#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b n LEU 1 N 0.00 3.32 -2.71 3.14 7.94 -0.13 -4.96 117.00 123.60 3k2b n LEU 1 Ca 0.00 -1.86 -0.01 0.00 -1.11 0.00 0.00 56.01 53.03 3k2b n LEU 1 Cb 0.00 -0.31 -0.01 0.00 0.53 0.00 0.00 43.42 43.63 3k2b n LEU 1 CO 0.00 0.80 -0.18 0.29 -1.11 0.00 0.00 177.39 177.19 3k2b n LYS 2 N 1.08 -2.07 -4.38 1.96 5.02 -1.25 -4.23 118.16 114.29 3k2b n LYS 2 Ca 0.17 1.68 -0.29 0.00 -2.02 0.00 0.00 58.31 57.85 3k2b n LYS 2 Cb 0.51 -1.98 -0.12 0.00 -0.02 0.00 0.00 35.03 33.43 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 -0.19 2.61 0.02 -0.18 1.01 0.27 -1.85 120.40 122.10 3k2b s VAL 3 Ca -0.06 -1.57 0.07 0.00 0.00 0.00 0.00 61.98 60.43 3k2b s VAL 3 Cb 0.00 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 3k2b s VAL 3 CO 0.17 0.12 -0.22 0.00 0.00 0.00 0.00 175.10 175.17 3k2b s ALA 4 N -1.09 1.86 -0.20 5.51 0.00 -0.15 -1.67 121.76 126.02 3k2b s ALA 4 Ca 0.16 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.03 3k2b s ALA 4 Cb -0.10 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 3k2b s ALA 4 CO 0.08 0.44 -0.04 0.42 0.00 0.00 0.00 175.76 176.65 3k2b s ILE 5 N -0.70 3.50 -0.43 0.00 1.01 -0.78 -0.93 121.20 122.87 3k2b s ILE 5 Ca 0.09 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.24 3k2b s ILE 5 Cb -0.09 -2.57 0.11 0.00 0.01 0.00 0.00 42.46 39.92 3k2b s ILE 5 CO 0.01 0.44 0.23 0.21 0.00 0.00 0.00 174.94 175.83 3k2b s ASN 6 N 1.19 5.31 0.00 3.58 2.47 -0.18 -0.59 114.94 126.72 3k2b s ASN 6 Ca 0.02 -2.06 0.00 0.00 0.42 0.00 0.00 52.86 51.25 3k2b s ASN 6 Cb -0.14 -1.85 0.00 0.00 -1.45 0.00 0.00 41.25 37.81 3k2b s ASN 6 CO -0.01 -0.55 0.00 0.61 -3.72 0.00 0.00 177.10 173.43 3k2b n GLY 7 N 4.58 0.78 2.61 1.21 0.00 -0.54 -0.56 105.19 113.27 3k2b n GLY 7 Ca -0.02 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.89 3k2b n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k2b n PHE 8 N 0.03 2.69 -2.02 1.61 7.35 -1.25 -3.72 117.46 122.16 3k2b n PHE 8 Ca 0.00 -2.80 0.00 0.00 -0.76 0.00 0.00 57.45 53.89 3k2b n PHE 8 Cb 0.00 -1.86 0.00 0.00 0.35 0.00 0.00 39.48 37.97 3k2b n PHE 8 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3k2b n GLY 9 N 2.05 3.03 0.31 7.13 0.00 -1.26 -4.62 105.19 111.84 3k2b n GLY 9 Ca 0.54 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.26 -0.50 1.61 2.47 -1.93 0.13 114.38 115.90 3k2b h ARG 10 Ca 0.00 0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.76 3k2b h ARG 10 Cb 0.00 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.35 3k2b h ARG 10 CO 0.00 -0.17 0.29 0.82 0.56 0.00 0.00 179.97 181.47 3k2b h ILE 11 N -0.27 1.04 -0.20 2.04 1.08 -1.91 0.13 117.51 119.42 3k2b h ILE 11 Ca 0.05 -0.20 0.05 0.00 -0.39 0.00 0.00 64.86 64.37 3k2b h ILE 11 Cb 0.41 0.40 -0.05 0.00 -3.07 0.00 0.00 36.82 34.52 3k2b h ILE 11 CO -0.42 0.11 -0.11 1.23 -0.69 0.00 0.00 178.15 178.27 3k2b h GLY 12 N 0.59 0.06 1.09 5.37 0.00 -1.50 0.57 103.07 109.25 3k2b h GLY 12 Ca 0.20 0.13 -0.13 0.00 0.00 0.00 0.00 47.33 47.53 3k2b h GLY 12 CO -0.10 -0.12 -0.24 3.21 0.00 0.00 0.00 176.54 179.29 3k2b h ARG 13 N -0.09 0.94 -0.91 4.80 3.08 -0.46 -1.37 114.38 120.38 3k2b h ARG 13 Ca 0.11 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.72 3k2b h ARG 13 Cb 0.25 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.24 3k2b h ARG 13 CO -0.26 1.09 0.52 -0.91 -1.07 0.00 0.00 179.97 179.34 3k2b h ASN 14 N 0.78 1.12 0.39 7.04 2.35 -0.42 -1.70 115.58 125.14 3k2b h ASN 14 Ca 0.10 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3k2b h ASN 14 Cb 0.82 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 3k2b h ASN 14 CO 0.07 0.88 -0.31 0.15 -1.65 0.00 0.00 177.43 176.57 3k2b h PHE 15 N 1.26 -0.83 -0.61 1.19 3.57 0.55 0.30 116.94 122.37 3k2b h PHE 15 Ca 0.32 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.94 3k2b h PHE 15 Cb -0.01 0.31 -0.09 0.00 2.79 0.00 0.00 35.95 38.96 3k2b h PHE 15 CO 0.01 -0.46 0.09 1.25 -2.23 0.00 0.00 178.31 176.97 3k2b h LEU 16 N -0.70 -0.07 -0.40 0.59 6.46 -0.95 -0.52 115.31 119.72 3k2b h LEU 16 Ca -0.03 0.12 -0.09 0.00 -0.12 0.00 0.00 57.88 57.76 3k2b h LEU 16 Cb 0.61 0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.72 3k2b h LEU 16 CO -0.01 -0.03 -0.09 0.03 -0.62 0.00 0.00 178.44 177.72 3k2b h ARG 17 N 0.22 0.76 -0.15 1.25 3.08 -0.91 -0.90 114.38 117.72 3k2b h ARG 17 Ca 0.32 -0.29 0.04 0.00 0.07 0.00 0.00 59.98 60.12 3k2b h ARG 17 Cb 0.49 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 3k2b h ARG 17 CO -0.44 0.90 -0.14 0.00 -1.07 0.00 0.00 179.97 179.21 3k2b h TRP 18 N -0.17 -0.02 -0.81 0.00 7.01 -0.92 -1.91 115.95 119.13 3k2b h TRP 18 Ca 0.10 0.04 0.19 0.00 2.11 0.00 0.00 58.89 61.33 3k2b h TRP 18 Cb 0.31 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.40 3k2b h TRP 18 CO -0.27 -0.10 0.55 1.25 -2.79 0.00 0.00 178.44 177.08 3k2b h HIS 18 N 0.12 0.35 0.00 2.65 2.76 -0.61 -1.37 115.15 119.05 3k2b h HIS 18 Ca 0.24 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3k2b h HIS 18 Cb 0.36 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.21 3k2b h HIS 18 CO -0.30 0.11 0.00 0.41 -1.30 0.00 0.00 177.93 176.84 3k2b n GLY 19 N -1.57 -1.53 3.79 5.26 0.00 -0.72 -4.87 105.19 105.55 3k2b n GLY 19 Ca 0.17 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.03 4.04 -0.19 1.61 1.81 -0.52 -5.04 118.95 117.63 3k2b s ARG 20 Ca 0.13 1.41 -0.09 0.00 -1.72 0.00 0.00 55.73 55.45 3k2b s ARG 20 Cb 0.17 -2.34 -0.05 0.00 -0.45 0.00 0.00 34.95 32.28 3k2b s ARG 20 CO 0.53 -0.23 0.11 0.15 -0.68 0.00 0.00 175.30 175.18 3k2b s LYS 21 N -2.84 4.05 -0.88 3.54 1.02 -1.26 -4.57 119.74 118.81 3k2b s LYS 21 Ca 0.62 -0.26 -0.05 0.00 0.02 0.00 0.00 55.97 56.30 3k2b s