#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b s LEU 1 N 0.00 5.44 -0.22 3.14 2.96 -0.81 -4.92 118.68 124.27 3k2b s LEU 1 Ca 0.00 -2.04 -0.35 0.00 -0.22 0.00 0.00 54.13 51.52 3k2b s LEU 1 Cb 0.00 -1.90 -0.12 0.00 0.50 0.00 0.00 46.19 44.67 3k2b s LEU 1 CO 0.00 -0.59 1.97 0.29 -1.32 0.00 0.00 176.35 176.70 3k2b n LYS 2 N 4.65 1.60 -4.46 1.98 5.02 -1.26 -2.96 118.16 122.73 3k2b n LYS 2 Ca -0.04 0.54 -0.32 0.00 -2.02 0.00 0.00 58.31 56.47 3k2b n LYS 2 Cb 0.41 -2.50 -0.10 0.00 -0.02 0.00 0.00 35.03 32.81 3k2b n LYS 2 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3k2b s VAL 3 N 5.24 3.72 -0.16 -0.18 1.01 -0.35 -0.57 120.40 129.11 3k2b s VAL 3 Ca 1.00 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3k2b s VAL 3 Cb -0.81 -2.61 0.03 0.00 0.00 0.00 0.00 36.38 32.99 3k2b s VAL 3 CO 0.53 0.42 -0.11 0.00 0.00 0.00 0.00 175.10 175.94 3k2b s ALA 4 N -0.98 1.77 -0.59 5.51 0.00 0.06 -1.38 121.76 126.14 3k2b s ALA 4 Ca 0.17 -0.90 -0.25 0.00 0.00 0.00 0.00 51.96 50.97 3k2b s ALA 4 Cb -0.11 -1.09 0.04 0.00 0.00 0.00 0.00 23.12 21.96 3k2b s ALA 4 CO 0.07 -0.52 1.04 0.42 0.00 0.00 0.00 175.76 176.77 3k2b s ILE 5 N 1.52 4.22 -0.42 0.00 1.01 -0.68 -0.83 121.20 126.02 3k2b s ILE 5 Ca 0.03 0.37 -0.18 0.00 0.00 0.00 0.00 60.65 60.87 3k2b s ILE 5 Cb -0.14 -4.64 0.02 0.00 0.01 0.00 0.00 42.46 37.71 3k2b s ILE 5 CO -0.09 -1.29 0.46 0.21 0.00 0.00 0.00 174.94 174.22 3k2b s ASN 6 N 3.07 6.21 0.00 3.58 2.47 -0.83 -1.46 114.94 127.97 3k2b s ASN 6 Ca 0.33 -0.62 0.00 0.00 0.42 0.00 0.00 52.86 52.98 3k2b s ASN 6 Cb -0.11 -2.23 0.00 0.00 -1.45 0.00 0.00 41.25 37.45 3k2b s ASN 6 CO 0.19 -0.60 0.00 0.61 -3.72 0.00 0.00 177.10 173.59 3k2b n GLY 7 N 5.10 0.02 2.27 1.21 0.00 0.28 -0.60 105.19 113.45 3k2b n GLY 7 Ca -0.07 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.01 3k2b n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k2b n PHE 8 N 0.00 1.01 -2.14 1.61 7.35 -1.26 -4.05 117.46 119.98 3k2b n PHE 8 Ca 0.00 -1.87 0.00 0.00 -0.76 0.00 0.00 57.45 54.82 3k2b n PHE 8 Cb 0.00 -1.57 0.00 0.00 0.35 0.00 0.00 39.48 38.26 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 1.79 1.49 0.22 7.13 0.00 -1.26 -4.45 105.19 110.10 3k2b n GLY 9 Ca 0.49 -2.02 -0.06 0.00 0.00 0.00 0.00 46.02 44.44 3k2b n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k2b n ARG 10 N -0.44 -0.23 -0.21 1.61 5.12 -1.26 0.19 116.66 121.44 3k2b n ARG 10 Ca 0.00 1.10 -0.05 0.00 -1.93 0.00 0.00 57.85 56.97 3k2b n ARG 10 Cb 0.00 -1.62 0.05 0.00 -1.16 0.00 0.00 32.46 29.73 3k2b n ARG 10 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 3k2b h ILE 11 N 0.00 1.07 -0.30 0.55 1.08 -1.91 0.27 117.51 118.28 3k2b h ILE 11 Ca 0.08 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 3k2b h ILE 11 Cb 0.21 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 3k2b h ILE 11 CO -0.48 0.13 0.20 1.23 -0.69 0.00 0.00 178.15 178.54 3k2b h GLY 12 N 0.72 0.43 1.25 5.37 0.00 -0.92 0.31 103.07 110.23 3k2b h GLY 12 Ca 0.24 -0.16 -0.16 0.00 0.00 0.00 0.00 47.33 47.26 3k2b h GLY 12 CO -0.10 0.15 -0.41 3.21 0.00 0.00 0.00 176.54 179.39 3k2b h ARG 13 N 0.41 0.81 -0.33 4.80 3.08 -0.04 -1.96 114.38 121.15 3k2b h ARG 13 Ca 0.11 -0.44 -0.01 0.00 0.07 0.00 0.00 59.98 59.71 3k2b h ARG 13 Cb -0.04 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3k2b h ARG 13 CO -0.03 1.07 0.16 -0.91 -1.07 0.00 0.00 179.97 179.19 3k2b h ASN 14 N 0.66 0.43 -0.45 7.04 2.35 -0.74 -2.08 115.58 122.79 3k2b h ASN 14 Ca 0.05 -0.12 0.08 0.00 -0.55 0.00 0.00 56.30 55.76 3k2b h ASN 14 Cb 0.98 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 39.17 3k2b h ASN 14 CO 0.09 0.43 0.01 0.15 -1.65 0.00 0.00 177.43 176.46 3k2b h PHE 15 N 0.40 -0.01 -0.72 1.19 3.57 -0.15 0.26 116.94 121.48 3k2b h PHE 15 Ca 0.11 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 3k2b h PHE 15 Cb 0.11 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 3k2b h PHE 15 CO -0.02 -0.08 0.31 1.25 -2.23 0.00 0.00 178.31 177.54 3k2b h LEU 16 N 0.12 0.95 -0.15 0.59 6.46 -1.10 -0.69 115.31 121.50 3k2b h LEU 16 Ca 0.22 -0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.79 3k2b h LEU 16 Cb 0.32 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.00 3k2b h LEU 16 CO -0.36 0.83 -0.16 0.03 -0.62 0.00 0.00 178.44 178.16 3k2b h ARG 17 N 1.03 0.37 -0.71 1.25 3.08 -0.60 0.59 114.38 119.39 3k2b h ARG 17 Ca 0.24 -0.20 0.12 0.00 0.07 0.00 0.00 59.98 60.21 3k2b h ARG 17 Cb 0.16 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.13 3k2b h ARG 17 CO -0.03 0.76 0.29 0.00 -1.07 0.00 0.00 179.97 179.93 3k2b h TRP 18 N 0.46 1.06 0.00 0.00 7.01 -1.00 -2.30 115.95 121.19 3k2b h TRP 18 Ca 0.38 -0.25 0.00 0.00 2.11 0.00 0.00 58.89 61.12 3k2b h TRP 18 Cb 0.52 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 27.33 3k2b h TRP 18 CO -0.16 1.05 0.00 1.58 -2.79 0.00 0.00 178.44 178.12 3k2b n HIS 18 N -4.18 0.00 -2.17 2.65 -0.00 0.19 -2.33 115.22 109.37 3k2b n HIS 18 Ca -0.00 -0.02 0.01 0.00 0.46 0.00 0.00 57.72 58.17 3k2b n HIS 18 Cb 0.44 -0.05 0.01 0.00 -0.12 0.00 0.00 29.99 30.26 3k2b n HIS 18 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3k2b n GLY 19 N 0.37 0.71 3.23 1.57 0.00 -0.86 -5.02 105.19 105.18 3k2b n GLY 19 Ca 0.00 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.02 2.66 0.24 1.61 1.81 -0.99 -5.07 118.95 119.19 3k2b s ARG 20 Ca 0.12 -0.86 -0.30 0.00 -1.72 0.00 0.00 55.73 52.97 3k2b s ARG 20 Cb 0.14 -2.15 -0.09 0.00 -0.45 0.00 0.00 34.95 32.40 3k2b s ARG 20 CO -0.06 0.29 1.11 0.15 -0.68 0.00 0.00 175.30 176.10 3k2b s LYS 21 N 0.06 4.62 -0.59 3.54 1.02 -1.26 -4.10 119.74 123.02 3k2b s LYS 21 Ca -0.10 1.78 -0.20 0.00 0.02 0.00 0.00 55.97 57.47 3k2b s LYS 21 Cb -0.15 -3.22 0.03 0.00 -0.52 0.00 0.00 37.83 33.97 3k2b s LYS 21 CO 0.06 0.15 0.60 -0.25 -0.92 0.00 0.00 175.35 174.98 3k2b n ASP 22 N 1.69 -4.86 -4.84 2.83 8.00 -1.26 -4.92 116.55 113.20 3k2b n ASP 22 Ca 0.01 -0.52 -0.34 0.00 0.71 0.00 0.00 54.79 54.65 3k2b n ASP 22 Cb 0.45 -1.50 -0.06 0.00 -0.02 0.00 0.00 41.12 39.99 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3k2b s SER 23 N -2.09 6.89 0.00 -2.24 0.15 -1.26 -4.95 113.70 110.20 3k2b s SER 23 Ca 0.20 1.32 0.27 0.00 0.70 0.00 0.00 55.95 58.44 3k2b s SER 23 Cb -0.02 -2.39 1.43 0.00 -1.71 0.00 0.00 66.02 63.34 3k2b s SER 23 CO 0.84 -0.10 1.94 -2.65 1.20 0.00 0.00 173.24 174.47 3k2b n PRO 24 N 0.11 0.50 -4.59 5.44 -0.02 -1.26 -4.25 135.00 130.92 3k2b n PRO 24 Ca 0.01 0.02 -0.34 0.00 -2.02 0.00 0.00 63.50 61.17 3k2b n PRO 24 Cb 0.52 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.39 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 -2.44 3.21 -0.28 2.45 1.43 -1.26 -1.50 118.68 120.29 3k2b s LEU 25 Ca 0.29 -0.01 -0.00 0.00 -1.03 0.00 0.00 54.13 53.38 3k2b s LEU 25 Cb 0.18 -1.71 0.08 0.00 0.03 0.00 0.00 46.19 44.78 3k2b s LEU 25 CO 0.39 0.35 0.05 -0.62 0.23 0.00 0.00 176.35 176.75 3k2b s ASP 26 N -0.73 3.90 -0.24 2.29 2.15 -1.15 -4.51 116.67 118.38 3k2b s ASP 26 Ca 0.11 -1.46 -0.29 0.00 0.43 0.00 0.00 52.55 51.34 3k2b s ASP 26 Cb -0.11 -0.99 -0.02 0.00 -0.30 0.00 0.00 42.92 41.49 3k2b s ASP 26 CO 0.02 -0.35 1.65 -0.63 -0.17 0.00 0.00 175.17 175.68 3k2b s ILE 27 N 1.51 3.65 -0.10 4.11 1.01 -1.26 -1.21 121.20 128.91 3k2b s ILE 27 Ca 0.05 0.72 0.18 0.00 0.00 0.00 0.00 60.65 61.60 3k2b s ILE 27 Cb -0.18 -3.70 -0.26 0.00 0.01 0.00 0.00 42.46 38.33 3k2b s ILE 27 CO -0.16 -0.32 0.26 2.30 0.00 0.00 0.00 174.94 177.02 3k2b n ILE 28 N 6.59 0.57 -3.80 2.92 -5.35 -0.48 -4.79 119.36 115.02 3k2b n ILE 28 Ca 0.19 -0.59 -0.11 0.00 -0.27 0.00 0.00 62.75 61.97 3k2b n ILE 28 Cb 0.45 -0.21 -0.08 0.00 -1.74 0.00 0.00 39.64 38.06 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 -2.92 -0.56 -0.09 -1.28 0.00 -1.22 0.03 121.76 115.72 3k2b s ALA 29 Ca -0.08 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.84 3k2b s ALA 29 Cb 0.09 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.48 3k2b s ALA 29 CO 0.77 -0.35 -0.09 0.42 0.00 0.00 0.00 175.76 176.51 3k2b s ILE 30 N -2.26 0.98 -0.17 0.00 1.01 0.11 -1.68 121.20 119.18 3k2b s ILE 30 Ca -0.07 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.27 3k2b s ILE 30 Cb -0.02 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.50 3k2b s ILE 30 CO -0.02 0.34 -0.19 0.21 0.00 0.00 0.00 174.94 175.28 3k2b s ASN 31 N 1.26 3.21 0.02 3.58 2.47 -0.54 -1.33 114.94 123.61 3k2b s ASN 31 Ca -0.04 -0.62 -0.05 0.00 0.42 0.00 0.00 52.86 52.57 3k2b s ASN 31 Cb -0.14 -1.49 -0.01 0.00 -1.45 0.00 0.00 41.25 38.16 3k2b s ASN 31 CO -0.03 0.02 0.08 -0.62 -3.72 0.00 0.00 177.10 172.83 3k2b s ASP 32 N 1.19 0.13 0.00 -4.21 2.15 -0.86 -0.56 116.67 114.52 3k2b s ASP 32 Ca 0.02 -0.39 0.00 0.00 0.43 0.00 0.00 52.55 52.61 3k2b s ASP 32 Cb -0.14 0.19 0.00 0.00 -0.30 0.00 0.00 42.92 42.67 3k2b s ASP 32 CO -0.10 -0.40 0.36 0.35 -0.17 0.00 0.00 175.17 175.21 3k2b n THR 33 N 1.25 0.00 0.00 1.71 -2.24 -1.26 -4.23 114.28 109.50 3k2b n THR 33 Ca -0.22 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3k2b n THR 33 Cb 0.56 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.15 0.07 0.00 3.38 0.00 -1.26 -5.02 105.19 102.52 3k2b n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 2.78 -0.81 0.00 -0.02 0.00 -1.26 -4.98 105.19 100.90 3k2b n GLY 36 Ca 0.00 -0.86 0.06 0.00 0.00 0.00 0.00 46.02 45.23 3k2b n GLY 36 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k2b n VAL 37 N 3.44 0.00 0.09 1.61 0.31 -1.26 -3.68 118.33 118.84 3k2b n VAL 37 Ca 0.00 -0.27 -0.13 0.00 -0.01 0.00 0.00 64.34 63.93 3k2b n VAL 37 Cb 0.00 0.41 -0.10 0.00 -0.91 0.00 0.00 33.84 33.24 3k2b n VAL 37 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 3k2b h LYS 38 N 0.00 0.23 0.04 5.55 2.10 -1.94 -3.19 116.57 119.36 3k2b h LYS 38 Ca 0.00 -0.34 -0.00 0.00 -2.00 0.00 0.00 60.65 58.31 3k2b h LYS 38 Cb 0.51 0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 3k2b h LYS 38 CO 0.00 1.12 -0.02 1.96 -2.00 0.00 0.00 179.45 180.51 3k2b h GLN 39 N 0.09 -0.05 -0.96 0.07 4.20 -1.94 -3.07 115.11 113.44 3k2b h GLN 39 Ca -0.09 0.00 0.18 0.00 0.06 0.00 0.00 58.65 58.80 3k2b h GLN 39 Cb 1.79 0.01 -0.17 0.00 0.30 0.00 0.00 27.48 29.41 3k2b h GLN 39 CO 0.17 0.41 -0.28 0.00 -0.67 0.00 0.00 178.83 178.46 3k2b h ALA 40 N -0.50 0.49 -0.26 3.87 0.00 -1.70 0.28 119.26 121.44 3k2b h ALA 40 Ca -0.01 0.34 0.01 0.00 0.00 0.00 0.00 54.91 55.25 3k2b h ALA 40 Cb 0.49 0.81 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3k2b h ALA 40 CO 0.01 -0.46 0.16 1.03 0.00 0.00 0.00 179.25 179.99 3k2b h SER 41 N -0.01 0.26 -0.21 0.00 0.87 -1.67 -2.11 113.55 110.69 3k2b h SER 41 Ca 0.42 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.94 3k2b h SER 41 Cb 0.67 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.57 3k2b h SER 41 CO -0.98 0.19 -0.05 -0.74 -0.53 0.00 0.00 176.83 174.72 3k2b h HIS 42 N 0.32 0.45 0.00 2.24 6.17 -0.52 -2.58 115.15 121.23 3k2b h HIS 42 Ca 0.10 -0.10 0.00 0.00 0.71 0.00 0.00 60.37 61.08 3k2b h HIS 42 Cb -0.02 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 29.80 3k2b h HIS 42 CO -0.07 0.64 0.00 -0.07 0.71 0.00 0.00 177.93 179.14 3k2b h LEU 43 N 0.13 0.00 0.00 0.26 3.38 -0.63 -1.17 115.31 117.28 3k2b h LEU 43 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3k2b h LEU 43 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 