n LEU 193 N 5.53 0.00 -0.04 -1.34 4.77 -1.26 -2.44 117.00 122.23 3k2b n LEU 193 Ca -0.06 0.41 -0.22 0.00 -0.03 0.00 0.00 56.01 56.11 3k2b n LEU 193 Cb 0.50 -0.41 -0.13 0.00 -2.33 0.00 0.00 43.42 41.04 3k2b n LEU 193 CO 0.41 -0.24 -0.82 0.54 -1.33 0.00 0.00 177.39 175.96 3k2b n ARG 194 N -1.41 0.70 0.06 3.23 5.12 -1.26 -3.96 116.66 119.14 3k2b n ARG 194 Ca 0.04 0.32 0.09 0.00 -1.93 0.00 0.00 57.85 56.37 3k2b n ARG 194 Cb 0.13 -1.69 0.38 0.00 -1.16 0.00 0.00 32.46 30.11 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 -3.71 0.09 0.20 5.56 1.74 -1.10 -1.81 116.66 117.63 3k2b n ARG 195 Ca -0.34 0.36 0.08 0.00 -0.77 0.00 0.00 57.85 57.18 3k2b n ARG 195 Cb 0.96 -1.67 0.29 0.00 -1.02 0.00 0.00 32.46 31.01 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 2.34 0.91 -2.51 7.54 0.00 -1.60 -2.34 119.26 123.59 3k2b h ALA 196 Ca 0.00 -0.24 -0.48 0.00 0.00 0.00 0.00 54.91 54.18 3k2b h ALA 196 Cb 0.26 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.02 3k2b h ALA 196 CO 0.00 0.34 0.40 1.03 0.00 0.00 0.00 179.25 181.02 3k2b s ARG 197 N -3.37 4.28 -0.96 0.00 1.81 -0.75 -0.82 118.95 119.13 3k2b s ARG 197 Ca 0.03 1.50 -0.32 0.00 -1.72 0.00 0.00 55.73 55.21 3k2b s ARG 197 Cb 0.09 -2.64 -0.22 0.00 -0.45 0.00 0.00 34.95 31.73 3k2b s ARG 197 CO 0.67 -0.03 2.66 0.00 -0.68 0.00 0.00 175.30 177.92 3k2b n ALA 198 N 0.14 0.29 -0.16 2.13 0.00 -1.26 -4.40 120.51 117.24 3k2b n ALA 198 Ca 0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 53.44 53.19 3k2b n ALA 198 Cb 0.49 -2.26 0.03 0.00 0.00 0.00 0.00 19.45 17.71 3k2b n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b h ALA 199 N 11.84 0.20 0.00 0.00 0.00 -0.99 -1.64 119.26 128.67 3k2b h ALA 199 Ca -0.05 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3k2b h ALA 199 Cb 1.32 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.62 3k2b h ALA 199 CO 1.37 -0.52 0.00 0.00 0.00 0.00 0.00 179.25 180.09 3k2b n ALA 200 N -2.97 2.47 0.13 0.00 0.00 -1.26 -3.43 120.51 115.43 3k2b n ALA 200 Ca 0.04 -0.15 0.10 0.00 0.00 0.00 0.00 53.44 53.43 3k2b n ALA 200 Cb 0.31 -1.47 -0.15 0.00 0.00 0.00 0.00 19.45 18.15 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 -1.20 0.13 -4.46 0.00 4.77 -0.65 -4.73 117.00 110.86 3k2b n LEU 201 Ca 0.16 -0.08 -0.22 0.00 -0.03 0.00 0.00 56.01 55.84 3k2b n LEU 201 Cb 0.19 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.18 3k2b n LEU 201 CO 0.20 0.03 -0.34 0.20 -1.33 0.00 0.00 177.39 176.16 3k2b s ASN 202 N -4.03 2.85 -0.42 -1.43 -0.87 -0.99 -5.03 114.94 105.02 3k2b s ASN 202 Ca -0.05 -1.25 -0.14 0.00 -1.57 0.00 0.00 52.86 49.85 3k2b s ASN 202 Cb 0.13 -0.18 0.04 0.00 -0.02 0.00 0.00 41.25 41.21 3k2b s ASN 202 CO 0.81 -0.40 0.31 -0.63 -2.57 0.00 0.00 177.10 174.61 3k2b s ILE 203 N -3.02 5.12 -0.38 0.60 1.01 -1.26 -3.97 121.20 119.30 3k2b s ILE 203 Ca 0.32 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 3k2b s ILE 203 Cb 0.05 -3.92 0.07 0.00 0.01 0.00 0.00 42.46 38.68 3k2b s ILE 203 CO 0.14 -0.37 0.19 -0.69 0.00 0.00 0.00 174.94 174.20 3k2b s VAL 204 N 1.64 3.90 0.48 2.92 1.01 0.50 -4.90 120.40 125.95 3k2b s VAL 204 Ca 0.04 -1.39 -0.23 0.00 0.00 0.00 0.00 61.98 60.40 3k2b s VAL 204 Cb -0.20 -3.35 -0.07 0.00 0.00 0.00 0.00 36.38 32.75 3k2b s VAL 204 CO 0.08 -0.40 1.21 -2.84 0.00 0.00 0.00 175.10 173.16 3k2b s PRO 205 N 1.37 3.64 -0.03 2.72 0.02 -1.26 -0.82 135.00 140.64 3k2b s PRO 205 Ca 0.02 1.89 -0.29 0.00 0.02 0.00 0.00 61.00 62.64 3k2b s PRO 205 Cb -0.22 -2.39 0.08 0.00 0.02 0.00 0.00 34.50 31.99 3k2b s PRO 205 CO 0.01 -0.69 0.73 -0.08 -0.33 0.00 0.00 177.00 176.65 3k2b s THR 206 N -1.48 0.00 0.95 0.99 -1.32 -0.30 -4.75 115.64 109.73 3k2b s THR 206 Ca 0.65 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 61.01 3k2b s THR 206 Cb -0.32 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 69.84 3k2b s THR 206 CO 0.38 0.00 1.09 -0.94 -2.21 0.00 0.00 174.62 172.94 3k2b s SER 207 N -1.56 2.99 -0.06 8.08 1.04 -1.26 -0.40 113.70 122.52 3k2b s SER 207 Ca -0.06 1.31 -0.12 0.00 0.48 0.00 0.00 55.95 57.56 3k2b s SER 207 Cb -0.00 -1.98 0.02 0.00 0.10 0.00 0.00 66.02 64.16 3k2b s SER 207 CO 0.03 -2.92 0.29 0.28 0.98 0.00 0.00 173.24 171.91 3k2b s THR 208 N -2.96 0.03 -0.85 2.02 -1.32 -1.26 -4.61 115.64 106.70 3k2b s THR 208 Ca 0.64 -0.26 0.21 0.00 -1.21 0.00 0.00 61.69 61.08 3k2b s THR 208 Cb -0.18 -0.51 -0.23 0.00 -1.51 0.00 0.00 72.50 70.07 3k2b s THR 208 CO 0.57 -0.14 0.87 0.61 -2.21 0.00 0.00 174.62 174.32 3k2b n GLY 209 N 2.11 -1.02 0.38 6.08 0.00 -1.26 -4.57 105.19 106.90 3k2b n GLY 209 Ca -0.17 -0.57 -0.04 0.00 0.00 0.00 0.00 46.02 45.23 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 2.84 -0.05 -0.85 4.61 0.00 -1.96 0.51 119.26 124.36 3k2b h ALA 210 Ca 0.00 0.20 0.20 0.00 0.00 0.00 0.00 54.91 55.31 3k2b h ALA 210 Cb 0.58 0.97 -0.06 0.00 0.00 