LYS 21 Cb -0.18 -3.33 -0.01 0.00 -0.52 0.00 0.00 37.83 33.78 3k2b s LYS 21 CO 0.23 0.33 0.74 -3.47 -0.92 0.00 0.00 175.35 172.26 3k2b n ASP 22 N 3.40 -6.74 -4.74 2.83 4.64 -1.26 -4.96 116.55 109.71 3k2b n ASP 22 Ca -0.16 -0.48 -0.39 0.00 -1.38 0.00 0.00 54.79 52.37 3k2b n ASP 22 Cb 0.52 -4.42 -0.05 0.00 -1.04 0.00 0.00 41.12 36.13 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 3k2b s SER 23 N -3.15 7.05 0.00 1.67 0.15 -1.26 -4.95 113.70 113.22 3k2b s SER 23 Ca 0.16 1.26 0.18 0.00 0.70 0.00 0.00 55.95 58.26 3k2b s SER 23 Cb -0.04 -2.41 0.87 0.00 -1.71 0.00 0.00 66.02 62.73 3k2b s SER 23 CO 0.79 0.01 1.57 -0.81 1.20 0.00 0.00 173.24 176.00 3k2b n PRO 24 N 3.04 0.17 -3.36 5.44 -0.04 -1.26 -4.27 135.00 134.72 3k2b n PRO 24 Ca -0.04 0.14 -0.19 0.00 -0.04 0.00 0.00 63.50 63.37 3k2b n PRO 24 Cb 0.51 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 3k2b n PRO 24 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k2b s LEU 25 N -2.72 3.57 -0.23 1.53 1.43 -1.26 -0.96 118.68 120.04 3k2b s LEU 25 Ca 0.14 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 52.67 3k2b s LEU 25 Cb 0.12 -2.38 0.12 0.00 0.03 0.00 0.00 46.19 44.09 3k2b s LEU 25 CO 0.30 -0.64 0.40 -0.62 0.23 0.00 0.00 176.35 176.01 3k2b s ASP 26 N -4.21 0.01 0.01 2.29 2.15 -1.26 -3.58 116.67 112.08 3k2b s ASP 26 Ca 0.50 0.48 -0.30 0.00 0.43 0.00 0.00 52.55 53.66 3k2b s ASP 26 Cb -0.07 1.24 -0.04 0.00 -0.30 0.00 0.00 42.92 43.75 3k2b s ASP 26 CO 0.30 -0.28 1.19 -0.63 -0.17 0.00 0.00 175.17 175.58 3k2b s ILE 27 N 2.58 4.17 0.00 4.11 -1.09 -1.26 0.95 121.20 130.66 3k2b s ILE 27 Ca 0.09 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 60.05 3k2b s ILE 27 Cb -0.14 -3.99 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 3k2b s ILE 27 CO -0.15 0.07 0.00 2.30 -1.23 0.00 0.00 174.94 175.92 3k2b n ILE 28 N 4.23 0.00 -3.86 2.92 -6.64 -0.67 -4.83 119.36 110.51 3k2b n ILE 28 Ca 0.10 -0.04 -0.10 0.00 -1.77 0.00 0.00 62.75 60.94 3k2b n ILE 28 Cb 0.47 0.39 -0.08 0.00 -1.44 0.00 0.00 39.64 38.97 3k2b n ILE 28 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3k2b s ALA 29 N -1.03 -0.26 -0.03 -1.28 0.00 -1.23 -0.79 121.76 117.15 3k2b s ALA 29 Ca 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 3k2b s ALA 29 Cb 0.00 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.48 3k2b s ALA 29 CO 0.00 -0.42 0.09 0.42 0.00 0.00 0.00 175.76 175.85 3k2b s ILE 30 N -3.11 0.01 0.02 0.00 1.01 0.10 -1.87 121.20 117.36 3k2b s ILE 30 Ca -0.01 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.57 3k2b s ILE 30 Cb 0.02 -0.17 -0.02 0.00 0.01 0.00 0.00 42.46 42.30 3k2b s ILE 30 CO -0.07 -0.07 -0.15 0.21 0.00 0.00 0.00 174.94 174.87 3k2b s ASN 31 N -0.17 1.72 -0.27 3.58 2.47 0.24 0.71 114.94 123.22 3k2b s ASN 31 Ca -0.02 -0.38 -0.32 0.00 0.42 0.00 0.00 52.86 52.56 3k2b s ASN 31 Cb -0.02 -0.15 0.17 0.00 -1.45 0.00 0.00 41.25 39.81 3k2b s ASN 31 CO 0.00 0.10 1.32 -0.62 -3.72 0.00 0.00 177.10 174.19 3k2b s ASP 32 N -0.80 -0.07 -1.39 -4.21 -1.08 -1.00 -1.47 116.67 106.65 3k2b s ASP 32 Ca 0.04 0.05 -0.07 0.00 -0.52 0.00 0.00 52.55 52.04 3k2b s ASP 32 Cb -0.07 0.06 0.01 0.00 -1.46 0.00 0.00 42.92 41.46 3k2b s ASP 32 CO 0.01 -0.08 2.70 0.35 0.52 0.00 0.00 175.17 178.67 3k2b n THR 33 N 0.34 4.70 -0.05 1.71 -2.24 -1.26 -4.23 114.28 113.26 3k2b n THR 33 Ca 0.00 -3.41 0.00 0.00 -2.27 0.00 0.00 64.05 58.38 3k2b n THR 33 Cb 0.58 -2.30 0.00 0.00 -2.10 0.00 0.00 70.33 66.51 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 2.55 0.14 0.00 3.38 0.00 -1.26 -5.13 105.19 104.87 3k2b n GLY 34 Ca 0.69 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.71 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 0.00 1.40 0.13 -0.02 0.00 -1.26 -4.42 105.19 101.02 3k2b n GLY 36 Ca 0.00 -2.00 -0.22 0.00 0.00 0.00 0.00 46.02 43.80 3k2b n GLY 36 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k2b h VAL 37 N 0.00 1.23 -0.19 1.61 2.07 -1.94 -3.18 116.25 115.86 3k2b h VAL 37 Ca 0.00 -2.53 0.04 0.00 0.82 0.00 0.00 66.70 65.03 3k2b h VAL 37 Cb 0.00 2.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 3k2b h VAL 37 CO 0.00 0.76 -0.04 0.11 0.02 0.00 0.00 177.57 178.42 3k2b h LYS 38 N -0.16 0.01 0.00 1.57 6.56 -1.93 -1.10 116.57 121.52 3k2b h LYS 38 Ca -0.25 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.34 3k2b h LYS 38 Cb 1.87 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.53 3k2b h LYS 38 CO 0.16 0.01 0.00 0.94 -2.06 0.00 0.00 179.45 178.49 3k2b n GLN 39 N -5.18 0.22 -0.11 3.15 7.27 -1.25 -2.96 117.38 118.51 3k2b n GLN 39 Ca -0.03 0.12 -0.21 0.00 0.07 0.00 0.00 57.00 56.95 3k2b n GLN 39 Cb 0.11 -1.50 -0.09 0.00 2.41 0.00 0.00 30.24 31.18 3k2b n GLN 39 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3k2b n ALA 40 N -1.18 1.53 -0.17 1.69 0.00 -0.46 -3.84 120.51 118.08 3k2b n ALA 40 Ca 0.06 -0.91 -0.00 0.00 0.00 0.00 0.00 53.44 52.59 3k2b n ALA 40 Cb 0.07 0.14 0.24 0.00 0.00 0.00 0.00 19.45 19.89 3k2b n ALA 40 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k2b h SER 41 N -0.53 0.81 0.43 0.00 4.64 -1.42 -1.79 113.55 115.68 3k2b h SER 41 Ca -0.54 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 60.69 3k2b h SER 41 Cb 1.59 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3k2b h SER 41 CO -0.25 0.66 -0.21 -0.74 -0.87 0.00 0.00 176.83 175.42 3k2b h HIS 42 N 0.91 -0.54 0.00 4.77 6.17 -1.75 -0.81 115.15 123.91 3k2b h HIS 42 Ca 0.23 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.30 3k2b h HIS 42 Cb 0.04 0.18 0.00 0.00 2.52 0.00 0.00 27.41 30.14 3k2b h HIS 42 CO 0.01 -0.32 0.00 1.28 0.71 0.00 0.00 177.93 179.61 3k2b n LEU 43 N -5.33 0.00 -0.02 0.26 4.77 -1.10 0.02 117.00 115.61 3k2b n