3k2b h LEU 43 CO 0.02 0.00 -0.82 0.25 0.09 0.00 0.00 178.44 177.98 3k2b h LEU 44 N 0.00 0.00 0.01 1.67 5.85 -1.28 -3.37 115.31 118.19 3k2b h LEU 44 Ca 0.00 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 3k2b h LEU 44 Cb 0.52 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 3k2b h LEU 44 CO 0.00 0.45 -0.80 0.50 -0.34 0.00 0.00 178.44 178.26 3k2b h LYS 45 N 0.00 0.03 -4.89 1.25 1.63 -1.02 -3.41 116.57 110.16 3k2b h LYS 45 Ca -0.06 -0.05 -0.67 0.00 -0.85 0.00 0.00 60.65 59.02 3k2b h LYS 45 Cb 1.40 0.02 -0.27 0.00 -0.60 0.00 0.00 32.23 32.77 3k2b h LYS 45 CO 0.05 1.02 -0.67 0.71 -3.45 0.00 0.00 179.45 177.11 3k2b s TYR 46 N -2.32 3.08 -0.07 1.91 2.02 -0.49 -1.18 117.35 120.30 3k2b s TYR 46 Ca -0.24 -1.05 0.03 0.00 -0.37 0.00 0.00 57.07 55.44 3k2b s TYR 46 Cb 0.02 -2.17 0.01 0.00 -0.40 0.00 0.00 41.96 39.42 3k2b s TYR 46 CO 0.65 -0.58 -0.14 0.34 -1.57 0.00 0.00 175.55 174.25 3k2b s ASP 47 N 1.47 1.98 0.42 2.29 -1.08 -0.84 -4.58 116.67 116.34 3k2b s ASP 47 Ca 0.03 -0.34 0.10 0.00 -0.52 0.00 0.00 52.55 51.82 3k2b s ASP 47 Cb -0.16 -0.91 0.91 0.00 -1.46 0.00 0.00 42.92 41.30 3k2b s ASP 47 CO -0.00 0.06 2.02 0.28 0.52 0.00 0.00 175.17 178.04 3k2b h SER 48 N 6.92 0.27 0.00 -0.34 0.02 -1.95 0.50 113.55 118.96 3k2b h SER 48 Ca -0.29 -0.03 -0.32 0.00 -0.84 0.00 0.00 61.79 60.32 3k2b h SER 48 Cb 1.20 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.62 3k2b h SER 48 CO 0.47 0.29 -1.76 0.41 -1.14 0.00 0.00 176.83 175.10 3k2b n THR 49 N -4.40 1.53 0.62 -2.27 -1.04 -1.26 -4.47 114.28 102.99 3k2b n THR 49 Ca 0.00 -0.16 0.13 0.00 -2.04 0.00 0.00 64.05 61.98 3k2b n THR 49 Cb 0.16 -2.00 0.41 0.00 -1.82 0.00 0.00 70.33 67.08 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 -4.36 0.82 0.00 -4.42 4.77 -1.23 -5.05 117.00 107.52 3k2b n LEU 50 Ca -0.40 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 3k2b n LEU 50 Cb 0.75 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3k2b n LEU 50 CO 0.12 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.60 3k2b n GLY 51 N 1.29 -1.65 3.70 -0.72 0.00 0.17 -4.82 105.19 103.16 3k2b n GLY 51 Ca 0.06 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 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 4.91 -0.22 -0.61 1.01 -1.26 -1.99 121.20 123.05 3k2b s ILE 52 Ca 0.00 1.75 -0.29 0.00 0.00 0.00 0.00 60.65 62.11 3k2b s ILE 52 Cb 0.00 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3k2b s ILE 52 CO 0.00 0.12 1.68 0.12 0.00 0.00 0.00 174.94 176.86 3k2b s PHE 53 N 1.45 1.99 0.00 3.97 5.36 -0.33 -4.87 117.98 125.54 3k2b s PHE 53 Ca 0.43 0.50 -0.02 0.00 -0.96 0.00 0.00 56.93 56.87 3k2b s PHE 53 Cb -0.18 -4.01 -0.10 0.00 -0.34 0.00 0.00 43.02 38.39 3k2b s PHE 53 CO 0.19 -3.14 1.85 -3.47 -1.46 0.00 0.00 175.22 169.19 3k2b n ASP 54 N 8.72 2.98 -3.32 6.13 2.03 -1.26 -4.74 116.55 127.08 3k2b n ASP 54 Ca 0.20 -1.96 -0.18 0.00 0.52 0.00 0.00 54.79 53.37 3k2b n ASP 54 Cb 0.45 -0.74 -0.04 0.00 -0.72 0.00 0.00 41.12 40.07 3k2b n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k2b n ALA 55 N 2.36 0.29 -3.68 -1.67 0.00 -1.26 -5.08 120.51 111.46 3k2b n ALA 55 Ca 0.15 -1.30 -0.36 0.00 0.00 0.00 0.00 53.44 51.94 3k2b n ALA 55 Cb 0.43 0.77 -0.08 0.00 0.00 0.00 0.00 19.45 20.57 3k2b n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3k2b s ASP 56 N -2.58 5.70 -0.08 0.00 3.68 -1.26 -4.93 116.67 117.20 3k2b s ASP 56 Ca 0.05 -3.49 -0.24 0.00 2.13 0.00 0.00 52.55 50.99 3k2b s ASP 56 Cb 0.00 -1.87 -0.03 0.00 -1.45 0.00 0.00 42.92 39.56 3k2b s ASP 56 CO 0.03 -0.23 0.72 -0.69 0.13 0.00 0.00 175.17 175.14 3k2b s VAL 57 N -1.00 5.02 0.02 1.11 1.01 -1.25 -1.93 120.40 123.37 3k2b s VAL 57 Ca 0.24 1.48 -0.10 0.00 0.00 0.00 0.00 61.98 63.60 3k2b s VAL 57 Cb -0.11 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.22 3k2b s VAL 57 CO -0.10 0.22 0.21 -0.54 0.00 0.00 0.00 175.10 174.89 3k2b s LYS 58 N 0.97 0.63 -1.25 2.72 1.02 -0.26 -4.97 119.74 118.61 3k2b s LYS 58 Ca 0.38 -0.47 -0.07 0.00 0.02 0.00 0.00 55.97 55.83 3k2b s LYS 58 Cb -0.18 0.27 0.18 0.00 -0.52 0.00 0.00 37.83 37.58 3k2b s LYS 58 CO 0.18 -0.17 1.97 -2.30 -0.92 0.00 0.00 175.35 174.11 3k2b n PRO 59 N 1.03 4.13 -1.68 -1.68 -0.02 -1.26 0.11 135.00 135.62 3k2b n PRO 59 Ca -0.21 -3.71 -0.16 0.00 -2.02 0.00 0.00 63.50 57.40 3k2b n PRO 59 Cb 0.57 -2.76 -0.07 0.00 -0.02 0.00 0.00 33.50 31.23 3k2b n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3k2b s SER 60 N 0.22 4.15 0.00 2.55 0.15 -1.10 -4.68 113.70 115.00 3k2b s SER 60 Ca 0.43 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.91 3k2b s SER 60 Cb 0.12 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 3k2b s SER 60 CO -0.02 -3.67 0.00 0.61 1.20 0.00 0.00 173.24 171.37 3k2b n GLY 60 N 6.80 0.69 0.82 9.45 0.00 -1.25 -4.09 105.19 117.59 3k2b n GLY 60 Ca 0.45 -2.21 0.13 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.43 2.13 -2.73 1.61 -0.58 -1.26 -4.29 120.64 115.08 3k2b n GLU 61 Ca 0.00 -1.65 -0.03 0.00 -0.42 0.00 0.00 57.16 55.06 3k2b n GLU 61 Cb 0.00 -1.47 0.08 0.00 -0.57 0.00 0.00 31.44 29.49 3k2b n GLU 61 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3k2b n THR 62 N 1.00 0.63 -3.60 2.62 -2.24 -1.26 -4.80 114.28 106.64 3k2b n THR 62 Ca 0.15 -2.14 -0.05 0.00 -2.27 0.00 0.00 64.05 59.74 3k2b n THR 62 Cb 0.53 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.78 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b s ALA 63 N -1.86 -2.05 0.04 6.98 0.00 -1.26 -2.39 121.76 121.22 3k2b s ALA 63 Ca 0.21 1.63 0.02 0.00 0.00 0.00 0.00 51.96 53.82 3k2b s ALA 63 Cb 0.40 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 3k2b s ALA 63 CO -0.06 -0.50 -0.08 0.96 0.00 0.00 0.00 175.76 176.08 3k2b s ILE 64 N -2.04 0.56 -0.13 0.00 -4.36 -0.57 -2.71 121.20 111.95 3k2b s ILE 64 Ca 0.08 -1.01 -0.06 0.00 -0.26 0.00 0.00 60.65 59.40 3k2b s ILE 64 Cb -0.01 -0.61 -0.04 0.00 1.25 0.00 0.00 42.46 43.06 3k2b s ILE 64 CO -0.05 -0.33 0.08 -0.55 0.24 0.00 0.00 174.94 174.34 3k2b s SER 65 N -1.46 5.87 -0.31 4.36 0.15 0.30 -0.90 113.70 121.72 3k2b s SER 65 Ca -0.09 0.28 -0.01 0.00 0.70 0.00 0.00 55.95 56.83 3k2b s SER 65 Cb -0.09 -1.87 0.10 0.00 -1.71 0.00 0.00 66.02 62.45 3k2b s SER 65 CO 0.00 0.34 0.10 -0.69 1.20 0.00 0.00 173.24 174.20 3k2b s VAL 66 N -0.63 0.77 -1.14 4.45 1.01 0.16 -1.10 120.40 123.92 3k2b s VAL 66 Ca 0.12 -1.32 -0.14 0.00 0.00 0.00 0.00 61.98 60.64 3k2b s VAL 66 Cb -0.12 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 3k2b s VAL 66 CO 0.02 -0.67 0.81 0.47 0.00 0.00 0.00 175.10 175.73 3k2b n ASP 67 N 4.89 -5.13 0.00 3.32 8.00 -0.81 -2.24 116.55 124.58 3k2b n ASP 67 Ca -0.03 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.57 3k2b n ASP 67 Cb 0.42 -3.98 0.00 0.00 -0.02 0.00 0.00 41.12 37.54 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 -1.54 1.58 3.65 0.44 0.00 -1.26 -4.94 105.19 103.11 3k2b n GLY 68 Ca -0.11 -0.05 -0.49 0.00 0.00 0.00 0.00 46.02 45.36 3k2b n GLY 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3k2b n LYS 69 N 0.00 1.71 -4.17 1.61 4.81 -0.95 -4.91 118.16 116.26 3k2b n LYS 69 Ca 0.00 0.62 -0.34 0.00 -0.87 0.00 0.00 58.31 57.72 3k2b n LYS 69 Cb 0.00 -2.35 -0.10 0.00 0.02 0.00 0.00 35.03 32.60 3k2b n LYS 69 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 3k2b s ILE 70 N 1.42 4.50 -0.06 3.15 1.10 -1.26 0.37 121.20 130.42 3k2b s ILE 70 Ca 0.84 -0.15 0.05 0.00 -0.51 0.00 0.00 60.65 60.89 3k2b s ILE 70 Cb -0.81 -2.99 -0.01 0.00 0.15 0.00 0.00 42.46 38.81 3k2b s ILE 70 CO 0.45 0.51 -0.22 -0.63 -2.11 0.00 0.00 174.94 172.94 3k2b s ILE 71 N 0.04 1.83 0.07 2.00 1.01 -0.08 -4.94 121.20 121.13 3k2b s ILE 71 Ca 0.04 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.46 3k2b s ILE 71 Cb -0.13 -1.57 -0.05 0.00 0.01 0.00 0.00 42.46 40.73 3k2b s ILE 71 CO 0.01 0.51 1.07 -1.58 0.00 0.00 0.00 174.94 174.96 3k2b s GLN 72 N 0.02 4.54 -0.17 2.79 2.00 0.10 -1.51 119.66 127.44 3k2b s GLN 72 Ca -0.07 1.60 -0.03 0.00 -2.00 0.00 0.00 55.36 54.86 3k2b s GLN 72 Cb -0.14 -3.38 -0.02 0.00 0.80 0.00 0.00 33.01 30.28 3k2b s GLN 72 CO 0.04 -0.06 -0.07 0.08 -0.50 0.00 0.00 175.29 174.78 3k2b s VAL 73 N 0.66 3.42 0.23 1.34 1.01 -1.00 0.04 120.40 126.09 3k2b s VAL 73 Ca 0.53 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 62.06 3k2b s VAL 73 Cb -0.26 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 3k2b s VAL 73 CO 0.30 0.48 -0.06 0.68 0.00 0.00 0.00 175.10 176.50 3k2b s VAL 74 N 0.76 1.37 -0.09 2.92 -7.23 -0.45 -4.42 120.40 113.26 3k2b s VAL 74 Ca -0.03 -2.10 -0.02 0.00 -1.81 0.00 0.00 61.98 58.03 3k2b s VAL 74 Cb -0.15 -2.24 0.03 0.00 0.56 0.00 0.00 36.38 34.58 3k2b s VAL 74 CO 0.02 -0.43 0.02 -0.44 -0.31 0.00 0.00 175.10 173.95 3k2b s SER 75 N -3.33 1.76 -0.30 4.85 0.01 -1.26 -2.02 113.70 113.41 3k2b s SER 75 Ca 0.26 -0.20 -0.11 0.00 1.31 0.00 0.00 55.95 57.21 3k2b s SER 75 Cb 0.03 -0.42 0.18 0.00 0.21 0.00 0.00 66.02 66.02 3k2b s SER 75 CO 0.08 -0.22 0.93 0.21 0.41 0.00 0.00 173.24 174.64 3k2b s ASN 76 N 1.99 -0.71 0.00 2.44 3.84 -1.26 -5.01 114.94 116.23 3k2b s ASN 76 Ca 0.04 0.56 0.07 0.00 0.21 0.00 0.00 52.86 53.74 3k2b s ASN 76 Cb -0.13 1.64 0.36 0.00 -0.55 0.00 0.00 41.25 42.57 3k2b s ASN 76 CO -0.06 -0.13 1.11 -2.11 -2.79 0.00 0.00 177.10 173.12 3k2b n ARG 77 N 5.35 0.09 -3.72 0.43 1.85 -1.26 -4.47 116.66 114.93 3k2b n ARG 77 Ca -0.06 0.24 -0.38 0.00 -1.00 0.00 0.00 57.85 56.65 3k2b n ARG 77 Cb 0.53 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 30.32 3k2b n ARG 77 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3k2b s ASN 78 N -2.64 5.29 0.34 2.89 3.84 -1.26 -4.96 114.94 118.44 3k2b s ASN 78 Ca 0.06 -0.65 0.06 0.00 0.21 0.00 0.00 52.86 52.55 3k2b s ASN 78 Cb 0.05 -1.93 0.74 0.00 -0.55 0.00 0.00 41.25 39.56 3k2b s ASN 78 CO 0.11 -0.20 1.89 -0.65 -2.79 0.00 0.00 177.10 175.47 3k2b h PRO 79 N 8.28 0.76 -0.54 0.43 0.11 -1.95 -2.69 132.00 136.40 3k2b h PRO 79 Ca -0.32 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.80 3k2b h PRO 79 Cb 1.13 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.03 3k2b h PRO 79 CO 0.61 0.50 0.28 0.77 -0.21 0.00 0.00 178.00 179.95 3k2b h SER 80 N 0.78 0.41 0.00 -2.05 0.02 -1.93 -2.54 113.55 108.23 3k2b h SER 80 Ca 0.42 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 3k2b h SER 80 Cb 0.53 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.02 3k2b h SER 80 CO -0.18 0.28 0.00 0.18 -1.14 0.00 0.00 176.83 175.97 3k2b n LEU 81 N -4.86 0.08 -4.81 5.07 4.77 -1.01 -4.45 117.00 111.79 3k2b n LEU 81 Ca 0.05 -0.04 -0.36 0.00 -0.03 0.00 0.00 56.01 55.63 3k2b n LEU 81 Cb 0.14 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 3k2b n LEU 81 CO 0.29 0.02 0.50 -0.76 -1.33 0.00 0.00 177.39 176.11 3k2b s LEU 82 N -0.90 4.32 0.00 2.23 1.43 -0.96 -4.97 118.68 119.83 3k2b s LEU 82 Ca 0.00 1.55 -0.04 0.00 -1.03 0.00 0.00 54.13 54.62 3k2b s LEU 82 Cb 0.00 -3.76 -0.16 0.00 0.03 0.00 0.00 46.19 42.30 3k2b s LEU 82 CO 0.00 -0.02 2.66 -0.81 0.23 0.00 0.00 176.35 178.41 3k2b n PRO 83 N 0.60 1.40 -0.04 1.29 -0.04 -1.26 -4.51 135.00 132.45 3k2b n PRO 83 Ca -0.01 -0.61 -0.15 0.00 -0.04 0.00 0.00 63.50 62.70 3k2b n PRO 83 Cb 0.51 -1.71 -0.12 0.00 -0.04 0.00 0.00 33.50 32.14 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 3.15 0.12 -0.73 0.54 -0.00 -1.84 -1.15 115.95 116.05 3k2b h TRP 