0.00 0.00 17.79 19.28 3k2b h ALA 210 CO 0.00 -0.71 0.57 0.00 0.00 0.00 0.00 179.25 179.12 3k2b h ALA 211 N 1.05 2.26 0.00 0.00 0.00 -1.91 0.54 119.26 121.21 3k2b h ALA 211 Ca 0.27 0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.87 3k2b h ALA 211 Cb 0.56 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 3k2b h ALA 211 CO -0.84 -0.52 -1.88 1.17 0.00 0.00 0.00 179.25 177.17 3k2b n LYS 212 N -4.47 0.65 -0.20 0.00 4.81 0.10 -4.11 118.16 114.93 3k2b n LYS 212 Ca 0.18 0.23 -0.03 0.00 -0.87 0.00 0.00 58.31 57.81 3k2b n LYS 212 Cb 0.68 -1.73 0.16 0.00 0.02 0.00 0.00 35.03 34.17 3k2b n LYS 212 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3k2b h ALA 213 N 0.97 1.21 -1.04 3.14 0.00 0.13 -2.57 119.26 121.11 3k2b h ALA 213 Ca -0.35 -0.17 0.29 0.00 0.00 0.00 0.00 54.91 54.68 3k2b h ALA 213 Cb 2.07 -0.26 -0.13 0.00 0.00 0.00 0.00 17.79 19.47 3k2b h ALA 213 CO 0.07 0.57 0.62 0.28 0.00 0.00 0.00 179.25 180.79 3k2b h VAL 214 N 0.96 0.41 0.00 0.00 2.07 -1.11 0.52 116.25 119.09 3k2b h VAL 214 Ca 0.22 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3k2b h VAL 214 Cb 0.19 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 3k2b h VAL 214 CO -0.02 0.08 0.03 0.00 0.02 0.00 0.00 177.57 177.68 3k2b h ALA 215 N 1.74 1.03 -0.00 1.67 0.00 -1.66 0.23 119.26 122.27 3k2b h ALA 215 Ca 0.68 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 55.38 3k2b h ALA 215 Cb 1.56 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3k2b h ALA 215 CO -0.49 -0.03 -0.92 -0.07 0.00 0.00 0.00 179.25 177.74 3k2b h LEU 216 N 0.00 0.47 0.00 0.00 3.38 -0.13 -2.82 115.31 116.22 3k2b h LEU 216 Ca 0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3k2b h LEU 216 Cb 0.06 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3k2b h LEU 216 CO 0.00 1.18 -1.48 1.33 0.09 0.00 0.00 178.44 179.55 3k2b n VAL 217 N -3.73 0.00 -3.26 1.22 0.24 -0.61 -4.55 118.33 107.64 3k2b n VAL 217 Ca -0.06 -0.26 -0.25 0.00 -2.04 0.00 0.00 64.34 61.73 3k2b n VAL 217 Cb 0.83 0.48 -0.07 0.00 -1.47 0.00 0.00 33.84 33.61 3k2b n VAL 217 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3k2b n LEU 218 N -1.87 1.67 -0.22 1.34 4.77 0.70 -4.78 117.00 118.61 3k2b n LEU 218 Ca -0.00 -5.02 0.10 0.00 -0.03 0.00 0.00 56.01 51.05 3k2b n LEU 218 Cb 0.44 0.13 0.19 0.00 -2.33 0.00 0.00 43.42 41.84 3k2b n LEU 218 CO 0.42 2.09 0.51 -2.65 -1.33 0.00 0.00 177.39 176.43 3k2b n PRO 219 N 1.08 -0.05 0.11 3.23 -0.02 -1.06 0.94 135.00 139.22 3k2b n PRO 219 Ca 0.25 0.95 0.19 0.00 -2.02 0.00 0.00 63.50 62.87 3k2b n PRO 219 Cb 0.49 -1.52 0.75 0.00 -0.02 0.00 0.00 33.50 33.20 3k2b n PRO 219 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 3k2b h ASN 220 N 0.00 0.00 -0.02 2.55 -1.24 -1.94 -0.29 115.58 114.64 3k2b h ASN 220 Ca 0.39 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.40 3k2b h ASN 220 Cb 0.80 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.85 3k2b h ASN 220 CO -0.60 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 175.72 3k2b n LEU 221 N -4.01 0.21 -4.67 0.34 7.99 0.27 -4.88 117.00 112.24 3k2b n LEU 221 Ca 0.06 -0.09 -0.45 0.00 -0.01 0.00 0.00 56.01 55.52 3k2b n LEU 221 Cb 0.48 -0.01 -0.04 0.00 -0.11 0.00 0.00 43.42 43.74 3k2b n LEU 221 CO 0.31 0.04 1.51 1.17 -1.51 0.00 0.00 177.39 178.91 3k2b n LYS 222 N -0.67 2.53 -0.97 3.23 4.81 -0.12 -1.83 118.16 125.13 3k2b n LYS 222 Ca 0.15 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.52 3k2b n LYS 222 Cb 0.10 -2.82 0.00 0.00 0.02 0.00 0.00 35.03 32.34 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 4.37 0.70 0.12 3.14 0.00 -1.26 -4.90 105.19 107.35 3k2b n GLY 223 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.28 0.68 -2.56 1.61 5.02 -0.76 -5.02 118.16 114.85 3k2b n LYS 224 Ca 0.00 0.14 -0.24 0.00 -2.02 0.00 0.00 58.31 56.19 3k2b n LYS 224 Cb 0.02 -1.57 0.12 0.00 -0.02 0.00 0.00 35.03 33.58 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 -6.34 2.94 0.00 -0.35 1.43 -1.25 -2.22 118.68 112.89 3k2b s LEU 225 Ca -0.25 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 3k2b s LEU 225 Cb 0.08 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.42 3k2b s LEU 225 CO 0.70 -1.99 0.00 -3.20 0.23 0.00 0.00 176.35 172.09 3k2b n ASN 226 N -2.93 0.00 -3.40 2.29 5.15 -1.14 -4.75 115.26 110.48 3k2b n ASN 226 Ca 0.16 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 54.12 3k2b n ASN 226 Cb 0.61 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 39.88 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 -0.09 0.52 3.35 8.20 0.00 -1.26 -0.35 105.19 115.57 3k2b n GLY 227 Ca 0.00 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.72 3k2b n GLY 227 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k2b s ILE 228 N -2.05 0.00 0.07 -0.61 -4.36 -0.74 -4.34 121.20 109.17 3k2b s ILE 228 Ca 0.24 -1.85 0.04 0.00 -0.26 