LEU 43 Ca -0.11 0.19 0.02 0.00 -0.03 0.00 0.00 56.01 56.08 3k2b n LEU 43 Cb 0.25 -0.19 -0.13 0.00 -2.33 0.00 0.00 43.42 41.02 3k2b n LEU 43 CO 0.36 -0.06 -0.71 -0.11 -1.33 0.00 0.00 177.39 175.54 3k2b n LEU 44 N -1.19 0.28 0.00 2.23 7.94 -0.69 -4.40 117.00 121.16 3k2b n LEU 44 Ca 0.12 0.12 -0.20 0.00 -1.11 0.00 0.00 56.01 54.94 3k2b n LEU 44 Cb 0.14 0.17 -0.14 0.00 0.53 0.00 0.00 43.42 44.11 3k2b n LEU 44 CO 0.15 0.18 -0.80 1.17 -1.11 0.00 0.00 177.39 176.97 3k2b n LYS 45 N -2.60 0.75 -3.94 1.96 3.00 -0.34 -4.33 118.16 112.66 3k2b n LYS 45 Ca -0.14 0.26 -0.35 0.00 -0.00 0.00 0.00 58.31 58.09 3k2b n LYS 45 Cb 0.82 -1.71 -0.14 0.00 0.00 0.00 0.00 35.03 33.99 3k2b n LYS 45 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 3k2b s TYR 46 N -2.56 3.12 -0.11 5.64 2.02 0.10 -1.62 117.35 123.95 3k2b s TYR 46 Ca -0.21 -1.63 -0.00 0.00 -0.37 0.00 0.00 57.07 54.86 3k2b s TYR 46 Cb 0.07 -2.07 0.02 0.00 -0.40 0.00 0.00 41.96 39.58 3k2b s TYR 46 CO 0.77 -0.74 -0.08 0.34 -1.57 0.00 0.00 175.55 174.27 3k2b s ASP 47 N 1.31 2.13 0.30 2.29 -1.08 -0.92 -4.55 116.67 116.15 3k2b s ASP 47 Ca -0.01 -0.30 0.21 0.00 -0.52 0.00 0.00 52.55 51.93 3k2b s ASP 47 Cb -0.17 -0.83 1.09 0.00 -1.46 0.00 0.00 42.92 41.55 3k2b s ASP 47 CO -0.03 -0.11 1.65 -1.20 0.52 0.00 0.00 175.17 176.00 3k2b n SER 48 N 4.86 0.56 -0.06 -0.34 7.64 -1.26 -0.06 113.62 124.96 3k2b n SER 48 Ca -0.13 0.73 -0.13 0.00 1.01 0.00 0.00 58.87 60.35 3k2b n SER 48 Cb 0.50 -0.82 -0.05 0.00 -1.01 0.00 0.00 64.21 62.84 3k2b n SER 48 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3k2b n THR 49 N -2.23 0.71 0.07 0.44 -1.04 -1.26 -4.68 114.28 106.29 3k2b n THR 49 Ca -0.01 -0.20 -0.02 0.00 -2.04 0.00 0.00 64.05 61.78 3k2b n THR 49 Cb 0.08 -1.49 -0.06 0.00 -1.82 0.00 0.00 70.33 67.04 3k2b n THR 49 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3k2b h LEU 50 N -0.35 0.00 0.00 -4.42 3.38 -1.98 -3.50 115.31 108.43 3k2b h LEU 50 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3k2b h LEU 50 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 3k2b h LEU 50 CO -0.16 0.70 0.00 0.61 0.09 0.00 0.00 178.44 179.68 3k2b n GLY 51 N 1.34 -1.66 3.69 0.83 0.00 0.91 -4.92 105.19 105.38 3k2b n GLY 51 Ca -0.04 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 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 4.89 -0.11 -0.61 1.01 -1.26 -2.16 121.20 122.97 3k2b s ILE 52 Ca 0.00 1.76 -0.29 0.00 0.00 0.00 0.00 60.65 62.11 3k2b s ILE 52 Cb 0.00 -4.19 -0.06 0.00 0.01 0.00 0.00 42.46 38.23 3k2b s ILE 52 CO 0.00 0.10 1.88 0.12 0.00 0.00 0.00 174.94 177.04 3k2b s PHE 53 N 1.61 1.58 -1.20 3.97 5.36 -0.64 -4.83 117.98 123.83 3k2b s PHE 53 Ca 0.43 0.13 -0.11 0.00 -0.96 0.00 0.00 56.93 56.42 3k2b s PHE 53 Cb -0.18 -4.05 -0.07 0.00 -0.34 0.00 0.00 43.02 38.38 3k2b s PHE 53 CO 0.18 -4.27 2.36 -3.47 -1.46 0.00 0.00 175.22 168.55 3k2b n ASP 54 N 8.68 5.51 -4.01 6.13 2.03 -1.26 -4.76 116.55 128.88 3k2b n ASP 54 Ca 0.21 -2.54 -0.10 0.00 0.52 0.00 0.00 54.79 52.88 3k2b n ASP 54 Cb 0.43 -1.33 -0.06 0.00 -0.72 0.00 0.00 41.12 39.44 3k2b n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k2b s ALA 55 N 3.27 -0.02 -0.59 -1.67 0.00 -1.26 -5.11 121.76 116.39 3k2b s ALA 55 Ca 0.53 -0.97 -0.21 0.00 0.00 0.00 0.00 51.96 51.31 3k2b s ALA 55 Cb 0.14 1.06 0.07 0.00 0.00 0.00 0.00 23.12 24.39 3k2b s ALA 55 CO -0.03 -0.77 0.83 0.34 0.00 0.00 0.00 175.76 176.14 3k2b s ASP 56 N -3.02 6.22 -0.25 0.00 2.15 -1.26 -4.91 116.67 115.60 3k2b s ASP 56 Ca 0.23 -0.92 0.00 0.00 0.43 0.00 0.00 52.55 52.29 3k2b s ASP 56 Cb 0.01 -2.37 0.04 0.00 -0.30 0.00 0.00 42.92 40.30 3k2b s ASP 56 CO 0.07 -1.21 -0.09 -0.69 -0.17 0.00 0.00 175.17 173.08 3k2b s VAL 57 N 3.44 2.54 -0.06 1.11 1.01 -1.26 -0.41 120.40 126.78 3k2b s VAL 57 Ca 0.20 -1.24 -0.18 0.00 0.00 0.00 0.00 61.98 60.76 3k2b s VAL 57 Cb -0.18 -2.34 0.04 0.00 0.00 0.00 0.00 36.38 33.90 3k2b s VAL 57 CO 0.12 0.15 0.42 -1.59 0.00 0.00 0.00 175.10 174.20 3k2b s LYS 58 N 1.24 0.72 0.99 2.72 -2.85 -0.96 -4.96 119.74 116.64 3k2b s LYS 58 Ca -0.02 0.10 -0.11 0.00 -1.00 0.00 0.00 55.97 54.94 3k2b s LYS 58 Cb -0.17 0.33 0.19 0.00 -2.06 0.00 0.00 37.83 36.11 3k2b s LYS 58 CO -0.06 -0.18 1.11 -2.14 0.10 0.00 0.00 175.35 174.18 3k2b s PRO 59 N -0.91 0.43 -0.38 1.78 0.02 -1.26 0.12 135.00 134.79 3k2b s PRO 59 Ca -0.10 1.36 0.01 0.00 0.02 0.00 0.00 61.00 62.29 3k2b s PRO 59 Cb -0.04 -1.67 0.14 0.00 0.02 0.00 0.00 34.50 32.95 3k2b s PRO 59 CO 0.05 -2.97 0.24 0.45 -0.33 0.00 0.00 177.00 174.43 3k2b s SER 60 N -2.61 2.90 0.00 2.53 0.15 -0.47 -4.55 113.70 111.65 3k2b s SER 60 Ca 0.67 -2.40 0.00 0.00 0.70 0.00 0.00 55.95 54.92 3k2b s SER 60 Cb -0.24 -0.53 0.00 0.00 -1.71 0.00 0.00 66.02 63.55 3k2b s SER 60 CO 0.60 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.37 3k2b n GLY 60 N 3.77 -2.23 1.72 9.45 0.00 -1.26 -3.45 105.19 113.19 3k2b n GLY 60 Ca 0.14 -1.51 -0.00 0.00 0.00 0.00 0.00 46.02 44.65 3k2b n GLY 60 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3k2b n GLU 61 N -0.66 3.67 -0.46 1.61 0.28 -1.26 -4.10 120.64 119.72 3k2b n GLU 61 Ca 0.00 -2.53 0.00 0.00 -0.16 0.00 0.00 57.16 54.47 3k2b n GLU 61 Cb 0.00 -2.09 0.00 0.00 1.43 0.00 0.00 31.44 30.79 3k2b n GLU 61 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3k2b n THR 62 N 0.19 0.03 -3.81 3.84 -2.24 -1.26 -4.73 114.28 106.30 3k2b n THR 62 Ca 0.29 -0.04 -0.04 0.00 -2.27 0.00 0.00 64.05 61.99 3k2b n THR 62 Cb 1.12 0.52 -0.00 0.00 -2.10 0.00 0.00 70.33 69.88 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b s ALA 63 N -0.05 -1.46 0.02 6.98 0.00 -1.22 -1.09 121.76 124.93 3k2b s ALA 63 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 