84 Ca 0.12 -0.07 0.11 0.00 -0.00 0.00 0.00 58.89 59.04 3k2b h TRP 84 Cb 1.11 -0.01 -0.08 0.00 -0.00 0.00 0.00 29.16 30.18 3k2b h TRP 84 CO 1.31 0.90 0.35 1.57 -0.00 0.00 0.00 178.44 182.57 3k2b h LYS 85 N -0.69 0.55 0.24 0.49 5.09 -0.81 -1.12 116.57 120.32 3k2b h LYS 85 Ca -0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 60.65 60.68 3k2b h LYS 85 Cb 0.94 -0.12 0.00 0.00 0.10 0.00 0.00 32.23 33.15 3k2b h LYS 85 CO 0.03 0.36 -0.12 0.93 -2.09 0.00 0.00 179.45 178.56 3k2b h GLU 86 N 0.56 -0.31 -0.13 0.07 3.07 -1.83 -2.90 114.58 113.12 3k2b h GLU 86 Ca 0.38 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 3k2b h GLU 86 Cb 0.46 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 3k2b h GLU 86 CO -0.31 -0.05 0.00 1.28 -1.40 0.00 0.00 179.01 178.53 3k2b n LEU 87 N -5.13 0.13 -4.15 1.33 4.77 -0.44 -4.85 117.00 108.66 3k2b n LEU 87 Ca -0.09 -0.06 -0.32 0.00 -0.03 0.00 0.00 56.01 55.50 3k2b n LEU 87 Cb 0.22 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3k2b n LEU 87 CO 0.33 0.03 -0.13 0.61 -1.33 0.00 0.00 177.39 176.90 3k2b n GLY 88 N 0.22 -0.35 3.70 -0.72 0.00 -0.50 -4.87 105.19 102.66 3k2b n GLY 88 Ca 0.00 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.59 3.85 -0.22 -0.61 -1.09 -0.75 -4.67 121.20 114.12 3k2b s ILE 89 Ca 0.45 1.26 -0.17 0.00 -2.23 0.00 0.00 60.65 59.96 3k2b s ILE 89 Cb -0.25 -3.81 -0.14 0.00 -1.58 0.00 0.00 42.46 36.68 3k2b s ILE 89 CO 0.92 0.03 -0.06 0.47 -1.23 0.00 0.00 174.94 175.07 3k2b n ASP 90 N 4.83 1.89 -4.15 3.58 8.00 0.27 -2.58 116.55 128.39 3k2b n ASP 90 Ca 0.11 0.41 -0.32 0.00 0.71 0.00 0.00 54.79 55.70 3k2b n ASP 90 Cb 0.45 -0.89 -0.16 0.00 -0.02 0.00 0.00 41.12 40.49 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 -2.44 2.01 -0.30 0.53 1.01 -1.13 0.79 121.20 121.66 3k2b s ILE 91 Ca -0.31 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 59.32 3k2b s ILE 91 Cb 0.08 -1.78 0.01 0.00 0.01 0.00 0.00 42.46 40.78 3k2b s ILE 91 CO 0.51 0.54 0.10 -0.69 0.00 0.00 0.00 174.94 175.40 3k2b s VAL 92 N 0.91 4.14 -0.98 2.92 1.01 0.29 -0.76 120.40 127.91 3k2b s VAL 92 Ca -0.05 -0.64 -0.23 0.00 0.00 0.00 0.00 61.98 61.05 3k2b s VAL 92 Cb -0.15 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.13 3k2b s VAL 92 CO -0.04 0.06 1.50 -0.63 0.00 0.00 0.00 175.10 176.00 3k2b s ILE 93 N 1.53 3.84 -0.49 2.22 -1.09 -0.01 -1.30 121.20 125.90 3k2b s ILE 93 Ca 0.03 -0.63 -0.27 0.00 -2.23 0.00 0.00 60.65 57.55 3k2b s ILE 93 Cb -0.17 -4.91 -0.02 0.00 -1.58 0.00 0.00 42.46 35.78 3k2b s ILE 93 CO 0.03 -1.80 1.77 -0.70 -1.23 0.00 0.00 174.94 173.01 3k2b s GLU 94 N 5.30 3.00 -0.28 2.79 2.56 0.54 -1.97 118.70 130.63 3k2b s GLU 94 Ca 0.48 0.91 0.19 0.00 0.00 0.00 0.00 54.97 56.56 3k2b s GLU 94 Cb -0.01 -4.27 0.49 0.00 2.00 0.00 0.00 34.13 32.33 3k2b s GLU 94 CO -0.07 -2.28 1.10 0.41 -0.56 0.00 0.00 175.26 173.86 3k2b n GLY 95 N 5.52 2.61 0.08 -1.50 0.00 0.23 -0.83 105.19 111.31 3k2b n GLY 95 Ca 0.20 -1.41 -0.06 0.00 0.00 0.00 0.00 46.02 44.75 3k2b n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k2b n THR 96 N -0.53 1.46 -0.57 2.61 -2.24 -1.03 -4.52 114.28 109.46 3k2b n THR 96 Ca 0.14 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 3k2b n THR 96 Cb 0.82 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 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 1.53 0.73 1.06 3.38 0.00 -1.26 -4.93 105.19 105.70 3k2b n GLY 97 Ca -0.17 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.43 0.70 -2.89 1.61 0.24 -1.26 -4.84 118.33 109.46 3k2b n VAL 98 Ca 0.00 -1.56 -0.13 0.00 -2.04 0.00 0.00 64.34 60.61 3k2b n VAL 98 Cb 0.00 0.54 0.02 0.00 -1.47 0.00 0.00 33.84 32.93 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 -0.10 -2.19 0.88 6.34 3.72 -1.26 -4.98 117.46 119.86 3k2b n PHE 99 Ca 0.09 -2.47 0.10 0.00 -0.05 0.00 0.00 57.45 55.12 3k2b n PHE 99 Cb 0.94 0.94 0.02 0.00 -0.94 0.00 0.00 39.48 40.45 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 1.14 0.00 -4.07 -4.37 0.24 -1.26 -4.15 118.33 105.85 3k2b n VAL 100 Ca 0.13 -0.34 -0.22 0.00 -2.04 0.00 0.00 64.34 61.87 3k2b n VAL 100 Cb 0.63 1.28 -0.04 0.00 -1.47 0.00 0.00 33.84 34.25 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 -2.12 5.76 0.24 -1.34 -4.77 -1.26 -1.80 116.67 111.38 3k2b s ASP 101 Ca 0.18 -0.16 -0.06 0.00 -3.30 0.00 0.00 52.55 49.22 3k2b s ASP 101 Cb 0.16 -1.54 0.42 0.00 -1.09 0.00 0.00 42.92 40.88 3k2b s ASP 101 CO 0.44 -0.05 1.68 0.03 0.70 0.00 0.00 175.17 177.97 3k2b h ARG 102 N 1.40 0.23 -0.26 2.11 3.08 -1.93 -0.49 114.38 118.51 3k2b h ARG 102 Ca -0.50 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.48 3k2b h ARG 102 Cb 1.24 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 3k2b h ARG 102 CO 0.61 0.15 -0.06 1.49 -1.07 0.00 0.00 179.97 181.09 3k2b h GLU 103 N 0.23 0.50 0.00 0.04 4.81 -1.95 0.37 114.58 118.59 3k2b h GLU 103 Ca 0.39 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 3k2b h GLU 103 Cb 0.67 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3k2b h GLU 103 CO -0.52 0.72 0.00 0.78 -0.73 0.00 0.00 179.01 179.26 3k2b h GLY 104 N 0.26 0.00 0.00 1.92 0.00 -1.75 -3.10 103.07 100.40 3k2b h GLY 104 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 3k2b h GLY 104 CO 0.03 0.00 -1.53 0.00 0.00 0.00 0.00 176.54 175.04 3k2b n ALA 105 N -1.85 2.42 0.28 3.60 0.00 -0.25 -4.47 120.51 120.24 3k2b n ALA 105 Ca 0.02 -0.28 0.15 0.00 0.00 0.00 0.00 53.44 53.34 3k2b n ALA 105 Cb 0.27 -0.39 0.79 0.00 0.00 0.00 0.00 19.45 20.12 3k2b n ALA 105 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3k2b h GLY 106 N 2.10 0.00 0.21 0.00 0.00 -0.17 -2.81 103.07 102.41 3k2b h GLY 106 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.42 3k2b h GLY 106 CO 0.00 0.00 0.03 0.50 0.00 0.00 0.00 176.54 177.07 3k2b h LYS 107 N 0.00 0.14 -1.09 4.80 1.57 -1.78 -0.20 116.57 120.02 3k2b h LYS 107 Ca -0.00 -0.01 0.32 0.00 -1.87 0.00 0.00 60.65 59.09 3k2b h LYS 107 Cb 0.33 -0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.48 3k2b h LYS 107 CO 0.01 0.10 0.67 0.45 -0.57 0.00 0.00 179.45 180.11 3k2b h HIS 108 N 0.15 0.76 0.05 -1.35 3.86 -1.72 0.65 115.15 117.55 3k2b h HIS 108 Ca 0.26 0.03 -0.24 0.00 -1.16 0.00 0.00 60.37 59.26 3k2b h HIS 108 Cb 0.38 -0.21 0.02 0.00 1.06 0.00 0.00 27.41 28.66 3k2b h HIS 108 CO -0.29 -0.07 -0.96 0.82 0.86 0.00 0.00 177.93 178.29 3k2b h ILE 109 N 0.33 1.34 -0.45 2.45 2.04 -1.22 -1.21 117.51 120.80 3k2b h ILE 109 Ca 0.70 -2.29 0.03 0.00 1.00 0.00 0.00 64.86 64.30 3k2b h ILE 109 Cb 1.77 2.62 -0.02 0.00 -0.74 0.00 0.00 36.82 40.44 3k2b h ILE 109 CO -0.45 0.69 0.30 -0.33 0.00 0.00 0.00 178.15 178.36 3k2b h GLU 110 N 0.14 0.46 0.00 2.37 5.08 0.58 0.18 114.58 123.39 3k2b h GLU 110 Ca -0.13 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3k2b h GLU 110 Cb 1.65 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.80 3k2b h GLU 110 CO 0.19 0.31 0.00 0.00 -1.00 0.00 0.00 179.01 178.50 3k2b n ALA 111 N -2.49 2.42 0.00 3.43 0.00 0.19 -4.86 120.51 119.19 3k2b n ALA 111 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3k2b n ALA 111 Cb 0.16 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3k2b n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k2b n GLY 112 N 0.69 1.03 3.86 0.00 0.00 0.64 -0.57 105.19 110.84 3k2b n GLY 112 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 3k2b n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b s ALA 113 N -2.00 3.60 -0.07 4.61 0.00 -0.47 -3.22 121.76 124.21 3k2b s ALA 113 Ca 0.00 -0.23 0.14 0.00 0.00 0.00 0.00 51.96 51.87 3k2b s ALA 113 Cb 0.00 -2.44 -0.15 0.00 0.00 0.00 0.00 23.12 20.52 3k2b s ALA 113 CO 0.00 0.50 0.90 0.87 0.00 0.00 0.00 175.76 178.02 3k2b h LYS 114 N 3.19 0.00 -3.31 0.00 1.57 -1.27 -3.36 116.57 113.39 3k2b h LYS 114 Ca -0.48 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.19 3k2b h LYS 114 Cb 1.18 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.31 3k2b h LYS 114 CO 0.67 0.46 -0.34 0.21 -0.57 0.00 0.00 179.45 179.89 3k2b s LYS 115 N -2.80 0.67 -0.03 3.15 2.20 0.24 -4.77 119.74 118.40 3k2b s LYS 115 Ca -0.02 -0.41 0.02 0.00 -0.36 0.00 0.00 55.97 55.20 3k2b s LYS 115 Cb 0.08 0.29 0.01 0.00 -1.51 0.00 0.00 37.83 36.70 3k2b s LYS 115 CO 0.81 -0.19 -0.07 0.08 -0.36 0.00 0.00 175.35 175.61 3k2b s VAL 116 N -1.92 0.68 -0.28 4.02 1.01 0.12 -0.55 120.40 123.49 3k2b s VAL 116 Ca -0.10 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.61 3k2b s VAL 116 Cb -0.04 -0.62 0.06 0.00 0.00 0.00 0.00 36.38 35.78 3k2b s VAL 116 CO 0.00 0.22 -0.06 -0.63 0.00 0.00 0.00 175.10 174.63 3k2b s ILE 117 N 0.32 2.46 -0.27 2.22 1.01 -0.42 -1.91 121.20 124.61 3k2b s ILE 117 Ca -0.05 -1.59 -0.25 0.00 0.00 0.00 0.00 60.65 58.76 3k2b s ILE 117 Cb -0.09 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.92 3k2b s ILE 117 CO 0.00 -0.09 0.85 -0.63 0.00 0.00 0.00 174.94 175.08 3k2b s ILE 118 N 1.14 4.78 -0.03 2.92 1.01 -0.44 -0.34 121.20 130.24 3k2b s ILE 118 Ca -0.07 1.50 -0.05 0.00 0.00 0.00 0.00 60.65 62.03 3k2b s ILE 118 Cb -0.20 -4.17 -0.23 0.00 0.01 0.00 0.00 42.46 37.87 3k2b s ILE 118 CO -0.04 -0.17 3.21 0.35 0.00 0.00 0.00 174.94 178.29 3k2b n THR 119 N 5.40 2.63 0.00 2.92 -2.24 -0.01 -2.25 114.28 120.74 3k2b n THR 119 Ca 0.06 -1.32 0.00 0.00 -2.27 0.00 0.00 64.05 60.52 3k2b n THR 119 Cb 0.48 -1.95 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 3k2b n THR 119 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b n ALA 120 N 2.59 0.00 -1.77 6.98 0.00 -1.24 -4.94 120.51 122.13 3k2b n ALA 120 Ca 0.38 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.42 3k2b n ALA 120 Cb 0.79 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.25 3k2b n ALA 120 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3k2b s PRO 121 N -2.00 3.81 -0.30 0.00 0.02 -1.26 -4.07 135.00 131.20 3k2b s PRO 121 Ca 0.00 2.46 -0.11 0.00 0.02 0.00 0.00 61.00 63.37 3k2b s PRO 121 Cb 0.00 -2.75 -0.04 0.00 0.02 0.00 0.00 34.50 31.74 3k2b s PRO 121 CO 0.00 -0.73 0.19 0.20 -0.33 0.00 0.00 177.00 176.32 3k2b s GLY 122 N -0.40 1.92 -0.19 0.52 0.00 -1.26 -4.91 107.32 102.99 3k2b s GLY 122 Ca 0.59 -1.20 -0.28 0.00 0.00 0.00 0.00 44.72 43.82 3k2b s GLY 122 CO 0.58 0.67 2.08 0.54 0.00 0.00 0.00 173.10 176.98 3k2b s LYS 122 N 1.72 3.37 0.00 2.90 -0.14 -0.75 -4.43 119.74 122.41 3k2b s LYS 122 Ca 0.06 2.03 0.00 0.00 -1.36 0.00 0.00 55.97 56.71 3k2b s LYS 122 Cb -0.16 -4.29 0.00 0.00 -1.68 0.00 0.00 37.83 31.69 3k2b s LYS 122 CO 0.10 -1.83 0.00 0.41 -0.76 0.00 0.00 175.35 173.27 3k2b n GLY 123 N 5.44 0.63 1.76 -3.33 0.00 -1.26 -4.07 105.19 104.36 3k2b n GLY 123 Ca 0.27 -2.32 -0.01 0.00 0.00 0.00 0.00 46.02 43.95 3k2b n GLY 123 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k2b n ASP 124 N 0.00 3.42 -4.67 1.61 5.75 -1.26 -4.83 116.55 116.57 3k2b n ASP 124 Ca 0.00 -1.94 -0.43 0.00 -0.01 0.00 0.00 54.79 52.41 3k2b n ASP 124 Cb 0.00 -0.76 -0.02 0.00 -1.03 0.00 0.00 41.12 39.31 3k2b n ASP 124 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3k2b s ILE 125 N 0.89 4.71 0.17 2.12 1.01 -1.26 -4.98 121.20 123.85 3k2b s ILE 125 Ca 0.07 2.02 -0.34 0.00 0.00 0.00 0.00 60.65 62.41 3k2b s ILE 125 Cb 0.03 -4.31 -0.15 0.00 0.01 0.00 0.00 42.46 38.05 3k2b s ILE 125 CO 0.00 -0.13 1.39 -2.65 0.00 0.00 0.00 174.94 173.55 3k2b n PRO 126 N 5.99 1.69 -5.03 2.79 -0.02 -1.26 -4.63 135.00 134.53 3k2b n PRO 126 Ca 0.11 0.60 -0.32 0.00 -2.02 0.00 0.00 63.50 61.87 3k2b n PRO 126 Cb 0.47 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.55 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 0.32 2.71 -0.02 3.45 2.01 -1.26 0.11 115.64 122.96 3k2b s THR 127 Ca 0.76 -0.85 0.00 0.00 0.31 0.00 0.00 61.69 61.91 3k2b s THR 127 Cb -0.77 -2.03 0.03 0.00 0.01 0.00 0.00 72.50 69.74 3k2b s THR 127 CO 0.46 0.58 0.02 -0.31 -0.69 0.00 0.00 174.62 174.69 3k2b s TYR 128 N -0.61 0.10 -0.37 4.92 2.02 -0.47 -4.77 117.35 118.16 3k2b s TYR 128 Ca 0.09 0.09 -0.06 0.00 -0.37 0.00 0.00 57.07 56.83 3k2b s TYR 128 Cb -0.11 -0.27 0.07 0.00 -0.40 0.00 0.00 41.96 41.26 3k2b s TYR 128 CO 0.00 -0.09 0.16 0.08 -1.57 0.00 0.00 175.55 174.13 3k2b s VAL 129 N 1.01 3.68 -0.03 0.71 1.01 -1.26 -4.36 120.40 121.16 3k2b s VAL 129 Ca -0.09 -1.48 -0.37 0.00 0.00 0.00 0.00 61.98 60.05 3k2b s VAL 129 Cb -0.12 -3.25 -0.15 0.00 0.00 0.00 0.00 36.38 32.85 3k2b s VAL 129 CO -0.03 -0.39 1.56 1.33 0.00 0.00 0.00 175.10 177.57 3k2b n VAL 130 N 4.76 0.16 0.00 2.92 0.24 -1.26 -0.60 118.33 124.55 3k2b n VAL 130 Ca -0.09 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 3k2b n VAL 130 Cb 0.43 -1.18 0.00 0.00 -1.47 0.00 0.00 33.84 31.62 3k2b n VAL 130 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3k2b n GLY 131 N 3.37 1.56 0.00 7.63 0.00 -1.26 -4.93 105.19 111.56 3k2b n GLY 131 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.05 0.00 1.30 1.61 0.31 0.23 -4.89 118.33 116.84 3k2b n VAL 132 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.44 3k2b n VAL 132 Cb 0.00 0.00 0.63 0.00 -0.91 0.00 0.00 33.84 33.56 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 0.00 0.00 -0.19 4.52 2.04 -1.23 -4.10 115.26 116.29 3k2b n ASN 133 Ca 0.00 -0.54 0.29 0.00 -0.44 0.00 0.00 54.58 53.89 3k2b n ASN 133 Cb 0.00 -0.06 0.58 0.00 -2.53 0.00 0.00 39.78 37.76 3k2b n ASN 133 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3k2b h ALA 134 N 3.30 2.86 0.00 -2.53 0.00 -1.88 0.89 119.26 121.90 3k2b h ALA 134 Ca 0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3k2b h ALA 134 Cb 0.04 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3k2b h ALA 134 CO 0.00 -1.53 -0.33 -0.44 0.00 0.00 0.00 179.25 176.95 3k2b h ASP 135 N 0.00 0.00 0.09 0.00 3.45 -1.91 -3.04 116.42 115.01 3k2b h ASP 135 Ca 0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.93 3k2b h ASP 135 Cb 2.51 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 41.28 3k2b h ASP 135 CO -0.00 0.33 0.00 0.00 -1.57 0.00 0.00 179.24 177.99 3k2b h ALA 136 N 1.67 1.00 -1.54 3.45 0.00 0.50 -3.44 119.26 120.90 3k2b h ALA 136 Ca -0.00 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.17 3k2b h ALA 136 Cb 0.82 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.64 3k2b h ALA 136 CO 0.04 0.00 0.77 0.98 0.00 0.00 0.00 179.25 181.04 3k2b n TYR 137 N -2.93 1.88 -3.77 0.00 9.36 -1.15 -4.94 117.16 115.61 3k2b n TYR 137 Ca -0.02 0.60 -0.37 0.00 3.32 0.00 0.00 57.90 61.43 3k2b n TYR 137 Cb 0.09 -2.41 -0.13 0.00 -0.63 0.00 0.00 39.34 36.26 3k2b n TYR 137 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3k2b s SER 138 N 2.71 5.06 0.11 2.98 1.04 -1.26 -4.97 113.70 119.38 3k2b s SER 138 Ca 0.95 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 57.02 3k2b s SER 138 Cb -1.07 -1.90 0.18 0.00 0.10 0.00 0.00 66.02 63.33 3k2b s SER 138 CO 0.62 -0.09 0.86 0.00 0.98 0.00 0.00 173.24 175.61 3k2b n HIS 139 N 4.90 0.11 1.06 5.02 1.44 -1.26 -0.80 115.22 125.69 3k2b n HIS 139 Ca -0.16 0.06 0.02 0.00 -2.01 0.00 0.00 57.72 55.63 3k2b n HIS 139 Cb 0.50 -0.31 0.06 0.00 0.12 0.00 0.00 29.99 30.37 3k2b n HIS 139 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 3k2b n ASP 140 N -1.47 1.34 -4.25 4.39 5.68 -1.26 -4.74 116.55 116.24 3k2b n ASP 140 Ca -0.00 -2.09 -0.32 0.00 -0.50 0.00 0.00 54.79 51.87 3k2b n ASP 140 Cb 0.34 -0.35 -0.16 0.00 -1.14 0.00 0.00 41.12 39.81 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 -1.52 3.13 -0.02 0.11 2.02 0.02 -5.03 118.70 117.42 3k2b s GLU 141 Ca 0.09 -0.82 -0.09 0.00 0.02 0.00 0.00 54.97 54.17 3k2b s GLU 141 Cb 0.06 -2.42 -0.30 0.00 0.10 0.00 0.00 34.13 31.57 3k2b s GLU 141 CO 0.04 0.14 0.79 -1.00 0.02 0.00 0.00 175.26 175.26 3k2b h PRO 142 N 6.85 0.36 -5.14 0.39 0.13 -1.86 -3.46 132.00 129.28 3k2b h PRO 142 Ca -0.24 -0.62 -0.66 0.00 -0.87 0.00 0.00 66.00 63.62 3k2b h PRO 142 Cb 1.22 0.23 -0.34 0.00 0.13 0.00 0.00 31.00 32.24 3k2b h PRO 142 CO 0.51 1.26 -0.87 0.42 -0.23 0.00 0.00 178.00 179.10 3k2b s ILE 143 N -2.60 1.95 0.07 -3.56 1.01 -1.26 0.15 121.20 116.96 3k2b s ILE 143 Ca -0.12 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.62 3k2b s ILE 143 Cb 0.06 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 3k2b s ILE 143 CO 0.87 0.53 -0.06 0.27 0.00 0.00 0.00 174.94 176.55 3k2b s ILE 144 N 0.76 0.53 0.10 2.92 -4.36 -0.80 -4.12 121.20 116.23 3k2b s ILE 144 Ca -0.09 -1.54 0.05 0.00 -0.26 0.00 0.00 60.65 58.81 3k2b s ILE 144 Cb -0.16 -1.18 -0.04 0.00 1.25 0.00 0.00 42.46 42.34 3k2b s ILE 144 CO 0.00 -0.69 0.03 -0.55 0.24 0.00 0.00 174.94 173.97 3k2b s SER 145 N -2.39 5.15 -0.18 4.36 0.15 0.29 -1.33 113.70 119.74 3k2b s SER 145 Ca 0.01 -0.16 0.17 0.00 0.70 0.00 0.00 55.95 56.67 3k2b s SER 145 Cb -0.01 -1.26 0.54 0.00 -1.71 0.00 0.00 66.02 63.58 3k2b s SER 145 CO -0.03 0.16 1.44 -3.20 1.20 0.00 0.00 173.24 172.80 3k2b n ASN 146 N 0.42 3.97 -1.11 5.45 5.15 -0.96 -1.36 115.26 126.82 3k2b n ASN 146 Ca -0.10 -3.01 0.07 0.00 -0.60 0.00 0.00 54.58 50.95 3k2b n ASN 146 Cb 0.52 -0.55 -0.02 0.00 -0.53 0.00 0.00 39.78 39.20 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 -0.44 -1.41 -2.00 5.20 0.00 -1.26 -4.80 120.51 115.80 3k2b n ALA 147 Ca 0.22 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.59 3k2b n ALA 147 Cb 0.91 -0.49 0.12 0.00 0.00 0.00 0.00 19.45 19.99 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 -5.15 4.23 0.01 0.00 1.04 -1.26 -3.63 113.70 108.94 3k2b s SER 148 Ca 0.00 -0.53 -0.25 0.00 0.48 0.00 0.00 55.95 55.64 3k2b s SER 148 Cb 0.00 0.25 -0.17 0.00 0.10 0.00 0.00 66.02 66.21 3k2b s SER 148 CO 0.00 -1.96 1.27 0.00 0.98 0.00 0.00 173.24 173.53 3k2b h THR 150 N -0.73 0.80 0.00 0.00 2.02 -1.96 -0.55 112.91 112.50 3k2b h THR 150 Ca -0.04 -0.25 -0.05 0.00 0.77 0.00 0.00 66.41 66.83 3k2b h THR 150 Cb 0.49 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 3k2b h THR 150 CO 0.07 0.13 -0.25 0.74 0.37 0.00 0.00 175.52 176.58 3k2b h THR 151 N 0.73 0.59 -0.00 3.16 2.02 -1.85 -2.40 112.91 115.17 3k2b h THR 151 Ca 0.49 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 66.45 3k2b h THR 151 Cb 0.78 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 3k2b h THR 151 CO -0.25 0.25 -0.11 0.59 0.37 0.00 0.00 175.52 176.37 3k2b n ASN 152 N -3.39 0.38 -0.10 4.18 4.13 -0.22 -2.15 115.26 118.10 3k2b n ASN 152 Ca 0.00 -0.44 -0.18 0.00 1.68 0.00 0.00 54.58 55.64 3k2b n ASN 152 Cb 0.46 -0.11 -0.06 0.00 -1.54 0.00 0.00 39.78 38.53 3k2b n ASN 152 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3k2b h LEU 154 N -0.82 -1.04 -0.45 0.00 5.85 -1.56 -3.24 115.31 114.06 3k2b h LEU 154 Ca -0.37 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.51 3k2b h LEU 154 Cb 1.26 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 42.54 3k2b h LEU 154 CO -0.22 -0.54 -0.41 0.00 -0.34 0.00 0.00 178.44 176.93 3k2b h ALA 155 N -0.40 -0.35 -0.63 1.25 0.00 -1.67 -2.27 119.26 115.20 3k2b h ALA 155 Ca -0.03 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.09 3k2b h ALA 155 Cb 0.71 0.87 -0.12 0.00 0.00 0.00 0.00 17.79 19.25 3k2b h ALA 155 CO -0.06 -0.82 -0.17 -1.35 0.00 0.00 0.00 179.25 176.84 3k2b h PRO 156 N -0.29 -0.02 0.00 0.00 0.11 -1.79 -1.75 132.00 128.27 3k2b h PRO 156 Ca 0.16 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 3k2b h PRO 156 Cb 0.57 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.68 3k2b h PRO 156 CO -0.59 -0.01 -0.33 0.27 -0.21 0.00 0.00 178.00 177.12 3k2b h PHE 157 N -0.02 0.00 -0.39 0.65 -5.15 -1.61 -3.13 116.94 107.30 3k2b h PHE 157 Ca 0.30 0.00 -0.10 0.00 -0.20 0.00 0.00 57.97 57.97 3k2b h PHE 157 Cb 0.47 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.63 3k2b h PHE 157 CO -0.53 0.10 -0.16 0.28 -2.00 0.00 0.00 178.31 176.01 3k2b h VAL 158 N 0.00 1.26 -0.71 0.88 2.07 -0.79 -1.31 116.25 117.65 3k2b h VAL 158 Ca -0.01 -1.21 0.06 0.00 0.82 0.00 0.00 66.70 66.36 3k2b h VAL 158 Cb 1.08 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 3k2b h VAL 158 CO 0.01 0.40 0.41 0.50 0.02 0.00 0.00 177.57 178.91 3k2b h LYS 159 N 0.64 0.73 -0.10 1.57 3.64 -1.28 -0.15 116.57 121.61 3k2b h LYS 159 Ca 0.10 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 3k2b h LYS 159 Cb 0.62 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3k2b h LYS 159 CO 0.04 0.48 -0.04 0.28 -2.27 0.00 0.00 179.45 177.95 3k2b h VAL 160 N 0.75 1.31 -0.07 2.00 2.07 -1.51 -2.55 116.25 118.25 3k2b h VAL 160 Ca 0.31 -1.03 0.04 0.00 0.82 0.00 0.00 66.70 66.85 3k2b h VAL 160 Cb 0.17 1.78 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 3k2b h VAL 160 CO -0.17 0.29 -0.34 -0.07 0.02 0.00 0.00 177.57 177.29 3k2b h LEU 161 N -0.14 -1.05 0.00 2.57 3.38 -0.80 -3.05 115.31 116.23 3k2b h LEU 161 Ca 0.02 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3k2b h LEU 161 Cb 0.48 0.43 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3k2b h LEU 161 CO 0.01 -0.39 0.00 -0.67 0.09 0.00 0.00 178.44 177.49 3k2b n ASP 162 N -5.42 0.00 -0.84 -0.43 2.03 -0.11 0.50 116.55 112.29 3k2b n ASP 162 Ca -0.04 0.65 0.00 0.00 0.52 0.00 0.00 54.79 55.92 3k2b n ASP 162 Cb 0.34 -0.15 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 3k2b n ASP 162 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k2b n GLN 163 N -1.08 0.04 0.00 -0.67 6.02 -0.96 0.22 117.38 120.95 3k2b n GLN 163 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3k2b n GLN 163 Cb 0.00 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 29.93 3k2b n GLN 163 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 3k2b n LYS 164 N 0.82 0.00 0.00 -1.09 4.81 -1.15 -4.93 118.16 116.62 3k2b n LYS 164 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3k2b n LYS 164 Cb 0.02 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.07 3k2b n LYS 164 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 3k2b n PHE 165 N 0.00 0.00 -1.78 5.64 3.72 0.18 -5.03 117.46 120.19 3k2b n PHE 165 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3k2b n PHE 165 Cb 0.04 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 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 0.00 -4.90 3.35 1.37 0.00 0.60 -1.33 105.19 104.28 3k2b n GLY 166 Ca 0.00 -0.24 -0.46 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.39 5.75 0.14 -0.61 1.01 -1.26 -1.19 121.20 124.65 3k2b s ILE 167 Ca 0.00 -2.91 -0.24 0.00 0.00 0.00 0.00 60.65 57.49 3k2b s ILE 167 Cb 0.00 -4.57 -0.00 0.00 0.01 0.00 0.00 42.46 37.89 3k2b s ILE 167 CO 0.00 -1.16 1.63 0.40 0.00 0.00 0.00 174.94 175.81 3k2b h ILE 168 N 4.27 0.37 0.00 2.92 2.04 -1.83 -3.47 117.51 121.81 3k2b h ILE 168 Ca 0.16 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.02 3k2b h ILE 168 Cb 0.95 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3k2b h ILE 168 CO 0.92 0.00 0.00 0.29 