0.00 0.00 60.65 58.82 3k2b s ILE 228 Cb -0.02 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 3k2b s ILE 228 CO 0.04 0.00 -0.12 0.00 0.24 0.00 0.00 174.94 175.11 3k2b s ALA 229 N -3.39 0.99 -0.24 2.27 0.00 0.46 -1.99 121.76 119.86 3k2b s ALA 229 Ca 0.37 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.36 3k2b s ALA 229 Cb 0.02 -0.03 0.07 0.00 0.00 0.00 0.00 23.12 23.17 3k2b s ALA 229 CO 0.23 0.07 -0.02 -0.51 0.00 0.00 0.00 175.76 175.53 3k2b s LEU 230 N -1.83 2.45 -0.11 0.00 1.43 -0.33 -1.15 118.68 119.15 3k2b s LEU 230 Ca -0.03 -1.22 -0.30 0.00 -1.03 0.00 0.00 54.13 51.56 3k2b s LEU 230 Cb -0.09 -1.09 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 3k2b s LEU 230 CO 0.01 -0.27 1.04 -0.13 0.23 0.00 0.00 176.35 177.23 3k2b s ARG 231 N 1.46 4.40 0.26 1.70 1.81 -0.00 -0.15 118.95 128.43 3k2b s ARG 231 Ca -0.03 1.44 0.12 0.00 -1.72 0.00 0.00 55.73 55.54 3k2b s ARG 231 Cb -0.18 -3.55 -0.05 0.00 -0.45 0.00 0.00 34.95 30.72 3k2b s ARG 231 CO -0.08 -0.36 -0.18 0.14 -0.68 0.00 0.00 175.30 174.14 3k2b s VAL 232 N 2.13 2.59 -0.04 3.52 -7.23 0.99 -0.37 120.40 121.99 3k2b s VAL 232 Ca 0.49 -2.27 -0.00 0.00 -1.81 0.00 0.00 61.98 58.38 3k2b s VAL 232 Cb -0.19 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 3k2b s VAL 232 CO 0.18 -0.34 0.85 -2.65 -0.31 0.00 0.00 175.10 172.82 3k2b n PRO 233 N -0.49 0.14 -4.36 4.82 -0.02 -1.25 -2.62 135.00 131.22 3k2b n PRO 233 Ca -0.06 -0.28 -0.19 0.00 -2.02 0.00 0.00 63.50 60.94 3k2b n PRO 233 Cb 0.59 -1.75 -0.14 0.00 -0.02 0.00 0.00 33.50 32.18 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 3.76 0.83 -0.20 3.45 -4.23 -1.26 -5.01 115.64 112.98 3k2b s THR 234 Ca 0.03 -0.63 0.26 0.00 -1.18 0.00 0.00 61.69 60.17 3k2b s THR 234 Cb 0.01 -0.73 0.33 0.00 1.34 0.00 0.00 72.50 73.45 3k2b s THR 234 CO -0.00 0.10 1.73 1.55 -0.54 0.00 0.00 174.62 177.46 3k2b h PRO 235 N 5.51 0.00 -2.28 3.99 0.13 -1.85 -1.03 132.00 136.46 3k2b h PRO 235 Ca -0.33 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.92 3k2b h PRO 235 Cb 1.18 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 3k2b h PRO 235 CO 0.47 0.05 0.50 1.21 -0.23 0.00 0.00 178.00 180.00 3k2b s ASN 236 N -6.06 -0.32 0.00 1.44 2.47 -1.26 -4.74 114.94 106.46 3k2b s ASN 236 Ca 0.04 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.24 3k2b s ASN 236 Cb 0.07 0.40 0.00 0.00 -1.45 0.00 0.00 41.25 40.27 3k2b s ASN 236 CO 0.63 -0.67 0.00 0.52 -3.72 0.00 0.00 177.10 173.86 3k2b n VAL 237 N -0.29 -0.85 -4.27 -5.21 0.31 -1.26 -4.87 118.33 101.89 3k2b n VAL 237 Ca -0.08 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.08 3k2b n VAL 237 Cb 0.62 -0.85 -0.09 0.00 -0.91 0.00 0.00 33.84 32.61 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 -0.85 1.12 -0.02 4.52 0.01 0.35 -3.68 113.70 115.15 3k2b s SER 238 Ca 0.00 -1.58 -0.02 0.00 1.31 0.00 0.00 55.95 55.66 3k2b s SER 238 Cb 0.00 0.45 0.01 0.00 0.21 0.00 0.00 66.02 66.69 3k2b s SER 238 CO 0.00 -0.94 0.05 0.54 0.41 0.00 0.00 173.24 173.30 3k2b s VAL 239 N -3.73 -0.01 -0.11 3.43 0.11 -0.66 -1.88 120.40 117.55 3k2b s VAL 239 Ca 0.39 0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.46 3k2b s VAL 239 Cb 0.05 -0.09 -0.03 0.00 -1.53 0.00 0.00 36.38 34.78 3k2b s VAL 239 CO 0.20 0.01 -0.07 0.68 -3.33 0.00 0.00 175.10 172.59 3k2b s VAL 240 N 0.17 3.65 -0.34 2.04 -7.23 -0.68 -0.97 120.40 117.04 3k2b s VAL 240 Ca -0.01 -0.47 -0.04 0.00 -1.81 0.00 0.00 61.98 59.65 3k2b s VAL 240 Cb -0.02 -2.53 0.06 0.00 0.56 0.00 0.00 36.38 34.45 3k2b s VAL 240 CO -0.00 0.55 0.09 -0.62 -0.31 0.00 0.00 175.10 174.80 3k2b s ASP 241 N -0.24 5.13 -0.05 4.85 -1.08 0.17 -1.87 116.67 123.58 3k2b s ASP 241 Ca 0.03 -1.42 0.02 0.00 -0.52 0.00 0.00 52.55 50.66 3k2b s ASP 241 Cb -0.13 -1.80 -0.03 0.00 -1.46 0.00 0.00 42.92 39.51 3k2b s ASP 241 CO 0.03 -0.36 -0.07 -0.22 0.52 0.00 0.00 175.17 175.06 3k2b s LEU 242 N 1.28 3.13 -0.10 -1.34 2.96 -0.39 -0.20 118.68 124.02 3k2b s LEU 242 Ca -0.01 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 3k2b s LEU 242 Cb -0.21 -1.71 0.03 0.00 0.50 0.00 0.00 46.19 44.81 3k2b s LEU 242 CO -0.01 0.34 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.67 3k2b s VAL 243 N -0.85 0.54 0.09 1.68 1.01 -0.70 -0.35 120.40 121.82 3k2b s VAL 243 Ca 0.14 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.09 3k2b s VAL 243 Cb -0.11 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 3k2b s VAL 243 CO 0.03 0.20 -0.14 0.68 0.00 0.00 0.00 175.10 175.87 3k2b s VAL 244 N 1.90 1.19 -0.48 2.92 -7.23 -0.57 -1.04 120.40 117.08 3k2b s VAL 244 Ca 0.04 -1.46 -0.16 0.00 -1.81 0.00 0.00 61.98 58.59 3k2b s VAL 244 Cb -0.13 -1.24 0.08 0.00 0.56 0.00 0.00 36.38 35.64 3k2b s VAL 244 CO -0.06 -0.29 0.43 -1.58 -0.31 0.00 0.00 175.10 173.28 3k2b s GLN 245 N -2.08 3.00 0.58 4.82 0.74 0.42 -0.96 119.66 126.17 