51.96 51.79 3k2b s ALA 63 Cb 0.00 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 3k2b s ALA 63 CO 0.00 -1.04 -0.01 0.96 0.00 0.00 0.00 175.76 175.67 3k2b s ILE 64 N -2.96 0.11 -0.14 0.00 -4.36 -0.62 -1.37 121.20 111.85 3k2b s ILE 64 Ca 0.15 -0.89 -0.02 0.00 -0.26 0.00 0.00 60.65 59.63 3k2b s ILE 64 Cb -0.03 -0.29 -0.02 0.00 1.25 0.00 0.00 42.46 43.37 3k2b s ILE 64 CO 0.05 -0.49 -0.07 -0.55 0.24 0.00 0.00 174.94 174.12 3k2b s SER 65 N -1.46 4.51 -0.28 4.36 0.15 0.12 -1.06 113.70 120.04 3k2b s SER 65 Ca -0.16 -0.19 0.02 0.00 0.70 0.00 0.00 55.95 56.33 3k2b s SER 65 Cb -0.10 -1.68 0.07 0.00 -1.71 0.00 0.00 66.02 62.60 3k2b s SER 65 CO -0.01 0.18 -0.06 -0.69 1.20 0.00 0.00 173.24 173.87 3k2b s VAL 66 N 0.27 2.34 -1.11 4.45 1.01 -0.20 -2.25 120.40 124.91 3k2b s VAL 66 Ca -0.05 -1.75 -0.09 0.00 0.00 0.00 0.00 61.98 60.09 3k2b s VAL 66 Cb -0.15 -2.45 0.07 0.00 0.00 0.00 0.00 36.38 33.86 3k2b s VAL 66 CO 0.04 -0.16 0.36 0.47 0.00 0.00 0.00 175.10 175.81 3k2b n ASP 67 N 4.43 -2.99 0.00 3.32 9.92 0.45 -2.11 116.55 129.57 3k2b n ASP 67 Ca -0.10 -0.28 0.00 0.00 -0.53 0.00 0.00 54.79 53.87 3k2b n ASP 67 Cb 0.42 -2.53 0.00 0.00 -0.64 0.00 0.00 41.12 38.37 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 -1.00 2.54 3.60 0.44 0.00 -1.26 -5.00 105.19 104.51 3k2b n GLY 68 Ca -0.01 -0.73 -0.52 0.00 0.00 0.00 0.00 46.02 44.76 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 1.14 -3.59 1.61 3.00 -0.90 -4.86 118.16 114.56 3k2b n LYS 69 Ca 0.00 0.41 -0.37 0.00 -0.00 0.00 0.00 58.31 58.35 3k2b n LYS 69 Cb 0.00 -2.06 -0.09 0.00 0.00 0.00 0.00 35.03 32.89 3k2b n LYS 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3k2b s ILE 70 N 0.68 5.32 -0.12 3.15 1.01 -1.26 -1.03 121.20 128.95 3k2b s ILE 70 Ca 0.85 0.35 0.01 0.00 0.00 0.00 0.00 60.65 61.86 3k2b s ILE 70 Cb -0.97 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 37.93 3k2b s ILE 70 CO 0.48 0.33 -0.17 -0.63 0.00 0.00 0.00 174.94 174.96 3k2b s ILE 71 N 1.00 2.72 0.39 2.92 1.01 -0.22 -4.86 121.20 124.16 3k2b s ILE 71 Ca 0.11 -0.78 -0.25 0.00 0.00 0.00 0.00 60.65 59.73 3k2b s ILE 71 Cb -0.13 -2.11 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 3k2b s ILE 71 CO 0.05 0.54 1.09 -1.10 0.00 0.00 0.00 174.94 175.51 3k2b s GLN 72 N 0.35 4.18 -0.20 2.79 -1.52 0.03 -1.60 119.66 123.69 3k2b s GLN 72 Ca -0.14 1.64 0.01 0.00 -1.95 0.00 0.00 55.36 54.92 3k2b s GLN 72 Cb -0.17 -2.65 0.03 0.00 -0.22 0.00 0.00 33.01 30.00 3k2b s GLN 72 CO 0.07 -0.16 -0.17 0.08 -0.25 0.00 0.00 175.29 174.86 3k2b s VAL 73 N -1.53 2.16 0.36 1.09 1.01 -0.25 0.00 120.40 123.24 3k2b s VAL 73 Ca 0.56 -1.08 0.08 0.00 0.00 0.00 0.00 61.98 61.54 3k2b s VAL 73 Cb -0.26 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3k2b s VAL 73 CO 0.32 0.40 0.20 0.68 0.00 0.00 0.00 175.10 176.70 3k2b s VAL 74 N 1.26 2.99 -0.10 2.92 -7.23 0.22 -4.61 120.40 115.84 3k2b s VAL 74 Ca 0.02 -1.59 -0.04 0.00 -1.81 0.00 0.00 61.98 58.55 3k2b s VAL 74 Cb -0.15 -3.02 0.05 0.00 0.56 0.00 0.00 36.38 33.82 3k2b s VAL 74 CO -0.11 -0.14 0.21 -0.55 -0.31 0.00 0.00 175.10 174.21 3k2b s SER 75 N -3.92 0.20 -0.30 4.85 0.15 -1.26 -2.37 113.70 111.05 3k2b s SER 75 Ca 0.40 0.46 -0.14 0.00 0.70 0.00 0.00 55.95 57.37 3k2b s SER 75 Cb -0.02 0.43 0.17 0.00 -1.71 0.00 0.00 66.02 64.89 3k2b s SER 75 CO 0.24 -0.21 1.02 0.21 1.20 0.00 0.00 173.24 175.70 3k2b s ASN 76 N 1.86 -0.53 0.56 5.45 3.04 -1.26 -4.96 114.94 119.10 3k2b s ASN 76 Ca -0.03 0.58 0.23 0.00 0.04 0.00 0.00 52.86 53.68 3k2b s ASN 76 Cb -0.11 1.54 1.56 0.00 -1.54 0.00 0.00 41.25 42.70 3k2b s ASN 76 CO -0.07 -0.10 2.20 0.03 -3.04 0.00 0.00 177.10 176.12 3k2b h ARG 77 N 7.62 0.00 -4.72 0.43 3.08 -2.00 -3.40 114.38 115.39 3k2b h ARG 77 Ca -0.15 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.22 3k2b h ARG 77 Cb 1.13 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.99 3k2b h ARG 77 CO 0.04 0.00 -0.48 1.21 -1.07 0.00 0.00 179.97 179.67 3k2b s ASN 78 N -6.57 6.03 0.36 7.04 3.84 -1.26 -4.97 114.94 119.41 3k2b s ASN 78 Ca -0.05 -0.42 0.03 0.00 0.21 0.00 0.00 52.86 52.63 3k2b s ASN 78 Cb 0.16 -2.13 0.69 0.00 -0.55 0.00 0.00 41.25 39.42 3k2b s ASN 78 CO 0.61 -0.23 2.02 -0.65 -2.79 0.00 0.00 177.10 176.05 3k2b h PRO 79 N 8.48 0.76 -0.82 0.43 0.11 -1.93 -2.24 132.00 136.79 3k2b h PRO 79 Ca -0.31 -0.05 0.24 0.00 0.11 0.00 0.00 66.00 65.98 3k2b h PRO 79 Cb 1.16 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 3k2b h PRO 79 CO 0.63 0.51 0.63 0.77 -0.21 0.00 0.00 178.00 180.33 3k2b h SER 80 N 0.78 0.00 1.03 -2.05 0.02 -1.94 -0.08 113.55 111.32 3k2b h SER 80 Ca 0.21 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.03 3k2b h SER 80 Cb -0.08 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 3k2b h SER 80 CO -0.04 0.00 -1.03 -0.07 -1.14 0.00 0.00 176.83 174.55 3k2b h LEU 81 N 0.00 0.00 -9.43 5.07 3.38 -1.75 -3.39 115.31 109.20 3k2b h LEU 81 Ca 0.39 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.76 3k2b h LEU 81 Cb 1.64 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.54 3k2b h LEU 81 CO -0.00 0.51 -0.27 0.18 0.09 0.00 0.00 178.44 178.95 3k2b n LEU 82 N -3.01 0.72 -1.70 1.67 4.77 -0.04 -4.82 117.00 114.59 3k2b n LEU 82 Ca -0.04 0.91 -0.04 0.00 -0.03 0.00 0.00 56.01 56.80 3k2b n LEU 82 Cb 0.78 -1.18 -0.06 0.00 -2.33 0.00 0.00 43.42 40.63 3k2b n LEU 82 CO 0.42 -2.60 1.21 -0.81 -1.33 0.00 0.00 177.39 174.27 3k2b n PRO 83 N 0.36 1.34 -0.11 3.23 -0.04 -1.26 -4.62 135.00 133.91 3k2b n PRO 83 Ca 0.11 -0.36 -0.11 0.00 -0.04 0.00 0.00 63.50 63.10 3k2b n PRO 83 Cb 0.41 -1.38 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 3k2b n PRO 83 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k2b