0.00 0.00 0.00 178.15 179.36 3k2b n LYS 169 N -5.38 0.00 0.00 2.37 5.02 -1.26 -4.97 118.16 113.93 3k2b n LYS 169 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3k2b n LYS 169 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.31 3k2b n LYS 169 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k2b n GLY 170 N 0.00 4.26 3.73 0.72 0.00 -1.25 -3.40 105.19 109.25 3k2b n GLY 170 Ca 0.00 -1.38 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 3k2b n GLY 170 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3k2b s THR 171 N -1.89 1.47 -0.28 2.61 -1.32 -0.36 -4.16 115.64 111.72 3k2b s THR 171 Ca 0.00 -1.97 -0.23 0.00 -1.21 0.00 0.00 61.69 58.28 3k2b s THR 171 Cb 0.00 -2.44 0.09 0.00 -1.51 0.00 0.00 72.50 68.64 3k2b s THR 171 CO 0.00 0.00 0.82 -0.32 -2.21 0.00 0.00 174.62 172.91 3k2b s MET 172 N -3.85 0.70 -0.02 7.08 0.00 -0.71 -0.31 119.30 122.20 3k2b s MET 172 Ca 0.17 0.89 0.00 0.00 0.00 0.00 0.00 55.69 56.76 3k2b s MET 172 Cb 0.04 0.31 0.02 0.00 0.00 0.00 0.00 34.83 35.20 3k2b s MET 172 CO 0.09 -0.09 -0.01 0.99 0.00 0.00 0.00 175.02 176.00 3k2b s THR 173 N 0.54 0.15 -0.12 10.11 2.01 0.44 -2.68 115.64 126.09 3k2b s THR 173 Ca -0.01 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.03 3k2b s THR 173 Cb -0.05 -0.21 -0.01 0.00 0.01 0.00 0.00 72.50 72.24 3k2b s THR 173 CO -0.04 0.10 -0.15 0.28 -0.69 0.00 0.00 174.62 174.12 3k2b s THR 174 N 0.61 2.90 -0.65 -0.82 -1.32 -0.98 0.14 115.64 115.52 3k2b s THR 174 Ca -0.06 -0.72 -0.19 0.00 -1.21 0.00 0.00 61.69 59.52 3k2b s THR 174 Cb -0.09 -2.20 0.11 0.00 -1.51 0.00 0.00 72.50 68.82 3k2b s THR 174 CO -0.01 0.53 0.76 -0.89 -2.21 0.00 0.00 174.62 172.80 3k2b s THR 175 N 0.32 4.85 -0.04 5.08 2.01 0.18 0.39 115.64 128.45 3k2b s THR 175 Ca -0.12 -1.15 -0.02 0.00 0.31 0.00 0.00 61.69 60.72 3k2b s THR 175 Cb -0.16 -4.53 -0.04 0.00 0.01 0.00 0.00 72.50 67.79 3k2b s THR 175 CO 0.06 -1.17 0.07 -2.28 -0.69 0.00 0.00 174.62 170.61 3k2b s HIS 176 N 2.54 3.30 0.70 4.92 5.04 0.32 -1.65 115.29 130.45 3k2b s HIS 176 Ca 0.14 0.25 -0.13 0.00 -1.54 0.00 0.00 55.06 53.78 3k2b s HIS 176 Cb -0.21 -1.77 0.02 0.00 0.04 0.00 0.00 32.58 30.65 3k2b s HIS 176 CO 0.04 0.56 1.09 -1.12 -2.34 0.00 0.00 174.74 172.97 3k2b s SER 177 N -1.47 4.98 0.75 9.88 0.01 -1.23 -1.52 113.70 125.10 3k2b s SER 177 Ca 0.20 1.88 -0.11 0.00 1.31 0.00 0.00 55.95 59.24 3k2b s SER 177 Cb -0.12 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.62 3k2b s SER 177 CO 0.10 -1.72 1.08 -0.72 0.41 0.00 0.00 173.24 172.39 3k2b s TYR 178 N -2.62 2.77 0.27 2.43 -0.85 -1.04 -4.80 117.35 113.52 3k2b s TYR 178 Ca 0.64 1.50 0.03 0.00 -0.52 0.00 0.00 57.07 58.71 3k2b s TYR 178 Cb -0.18 -2.99 -0.05 0.00 0.38 0.00 0.00 41.96 39.11 3k2b s TYR 178 CO 0.48 -1.60 0.06 0.95 -1.52 0.00 0.00 175.55 173.91 3k2b s THR 179 N -2.96 0.86 0.55 -3.49 -4.23 -1.26 -4.78 115.64 100.32 3k2b s THR 179 Ca 0.60 -2.01 0.31 0.00 -1.18 0.00 0.00 61.69 59.42 3k2b s THR 179 Cb -0.16 -2.60 0.46 0.00 1.34 0.00 0.00 72.50 71.54 3k2b s THR 179 CO 0.56 -0.09 1.88 1.23 -0.54 0.00 0.00 174.62 177.65 3k2b h GLY 180 N 2.33 0.00 0.54 3.99 0.00 -1.98 -0.30 103.07 107.66 3k2b h GLY 180 Ca -0.39 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.03 3k2b h GLY 180 CO 0.64 0.00 0.44 -1.80 0.00 0.00 0.00 176.54 175.82 3k2b h ASP 181 N 0.00 0.62 -4.28 0.19 3.58 -1.99 -3.42 116.42 111.13 3k2b h ASP 181 Ca 0.39 0.05 -0.52 0.00 0.42 0.00 0.00 57.03 57.37 3k2b h ASP 181 Cb 1.65 -0.07 0.14 0.00 1.72 0.00 0.00 39.33 42.76 3k2b h ASP 181 CO -0.00 0.36 0.32 -1.10 -2.88 0.00 0.00 179.24 175.94 3k2b s GLN 182 N -6.05 2.19 0.02 0.28 -0.21 -0.12 -4.99 119.66 110.77 3k2b s GLN 182 Ca -0.12 1.30 -0.09 0.00 0.02 0.00 0.00 55.36 56.46 3k2b s GLN 182 Cb 0.19 -1.88 -0.05 0.00 1.00 0.00 0.00 33.01 32.26 3k2b s GLN 182 CO 0.78 -1.71 0.33 1.03 -2.12 0.00 0.00 175.29 173.59 3k2b s ARG 183 N -4.65 3.69 0.13 2.91 1.81 -1.19 -4.93 118.95 116.72 3k2b s ARG 183 Ca 0.64 0.10 -0.19 0.00 -1.72 0.00 0.00 55.73 54.56 3k2b s ARG 183 Cb -0.19 -3.09 -0.05 0.00 -0.45 0.00 0.00 34.95 31.17 3k2b s ARG 183 CO 0.53 0.64 1.78 1.25 -0.68 0.00 0.00 175.30 178.83 3k2b h LEU 184 N 4.16 0.27 0.00 2.53 5.85 -1.92 -1.64 115.31 124.57 3k2b h LEU 184 Ca -0.51 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.08 3k2b h LEU 184 Cb 1.20 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 3k2b h LEU 184 CO 0.64 0.20 -0.09 0.18 -0.34 0.00 0.00 178.44 179.03 3k2b n LEU 185 N -4.92 0.00 -4.65 2.25 4.77 -1.26 -4.10 117.00 109.09 3k2b n LEU 185 Ca -0.02 -0.62 -0.43 0.00 -0.03 0.00 0.00 56.01 54.91 3k2b n LEU 185 Cb 0.03 0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3k2b n LEU 185 CO 0.34 -0.09 1.07 -1.81 -1.33 0.00 0.00 177.39 175.57 3k2b s ASP 186 N -1.55 6.86 0.27 -1.43 1.01 -1.26 -3.24 116.67 117.34 3k2b s ASP 186 Ca 0.00 1.42 -0.19 0.00 0.71 0.00 0.00 52.55 54.50 3k2b s ASP 186 Cb -0.00 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.40 3k2b s ASP 186 CO 0.00 -0.88 0.64 0.00 0.21 0.00 0.00 175.17 175.14 3k2b s ALA 187 N 3.81 -0.93 0.17 5.23 0.00 0.97 -4.95 121.76 126.06 3k2b s ALA 187 Ca 0.53 -0.46 -0.24 0.00 0.00 0.00 0.00 51.96 51.79 3k2b s ALA 187 Cb -0.18 0.92 -0.14 0.00 0.00 0.00 0.00 23.12 23.71 3k2b s ALA 187 CO 0.17 -0.98 0.44 0.43 0.00 0.00 0.00 175.76 175.82 3k2b n SER 188 N -0.43 -1.05 0.00 0.00 7.64 -1.26 -4.37 113.62 114.14 3k2b n SER 188 Ca -0.04 0.95 0.00 0.00 1.01 0.00 0.00 58.87 60.79 3k2b n SER 188 Cb 0.60 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 3k2b n SER 188 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 3k2b n HIS 190 N 0.00 0.00 -0.28 1.43 -0.00 -1.26 -4.82 115.22 110.29 3k2b n HIS 190 Ca 0.15 0.00 0.22 0.00 -0.00 0.00 0.00 57.72 58.09 3k2b n HIS 190 Cb 0.21 0.00 0.42 0.00 -0.00 0.00 0.00 29.99 30.62 3k2b n HIS 190 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.34 179.23 3k2b n ARG 191 N 0.00 -0.06 -3.13 1.57 1.85 -1.26 -3.07 116.66 112.56 3k2b n ARG 191 Ca 0.00 1.21 -0.45 0.00 -1.00 0.00 0.00 57.85 57.61 3k2b n ARG 191 Cb 0.00 -2.08 -0.04 0.00 -1.05 0.00 0.00 32.46 29.29 3k2b n ARG 191 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3k2b s ASP 192 N -4.73 6.36 0.27 2.89 -1.08 -1.26 -4.94 116.67 114.18 3k2b s ASP 192 Ca -0.09 -1.78 -0.06 0.00 -0.52 0.00 0.00 52.55 50.10 3k2b s ASP 192 Cb 0.28 -2.30 0.47 0.00 -1.46 0.00 0.00 42.92 39.91 3k2b s ASP 192 CO 0.66 -1.00 1.46 0.18 0.52 0.00 0.00 175.17 177.00 3k2b n LEU 193 N 5.89 -0.31 0.27 -1.34 7.99 -1.18 0.12 117.00 128.45 3k2b n LEU 193 Ca -0.00 1.61 0.13 0.00 -0.01 0.00 0.00 56.01 57.74 3k2b n LEU 193 Cb 0.44 -0.50 0.80 0.00 -0.11 0.00 0.00 43.42 44.05 3k2b n LEU 193 CO 0.52 -1.56 1.11 0.03 -1.51 0.00 0.00 177.39 175.99 3k2b h ARG 194 N 0.00 0.00 -0.00 3.23 3.08 -1.90 -0.80 114.38 117.99 3k2b h ARG 194 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.52 3k2b h ARG 194 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 3k2b h ARG 194 CO -0.95 0.00 -0.38 0.54 -1.07 0.00 0.00 179.97 178.11 3k2b n ARG 195 N -4.12 0.47 0.00 0.04 1.74 0.33 -3.49 116.66 111.63 3k2b n ARG 195 Ca -0.02 -0.28 0.14 0.00 -0.77 0.00 0.00 57.85 56.91 3k2b n ARG 195 Cb 0.11 -1.49 0.64 0.00 -1.02 0.00 0.00 32.46 30.70 3k2b n ARG 195 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k2b n ALA 196 N -1.02 2.33 -1.77 7.54 0.00 -0.31 -3.19 120.51 124.09 3k2b n ALA 196 Ca 0.09 -0.11 -0.40 0.00 0.00 0.00 0.00 53.44 53.02 3k2b n ALA 196 Cb 0.34 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 18.28 3k2b n ALA 196 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3k2b s ARG 197 N -2.85 4.81 -0.11 0.00 1.81 -1.23 -0.02 118.95 121.36 3k2b s ARG 197 Ca 0.18 1.45 -0.16 0.00 -1.72 0.00 0.00 55.73 55.48 3k2b s ARG 197 Cb 0.19 -3.23 -0.19 0.00 -0.45 0.00 0.00 34.95 31.26 3k2b s ARG 197 CO 0.48 0.50 1.19 0.00 -0.68 0.00 0.00 175.30 176.80 3k2b n ALA 198 N 1.40 0.43 -0.39 2.13 0.00 -1.20 -4.21 120.51 118.67 3k2b n ALA 198 Ca -0.02 -1.69 0.30 0.00 0.00 0.00 0.00 53.44 52.03 3k2b n ALA 198 Cb 0.47 -2.05 0.46 0.00 0.00 0.00 0.00 19.45 18.34 3k2b n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b n ALA 199 N 7.74 1.07 -0.17 0.00 0.00 -0.62 0.22 120.51 128.75 3k2b n ALA 199 Ca 0.25 0.37 0.03 0.00 0.00 0.00 0.00 53.44 54.09 3k2b n ALA 199 Cb 0.37 -0.64 0.31 0.00 0.00 0.00 0.00 19.45 19.49 3k2b n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b h ALA 200 N 0.56 1.57 -3.00 0.00 0.00 -1.77 -3.38 119.26 113.23 3k2b h ALA 200 Ca 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3k2b h ALA 200 Cb 2.20 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.74 3k2b h ALA 200 CO -0.01 0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.89 3k2b n LEU 201 N -4.45 0.04 0.00 0.00 4.77 0.13 -4.71 117.00 112.78 3k2b n LEU 201 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3k2b n LEU 201 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3k2b n LEU 201 CO 0.35 0.00 0.00 -0.46 -1.33 0.00 0.00 177.39 175.95 3k2b n ASN 202 N -0.04 -1.29 -4.23 -1.43 0.23 -1.26 -4.62 115.26 102.62 3k2b n ASN 202 Ca 0.00 0.00 -0.31 0.00 -0.53 0.00 0.00 54.58 53.74 3k2b n ASN 202 Cb 0.00 0.00 -0.17 0.00 -2.08 0.00 0.00 39.78 37.53 3k2b n ASN 202 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 3k2b s ILE 203 N -0.64 2.02 -0.07 1.53 1.01 -1.26 -4.22 121.20 119.57 3k2b s ILE 203 Ca 0.00 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.67 3k2b s ILE 203 Cb 0.00 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 40.74 3k2b s ILE 203 CO 0.00 0.55 -0.19 -0.69 0.00 0.00 0.00 174.94 174.61 3k2b s VAL 204 N 0.15 1.64 0.15 2.92 1.01 0.01 -4.90 120.40 121.37 3k2b s VAL 204 Ca -0.13 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 3k2b s VAL 204 Cb -0.16 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3k2b s VAL 204 CO 0.07 0.47 0.37 -2.84 0.00 0.00 0.00 175.10 173.16 3k2b s PRO 205 N 0.28 3.57 0.19 2.72 0.02 -1.26 0.32 135.00 140.84 3k2b s PRO 205 Ca -0.12 -0.19 -0.23 0.00 0.02 0.00 0.00 61.00 60.49 3k2b s PRO 205 Cb -0.15 -2.86 0.06 0.00 0.02 0.00 0.00 34.50 31.57 3k2b s PRO 205 CO 0.05 0.46 0.63 -0.08 -0.33 0.00 0.00 177.00 177.73 3k2b s THR 206 N -1.71 0.00 1.28 0.99 -1.32 -0.51 -4.82 115.64 109.56 3k2b s THR 206 Ca 0.40 -0.24 -0.20 0.00 -1.21 0.00 0.00 61.69 60.44 3k2b s THR 206 Cb -0.12 -1.24 0.30 0.00 -1.51 0.00 0.00 72.50 69.94 3k2b s THR 206 CO 0.26 0.00 0.69 -1.20 -2.21 0.00 0.00 174.62 172.16 3k2b n SER 207 N -0.40 -3.73 0.00 8.08 7.64 -1.26 -2.04 113.62 121.92 3k2b n SER 207 Ca -0.14 -0.69 0.00 0.00 1.01 0.00 0.00 58.87 59.06 3k2b n SER 207 Cb 0.64 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 3k2b n SER 207 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3k2b n THR 208 N -5.27 0.00 0.30 0.44 5.66 -1.26 -4.47 114.28 109.68 3k2b n THR 208 Ca 0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 3k2b n THR 208 Cb 0.48 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.26 3k2b n THR 208 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3k2b n GLY 209 N 0.00 -0.07 0.39 1.09 0.00 -1.26 -3.24 105.19 102.10 3k2b n GLY 209 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 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 1.30 2.13 0.66 4.61 0.00 -1.95 1.54 119.26 127.56 3k2b h ALA 210 