3k2b s GLN 245 Ca 0.02 -1.33 -0.12 0.00 0.05 0.00 0.00 55.36 53.98 3k2b s GLN 245 Cb -0.08 -4.14 -0.05 0.00 1.10 0.00 0.00 33.01 29.84 3k2b s GLN 245 CO 0.02 -1.07 0.99 0.14 -0.55 0.00 0.00 175.29 174.82 3k2b s VAL 246 N 1.75 4.68 0.06 1.34 -7.23 0.25 -0.71 120.40 120.54 3k2b s VAL 246 Ca 0.05 0.90 0.01 0.00 -1.81 0.00 0.00 61.98 61.13 3k2b s VAL 246 Cb -0.24 -3.83 -0.26 0.00 0.56 0.00 0.00 36.38 32.62 3k2b s VAL 246 CO 0.07 -0.99 1.05 -1.28 -0.31 0.00 0.00 175.10 173.64 3k2b h SER 247 N 0.08 0.26 -3.84 4.85 0.87 0.27 -3.44 113.55 112.60 3k2b h SER 247 Ca -0.45 -0.31 -0.64 0.00 -1.23 0.00 0.00 61.79 59.15 3k2b h SER 247 Cb 1.19 -0.08 -0.17 0.00 -0.44 0.00 0.00 62.40 62.90 3k2b h SER 247 CO 0.62 1.25 -0.47 -0.75 -0.53 0.00 0.00 176.83 176.96 3k2b s LYS 248 N -2.65 3.89 0.26 2.24 2.20 -0.18 -5.03 119.74 120.46 3k2b s LYS 248 Ca -0.04 -0.31 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 3k2b s LYS 248 Cb 0.08 -3.68 -0.14 0.00 -1.51 0.00 0.00 37.83 32.58 3k2b s LYS 248 CO 0.85 -0.24 1.22 1.63 -0.36 0.00 0.00 175.35 178.45 3k2b n LYS 249 N 5.12 1.66 -0.81 4.03 5.02 -1.26 -4.90 118.16 127.01 3k2b n LYS 249 Ca -0.13 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 3k2b n LYS 249 Cb 0.51 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 3k2b n LYS 249 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3k2b n THR 250 N 1.04 0.00 -3.68 -0.18 5.66 0.43 -5.02 114.28 112.53 3k2b n THR 250 Ca 0.10 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.98 3k2b n THR 250 Cb 0.31 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.02 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 -4.93 -0.24 0.23 1.09 -0.71 -1.26 -4.59 117.98 107.57 3k2b s PHE 251 Ca 0.00 0.20 -0.14 0.00 -1.04 0.00 0.00 56.93 55.95 3k2b s PHE 251 Cb 0.00 0.20 0.29 0.00 -1.21 0.00 0.00 43.02 42.30 3k2b s PHE 251 CO 0.00 -0.55 1.49 0.00 -1.34 0.00 0.00 175.22 174.81 3k2b n ALA 252 N 0.56 -0.02 -0.06 1.99 0.00 -1.26 -1.21 120.51 120.51 3k2b n ALA 252 Ca -0.19 0.98 -0.09 0.00 0.00 0.00 0.00 53.44 54.14 3k2b n ALA 252 Cb 0.59 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.54 3k2b n ALA 252 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3k2b h GLU 253 N 0.00 0.28 -0.89 0.00 3.07 -1.96 -1.52 114.58 113.57 3k2b h GLU 253 Ca 0.37 -0.02 0.03 0.00 -0.50 0.00 0.00 59.36 59.24 3k2b h GLU 253 Cb 0.61 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.40 3k2b h GLU 253 CO -0.96 0.19 0.58 1.49 -1.40 0.00 0.00 179.01 178.91 3k2b h GLU 254 N 0.29 1.09 0.09 2.33 4.81 -1.58 -2.15 114.58 119.47 3k2b h GLU 254 Ca 0.10 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3k2b h GLU 254 Cb -0.00 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.13 3k2b h GLU 254 CO -0.05 0.72 -0.04 0.28 -0.73 0.00 0.00 179.01 179.19 3k2b h VAL 255 N 1.12 1.03 -0.73 0.32 2.07 -0.65 -2.60 116.25 116.81 3k2b h VAL 255 Ca 0.35 -0.43 0.09 0.00 0.82 0.00 0.00 66.70 67.53 3k2b h VAL 255 Cb -0.00 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 3k2b h VAL 255 CO -0.10 0.11 0.48 0.78 0.02 0.00 0.00 177.57 178.86 3k2b h ASN 256 N -0.31 0.61 0.62 0.57 -0.26 -0.99 -2.06 115.58 113.75 3k2b h ASN 256 Ca -0.01 0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.71 3k2b h ASN 256 Cb 0.26 -0.12 0.01 0.00 -1.06 0.00 0.00 38.32 37.41 3k2b h ASN 256 CO 0.02 0.37 -0.30 0.00 -1.06 0.00 0.00 177.43 176.46 3k2b h ALA 257 N 1.62 -0.83 -0.92 -0.83 0.00 -1.24 -1.36 119.26 115.69 3k2b h ALA 257 Ca 0.33 -0.18 0.27 0.00 0.00 0.00 0.00 54.91 55.32 3k2b h ALA 257 Cb 0.40 0.32 -0.15 0.00 0.00 0.00 0.00 17.79 18.36 3k2b h ALA 257 CO -0.12 -0.97 0.31 0.00 0.00 0.00 0.00 179.25 178.48 3k2b h ALA 258 N -0.46 1.47 -0.07 0.00 0.00 -0.99 0.13 119.26 119.34 3k2b h ALA 258 Ca -0.09 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3k2b h ALA 258 Cb 0.64 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3k2b h ALA 258 CO 0.14 -0.52 -0.01 0.74 0.00 0.00 0.00 179.25 179.59 3k2b h PHE 259 N 0.21 0.14 -0.87 0.00 0.04 -1.05 -2.29 116.94 113.12 3k2b h PHE 259 Ca 0.61 -0.03 0.12 0.00 2.80 0.00 0.00 57.97 61.48 3k2b h PHE 259 Cb 1.31 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 39.36 3k2b h PHE 259 CO -0.21 0.45 0.56 0.00 -0.60 0.00 0.00 178.31 178.51 3k2b h ARG 260 N -0.20 0.72 0.93 1.51 3.08 0.28 0.42 114.38 121.12 3k2b h ARG 260 Ca 0.02 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 3k2b h ARG 260 Cb 0.40 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.30 3k2b h ARG 260 CO 0.01 0.48 -0.45 -0.44 -1.07 0.00 0.00 179.97 178.50 3k2b h ASP 261 N 0.74 -1.06 -0.77 7.04 5.19 -0.86 -2.04 116.42 124.66 3k2b h ASP 261 Ca 0.42 0.04 0.18 0.00 -0.62 0.00 0.00 57.03 57.05 3k2b h ASP 261 Cb 0.60 0.27 -0.12 0.00 0.18 0.00 0.00 39.33 40.26 3k2b h ASP 261 CO -0.19 -0.75 0.14 0.28 -3.12 0.00 0.00 179.24 