h TRP 84 N 1.81 0.60 0.00 0.54 -0.00 -1.87 -2.58 115.95 114.45 3k2b h TRP 84 Ca 0.07 -0.10 -0.04 0.00 -0.00 0.00 0.00 58.89 58.83 3k2b h TRP 84 Cb 1.17 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.16 30.16 3k2b h TRP 84 CO 0.81 0.66 -0.17 -0.22 -0.00 0.00 0.00 178.44 179.52 3k2b h LYS 85 N 0.36 0.00 -0.05 0.49 3.64 0.10 -1.90 116.57 119.22 3k2b h LYS 85 Ca 0.09 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.23 3k2b h LYS 85 Cb 0.40 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.24 3k2b h LYS 85 CO 0.01 0.17 -0.93 0.93 -2.27 0.00 0.00 179.45 177.36 3k2b h GLU 86 N 0.00 0.72 -0.01 1.90 3.07 -1.77 -3.29 114.58 115.20 3k2b h GLU 86 Ca -0.00 -0.71 0.00 0.00 -0.50 0.00 0.00 59.36 58.15 3k2b h GLU 86 Cb 0.32 0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3k2b h GLU 86 CO 0.02 1.29 -0.02 1.28 -1.40 0.00 0.00 179.01 180.18 3k2b n LEU 87 N -3.91 1.04 -1.79 1.33 4.77 -0.99 -4.92 117.00 112.54 3k2b n LEU 87 Ca -0.10 -0.33 -0.10 0.00 -0.03 0.00 0.00 56.01 55.45 3k2b n LEU 87 Cb 0.83 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.93 3k2b n LEU 87 CO 0.54 0.18 0.09 0.61 -1.33 0.00 0.00 177.39 177.48 3k2b n GLY 88 N 1.15 0.27 3.64 -0.72 0.00 -1.03 -4.94 105.19 103.56 3k2b n GLY 88 Ca 0.19 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.08 3.62 -0.14 -0.61 -1.09 -0.74 -4.85 121.20 114.31 3k2b s ILE 89 Ca 0.24 0.72 -0.11 0.00 -2.23 0.00 0.00 60.65 59.26 3k2b s ILE 89 Cb -0.10 -3.57 -0.08 0.00 -1.58 0.00 0.00 42.46 37.13 3k2b s ILE 89 CO 0.29 -0.18 0.04 0.44 -1.23 0.00 0.00 174.94 174.31 3k2b h ASP 90 N 10.42 0.00 -3.76 3.58 3.32 -1.54 -2.71 116.42 125.73 3k2b h ASP 90 Ca -0.36 -0.20 -0.68 0.00 0.02 0.00 0.00 57.03 55.81 3k2b h ASP 90 Cb 1.17 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.46 3k2b h ASP 90 CO 0.98 0.85 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.93 3k2b s ILE 91 N -2.08 2.87 -0.26 0.35 1.01 -1.17 -0.31 121.20 121.61 3k2b s ILE 91 Ca -0.14 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 59.75 3k2b s ILE 91 Cb 0.02 -2.14 0.04 0.00 0.01 0.00 0.00 42.46 40.39 3k2b s ILE 91 CO 0.28 0.56 -0.08 -0.69 0.00 0.00 0.00 174.94 175.01 3k2b s VAL 92 N -0.22 2.57 -0.51 2.92 1.01 0.15 -0.98 120.40 125.34 3k2b s VAL 92 Ca 0.00 -1.32 -0.28 0.00 0.00 0.00 0.00 61.98 60.38 3k2b s VAL 92 Cb -0.13 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.88 3k2b s VAL 92 CO 0.03 0.08 1.11 -0.63 0.00 0.00 0.00 175.10 175.70 3k2b s ILE 93 N 1.23 4.20 -0.56 2.22 -1.09 -0.10 -1.30 121.20 125.79 3k2b s ILE 93 Ca -0.04 1.03 -0.22 0.00 -2.23 0.00 0.00 60.65 59.19 3k2b s ILE 93 Cb -0.18 -4.61 0.06 0.00 -1.58 0.00 0.00 42.46 36.14 3k2b s ILE 93 CO -0.05 -1.08 0.82 -0.70 -1.23 0.00 0.00 174.94 172.70 3k2b s GLU 94 N 4.47 3.18 -0.17 2.79 -6.30 0.12 -1.01 118.70 121.78 3k2b s GLU 94 Ca 0.44 -0.70 0.14 0.00 -2.50 0.00 0.00 54.97 52.35 3k2b s GLU 94 Cb -0.08 -4.13 0.38 0.00 0.00 0.00 0.00 34.13 30.30 3k2b s GLU 94 CO 0.29 -1.48 1.20 0.41 0.02 0.00 0.00 175.26 175.70 3k2b n GLY 95 N 5.20 4.73 0.14 -1.50 0.00 0.27 -1.73 105.19 112.31 3k2b n GLY 95 Ca -0.03 -1.21 0.04 0.00 0.00 0.00 0.00 46.02 44.81 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 1.25 0.65 0.00 2.61 1.35 -1.80 -3.44 112.91 113.53 3k2b h THR 96 Ca -0.01 -1.96 0.00 0.00 -0.55 0.00 0.00 66.41 63.89 3k2b h THR 96 Cb 1.06 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 3k2b h THR 96 CO 0.01 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.26 3k2b n GLY 97 N 1.23 0.48 0.08 5.82 0.00 -1.26 -4.86 105.19 106.69 3k2b n GLY 97 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.74 0.95 -2.68 1.61 0.24 -1.26 -4.74 118.33 109.71 3k2b n VAL 98 Ca 0.00 -1.05 -0.08 0.00 -2.04 0.00 0.00 64.34 61.17 3k2b n VAL 98 Cb 0.06 0.38 0.04 0.00 -1.47 0.00 0.00 33.84 32.86 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 -0.61 0.72 1.20 6.34 3.72 -1.26 -4.91 117.46 122.66 3k2b n PHE 99 Ca 0.05 -2.62 0.09 0.00 -0.05 0.00 0.00 57.45 54.92 3k2b n PHE 99 Cb 0.46 -0.12 0.33 0.00 -0.94 0.00 0.00 39.48 39.21 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 -0.19 0.25 -4.21 -4.37 0.24 -1.26 -3.47 118.33 105.32 3k2b n VAL 100 Ca 0.07 -0.35 -0.25 0.00 -2.04 0.00 0.00 64.34 61.77 3k2b n VAL 100 Cb 0.82 0.30 -0.08 0.00 -1.47 0.00 0.00 33.84 33.42 3k2b n VAL 100 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3k2b s ASP 101 N -1.44 4.33 0.44 -1.34 -4.77 -1.26 -0.25 116.67 112.38 3k2b s ASP 101 Ca 0.30 -1.13 0.18 0.00 -3.30 0.00 0.00 52.55 48.60 3k2b s ASP 101 Cb 0.16 -0.46 1.01 0.00 -1.09 0.00 0.00 42.92 42.54 3k2b s ASP 101 CO 0.23 -0.53 1.94 -0.09 0.70 0.00 0.00 175.17 177.42 3k2b h ARG 102 N 1.48 0.00 0.48 2.11 2.43 -1.91 0.08 114.38 119.05 3k2b h ARG 102 Ca -0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.72 3k2b h ARG 102 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3k2b h ARG 102 CO 0.72 0.24 -0.23 1.49 -1.51 0.00 0.00 179.97 180.68 3k2b h GLU 103 N 0.00 -0.62 -0.00 0.20 4.22 -1.95 -1.94 114.58 114.48 3k2b h GLU 103 Ca -0.00 0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.48 3k2b h GLU 103 Cb 0.49 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 3k2b h GLU 103 CO 0.03 -0.31 -0.00 0.78 -2.18 0.00 0.00 179.01 177.33 3k2b h GLY 104 N -0.96 0.00 2.00 1.92 0.00 -1.85 -2.98 103.07 101.21 3k2b h GLY 104 Ca -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3k2b h GLY 104 CO 0.11 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.65 3k2b h ALA 105 N 0.67 1.00 -0.07 3.60 0.00 -1.01 -2.05 119.26 121.41 3k2b h ALA 105 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3k2b h ALA 105 Cb 0.33 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3k2b