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3k2b h ALA 210 Cb 0.02 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3k2b h ALA 210 CO 0.00 -0.40 -0.32 0.00 0.00 0.00 0.00 179.25 178.53 3k2b h ALA 211 N 1.62 -0.89 -0.51 0.00 0.00 -1.89 -2.83 119.26 114.75 3k2b h ALA 211 Ca 0.46 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.27 3k2b h ALA 211 Cb 1.07 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 19.12 3k2b h ALA 211 CO -0.18 -0.83 0.03 -0.22 0.00 0.00 0.00 179.25 178.05 3k2b h LYS 212 N -1.23 0.14 -0.31 0.00 3.64 -1.54 -2.87 116.57 114.40 3k2b h LYS 212 Ca -0.09 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3k2b h LYS 212 Cb 0.68 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 3k2b h LYS 212 CO 0.15 0.09 -0.19 0.00 -2.27 0.00 0.00 179.45 177.24 3k2b n ALA 213 N -2.64 -0.20 -0.40 5.00 0.00 0.52 -0.54 120.51 122.25 3k2b n ALA 213 Ca 0.06 0.27 0.35 0.00 0.00 0.00 0.00 53.44 54.11 3k2b n ALA 213 Cb 0.27 0.27 0.54 0.00 0.00 0.00 0.00 19.45 20.53 3k2b n ALA 213 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3k2b n VAL 214 N -3.69 0.00 -0.18 0.00 0.31 -1.07 0.15 118.33 113.85 3k2b n VAL 214 Ca 0.01 1.17 0.01 0.00 -0.01 0.00 0.00 64.34 65.52 3k2b n VAL 214 Cb 0.08 -2.01 0.27 0.00 -0.91 0.00 0.00 33.84 31.27 3k2b n VAL 214 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k2b h ALA 215 N 0.65 1.50 -0.63 3.52 0.00 -0.94 0.43 119.26 123.79 3k2b h ALA 215 Ca 0.62 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.39 3k2b h ALA 215 Cb 2.87 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 20.35 3k2b h ALA 215 CO -0.01 0.46 0.07 -0.07 0.00 0.00 0.00 179.25 179.71 3k2b h LEU 216 N 0.95 1.02 0.00 0.00 3.38 0.13 -1.06 115.31 119.73 3k2b h LEU 216 Ca 0.26 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k2b h LEU 216 Cb -0.11 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.37 3k2b h LEU 216 CO -0.06 1.03 -0.86 1.33 0.09 0.00 0.00 178.44 179.98 3k2b n VAL 217 N -4.20 0.21 -3.35 1.22 0.24 -1.00 -4.57 118.33 106.87 3k2b n VAL 217 Ca 0.04 -0.23 -0.23 0.00 -2.04 0.00 0.00 64.34 61.88 3k2b n VAL 217 Cb 0.30 0.12 -0.09 0.00 -1.47 0.00 0.00 33.84 32.71 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 -3.92 0.73 0.14 1.34 1.43 0.15 -4.31 118.68 114.23 3k2b s LEU 218 Ca 0.05 -2.41 -0.30 0.00 -1.03 0.00 0.00 54.13 50.44 3k2b s LEU 218 Cb 0.14 -0.01 -0.06 0.00 0.03 0.00 0.00 46.19 46.29 3k2b s LEU 218 CO 0.77 -0.22 1.57 -0.65 0.23 0.00 0.00 176.35 178.05 3k2b h PRO 219 N 6.24 -0.42 -1.54 1.29 0.11 -1.41 -2.26 132.00 134.00 3k2b h PRO 219 Ca 0.15 0.03 0.45 0.00 0.11 0.00 0.00 66.00 66.74 3k2b h PRO 219 Cb 0.97 0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 3k2b h PRO 219 CO 0.27 -0.28 1.16 0.09 -0.21 0.00 0.00 178.00 179.03 3k2b n ASN 220 N -5.42 0.00 -0.59 -2.05 4.13 -1.26 0.20 115.26 110.27 3k2b n ASN 220 Ca -0.03 0.79 0.13 0.00 1.68 0.00 0.00 54.58 57.15 3k2b n ASN 220 Cb 0.36 -0.39 0.42 0.00 -1.54 0.00 0.00 39.78 38.63 3k2b n ASN 220 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 3k2b n LEU 221 N -3.50 1.81 -4.29 3.41 7.94 -0.85 -4.97 117.00 116.55 3k2b n LEU 221 Ca 0.35 -0.67 -0.38 0.00 -1.11 0.00 0.00 56.01 54.20 3k2b n LEU 221 Cb 1.62 -0.05 0.03 0.00 0.53 0.00 0.00 43.42 45.55 3k2b n LEU 221 CO 0.35 0.34 -0.49 1.17 -1.11 0.00 0.00 177.39 177.65 3k2b n LYS 222 N 0.41 0.14 -0.03 1.96 4.81 0.53 -2.44 118.16 123.54 3k2b n LYS 222 Ca 0.18 0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 3k2b n LYS 222 Cb 0.38 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 34.16 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 2.36 0.00 0.00 3.14 0.00 -1.26 -4.66 105.19 104.77 3k2b n GLY 223 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.31 0.00 -0.13 1.61 5.02 -1.02 -4.95 118.16 119.00 3k2b n LYS 224 Ca 0.00 0.20 -0.06 0.00 -2.02 0.00 0.00 58.31 56.42 3k2b n LYS 224 Cb 0.00 -0.86 0.06 0.00 -0.02 0.00 0.00 35.03 34.21 3k2b n LYS 224 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3k2b n LEU 225 N -1.09 0.00 0.00 -0.35 4.77 -1.26 -4.85 117.00 114.23 3k2b n LEU 225 Ca 0.00 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 3k2b n LEU 225 Cb 0.00 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 3k2b n LEU 225 CO 0.00 -1.70 0.00 -3.20 -1.33 0.00 0.00 177.39 171.16 3k2b n ASN 226 N -2.06 0.00 0.00 -1.43 5.15 -1.26 -4.78 115.26 110.88 3k2b n ASN 226 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 3k2b n ASN 226 Cb 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 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 -0.98 -1.12 1.72 8.20 0.00 -1.25 -1.73 105.19 110.03 3k2b n GLY 227 Ca 0.00 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 3k2b n GLY 227 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3k2b n ILE 228 N 9.00 0.00 -4.15 -0.61 -0.00 -1.09 -4.68 119.36 117.82 3k2b n ILE 228 Ca 0.00 -1.11 -0.16 0.00 -0.00 0.00 0.00 62.75 61.47 3k2b n ILE 228 Cb 0.00 0.61 -0.12 0.00 -0.00 0.00 0.00 39.64 40.13 3k2b n ILE 228 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3k2b s ALA 229 N -2.47 1.06 -0.24 -1.28 0.00 -0.86 -2.33 121.76 115.64 3k2b s ALA 229 Ca 0.18 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.15 3k2b s ALA 229 Cb 0.00 -0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.12 3k2b s ALA 229 CO 0.13 0.08 -0.12 -0.51 0.00 0.00 0.00 175.76 175.34 3k2b s LEU 230 N -1.89 3.05 -0.62 0.00 1.43 0.16 -1.43 118.68 119.39 3k2b s LEU 230 Ca -0.01 -1.09 -0.23 0.00 -1.03 0.00 0.00 54.13 51.77 3k2b s LEU 230 Cb -0.08 -1.56 0.06 0.00 0.03 0.00 0.00 46.19 44.64 3k2b s LEU 230 CO 0.02 -0.13 0.93 -0.13 0.23 0.00 0.00 176.35 177.27 3k2b s ARG 231 N 1.20 3.18 0.08 1.70 1.81 0.94 -0.52 118.95 127.34 3k2b s ARG 231 Ca -0.03 -0.67 0.01 0.00 -1.72 0.00 0.00 55.73 53.32 3k2b s ARG 231 Cb -0.17 -4.17 -0.04 0.00 -0.45 0.00 0.00 34.95 30.12 3k2b s ARG 231 CO -0.07 -1.68 0.18 0.14 -0.68 0.00 0.00 175.30 173.20 3k2b s VAL 232 N 3.93 5.13 -0.13 3.52 -7.23 -0.58 -0.81 120.40 124.24 3k2b s VAL 232 Ca 0.24 -0.56 -0.01 0.00 -1.81 0.00 0.00 61.98 59.85 3k2b s VAL 232 Cb -0.16 -3.52 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 3k2b s VAL 232 CO 0.13 0.09 1.12 -2.65 -0.31 0.00 0.00 175.10 173.48 3k2b n PRO 233 N 0.18 0.32 -4.44 4.82 -0.02 -1.26 -3.26 135.00 131.34 3k2b n PRO 233 Ca -0.06 -0.57 -0.25 0.00 -2.02 0.00 0.00 63.50 60.59 3k2b n PRO 233 Cb 0.52 -1.99 -0.17 0.00 -0.02 0.00 0.00 33.50 31.84 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 4.43 1.15 0.29 3.45 -4.23 -1.26 -5.01 115.64 114.46 3k2b s THR 234 Ca 0.06 -0.46 0.03 0.00 -1.18 0.00 0.00 61.69 60.14 3k2b s THR 234 Cb 0.02 -1.08 0.28 0.00 1.34 0.00 0.00 72.50 73.06 3k2b s THR 234 CO -0.00 0.37 1.79 1.55 -0.54 0.00 0.00 174.62 177.78 3k2b h PRO 235 N 7.25 0.77 -2.96 3.99 0.13 -1.88 -2.75 132.00 136.54 3k2b h PRO 235 Ca -0.31 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.73 3k2b h PRO 235 Cb 1.17 -0.17 -0.14 0.00 0.13 0.00 0.00 31.00 31.99 3k2b h PRO 235 CO 0.46 0.51 0.05 1.21 -0.23 0.00 0.00 178.00 180.00 3k2b s ASN 236 N -5.50 -0.42 0.00 1.44 2.47 -1.26 -4.58 114.94 107.09 3k2b s ASN 236 Ca -0.12 0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.19 3k2b s ASN 236 Cb 0.23 0.51 0.00 0.00 -1.45 0.00 0.00 41.25 40.54 3k2b s ASN 236 CO 0.80 -0.81 0.00 0.52 -3.72 0.00 0.00 177.10 173.89 3k2b n VAL 237 N 0.09 -0.15 -4.32 -5.21 0.31 -1.26 -4.88 118.33 102.90 3k2b n VAL 237 Ca -0.17 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 63.98 3k2b n VAL 237 Cb 0.62 -0.14 -0.09 0.00 -0.91 0.00 0.00 33.84 33.32 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 -0.16 1.39 -0.18 4.52 0.01 0.13 -3.51 113.70 115.89 3k2b s SER 238 Ca 0.00 -1.51 -0.12 0.00 1.31 0.00 0.00 55.95 55.63 3k2b s SER 238 Cb 0.00 0.34 0.06 0.00 0.21 0.00 0.00 66.02 66.62 3k2b s SER 238 CO 0.00 -0.85 0.44 0.54 0.41 0.00 0.00 173.24 173.78 3k2b s VAL 239 N -3.67 -0.02 0.25 3.43 0.11 -0.66 -1.00 120.40 118.85 3k2b s VAL 239 Ca 0.36 0.06 -0.06 0.00 -2.93 0.00 0.00 61.98 59.41 3k2b s VAL 239 Cb 0.06 -0.64 -0.06 0.00 -1.53 0.00 0.00 36.38 34.21 3k2b s VAL 239 CO 0.16 0.02 0.53 0.68 -3.33 0.00 0.00 175.10 173.17 3k2b s VAL 240 N 1.06 5.02 -0.43 2.04 -7.23 -0.56 -0.64 120.40 119.65 3k2b s VAL 240 Ca -0.07 0.16 0.02 0.00 -1.81 0.00 0.00 61.98 60.29 3k2b s VAL 240 Cb -0.07 -3.69 0.15 0.00 0.56 0.00 0.00 36.38 33.34 3k2b s VAL 240 CO -0.09 -0.21 0.29 -0.62 -0.31 0.00 0.00 175.10 174.16 3k2b s ASP 241 N -2.86 2.86 0.36 4.85 2.15 0.38 -3.26 116.67 121.15 3k2b s ASP 241 Ca 0.44 -2.78 0.08 0.00 0.43 0.00 0.00 52.55 50.72 3k2b s ASP 241 Cb -0.11 -0.72 -0.05 0.00 -0.30 0.00 0.00 42.92 41.74 3k2b s ASP 241 CO 0.27 -0.23 0.14 -1.48 -0.17 0.00 0.00 175.17 173.70 3k2b s LEU 242 N 0.26 3.19 -0.20 -1.34 2.34 -1.20 -0.42 118.68 121.31 3k2b s LEU 242 Ca 0.24 -0.88 -0.04 0.00 0.06 0.00 0.00 54.13 53.51 3k2b s LEU 242 Cb -0.13 -1.62 0.10 0.00 -0.56 0.00 0.00 46.19 43.99 3k2b s LEU 242 CO -0.08 -0.36 0.26 -0.69 -1.06 0.00 0.00 176.35 174.42 3k2b s VAL 243 N -2.48 -0.40 0.02 1.48 1.01 0.57 -2.53 120.40 118.07 3k2b s VAL 243 Ca 0.38 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.27 3k2b s VAL 243 Cb -0.01 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 3k2b s VAL 243 CO 0.22 -0.13 0.26 0.68 0.00 0.00 0.00 175.10 176.12 3k2b s VAL 244 N 2.39 5.32 -1.01 2.92 -7.23 -0.58 -1.22 120.40 121.00 3k2b s VAL 244 Ca 0.07 0.04 -0.02 0.00 -1.81 0.00 0.00 61.98 60.26 3k2b s VAL 244 Cb -0.15 -3.57 0.30 0.00 0.56 0.00 0.00 36.38 33.52 3k2b s VAL 244 CO -0.12 0.30 1.42 1.67 -0.31 0.00 0.00 175.10 178.06 3k2b n GLN 245 N 0.90 4.32 -0.90 4.82 7.27 -1.22 -2.16 117.38 130.41 3k2b n GLN 245 Ca -0.10 -4.59 -0.35 0.00 0.07 0.00 0.00 57.00 52.03 3k2b n GLN 245 Cb 0.52 -2.47 0.08 0.00 2.41 0.00 0.00 30.24 30.78 3k2b n GLN 245 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 3k2b n VAL 246 N 1.09 0.00 0.55 1.69 0.24 -1.25 -3.16 118.33 117.48 3k2b n VAL 246 Ca 0.29 -0.31 0.12 0.00 -2.04 0.00 0.00 64.34 62.40 3k2b n VAL 246 Cb 0.33 -0.26 0.21 0.00 -1.47 0.00 0.00 33.84 32.65 3k2b n VAL 246 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3k2b n SER 247 N 1.38 3.22 -3.75 -1.34 3.41 -0.33 -4.72 113.62 111.49 3k2b n SER 247 Ca 0.01 -1.97 -0.16 0.00 -0.26 0.00 0.00 58.87 56.49 3k2b n SER 247 Cb 0.59 -0.18 -0.16 0.00 -0.26 0.00 0.00 64.21 64.19 3k2b n SER 247 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3k2b s LYS 248 N -1.63 -0.04 0.32 4.33 2.20 -1.18 -5.00 119.74 118.73 3k2b s LYS 248 Ca 0.36 0.24 -0.28 0.00 -0.36 0.00 0.00 55.97 55.93 3k2b s LYS 248 Cb 0.22 -0.29 -0.13 0.00 -1.51 0.00 0.00 37.83 36.12 3k2b s LYS 248 CO 0.31 -0.20 1.12 1.63 -0.36 0.00 0.00 175.35 177.85 3k2b n LYS 249 N 4.40 1.65 -2.32 4.03 5.02 -1.26 -4.84 118.16 124.83 3k2b n LYS 249 Ca -0.23 0.58 -0.05 0.00 -2.02 0.00 0.00 58.31 56.59 3k2b n LYS 249 Cb 0.50 -2.04 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 3k2b n LYS 249 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3k2b n THR 250 N 0.23 0.00 -4.27 -0.18 5.66 -0.92 -5.04 114.28 109.76 3k2b n THR 250 Ca 0.08 -0.55 -0.15 0.00 -3.05 0.00 0.00 64.05 60.38 3k2b n THR 250 Cb 0.34 0.43 -0.10 0.00 -1.55 0.00 0.00 70.33 69.44 3k2b n THR 250 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 