175.61 3k2b h SER 262 N -1.27 -0.09 -0.42 6.45 0.02 -0.67 0.76 113.55 118.33 3k2b h SER 262 Ca -0.13 0.17 0.10 0.00 -0.84 0.00 0.00 61.79 61.09 3k2b h SER 262 Cb 0.96 0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 3k2b h SER 262 CO 0.21 -0.10 0.30 0.00 -1.14 0.00 0.00 176.83 176.09 3k2b h ALA 263 N 1.67 2.23 0.15 3.77 0.00 0.03 -0.70 119.26 126.41 3k2b h ALA 263 Ca 0.44 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.99 3k2b h ALA 263 Cb 0.80 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3k2b h ALA 263 CO -0.58 -0.33 -1.78 0.93 0.00 0.00 0.00 179.25 177.48 3k2b h GLU 264 N 0.13 0.32 0.00 0.00 5.08 0.11 -3.25 114.58 116.97 3k2b h GLU 264 Ca 0.20 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 3k2b h GLU 264 Cb 0.62 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.07 3k2b h GLU 264 CO -0.02 1.22 0.00 1.63 -1.00 0.00 0.00 179.01 180.83 3k2b n LYS 265 N -3.51 0.00 -0.16 2.33 5.02 0.51 -4.60 118.16 117.74 3k2b n LYS 265 Ca -0.25 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.00 3k2b n LYS 265 Cb 1.06 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 36.13 3k2b n LYS 265 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 3k2b h GLU 266 N 0.00 0.45 -0.86 1.97 9.09 -1.82 -2.60 114.58 120.80 3k2b h GLU 266 Ca 0.00 -0.03 -0.10 0.00 0.05 0.00 0.00 59.36 59.28 3k2b h GLU 266 Cb 0.00 -0.10 -0.06 0.00 -1.65 0.00 0.00 28.75 26.94 3k2b h GLU 266 CO 0.00 0.29 0.13 1.28 0.05 0.00 0.00 179.01 180.76 3k2b n LEU 267 N -4.92 4.01 -4.58 3.06 4.77 -0.31 -4.92 117.00 114.11 3k2b n LEU 267 Ca 0.04 -2.07 -0.50 0.00 -0.03 0.00 0.00 56.01 53.46 3k2b n LEU 267 Cb 0.15 -0.63 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 3k2b n LEU 267 CO 0.28 0.57 1.63 1.17 -1.33 0.00 0.00 177.39 179.71 3k2b n LYS 268 N 0.08 1.57 0.00 3.23 3.00 -0.98 -0.46 118.16 124.59 3k2b n LYS 268 Ca 0.21 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 3k2b n LYS 268 Cb 0.88 -2.56 0.00 0.00 0.00 0.00 0.00 35.03 33.35 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 5.37 3.34 0.11 3.14 0.00 -1.26 -4.83 105.19 111.05 3k2b n GLY 269 Ca 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 1.32 -4.29 -0.61 -0.00 0.39 -4.49 119.36 109.69 3k2b n ILE 270 Ca 0.00 -0.62 -0.25 0.00 -0.00 0.00 0.00 62.75 61.89 3k2b n ILE 270 Cb 0.00 -1.03 -0.08 0.00 -0.00 0.00 0.00 39.64 38.53 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 -6.01 3.13 -0.30 1.39 2.96 -0.55 0.37 118.68 119.67 3k2b s LEU 271 Ca -0.24 -0.61 -0.12 0.00 -0.22 0.00 0.00 54.13 52.95 3k2b s LEU 271 Cb 0.07 -1.71 0.15 0.00 0.50 0.00 0.00 46.19 45.20 3k2b s LEU 271 CO 0.62 0.04 0.82 -0.62 -1.32 0.00 0.00 176.35 175.89 3k2b s ASP 272 N -3.33 -0.87 -0.09 3.68 2.15 -0.04 -4.72 116.67 113.45 3k2b s ASP 272 Ca 0.29 1.18 -0.28 0.00 0.43 0.00 0.00 52.55 54.17 3k2b s ASP 272 Cb -0.07 1.99 -0.02 0.00 -0.30 0.00 0.00 42.92 44.51 3k2b s ASP 272 CO 0.18 -0.17 0.95 -0.69 -0.17 0.00 0.00 175.17 175.27 3k2b s VAL 273 N 2.68 4.84 -0.14 1.11 1.01 -1.26 -2.07 120.40 126.58 3k2b s VAL 273 Ca -0.04 1.93 -0.03 0.00 0.00 0.00 0.00 61.98 63.84 3k2b s VAL 273 Cb -0.09 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 3k2b s VAL 273 CO -0.18 0.07 -0.04 0.00 0.00 0.00 0.00 175.10 174.95 3k2b n ASP 275 N 3.19 2.69 -4.84 0.00 8.00 -1.26 -2.63 116.55 121.70 3k2b n ASP 275 Ca -0.18 -2.00 -0.38 0.00 0.71 0.00 0.00 54.79 52.95 3k2b n ASP 275 Cb 0.53 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 41.39 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 -1.00 3.87 -1.07 -1.24 0.41 -1.26 -4.92 118.70 113.49 3k2b s GLU 276 Ca 0.17 0.33 -0.19 0.00 -0.41 0.00 0.00 54.97 54.87 3k2b s GLU 276 Cb 0.09 -3.23 -0.07 0.00 -1.78 0.00 0.00 34.13 29.14 3k2b s GLU 276 CO 0.12 0.67 2.02 -0.35 -0.49 0.00 0.00 175.26 177.23 3k2b n PRO 277 N 1.95 2.08 -1.74 0.39 -0.04 -1.26 -4.90 135.00 131.49 3k2b n PRO 277 Ca -0.15 -2.23 -0.12 0.00 -0.04 0.00 0.00 63.50 60.96 3k2b n PRO 277 Cb 0.53 -3.14 0.06 0.00 -0.04 0.00 0.00 33.50 30.91 3k2b n PRO 277 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3k2b n LEU 278 N 7.53 0.00 -4.09 1.53 4.77 -1.26 -5.14 117.00 120.34 3k2b n LEU 278 Ca 0.50 -1.16 -0.08 0.00 -0.03 0.00 0.00 56.01 55.24 3k2b n LEU 278 Cb 0.41 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.09 3k2b n LEU 278 CO 0.95 -0.72 -0.29 0.68 -1.33 0.00 0.00 177.39 176.68 3k2b s VAL 279 N -1.37 0.16 0.06 4.08 -7.23 -1.26 -5.06 120.40 109.78 3k2b s VAL 279 Ca 0.34 -1.78 -0.12 0.00 -1.81 0.00 0.00 61.98 58.62 3k2b s VAL 279 Cb -0.02 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 35.15 3k2b s VAL 279 CO 0.23 -0.71 0.66 -1.54 -0.31 0.00 0.00 175.10 173.43 3k2b n SER 280 N -0.01 -0.41 -0.02 4.85 3.41 -1.26 -0.22 113.62 119.97 3k2b n SER 280 Ca -0.10 0.75 0.20 0.00 -0.26 0.00 0.00 58.87 59.47 3k2b n