h ALA 105 CO 0.00 0.00 -0.59 0.78 0.00 0.00 0.00 179.25 179.44 3k2b h GLY 106 N 1.12 0.25 -0.20 0.00 0.00 -1.19 -3.19 103.07 99.86 3k2b h GLY 106 Ca 0.00 -0.30 0.25 0.00 0.00 0.00 0.00 47.33 47.28 3k2b h GLY 106 CO 0.00 0.27 0.55 0.50 0.00 0.00 0.00 176.54 177.86 3k2b h LYS 107 N 0.17 0.50 -0.80 4.80 1.57 -1.37 0.29 116.57 121.73 3k2b h LYS 107 Ca -0.00 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 3k2b h LYS 107 Cb 1.09 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.25 3k2b h LYS 107 CO 0.09 0.33 0.35 0.45 -0.57 0.00 0.00 179.45 180.10 3k2b h HIS 108 N 0.52 1.19 -0.49 -1.35 3.86 -1.73 -0.53 115.15 116.62 3k2b h HIS 108 Ca 0.64 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.76 3k2b h HIS 108 Cb 1.25 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 29.33 3k2b h HIS 108 CO -0.03 0.88 0.23 0.82 0.86 0.00 0.00 177.93 180.69 3k2b h ILE 109 N 1.15 1.17 -0.16 2.45 1.08 -0.60 -1.38 117.51 121.22 3k2b h ILE 109 Ca 0.27 -0.47 -0.01 0.00 -0.39 0.00 0.00 64.86 64.26 3k2b h ILE 109 Cb 0.17 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 34.46 3k2b h ILE 109 CO -0.03 0.19 0.05 -0.33 -0.69 0.00 0.00 178.15 177.34 3k2b h GLU 110 N 0.68 0.25 0.00 2.37 5.08 -0.03 -2.18 114.58 120.76 3k2b h GLU 110 Ca 0.17 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3k2b h GLU 110 Cb 0.08 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3k2b h GLU 110 CO -0.02 0.37 0.00 0.00 -1.00 0.00 0.00 179.01 178.36 3k2b n ALA 111 N -2.25 1.61 0.00 3.43 0.00 -0.36 -4.76 120.51 118.18 3k2b n ALA 111 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3k2b n ALA 111 Cb 0.15 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.75 0.68 3.79 0.00 0.00 -0.82 0.14 105.19 108.23 3k2b n GLY 112 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 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 3.27 -0.00 4.61 0.00 -0.59 -4.08 121.76 122.97 3k2b s ALA 113 Ca 0.00 0.43 -0.21 0.00 0.00 0.00 0.00 51.96 52.17 3k2b s ALA 113 Cb 0.00 -3.08 -0.20 0.00 0.00 0.00 0.00 23.12 19.83 3k2b s ALA 113 CO 0.00 0.22 1.16 0.87 0.00 0.00 0.00 175.76 178.01 3k2b h LYS 114 N 3.28 0.32 -3.59 0.00 1.79 -1.18 -3.33 116.57 113.87 3k2b h LYS 114 Ca -0.47 -0.28 -0.16 0.00 -2.18 0.00 0.00 60.65 57.56 3k2b h LYS 114 Cb 1.19 0.06 -0.22 0.00 -1.58 0.00 0.00 32.23 31.68 3k2b h LYS 114 CO 0.65 0.93 -0.55 0.21 -1.08 0.00 0.00 179.45 179.61 3k2b s LYS 115 N -3.54 0.38 -0.12 3.15 2.20 0.58 -4.85 119.74 117.53 3k2b s LYS 115 Ca -0.14 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.16 3k2b s LYS 115 Cb 0.03 0.15 0.01 0.00 -1.51 0.00 0.00 37.83 36.52 3k2b s LYS 115 CO 0.77 -0.08 -0.18 0.08 -0.36 0.00 0.00 175.35 175.59 3k2b s VAL 116 N -1.09 1.70 -0.29 4.02 1.01 -0.32 0.33 120.40 125.75 3k2b s VAL 116 Ca -0.12 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.02 3k2b s VAL 116 Cb -0.07 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 3k2b s VAL 116 CO 0.01 0.48 0.12 -0.63 0.00 0.00 0.00 175.10 175.07 3k2b s ILE 117 N 0.96 4.38 -0.11 2.22 1.01 -0.42 -2.16 121.20 127.08 3k2b s ILE 117 Ca -0.06 -0.42 -0.23 0.00 0.00 0.00 0.00 60.65 59.93 3k2b s ILE 117 Cb -0.15 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 3k2b s ILE 117 CO -0.02 0.14 0.71 -0.63 0.00 0.00 0.00 174.94 175.13 3k2b s ILE 118 N 1.59 5.01 -0.85 2.92 1.01 -0.26 -0.70 121.20 129.92 3k2b s ILE 118 Ca 0.05 1.42 -0.05 0.00 0.00 0.00 0.00 60.65 62.07 3k2b s ILE 118 Cb -0.17 -4.04 0.04 0.00 0.01 0.00 0.00 42.46 38.30 3k2b s ILE 118 CO 0.05 0.18 2.73 0.35 0.00 0.00 0.00 174.94 178.25 3k2b n THR 119 N 4.15 4.13 0.00 2.92 -2.24 -0.70 -1.68 114.28 120.85 3k2b n THR 119 Ca -0.00 -3.33 0.00 0.00 -2.27 0.00 0.00 64.05 58.45 3k2b n THR 119 Cb 0.50 -1.91 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 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 1.61 0.00 -1.83 6.98 0.00 -1.11 -4.96 120.51 121.20 3k2b n ALA 120 Ca 0.56 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.59 3k2b n ALA 120 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.87 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 4.22 0.48 0.00 0.02 -1.19 -3.81 135.00 132.72 3k2b s PRO 121 Ca 0.00 2.39 -0.07 0.00 0.02 0.00 0.00 61.00 63.34 3k2b s PRO 121 Cb 0.00 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 3k2b s PRO 121 CO 0.00 -0.47 0.80 0.20 -0.33 0.00 0.00 177.00 177.20 3k2b s GLY 122 N 0.31 1.59 -0.05 0.52 0.00 -1.26 -4.90 107.32 103.54 3k2b s GLY 122 Ca 0.59 -0.42 -0.17 0.00 0.00 0.00 0.00 44.72 44.72 3k2b s GLY 122 CO 0.46 -0.24 0.47 0.54 0.00 0.00 0.00 173.10 174.34 3k2b s LYS 122 N -4.60 4.19 2.41 2.90 -0.14 0.65 -4.87 119.74 120.28 3k2b s LYS 122 Ca 0.49 0.49 0.00 0.00 -1.36 0.00 0.00 55.97 55.59 3k2b s LYS 122 Cb -0.10 -3.33 0.00 0.00 -1.68 0.00 0.00 37.83 32.71 3k2b s LYS 122 CO 0.43 0.41 0.00 0.41 -0.76 0.00 0.00 175.35 175.84 3k2b n GLY 123 N 2.54 0.53 1.23 -3.33 0.00 -1.26 -4.07 105.19 100.83 3k2b n GLY 123 Ca -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.14 0.00 -4.67 1.61 2.03 -1.26 -4.77 116.55 106.35 3k2b n ASP 124 Ca 0.00 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.94 3k2b n ASP 124 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 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 0.00 5.26 0.21 5.18 1.01 -1.26 -5.04 121.20 126.57 3k2b s ILE 125 Ca 0.00 0.52 -0.32 0.00 0.00 0.00 0.00 60.65 60.85 3k2b s ILE 125 Cb 0.00 -3.64 -0.14 0.00 0.01 0.00 0.00 42.46 38.68 3k2b s ILE 125 CO 0.00 0.29 1.33 -2.65 0.00 0.00 0.00 174.94 173.92 3k2b n PRO 126 N 4.33 1.74 -5.22 2.79 -0.02 -1.25 -4.76 135.00 132.62 3k2b n PRO 126 Ca -0.11 0.62 -0.30 0.00 -2.02 