3k2b s PHE 251 N -5.30 1.38 0.13 1.09 0.08 -1.26 -4.63 117.98 109.46 3k2b s PHE 251 Ca 0.09 -1.29 -0.14 0.00 0.12 0.00 0.00 56.93 55.71 3k2b s PHE 251 Cb -0.01 -0.75 -0.02 0.00 -0.57 0.00 0.00 43.02 41.67 3k2b s PHE 251 CO 0.07 -0.49 1.54 0.00 -0.10 0.00 0.00 175.22 176.24 3k2b h ALA 252 N 2.47 0.55 -0.75 5.36 0.00 -1.92 -1.72 119.26 123.26 3k2b h ALA 252 Ca -0.37 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.26 3k2b h ALA 252 Cb 1.25 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3k2b h ALA 252 CO 0.56 0.40 0.49 1.49 0.00 0.00 0.00 179.25 182.20 3k2b h GLU 253 N 0.58 0.96 -0.03 0.00 4.57 -1.97 -2.62 114.58 116.07 3k2b h GLU 253 Ca 0.11 -0.06 -0.16 0.00 -1.18 0.00 0.00 59.36 58.07 3k2b h GLU 253 Cb 0.58 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 3k2b h GLU 253 CO 0.03 0.64 -0.71 1.49 -1.18 0.00 0.00 179.01 179.28 3k2b h GLU 254 N 0.99 0.15 -0.40 1.92 4.81 -1.97 -2.95 114.58 117.14 3k2b h GLU 254 Ca 0.28 -0.12 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 3k2b h GLU 254 Cb -0.07 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 3k2b h GLU 254 CO -0.08 0.80 0.05 0.28 -0.73 0.00 0.00 179.01 179.33 3k2b h VAL 255 N 0.10 0.76 -0.39 0.32 2.07 -0.95 -1.76 116.25 116.41 3k2b h VAL 255 Ca -0.02 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 3k2b h VAL 255 Cb 1.26 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3k2b h VAL 255 CO 0.10 0.03 0.05 0.78 0.02 0.00 0.00 177.57 178.55 3k2b h ASN 256 N 0.17 0.55 -0.28 0.57 -0.26 -1.39 -2.87 115.58 112.08 3k2b h ASN 256 Ca 0.19 -0.10 0.07 0.00 -0.56 0.00 0.00 56.30 55.90 3k2b h ASN 256 Cb 0.25 -0.14 -0.07 0.00 -1.06 0.00 0.00 38.32 37.30 3k2b h ASN 256 CO -0.28 0.59 -0.18 0.00 -1.06 0.00 0.00 177.43 176.51 3k2b h ALA 257 N 1.48 0.03 -0.88 -0.83 0.00 -1.15 0.71 119.26 118.61 3k2b h ALA 257 Ca 0.13 0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.30 3k2b h ALA 257 Cb 0.30 0.40 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 3k2b h ALA 257 CO 0.00 -0.58 0.47 0.00 0.00 0.00 0.00 179.25 179.15 3k2b h ALA 258 N 1.03 1.36 0.44 0.00 0.00 -1.36 0.60 119.26 121.33 3k2b h ALA 258 Ca 0.15 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3k2b h ALA 258 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3k2b h ALA 258 CO -0.37 -0.08 -0.21 0.74 0.00 0.00 0.00 179.25 179.32 3k2b h PHE 259 N 0.65 -0.55 -0.28 0.00 0.04 -0.83 -2.50 116.94 113.48 3k2b h PHE 259 Ca 0.49 -0.01 0.07 0.00 2.80 0.00 0.00 57.97 61.32 3k2b h PHE 259 Cb 0.71 0.18 -0.01 0.00 2.20 0.00 0.00 35.95 39.03 3k2b h PHE 259 CO -0.08 -0.22 0.20 0.00 -0.60 0.00 0.00 178.31 177.61 3k2b h ARG 260 N -0.93 0.05 0.18 1.51 3.08 0.11 0.11 114.38 118.48 3k2b h ARG 260 Ca -0.06 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3k2b h ARG 260 Cb 0.57 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3k2b h ARG 260 CO 0.10 0.03 -0.09 -0.44 -1.07 0.00 0.00 179.97 178.50 3k2b h ASP 261 N 0.05 -0.21 -0.93 7.04 3.45 0.20 -2.93 116.42 123.08 3k2b h ASP 261 Ca 0.13 0.01 0.26 0.00 0.43 0.00 0.00 57.03 57.86 3k2b h ASP 261 Cb 0.47 0.05 -0.14 0.00 -0.56 0.00 0.00 39.33 39.16 3k2b h ASP 261 CO -0.01 -0.04 0.42 0.28 -1.57 0.00 0.00 179.24 178.33 3k2b h SER 262 N -0.47 0.33 -0.99 6.45 0.02 -1.37 0.37 113.55 117.88 3k2b h SER 262 Ca -0.03 0.17 0.33 0.00 -0.84 0.00 0.00 61.79 61.43 3k2b h SER 262 Cb 0.19 0.16 -0.16 0.00 0.14 0.00 0.00 62.40 62.73 3k2b h SER 262 CO 0.04 -0.07 0.51 0.00 -1.14 0.00 0.00 176.83 176.17 3k2b h ALA 263 N 1.77 1.90 -0.14 3.77 0.00 -0.74 0.13 119.26 125.95 3k2b h ALA 263 Ca 0.62 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.74 3k2b h ALA 263 Cb 1.27 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3k2b h ALA 263 CO -0.58 -0.63 0.00 -1.91 0.00 0.00 0.00 179.25 176.13 3k2b n GLU 264 N -5.12 1.78 0.00 0.00 2.13 0.12 -3.70 120.64 115.85 3k2b n GLU 264 Ca 0.32 -1.75 0.00 0.00 0.66 0.00 0.00 57.16 56.39 3k2b n GLU 264 Cb 1.00 -1.36 0.00 0.00 0.27 0.00 0.00 31.44 31.35 3k2b n GLU 264 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3k2b n LYS 265 N 1.04 0.00 0.00 5.31 0.00 0.18 -4.93 118.16 119.76 3k2b n LYS 265 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.43 3k2b n LYS 265 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.50 3k2b n LYS 265 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3k2b n GLU 266 N -1.59 0.00 -0.60 1.64 -0.58 -0.26 -4.15 120.64 115.10 3k2b n GLU 266 Ca 0.00 0.28 -0.05 0.00 -0.42 0.00 0.00 57.16 56.97 3k2b n GLU 266 Cb 0.00 -0.92 -0.07 0.00 -0.57 0.00 0.00 31.44 29.88 3k2b n GLU 266 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3k2b n LEU 267 N -1.34 4.15 -4.61 -4.62 4.77 0.21 -4.86 117.00 110.70 3k2b n LEU 267 Ca 0.00 -2.27 -0.43 0.00 -0.03 0.00 0.00 56.01 53.28 3k2b n LEU 267 Cb 0.00 -1.01 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 3k2b n LEU 267 CO 0.00 1.02 0.85 -0.75 -1.33 0.00 0.00 177.39 177.19 3k2b s LYS 268 N 0.96 3.88 0.00 3.23 2.20 -1.20 0.08 119.74 128.89 3k2b s LYS 268 Ca 0.28 0.70 0.00 0.00 -0.36 0.00 0.00 55.97 56.59 3k2b s LYS 268 Cb 0.13 -3.80 0.00 0.00 -1.51 0.00 0.00 37.83 32.65 3k2b s LYS 268 CO 0.00 -1.01 0.00 0.41 -0.36 0.00 0.00 175.35 174.39 3k2b n GLY 269 N 4.33 2.92 0.13 5.54 0.00 -1.26 -4.77 105.19 112.08 3k2b n GLY 269 Ca 0.09 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 3k2b n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3k2b h ILE 270 N 0.00 1.13 -4.40 -0.61 1.08 -1.83 -3.38 117.51 109.50 3k2b h ILE 270 Ca 0.00 -2.68 -0.62 0.00 -0.39 0.00 0.00 64.86 61.17 3k2b h ILE 270 Cb 0.00 2.85 -0.30 0.00 -3.07 0.00 0.00 36.82 36.30 3k2b h ILE 270 CO 0.00 0.84 -0.86 -0.22 -0.69 0.00 0.00 178.15 177.22 3k2b s LEU 271 N -7.28 2.03 -0.04 1.44 2.96 0.11 -2.69 118.68 115.22 3k2b s LEU 271 Ca -0.11 -0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 53.36 3k2b s LEU 271 Cb 0.06 -1.11 0.01 0.00 0.50 0.00 0.00 46.19 45.64 3k2b s LEU 271 CO 0.88 0.26 0.13 -0.62 -1.32 0.00 0.00 176.35 175.67 3k2b s ASP 272 N -0.45 -0.09 -0.43 3.68 3.68 -1.20 -4.59 116.67 117.27 3k2b s ASP 272 Ca 0.07 0.13 -0.01 0.00 2.13 0.00 0.00 52.55 54.87 3k2b s ASP 272 Cb -0.09 0.25 0.12 0.00 -1.45 0.00 0.00 42.92 41.75 3k2b s ASP 272 CO -0.00 -0.13 0.21 -0.69 0.13 0.00 0.00 175.17 174.69 3k2b s VAL 273 N -0.31 3.10 0.14 1.11 1.01 -1.26 -0.80 120.40 123.39 3k2b s VAL 273 Ca -0.04 -2.34 -0.19 0.00 0.00 0.00 0.00 61.98 59.41 3k2b s VAL 273 Cb -0.03 -3.14 -0.07 0.00 0.00 0.00 0.00 36.38 33.14 3k2b s VAL 273 CO 0.00 -0.71 0.64 0.00 0.00 0.00 0.00 175.10 175.03 3k2b n ASP 275 N 1.22 1.80 -4.48 0.00 8.00 -1.26 -2.41 116.55 119.42 3k2b n ASP 275 Ca -0.06 -0.04 -0.30 0.00 0.71 0.00 0.00 54.79 55.10 3k2b n ASP 275 Cb 0.51 0.44 0.22 0.00 -0.02 0.00 0.00 41.12 42.27 3k2b n ASP 275 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3k2b n GLU 276 N -2.73 -1.82 -0.90 -1.24 1.02 -1.26 -4.10 120.64 109.61 3k2b n GLU 276 Ca -0.27 -0.50 -0.13 0.00 -0.02 0.00 0.00 57.16 56.24 3k2b n GLU 276 Cb 0.93 -2.12 -0.01 0.00 -0.02 0.00 0.00 31.44 30.22 3k2b n GLU 276 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3k2b n PRO 277 N -4.18 1.71 -0.45 3.49 -0.04 -1.26 -4.89 135.00 129.38 3k2b n PRO 277 Ca 0.05 -1.21 -0.29 0.00 -0.04 0.00 0.00 63.50 62.01 3k2b n PRO 277 Cb 0.55 -1.59 0.27 0.00 -0.04 0.00 0.00 33.50 32.69 3k2b n PRO 277 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k2b s LEU 278 N -1.17 0.04 0.47 1.53 1.43 -1.26 -5.08 118.68 114.63 3k2b s LEU 278 Ca 0.32 1.29 0.02 0.00 -1.03 0.00 0.00 54.13 54.73 3k2b s LEU 278 Cb 0.21 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.41 3k2b s LEU 278 CO -0.04 -4.71 0.05 0.68 0.23 0.00 0.00 176.35 172.56 3k2b s VAL 279 N -2.36 0.98 0.13 -1.59 -7.23 -1.26 -5.05 120.40 104.03 3k2b s VAL 279 Ca 0.69 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 58.62 3k2b s VAL 279 Cb -0.22 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 3k2b s VAL 279 CO 0.63 0.00 1.64 0.77 -0.31 0.00 0.00 175.10 177.83 3k2b h SER 280 N 1.54 -0.68 0.00 4.85 4.64 -1.98 -1.24 113.55 120.68 3k2b h SER 280 Ca -0.41 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3k2b h SER 280 Cb 1.30 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 3k2b h SER 280 CO 0.68 -0.27 0.30 0.55 -0.87 0.00 0.00 176.83 177.22 3k2b n VAL 281 N -5.35 0.64 0.90 0.95 3.14 -1.26 -0.44 118.33 116.90 3k2b n VAL 281 Ca -0.03 0.72 0.11 0.00 -2.96 0.00 0.00 64.34 62.18 3k2b n VAL 281 Cb 0.27 -1.72 0.05 0.00 -1.06 0.00 0.00 33.84 31.37 3k2b n VAL 281 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3k2b n ASP 282 N -1.99 0.72 -1.38 6.55 8.00 -0.47 -4.13 116.55 123.85 3k2b n ASP 282 Ca -0.01 -0.54 0.08 0.00 0.71 0.00 0.00 54.79 55.03 3k2b n ASP 282 Cb 0.32 0.70 0.30 0.00 -0.02 0.00 0.00 41.12 42.42 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 -1.60 1.24 -0.89 1.24 3.72 0.41 -4.97 117.46 116.61 3k2b n PHE 283 Ca 0.04 -0.50 -0.30 0.00 -0.05 0.00 0.00 57.45 56.63 3k2b n PHE 283 Cb 0.36 -0.19 0.16 0.00 -0.94 0.00 0.00 39.48 38.86 3k2b n PHE 283 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3k2b s ARG 284 N -1.73 1.08 -0.20 -1.08 0.52 -1.26 -3.12 118.95 113.15 3k2b s ARG 284 Ca 0.44 1.25 0.00 0.00 -0.52 0.00 0.00 55.73 56.90 3k2b s ARG 284 Cb 0.28 -1.76 0.00 0.00 0.52 0.00 0.00 34.95 33.99 3k2b s ARG 284 CO 0.22 -2.49 0.00 0.00 0.02 0.00 0.00 175.30 173.05 3k2b s SER 286 N -1.39 6.95 0.00 0.00 1.04 -1.18 -4.91 113.70 114.21 3k2b s SER 286 Ca 0.00 1.18 0.00 0.00 0.48 0.00 0.00 55.95 57.61 3k2b s SER 286 Cb 0.00 -2.47 0.00 0.00 0.10 0.00 0.00 66.02 63.65 3k2b s SER 286 CO 0.00 -0.53 0.75 0.47 0.98 0.00 0.00 173.24 174.91 3k2b n ASP 287 N 5.88 0.17 -4.36 7.02 8.00 -1.26 -4.11 116.55 127.89 3k2b n ASP 287 Ca 0.07 -1.67 -0.44 0.00 0.71 0.00 0.00 54.79 53.46 3k2b n ASP 287 Cb 0.47 -0.08 -0.07 0.00 -0.02 0.00 0.00 41.12 41.42 3k2b n ASP 287 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3k2b s PHE 288 N -1.80 3.26 0.28 1.24 0.08 -1.26 -4.73 117.98 115.06 3k2b s PHE 288 Ca 0.00 -1.08 0.07 0.00 0.12 0.00 0.00 56.93 56.04 3k2b s PHE 288 Cb 0.00 -3.27 0.81 0.00 -0.57 0.00 0.00 43.02 39.99 3k2b s PHE 288 CO 0.00 -0.85 1.34 0.43 -0.10 0.00 0.00 175.22 176.04 3k2b n SER 289 N 5.18 0.03 -3.73 1.36 7.64 -1.10 -3.85 113.62 119.16 3k2b n SER 289 Ca -0.12 1.44 -0.23 0.00 1.01 0.00 0.00 58.87 60.97 3k2b n SER 289 Cb 0.43 -0.58 -0.18 0.00 -1.01 0.00 0.00 64.21 62.87 3k2b n SER 289 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3k2b s THR 290 N -5.64 0.21 -0.27 0.44 -1.32 -1.17 -4.07 115.64 103.82 3k2b s THR 290 Ca -0.10 0.14 -0.07 0.00 -1.21 0.00 0.00 61.69 60.45 3k2b s THR 290 Cb 0.26 -0.46 -0.01 0.00 -1.51 0.00 0.00 72.50 70.78 3k2b s THR 290 CO 0.66 0.16 0.08 0.28 -2.21 0.00 0.00 174.62 173.60 3k2b s THR 291 N 2.04 4.21 -0.45 5.08 -1.32 -0.42 -3.24 115.64 121.53 3k2b s THR 291 Ca 0.04 -0.39 -0.26 0.00 -1.21 0.00 0.00 61.69 59.87 3k2b s THR 291 Cb -0.13 -3.06 0.03 0.00 -1.51 0.00 0.00 72.50 67.83 3k2b s THR 291 CO -0.05 0.22 0.98 -0.63 -2.21 0.00 0.00 174.62 172.93 3k2b s ILE 292 N 1.57 4.42 -0.80 5.08 -1.09 0.02 -1.50 121.20 128.91 3k2b s ILE 292 Ca 0.05 0.93 -0.22 0.00 -2.23 0.00 0.00 60.65 59.18 3k2b s ILE 292 Cb -0.16 -4.47 0.08 0.00 -1.58 0.00 0.00 42.46 36.33 3k2b s ILE 292 CO 0.03 -0.84 1.12 -0.62 -1.23 0.00 0.00 174.94 173.40 3k2b s ASP 293 N 2.26 6.34 0.10 3.58 -1.08 -1.13 -2.21 116.67 124.53 3k2b s ASP 293 Ca 0.40 -1.27 -0.22 0.00 -0.52 0.00 0.00 52.55 50.94 3k2b s ASP 293 Cb -0.10 -2.45 -0.06 0.00 -1.46 0.00 0.00 42.92 38.85 3k2b s ASP 293 CO 0.27 -1.40 1.37 0.77 0.52 0.00 0.00 175.17 176.69 3k2b h SER 294 N 9.46 -1.34 0.00 -0.34 4.64 -1.74 -0.17 113.55 124.07 3k2b h SER 294 Ca -0.09 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3k2b h SER 294 Cb 1.05 0.57 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 3k2b h SER 294 CO 1.21 -0.22 0.00 -1.54 -0.87 0.00 0.00 176.83 175.41 3k2b n SER 295 N -4.50 0.00 -0.00 4.97 3.41 -1.26 0.44 113.62 116.68 3k2b n SER 295 Ca -0.01 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.60 3k2b n SER 295 Cb 0.21 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.15 3k2b n SER 295 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k2b n LEU 296 N -0.34 0.00 -4.77 1.04 4.77 -0.09 -5.02 117.00 112.59 3k2b n LEU 296 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 3k2b n LEU 296 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 3k2b n LEU 296 CO 0.00 0.00 1.09 0.28 -1.33 0.00 0.00 177.39 177.44 3k2b s THR 297 N -2.01 2.11 -0.03 -5.08 -1.32 0.17 -4.75 115.64 104.73 3k2b s THR 297 Ca -0.00 0.10 -0.27 0.00 -1.21 0.00 0.00 61.69 60.31 3k2b s THR 297 Cb 0.00 -3.06 0.06 0.00 -1.51 0.00 0.00 72.50 67.99 3k2b s THR 297 CO 0.01 0.02 0.60 0.00 -2.21 0.00 0.00 174.62 173.04 3k2b s MET 298 N -2.25 0.99 -0.16 7.08 0.23 -1.25 -4.94 119.30 119.00 3k2b s MET 298 Ca 0.57 0.12 -0.05 0.00 -1.03 0.00 0.00 55.69 55.30 3k2b s MET 298 Cb -0.45 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.29 3k2b s MET 298 CO 0.59 -0.31 -0.00 0.08 -2.03 0.00 0.00 175.02 173.34 3k2b s VAL 299 N -1.38 4.21 -0.56 5.16 1.01 -1.26 -2.54 120.40 125.03 3k2b s VAL 299 Ca -0.11 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 3k2b s VAL 299 Cb -0.01 -2.86 0.14 0.00 0.00 0.00 0.00 36.38 33.66 3k2b s VAL 299 CO 0.08 0.49 0.44 -0.04 0.00 0.00 0.00 175.10 176.06 3k2b s MET 300 N 0.29 2.69 -0.82 2.72 -1.94 -0.46 -4.62 119.30 117.16 3k2b s MET 300 Ca -0.01 -2.03 -0.05 0.00 -1.71 0.00 0.00 55.69 51.89 3k2b s MET 300 Cb -0.13 -3.98 0.01 0.00 2.01 0.00 0.00 34.83 32.73 3k2b s MET 300 CO 0.02 -1.21 0.72 0.41 -0.01 0.00 0.00 175.02 174.95 3k2b n GLY 301 N 4.48 0.03 4.57 -0.03 0.00 -1.26 -3.45 105.19 109.52 3k2b n GLY 301 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.37 0.00 -2.62 1.61 8.00 -1.26 -4.65 116.55 116.26 3k2b n ASP 302 Ca -0.01 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.22 3k2b n ASP 302 Cb 0.54 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.63 3k2b n ASP 302 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3k2b n ASP 303 N 0.86 4.53 -2.75 -2.24 9.92 -1.25 -2.16 116.55 123.46 3k2b n ASP 303 Ca 0.00 -3.68 -0.03 0.00 -0.53 0.00 0.00 54.79 50.55 3k2b n ASP 303 Cb 0.00 -0.49 0.02 0.00 -0.64 0.00 0.00 41.12 40.01 3k2b n ASP 303 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3k2b s MET 304 N -3.50 0.64 0.27 -1.24 1.75 -1.22 -3.94 119.30 112.05 3k2b s MET 304 Ca 0.48 -0.59 -0.22 0.00 -1.25 0.00 0.00 55.69 54.11 3k2b s MET 304 Cb 0.37 -0.02 -0.09 0.00 2.84 0.00 0.00 34.83 37.93 3k2b s MET 304 CO -0.17 -0.81 0.81 0.08 -0.65 0.00 0.00 175.02 174.28 3k2b s VAL 305 N 1.05 4.44 -0.36 10.11 1.01 -0.92 -1.35 120.40 134.38 3k2b s VAL 305 Ca 0.25 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.73 3k2b s VAL 305 Cb 0.05 -3.90 0.11 0.00 0.00 0.00 0.00 36.38 32.64 3k2b s VAL 305 CO -0.08 0.16 0.10 -0.75 0.00 0.00 0.00 175.10 174.53 3k2b s LYS 306 N -2.06 1.32 0.17 2.72 2.20 -1.05 -1.52 119.74 121.51 3k2b s LYS 306 Ca 0.46 -1.76 -0.20 0.00 -0.36 0.00 0.00 55.97 54.11 3k2b s LYS 306 Cb -0.17 -2.84 -0.08 0.00 -1.51 0.00 0.00 37.83 33.24 3k2b s LYS 306 CO 0.22 -0.99 0.68 0.08 -0.36 0.00 0.00 175.35 174.98 3k2b s VAL 307 N 0.92 4.59 -0.18 4.02 1.01 -1.05 -3.87 120.40 125.84 3k2b s VAL 307 Ca 0.12 1.32 0.01 0.00 0.00 0.00 0.00 61.98 63.42 3k2b s VAL 307 Cb -0.20 -3.92 0.04 0.00 0.00 0.00 0.00 36.38 32.30 3k2b s VAL 307 CO -0.11 0.36 -0.11 -0.63 0.00 0.00 0.00 175.10 174.62 3k2b s ILE 308 N -1.34 1.54 0.03 2.22 -1.09 -1.26 -3.22 121.20 118.08 3k2b s ILE 308 Ca 0.38 -0.84 0.06 0.00 -2.23 0.00 0.00 60.65 58.01 3k2b s ILE 308 Cb -0.19 -1.58 -0.02 0.00 -1.58 0.00 0.00 42.46 39.09 3k2b s ILE 308 CO 0.22 0.25 -0.17 0.00 -1.23 0.00 0.00 174.94 174.00 3k2b s ALA 309 N 1.46 1.45 0.10 9.38 0.00 -1.20 -2.82 121.76 130.13 3k2b s ALA 309 Ca 0.01 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.10 3k2b s ALA 309 Cb -0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 3k2b s ALA 309 CO -0.09 0.32 0.14 -1.58 0.00 0.00 0.00 175.76 174.54 3k2b s TRP 310 N -0.73 3.27 -0.04 0.00 0.52 -0.56 -1.50 118.94 119.90 3k2b s TRP 310 Ca 0.05 0.09 -0.24 0.00 0.02 0.00 0.00 56.10 56.03 3k2b s TRP 310 Cb -0.08 -1.63 0.05 0.00 -1.15 0.00 0.00 33.47 30.66 3k2b s TRP 310 CO 0.01 0.53 0.52 1.52 0.02 0.00 0.00 176.95 179.55 3k2b s TYR 311 N -1.52 -0.45 -0.53 -1.98 -0.85 -0.17 -1.30 117.35 110.54 3k2b s TYR 311 Ca 0.31 0.77 -0.18 0.00 -0.52 0.00 0.00 57.07 57.44 3k2b s TYR 311 Cb -0.12 0.27 0.08 0.00 0.38 0.00 0.00 41.96 42.57 3k2b s TYR 311 CO 0.24 -0.50 0.62 0.34 -1.52 0.00 0.00 175.55 174.72 3k2b s ASP 312 N -1.20 6.20 0.32 -0.18 -1.08 -1.26 -0.70 116.67 118.77 3k2b s ASP 312 Ca -0.12 -1.20 0.04 0.00 -0.52 0.00 0.00 52.55 50.75 3k2b s ASP 312 Cb -0.02 -2.28 0.64 0.00 -1.46 0.00 0.00 42.92 39.80 3k2b s ASP 312 CO 0.07 -0.94 1.89 -0.55 0.52 0.00 0.00 175.17 176.16 3k2b h ASN 313 N 9.03 0.81 0.00 -0.34 -1.07 -1.92 0.53 115.58 122.61 3k2b h ASN 313 Ca -0.28 0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.11 3k2b h ASN 313 Cb 1.09 -0.14 0.00 0.00 -2.07 0.00 0.00 38.32 37.20 3k2b h ASN 313 CO 1.01 0.47 0.00 -0.62 0.07 0.00 0.00 177.43 178.36 3k2b n GLU 314 N -4.53 0.00 0.05 4.14 1.02 -1.26 -3.52 120.64 116.54 3k2b n GLU 314 Ca 0.15 0.17 -0.12 0.00 -0.02 0.00 0.00 57.16 57.34 3k2b n GLU 314 Cb 0.31 -0.73 -0.06 0.00 -0.02 0.00 0.00 31.44 30.94 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 -0.08 -0.05 -0.32 2.91 -1.95 -1.41 115.95 115.05 3k2b h TRP 315 Ca 0.00 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.04 3k2b h TRP 315 Cb 0.00 0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 28.65 3k2b h TRP 315 CO 0.01 -0.05 -0.31 0.78 -1.03 0.00 0.00 178.44 177.84 3k2b h GLY 316 N -0.07 -1.28 0.17 2.65 0.00 -0.11 -2.19 103.07 102.25 3k2b h GLY 316 Ca 0.01 0.66 0.12 0.00 0.00 0.00 0.00 47.33 48.12 3k2b h GLY 316 CO -0.03 -0.37 0.14 -1.82 0.00 0.00 0.00 176.54 174.46 3k2b h TYR 317 N -0.35 0.21 -0.50 5.60 3.20 -1.44 -2.69 116.97 121.01 3k2b h TYR 317 Ca 0.01 0.04 0.09 0.00 3.14 0.00 0.00 58.73 62.01 3k2b h TYR 317 Cb 0.40 -0.00 -0.08 0.00 1.54 0.00 0.00 36.73 38.59 3k2b h TYR 317 CO -0.50 -0.03 0.05 0.77 -1.64 0.00 0.00 178.16 176.82 3k2b h SER 318 N 0.27 -0.10 -0.25 -2.11 0.02 -0.78 0.12 113.55 110.72 3k2b h SER 318 Ca 0.32 0.10 0.06 0.00 -0.84 0.00 0.00 61.79 61.43 3k2b h SER 318 Cb 0.48 0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 3k2b h SER 318 CO -0.41 -0.02 0.17 1.56 -1.14 0.00 0.00 176.83 177.00 3k2b h GLN 319 N 0.18 0.07 -0.27 3.45 1.08 -1.06 -1.49 115.11 117.07 3k2b h GLN 319 Ca 0.25 -0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.32 3k2b h GLN 319 Cb 0.36 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.77 3k2b h GLN 319 CO -0.37 0.05 -0.34 0.00 -0.95 0.00 0.00 178.83 177.22 3k2b h ARG 320 N 0.07 0.71 -0.99 1.46 2.47 -0.96 -0.86 114.38 116.28 3k2b h ARG 320 Ca 0.11 -0.40 0.06 0.00 -1.26 0.00 0.00 59.98 58.49 3k2b h ARG 320 Cb 0.36 0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.64 3k2b h ARG 320 CO -0.01 1.02 0.64 0.28 0.56 0.00 0.00 179.97 182.46 3k2b h VAL 321 N 0.44 1.09 0.44 2.04 2.07 -0.67 0.26 116.25 121.91 3k2b h VAL 321 Ca 0.03 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 3k2b h VAL 321 Cb 0.93 -0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3k2b h VAL 321 CO 0.08 0.21 -0.21 0.58 0.02 0.00 0.00 177.57 178.25 3k2b h VAL 322 N 1.17 0.57 -0.32 2.57 2.07 -1.13 0.18 116.25 121.36 3k2b h VAL 322 Ca 0.43 -0.08 0.07 0.00 0.82 0.00 0.00 66.70 67.93 3k2b h VAL 322 Cb 0.16 0.61 -0.08 0.00 -1.52 0.00 0.00 31.29 30.45 3k2b h VAL 322 CO -0.17 0.02 -0.36 0.44 0.02 0.00 0.00 177.57 177.52 3k2b h ASP 323 N -0.63 -1.17 -0.63 0.57 3.32 -0.16 0.37 116.42 118.08 3k2b h ASP 323 Ca -0.06 0.19 0.10 0.00 0.02 0.00 0.00 57.03 57.28 3k2b h ASP 323 Cb 0.48 0.52 -0.08 0.00 0.22 0.00 0.00 39.33 40.47 3k2b h ASP 323 CO 0.10 -0.35 0.24 0.25 -1.72 0.00 0.00 179.24 177.75 3k2b h LEU 324 N -0.32 0.23 -1.26 1.55 5.85 -0.34 0.14 115.31 121.15 3k2b h LEU 324 Ca 0.14 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 3k2b h LEU 324 Cb 0.56 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 3k2b h LEU 324 CO -0.50 0.13 0.42 0.00 -0.34 0.00 0.00 178.44 178.15 3k2b h ALA 325 N 1.44 1.45 -0.25 1.25 0.00 0.11 -1.28 119.26 121.98 3k2b h ALA 325 Ca 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3k2b h ALA 325 Cb 0.42 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3k2b h ALA 325 CO -0.32 0.48 0.13 -0.44 0.00 0.00 0.00 179.25 179.10 3k2b h ASP 326 N 0.94 0.32 -0.01 0.00 3.32 0.23 0.81 116.42 122.02 3k2b h ASP 326 Ca 0.25 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3k2b h ASP 326 Cb -0.05 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3k2b h ASP 326 CO -0.05 0.33 -0.05 0.40 -1.72 0.00 0.00 179.24 178.15 3k2b h ILE 327 N 0.29 0.00 -1.03 0.35 2.04 0.06 1.32 117.51 120.53 3k2b h ILE 327 Ca 0.09 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.24 3k2b h ILE 327 Cb 0.08 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.03 3k2b h ILE 327 CO -0.01 0.00 0.61 0.58 0.00 0.00 0.00 178.15 179.33 3k2b h VAL 328 N -0.05 0.41 0.15 1.67 2.07 -1.28 0.66 116.25 119.87 3k2b h VAL 328 Ca 0.00 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 3k2b h VAL 328 Cb 0.06 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 3k2b h VAL 328 CO -0.04 0.08 -0.07 0.00 0.02 0.00 0.00 177.57 177.56 3k2b h ALA 329 N 1.76 -0.20 0.00 1.67 0.00 0.11 -2.78 119.26 119.82 3k2b h ALA 329 Ca 0.69 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.47 3k2b h ALA 329 Cb 1.55 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.42 3k2b h ALA 329 CO -0.50 -0.51 0.00 0.09 0.00 0.00 0.00 179.25 178.33 3k2b n ASN 330 N -5.09 0.00 -3.20 0.00 5.03 0.43 -3.52 115.26 108.92 3k2b n ASN 330 Ca -0.09 -0.53 -0.24 0.00 0.87 0.00 0.00 54.58 54.60 3k2b n ASN 330 Cb 0.18 -0.14 -0.06 0.00 -1.02 0.00 0.00 39.78 38.74 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 -1.14 2.28 -4.18 6.41 3.02 0.20 -5.04 115.26 116.82 3k2b n ASN 331 Ca 0.18 -3.19 -0.30 0.00 -0.03 0.00 0.00 54.58 51.24 3k2b n ASN 331 Cb 0.16 -0.63 -0.17 0.00 -0.61 0.00 0.00 39.78 38.53 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 -2.33 2.19 -0.83 3.10 -0.11 -1.13 -4.59 118.94 115.25 3k2b s TRP 332 Ca 0.41 -0.80 0.07 0.00 1.22 0.00 0.00 56.10 56.99 3k2b s TRP 332 Cb 0.23 -1.48 0.05 0.00 -1.50 0.00 0.00 33.47 30.77 3k2b s TRP 332 CO -0.08 -0.32 0.71 1.17 -4.62 0.00 0.00 176.95 173.81