SER 280 Cb 0.62 -0.12 0.68 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 0.73 0.00 -3.33 3.04 -1.97 0.34 116.25 115.06 3k2b h VAL 281 Ca 0.06 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.75 3k2b h VAL 281 Cb 0.16 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 30.15 3k2b h VAL 281 CO -0.36 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 176.67 3k2b n ASP 282 N -4.38 0.00 -0.71 3.17 8.00 0.69 -1.78 116.55 121.54 3k2b n ASP 282 Ca 0.10 0.40 0.07 0.00 0.71 0.00 0.00 54.79 56.07 3k2b n ASP 282 Cb 0.62 -0.42 0.14 0.00 -0.02 0.00 0.00 41.12 41.44 3k2b n ASP 282 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3k2b n PHE 283 N -1.42 0.34 -1.67 1.24 3.72 0.11 -4.94 117.46 114.83 3k2b n PHE 283 Ca 0.01 -0.28 -0.45 0.00 -0.05 0.00 0.00 57.45 56.68 3k2b n PHE 283 Cb 0.04 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 3k2b n PHE 283 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3k2b n ARG 284 N 0.80 2.13 -1.26 -1.08 5.12 -0.74 -1.09 116.66 120.54 3k2b n ARG 284 Ca 0.12 0.76 -0.09 0.00 -1.93 0.00 0.00 57.85 56.71 3k2b n ARG 284 Cb 0.42 -2.47 -0.04 0.00 -1.16 0.00 0.00 32.46 29.21 3k2b n ARG 284 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3k2b s SER 286 N -2.75 6.73 0.00 0.00 0.15 -0.25 -4.87 113.70 112.72 3k2b s SER 286 Ca 0.00 2.35 0.31 0.00 0.70 0.00 0.00 55.95 59.31 3k2b s SER 286 Cb 0.00 -2.57 1.62 0.00 -1.71 0.00 0.00 66.02 63.35 3k2b s SER 286 CO 0.00 -0.77 2.10 0.47 1.20 0.00 0.00 173.24 176.24 3k2b n ASP 287 N 4.92 0.01 -4.81 5.45 8.00 -1.26 -3.83 116.55 125.03 3k2b n ASP 287 Ca 0.14 -0.37 -0.37 0.00 0.71 0.00 0.00 54.79 54.90 3k2b n ASP 287 Cb 0.42 -0.21 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 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 -2.42 3.69 -0.22 1.24 0.08 -1.26 -4.84 117.98 114.25 3k2b s PHE 288 Ca 0.34 1.42 0.19 0.00 0.12 0.00 0.00 56.93 59.00 3k2b s PHE 288 Cb 0.21 -2.64 0.31 0.00 -0.57 0.00 0.00 43.02 40.32 3k2b s PHE 288 CO 0.44 0.36 1.57 0.77 -0.10 0.00 0.00 175.22 178.26 3k2b h SER 289 N 3.56 0.00 -2.87 1.36 0.02 -0.34 -3.42 113.55 111.85 3k2b h SER 289 Ca -0.48 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 3k2b h SER 289 Cb 1.20 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.51 3k2b h SER 289 CO 0.65 0.28 -0.11 0.28 -1.14 0.00 0.00 176.83 176.79 3k2b s THR 290 N -3.15 -0.20 -0.30 -2.27 -1.32 -0.98 -3.78 115.64 103.63 3k2b s THR 290 Ca 0.05 0.03 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 3k2b s THR 290 Cb 0.07 -0.88 0.09 0.00 -1.51 0.00 0.00 72.50 70.27 3k2b s THR 290 CO 0.70 0.01 0.04 -0.89 -2.21 0.00 0.00 174.62 172.27 3k2b s THR 291 N 1.84 1.57 0.28 5.08 2.01 -0.69 -0.86 115.64 124.88 3k2b s THR 291 Ca -0.09 -1.70 -0.30 0.00 0.31 0.00 0.00 61.69 59.91 3k2b s THR 291 Cb -0.07 -2.08 -0.11 0.00 0.01 0.00 0.00 72.50 70.25 3k2b s THR 291 CO -0.18 -0.49 1.49 -0.63 -0.69 0.00 0.00 174.62 174.12 3k2b s ILE 292 N 1.29 2.40 -1.07 1.82 1.09 -0.88 -0.59 121.20 125.27 3k2b s ILE 292 Ca 0.06 0.35 -0.03 0.00 -1.10 0.00 0.00 60.65 59.93 3k2b s ILE 292 Cb -0.18 -3.22 0.25 0.00 -1.06 0.00 0.00 42.46 38.24 3k2b s ILE 292 CO -0.14 0.06 2.07 -0.67 -0.10 0.00 0.00 174.94 176.17 3k2b n ASP 293 N 2.02 7.54 0.00 3.58 -0.08 -0.18 -0.62 116.55 128.80 3k2b n ASP 293 Ca 0.06 -3.51 0.00 0.00 -1.51 0.00 0.00 54.79 49.83 3k2b n ASP 293 Cb 0.39 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.63 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 0.49 0.00 0.22 1.67 3.41 -1.08 0.67 113.62 119.00 3k2b n SER 294 Ca 0.53 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 59.29 3k2b n SER 294 Cb 0.27 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 64.81 3k2b n SER 294 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3k2b h SER 295 N 0.00 0.00 1.25 4.04 4.64 -1.91 -2.82 113.55 118.74 3k2b h SER 295 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3k2b h SER 295 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3k2b h SER 295 CO 0.00 0.00 -0.76 -0.07 -0.87 0.00 0.00 176.83 175.13 3k2b h LEU 296 N 0.00 0.00 -9.31 5.97 3.38 -0.15 -3.47 115.31 111.73 3k2b h LEU 296 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 3k2b h LEU 296 Cb 0.50 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.29 3k2b h LEU 296 CO 0.00 0.03 0.76 0.41 0.09 0.00 0.00 178.44 179.73 3k2b n THR 297 N -2.80 0.17 -4.32 0.22 -1.04 -1.07 -4.84 114.28 100.61 3k2b n THR 297 Ca 0.01 -0.03 -0.19 0.00 -2.04 0.00 0.00 64.05 61.80 3k2b n THR 297 Cb 0.56 -1.30 -0.10 0.00 -1.82 0.00 0.00 70.33 67.67 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 1.90 1.24 -0.20 -2.82 -1.94 -0.56 -4.84 119.30 112.08 3k2b s MET 298 Ca 0.87 -1.48 -0.05 0.00 -1.71 0.00 0.00 55.69 53.33 3k2b s MET 298 Cb -0.85 -1.09 0.07 0.00 2.01 0.00 0.00 34.83 34.98 3k2b s MET 298 CO 0.49 0.19 0.12 0.08 -0.01 0.00 0.00 175.02 175.89 3k2b s VAL 299 N -2.67 -0.13 -0.23 -6.03 1.01 -1.26 -0.98 120.40 110.12 3k2b s VAL 299 Ca 0.18 -0.28 -0.09 0.00 0.00 0.00 0.00 61.98 61.79 3k2b s VAL 299 Cb -0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 3k2b s VAL 299 CO 0.06 -0.36 0.13 -0.32 0.00 0.00 0.00 175.10 174.60 3k2b s MET 300 N 2.16 3.99 -1.36 2.72 0.00 0.15 -4.42 119.30 122.54 3k2b s MET 300 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 55.69 55.42 3k2b s MET 300 Cb -0.16 -3.44 0.00 0.00 0.00 0.00 0.00 34.83 31.23 3k2b s MET 300 CO -0.16 0.07 0.00 0.41 0.00 0.00 0.00 175.02 175.35 3k2b n GLY 301 N 4.21 0.66 4.20 2.11 0.00 -1.26 -1.95 105.19 113.17 3k2b n GLY 301 Ca -0.15 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3k2b n GLY 301 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k2b n ASP 302 N -0.49 0.00 0.00 1.61 8.00 -1.26 -4.60 116.55 119.81 3k2b n ASP 302 Ca -0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.35 3k2b n ASP 302 Cb 0.54 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 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 0.55 0.80 -4.29 -2.24 5.75 -1.23 -0.43 116.55 115.45 3k2b n ASP 303 Ca 0.00 -1.24 -0.40 0.00 -0.01 0.00 0.00 54.79 53.14 3k2b n ASP 303 Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 39.98 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 2.65 -0.12 0.11 1.75 -0.82 -0.58 119.30 122.04 3k2b s MET 304 Ca 0.00 -1.29 -0.06 0.00 -1.25 0.00 0.00 55.69 53.08 3k2b s MET 304 Cb 0.00 -3.68 -0.04 0.00 2.84 0.00 0.00 34.83 33.95 3k2b s MET 304 CO 0.00 -0.81 0.10 0.08 -0.65 0.00 0.00 175.02 173.74 3k2b s VAL 305 N 1.45 5.18 -0.14 10.11 1.01 -0.14 0.33 120.40 138.19 3k2b s VAL 305 Ca 0.02 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.09 3k2b s VAL 305 Cb -0.21 -3.26 -0.00 0.00 0.00 0.00 0.00 36.38 32.91 3k2b s VAL 305 CO 0.03 0.59 -0.18 -0.75 0.00 0.00 0.00 175.10 174.80 3k2b s LYS 306 N -0.76 3.18 -0.03 2.72 2.36 -0.15 -1.52 119.74 125.54 3k2b s LYS 306 Ca 0.13 -0.78 0.00 0.00 -2.55 0.00 0.00 55.97 52.77 3k2b s LYS 306 Cb -0.12 -2.54 0.03 0.00 -1.05 0.00 0.00 37.83 34.15 3k2b s LYS 306 CO 0.03 0.07 0.00 0.08 1.55 0.00 0.00 175.35 177.08 3k2b s VAL 307 N 0.66 0.20 -0.19 4.02 1.01 0.52 -1.50 120.40 125.14 3k2b s VAL 307 Ca -0.09 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 3k2b s VAL 307 Cb -0.16 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 3k2b s VAL 307 CO 0.02 0.16 -0.04 -0.63 0.00 0.00 0.00 175.10 174.61 3k2b s ILE 308 N 1.17 3.59 -0.05 2.22 -1.09 -1.26 -1.26 121.20 124.51 3k2b s ILE 308 Ca -0.08 -0.44 0.03 0.00 -2.23 0.00 0.00 60.65 57.93 3k2b s ILE 308 Cb -0.13 -2.60 0.01 0.00 -1.58 0.00 0.00 42.46 38.15 3k2b s ILE 308 CO -0.02 0.46 -0.13 0.00 -1.23 0.00 0.00 174.94 174.01 3k2b s ALA 309 N 0.92 1.26 0.38 9.38 0.00 -0.78 -1.01 121.76 131.91 3k2b s ALA 309 Ca -0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 3k2b s ALA 309 Cb -0.15 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 3k2b s ALA 309 CO 0.01 0.18 0.62 -1.58 0.00 0.00 0.00 175.76 174.98 3k2b s TRP 310 N 0.35 3.51 -0.22 0.00 0.52 0.24 -1.69 118.94 121.66 3k2b s TRP 310 Ca -0.08 0.52 -0.27 0.00 0.02 0.00 0.00 56.10 56.28 3k2b s TRP 310 Cb -0.13 -2.04 0.12 0.00 -1.15 0.00 0.00 33.47 30.27 3k2b s TRP 310 CO 0.03 0.02 0.98 1.52 0.02 0.00 0.00 176.95 179.51 3k2b s TYR 311 N -2.40 -0.46 -0.57 -1.98 1.13 -0.79 -1.70 117.35 110.57 3k2b s TYR 311 Ca 0.43 1.00 -0.21 0.00 -1.41 0.00 0.00 57.07 56.88 3k2b s TYR 311 Cb -0.10 0.39 0.07 0.00 -1.10 0.00 0.00 41.96 41.22 3k2b s TYR 311 CO 0.38 -0.31 0.78 0.34 -2.51 0.00 0.00 175.55 174.23 3k2b s ASP 312 N -0.37 6.23 0.58 -0.18 -1.08 -1.26 -0.50 116.67 120.08 3k2b s ASP 312 Ca 0.00 -0.94 0.32 0.00 -0.52 0.00 0.00 52.55 51.42 3k2b s ASP 312 Cb -0.03 -2.35 1.81 0.00 -1.46 0.00 0.00 42.92 40.89 3k2b s ASP 312 CO -0.02 -1.13 2.21 -0.55 0.52 0.00 0.00 175.17 176.20 3k2b h ASN 313 N 9.23 0.00 0.00 -0.34 -1.07 -1.91 -0.21 115.58 121.28 3k2b h ASN 313 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.09 3k2b h ASN 313 Cb 1.08 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 3k2b h ASN 313 CO 1.07 0.04 -0.12 -0.33 0.07 0.00 0.00 177.43 178.15 3k2b h GLU 314 N 0.00 0.00 0.50 4.14 5.08 -1.97 -3.36 114.58 118.96 3k2b h GLU 314 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3k2b h GLU 314 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3k2b h GLU 314 CO 0.01 0.00 -0.24 2.35 -1.00 0.00 0.00 179.01 180.13 3k2b h TRP 315 N -0.32 -0.62 -0.65 4.33 2.91 -1.93 -1.78 115.95 117.89 3k2b h TRP 315 Ca 0.00 -0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.12 3k2b h TRP 315 Cb 0.12 0.20 -0.08 0.00 -0.51 0.00 0.00 29.16 28.90 3k2b h TRP 315 CO -0.05 -0.37 0.24 0.78 -1.03 0.00 0.00 178.44 178.00 3k2b h GLY 316 N -0.69 0.93 0.89 2.65 0.00 -1.13 -0.50 103.07 105.22 3k2b h GLY 316 Ca -0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 3k2b h GLY 316 CO 0.11 -0.05 -0.26 -1.82 0.00 0.00 0.00 176.54 174.53 3k2b h TYR 317 N 0.41 -0.66 -0.85 5.60 3.20 -1.57 -2.41 116.97 120.68 3k2b h TYR 317 Ca 0.34 -0.02 0.20 0.00 3.14 0.00 0.00 58.73 62.40 3k2b h TYR 317 Cb 0.46 0.22 -0.12 0.00 1.54 0.00 0.00 36.73 38.83 3k2b h TYR 317 CO -0.18 -0.36 0.33 0.77 -1.64 0.00 0.00 178.16 177.08 3k2b h SER 318 N -0.84 0.24 -0.21 -2.11 0.02 -0.80 0.32 113.55 110.18 3k2b h SER 318 Ca -0.07 0.15 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3k2b h SER 318 Cb 0.60 0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 3k2b h SER 318 CO 0.12 -0.00 0.10 1.56 -1.14 0.00 0.00 176.83 177.47 3k2b h GLN 319 N 0.37 0.21 -0.94 3.45 1.08 -1.00 -0.92 115.11 117.37 3k2b h GLN 319 Ca 0.52 -0.01 0.11 0.00 -1.45 0.00 0.00 58.65 57.82 3k2b h GLN 319 Cb 0.95 -0.05 -0.08 0.00 -0.05 0.00 0.00 27.48 28.25 3k2b h GLN 319 CO -0.52 0.14 0.57 0.00 -0.95 0.00 0.00 178.83 178.07 3k2b h ARG 320 N 0.22 0.89 -0.71 1.46 2.47 -0.00 0.72 114.38 119.43 3k2b h ARG 320 Ca 0.08 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 3k2b h ARG 320 Cb 0.02 -0.20 -0.03 0.00 -1.65 0.00 0.00 29.97 28.11 3k2b h ARG 320 CO -0.06 0.59 0.35 0.28 0.56 0.00 0.00 179.97 181.69 3k2b h VAL 321 N 0.91 1.22 -0.15 2.04 2.07 0.31 -1.03 116.25 121.63 3k2b h VAL 321 Ca 0.46 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3k2b h VAL 321 Cb 0.45 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3k2b h VAL 321 CO -0.26 0.26 0.00 0.58 0.02 0.00 0.00 177.57 178.17 3k2b h VAL 322 N 1.00 1.25 -0.80 2.57 2.07 0.34 -0.89 116.25 121.79 3k2b h VAL 322 Ca 0.25 -0.83 0.09 0.00 0.82 0.00 0.00 66.70 67.02 3k2b h VAL 322 Cb 0.09 1.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 3k2b h VAL 322 CO -0.03 0.25 0.52 0.44 0.02 0.00 0.00 177.57 178.76 3k2b h ASP 323 N 0.01 0.70 0.65 0.57 3.32 -0.44 0.27 116.42 121.50 3k2b h ASP 323 Ca 0.04 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 56.95 3k2b h ASP 323 Cb 0.37 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 3k2b h ASP 323 CO 0.01 0.43 -0.74 0.25 -1.72 0.00 0.00 179.24 177.46 3k2b h LEU 324 N 0.78 0.09 -0.40 1.55 5.85 -1.01 -1.11 115.31 121.06 3k2b h LEU 324 Ca 0.36 -0.06 -0.17 0.00 0.84 0.00 0.00 57.88 58.85 3k2b h LEU 324 Cb 0.38 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 3k2b h LEU 324 CO -0.14 0.80 -0.44 0.00 -0.34 0.00 0.00 178.44 178.32 3k2b h ALA 325 N 1.20 0.58 -0.52 1.25 0.00 0.47 -0.82 119.26 121.41 3k2b h ALA 325 Ca -0.01 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.32 3k2b h ALA 325 Cb 1.31 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3k2b h ALA 325 CO 0.10 0.68 -0.07 -0.44 0.00 0.00 0.00 179.25 179.52 3k2b h ASP 326 N 0.70 0.92 -0.75 0.00 3.32 -0.42 -1.83 116.42 118.35 3k2b h ASP 326 Ca 0.04 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 3k2b h ASP 326 Cb 1.03 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 3k2b h ASP 326 CO 0.10 1.01 0.26 0.40 -1.72 0.00 0.00 179.24 179.30 3k2b h ILE 327 N 0.84 1.26 0.00 0.35 2.04 -0.96 0.22 117.51 121.26 3k2b h ILE 327 Ca 0.14 -0.87 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 3k2b h ILE 327 Cb 0.59 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3k2b h ILE 327 CO 0.04 0.35 -0.25 0.58 0.00 0.00 0.00 178.15 178.87 3k2b h VAL 328 N 1.10 0.85 0.00 1.67 2.07 -0.85 -2.60 116.25 118.49 3k2b h VAL 328 Ca 0.25 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 3k2b h VAL 328 Cb 0.27 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3k2b h VAL 328 CO -0.01 0.24 -0.00 0.00 0.02 0.00 0.00 177.57 177.82 3k2b h ALA 329 N 1.75 -0.00 0.00 1.67 0.00 -0.56 -3.07 119.26 119.05 3k2b h ALA 329 Ca -0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3k2b h ALA 329 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3k2b h ALA 329 CO 0.03 -0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.32 3k2b n ASN 330 N -4.67 0.60 -0.83 0.00 5.03 -0.01 -0.53 115.26 114.86 3k2b n ASN 330 Ca -0.10 0.74 0.10 0.00 0.87 0.00 0.00 54.58 56.19 3k2b n ASN 330 Cb 0.43 -0.83 0.11 0.00 -1.02 0.00 0.00 39.78 38.46 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 -2.26 2.77 -4.55 6.41 4.13 -0.99 -4.94 115.26 115.83 3k2b n ASN 331 Ca -0.00 -1.84 -0.44 0.00 1.68 0.00 0.00 54.58 53.98 3k2b n ASN 331 Cb 0.09 -0.06 -0.04 0.00 -1.54 0.00 0.00 39.78 38.23 3k2b n ASN 331 CO 0.00 0.00 0.00 1.87 0.28 0.00 0.00 177.26 179.41 3k2b n TRP 332 N 1.12 1.73 0.58 3.10 -0.00 0.31 -4.55 117.44 119.72 3k2b n TRP 332 Ca 0.13 0.04 0.07 0.00 -0.00 0.00 0.00 57.50 57.73 3k2b n TRP 332 Cb 0.50 -2.65 0.06 0.00 -0.00 0.00 0.00 31.31 29.21 3k2b n TRP 332 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32