0.00 0.00 63.50 61.69 3k2b n PRO 126 Cb 0.51 -2.23 -0.16 0.00 -0.02 0.00 0.00 33.50 31.60 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 -0.06 1.94 0.03 3.45 2.01 -1.26 -0.21 115.64 121.53 3k2b s THR 127 Ca 0.70 -1.03 0.02 0.00 0.31 0.00 0.00 61.69 61.69 3k2b s THR 127 Cb -0.72 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.15 3k2b s THR 127 CO 0.50 0.55 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.60 3k2b s TYR 128 N -0.42 0.59 -0.26 4.92 2.02 0.03 -4.83 117.35 119.40 3k2b s TYR 128 Ca 0.05 -0.42 -0.02 0.00 -0.37 0.00 0.00 57.07 56.31 3k2b s TYR 128 Cb -0.11 -0.36 0.08 0.00 -0.40 0.00 0.00 41.96 41.18 3k2b s TYR 128 CO 0.01 -0.08 0.07 0.08 -1.57 0.00 0.00 175.55 174.06 3k2b s VAL 129 N -1.15 0.68 0.25 0.71 1.01 -1.26 -4.04 120.40 116.60 3k2b s VAL 129 Ca -0.08 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.59 3k2b s VAL 129 Cb -0.08 -1.37 -0.14 0.00 0.00 0.00 0.00 36.38 34.78 3k2b s VAL 129 CO 0.00 -0.48 1.11 0.52 0.00 0.00 0.00 175.10 176.26 3k2b n VAL 130 N 4.96 1.51 0.00 2.92 0.31 -1.26 -0.31 118.33 126.46 3k2b n VAL 130 Ca -0.06 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3k2b n VAL 130 Cb 0.44 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 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 1.58 2.96 0.03 2.92 0.00 -1.26 -4.82 105.19 106.60 3k2b n GLY 131 Ca 0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 0.47 -2.27 1.61 0.31 0.58 -4.89 118.33 114.14 3k2b n VAL 132 Ca 0.00 0.39 0.04 0.00 -0.01 0.00 0.00 64.34 64.76 3k2b n VAL 132 Cb 0.00 -1.77 0.07 0.00 -0.91 0.00 0.00 33.84 31.23 3k2b n VAL 132 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3k2b n ASN 133 N -3.10 1.31 0.12 4.52 2.04 -0.97 -4.79 115.26 114.39 3k2b n ASN 133 Ca -0.04 -2.55 0.12 0.00 -0.44 0.00 0.00 54.58 51.68 3k2b n ASN 133 Cb 0.15 -0.37 0.45 0.00 -2.53 0.00 0.00 39.78 37.48 3k2b n ASN 133 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3k2b n ALA 134 N -0.02 1.97 -0.16 -2.53 0.00 -1.24 -2.49 120.51 116.04 3k2b n ALA 134 Ca 0.10 0.03 -0.05 0.00 0.00 0.00 0.00 53.44 53.52 3k2b n ALA 134 Cb 1.00 -1.43 0.13 0.00 0.00 0.00 0.00 19.45 19.15 3k2b n ALA 134 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3k2b h ASP 135 N 0.00 0.87 0.00 0.00 -0.00 -1.92 -2.66 116.42 112.71 3k2b h ASP 135 Ca 0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 3k2b h ASP 135 Cb 0.55 -0.23 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 3k2b h ASP 135 CO 0.00 0.88 0.00 0.00 -0.00 0.00 0.00 179.24 180.12 3k2b n ALA 136 N -2.47 1.88 -1.77 4.15 0.00 -1.04 -4.84 120.51 116.43 3k2b n ALA 136 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.09 3k2b n ALA 136 Cb 0.27 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 3k2b n ALA 136 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3k2b s TYR 137 N -1.48 3.04 -0.16 0.00 5.04 -1.01 -5.03 117.35 117.77 3k2b s TYR 137 Ca 0.00 1.53 -0.01 0.00 -2.44 0.00 0.00 57.07 56.15 3k2b s TYR 137 Cb 0.00 -3.44 0.04 0.00 0.35 0.00 0.00 41.96 38.91 3k2b s TYR 137 CO 0.00 -1.43 -0.04 0.45 -1.34 0.00 0.00 175.55 173.19 3k2b s SER 138 N -1.05 2.68 0.62 4.32 0.15 -1.26 -5.03 113.70 114.13 3k2b s SER 138 Ca 0.56 -0.60 0.25 0.00 0.70 0.00 0.00 55.95 56.86 3k2b s SER 138 Cb -0.32 -0.82 1.22 0.00 -1.71 0.00 0.00 66.02 64.39 3k2b s SER 138 CO 0.41 -0.20 1.67 -0.74 1.20 0.00 0.00 173.24 175.58 3k2b h HIS 139 N 8.16 0.00 -0.04 3.44 2.76 -1.96 0.18 115.15 127.69 3k2b h HIS 139 Ca -0.23 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 3k2b h HIS 139 Cb 1.11 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.07 3k2b h HIS 139 CO 0.43 0.00 0.00 -0.40 -1.30 0.00 0.00 177.93 176.66 3k2b n ASP 140 N -3.28 0.54 -4.54 3.26 5.75 -1.26 -4.69 116.55 112.32 3k2b n ASP 140 Ca 0.08 -2.02 -0.38 0.00 -0.01 0.00 0.00 54.79 52.47 3k2b n ASP 140 Cb 0.84 -0.17 -0.11 0.00 -1.03 0.00 0.00 41.12 40.65 3k2b n ASP 140 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3k2b s GLU 141 N -1.70 3.76 0.02 0.11 2.02 0.64 -4.98 118.70 118.57 3k2b s GLU 141 Ca 0.03 -0.44 0.04 0.00 0.02 0.00 0.00 54.97 54.62 3k2b s GLU 141 Cb 0.02 -3.62 -0.24 0.00 0.10 0.00 0.00 34.13 30.38 3k2b s GLU 141 CO 0.02 -0.25 0.91 -1.00 0.02 0.00 0.00 175.26 174.96 3k2b h PRO 142 N 8.37 0.11 -4.31 0.39 0.13 -1.88 -3.45 132.00 131.36 3k2b h PRO 142 Ca -0.35 -0.19 -0.62 0.00 -0.87 0.00 0.00 66.00 63.97 3k2b h PRO 142 Cb 1.18 0.07 -0.39 0.00 0.13 0.00 0.00 31.00 31.99 3k2b h PRO 142 CO 0.58 0.91 -0.76 0.42 -0.23 0.00 0.00 178.00 178.92 3k2b s ILE 143 N -2.64 1.63 0.34 -3.56 -1.09 -1.26 -1.17 121.20 113.45 3k2b s ILE 143 Ca -0.05 -1.58 0.08 0.00 -2.23 0.00 0.00 60.65 56.87 3k2b s ILE 143 Cb 0.08 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.88 3k2b s ILE 143 CO 0.83 -0.35 0.12 0.27 -1.23 0.00 0.00 174.94 174.59 3k2b s ILE 144 N 1.29 2.94 0.07 2.92 -4.36 -0.92 -3.95 121.20 119.20 3k2b s ILE 144 Ca 0.02 -1.74 0.09 0.00 -0.26 0.00 0.00 60.65 58.75 3k2b s ILE 144 Cb -0.19 -2.95 -0.03 0.00 1.25 0.00 0.00 42.46 40.55 3k2b s ILE 144 CO -0.10 -0.18 -0.24 -0.55 0.24 0.00 0.00 174.94 174.10 3k2b s SER 145 N -3.82 2.89 -0.17 4.36 0.15 0.71 -1.10 113.70 116.71 3k2b s SER 145 Ca 0.37 -0.61 0.16 0.00 0.70 0.00 0.00 55.95 56.57 3k2b s SER 145 Cb -0.02 -0.23 0.65 0.00 -1.71 0.00 0.00 66.02 64.71 3k2b s SER 145 CO 0.22 0.19 1.57 -3.20 1.20 0.00 0.00 173.24 173.22 3k2b n ASN 146 N 1.58 4.62 0.00 5.45 5.15 -0.68 -0.79 115.26 130.60 3k2b n ASN 146 Ca -0.17 -2.77 0.00 0.00 -0.60 0.00 0.00 54.58 51.03 3k2b n ASN 146 Cb 0.53 -0.57 0.00 0.00 -0.53 0.00 0.00 39.78 39.21 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 0.33 0.00 -2.42 5.20 0.00 -1.25 -4.79 120.51 117.57 3k2b n ALA 147 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.45 3k2b n ALA 147 Cb 0.95 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.35 3k2b n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k2b s SER 148 N -4.00 4.84 0.17 0.00 1.04 -1.26 -2.74 113.70 111.75 3k2b s SER 148 Ca 0.00 -0.77 -0.13 0.00 0.48 0.00 0.00 55.95 55.53 3k2b s SER 148 Cb 0.00 -0.69 0.08 0.00 0.10 0.00 0.00 66.02 65.51 3k2b s SER 148 CO 0.00 -0.44 1.78 0.00 0.98 0.00 0.00 173.24 175.55 3k2b h THR 150 N 0.78 0.76 -0.98 0.00 2.02 -1.96 -2.06 112.91 111.47 3k2b h THR 150 Ca 0.20 -0.09 0.16 0.00 0.77 0.00 0.00 66.41 67.46 3k2b h THR 150 Cb 0.06 0.81 -0.09 0.00 -1.74 0.00 0.00 68.15 67.19 3k2b h THR 150 CO -0.03 0.02 0.61 0.74 0.37 0.00 0.00 175.52 177.23 3k2b h THR 151 N -0.40 0.79 0.00 3.16 2.02 -1.84 0.53 112.91 117.18 3k2b h THR 151 Ca -0.04 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 3k2b h THR 151 Cb 0.30 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.64 3k2b h THR 151 CO 0.06 0.15 -0.10 0.78 0.37 0.00 0.00 175.52 176.77 3k2b h ASN 152 N 0.80 0.00 0.00 4.18 4.21 -0.66 0.30 115.58 124.41 3k2b h ASN 152 Ca 0.52 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.83 3k2b h ASN 152 Cb 0.76 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.93 3k2b h ASN 152 CO -0.29 0.10 -1.16 0.00 -1.29 0.00 0.00 177.43 174.79 3k2b h LEU 154 N -1.00 0.23 -0.04 0.00 5.85 -0.09 -3.30 115.31 116.95 3k2b h LEU 154 Ca -0.31 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.46 3k2b h LEU 154 Cb 1.21 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 3k2b h LEU 154 CO -0.19 0.17 -0.34 0.00 -0.34 0.00 0.00 178.44 177.75 3k2b h ALA 155 N 1.16 -0.47 -0.87 1.25 0.00 -1.15 -1.86 119.26 117.33 3k2b h ALA 155 Ca 0.13 -0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.25 3k2b h ALA 155 Cb 0.04 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 3k2b h ALA 155 CO -0.09 -0.84 0.59 -1.35 0.00 0.00 0.00 179.25 177.56 3k2b h PRO 156 N -0.46 0.23 0.00 0.00 0.11 -1.77 -1.48 132.00 128.63 3k2b h PRO 156 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3k2b h PRO 156 Cb 0.57 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.63 3k2b h PRO 156 CO -0.30 0.15 -1.43 1.97 -0.21 0.00 0.00 178.00 178.18 3k2b n PHE 157 N -4.42 0.21 0.16 0.65 -1.74 -1.08 -3.35 117.46 107.89 3k2b n PHE 157 Ca 0.18 0.06 0.01 0.00 -0.56 0.00 0.00 57.45 57.14 3k2b n PHE 157 Cb 0.78 -0.47 0.27 0.00 1.52 0.00 0.00 39.48 41.58 3k2b n PHE 157 CO 0.00 0.00 0.00 0.28 -0.56 0.00 0.00 176.76 176.48 3k2b h VAL 158 N 0.00 1.34 0.24 1.97 2.07 -0.64 -1.87 116.25 119.36 3k2b h VAL 158 Ca 0.00 -1.66 -0.01 0.00 0.82 0.00 0.00 66.70 65.84 3k2b h VAL 158 Cb 0.85 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 3k2b h VAL 158 CO 0.00 0.47 -0.11 0.50 0.02 0.00 0.00 177.57 178.45 3k2b h LYS 159 N 0.00 -0.31 -0.11 1.57 3.64 -1.38 -1.19 116.57 118.80 3k2b h LYS 159 Ca -0.00 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3k2b h LYS 159 Cb 0.86 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3k2b h LYS 159 CO 0.06 -0.01 0.01 0.28 -2.27 0.00 0.00 179.45 177.52 3k2b h VAL 160 N -0.60 0.95 0.07 2.00 2.07 -1.53 0.72 116.25 119.92 3k2b h VAL 160 Ca -0.03 -0.02 0.03 0.00 0.82 0.00 0.00 66.70 67.49 3k2b h VAL 160 Cb 0.44 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3k2b h VAL 160 CO 0.05 0.01 -0.33 -0.07 0.02 0.00 0.00 177.57 177.25 3k2b h LEU 161 N 0.06 -0.98 -0.92 2.57 3.38 -1.36 -1.54 115.31 116.52 3k2b h LEU 161 Ca 0.05 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.15 3k2b h LEU 161 Cb 0.05 0.38 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 3k2b h LEU 161 CO -0.07 -0.41 0.61 -0.78 0.09 0.00 0.00 178.44 177.88 3k2b h ASP 162 N -0.53 1.05 0.36 -0.43 3.58 -0.98 0.90 116.42 120.38 3k2b h ASP 162 Ca 0.04 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 3k2b h ASP 162 Cb 0.58 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.35 3k2b h ASP 162 CO -0.23 0.76 -0.37 1.56 -2.88 0.00 0.00 179.24 178.08 3k2b h GLN 163 N 1.24 -0.73 0.00 0.28 4.20 -0.38 -2.17 115.11 117.55 3k2b h GLN 163 Ca 0.34 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.10 3k2b h GLN 163 Cb -0.13 0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3k2b h GLN 163 CO -0.08 -0.49 -0.84 0.87 -0.67 0.00 0.00 178.83 177.62 3k2b h LYS 164 N -0.76 0.00 0.00 1.46 1.57 -1.17 -3.41 116.57 114.26 3k2b h LYS 164 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3k2b h LYS 164 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3k2b h LYS 164 CO -0.07 0.00 -0.79 1.19 -0.57 0.00 0.00 179.45 179.21 3k2b n PHE 165 N -2.53 0.00 -1.34 -1.35 3.72 0.29 -4.88 117.46 111.38 3k2b n PHE 165 Ca 0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3k2b n PHE 165 Cb 0.52 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.05 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 2.03 -2.94 3.65 1.37 0.00 -0.81 -1.06 105.19 107.42 3k2b n GLY 166 Ca 0.00 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.01 4.83 -0.19 -0.61 1.01 -1.26 -0.59 121.20 124.38 3k2b s ILE 167 Ca -0.00 1.62 -0.21 0.00 0.00 0.00 0.00 60.65 62.06 3k2b s ILE 167 Cb 0.00 -4.14 -0.18 0.00 0.01 0.00 0.00 42.46 38.15 3k2b s ILE 167 CO 0.01 -0.06 0.25 0.40 0.00 0.00 0.00 174.94 175.54 3k2b h ILE 168 N 5.38 0.93 -2.93 2.92 2.04 -1.55 -3.49 117.51 120.82 3k2b h ILE 168 Ca -0.24 -2.05 -0.03 0.00 1.00 0.00 0.00 64.86 63.54 3k2b h ILE 168 Cb 1.10 2.12 -0.13 0.00 -0.74 0.00 0.00 36.82 39.16 3k2b h ILE 168 CO 0.87 0.32 0.17 -1.59 0.00 0.00 0.00 178.15 177.93 3k2b s LYS 169 N -2.31 1.23 0.25 2.37 -2.85 -1.23 -4.87 119.74 112.33 3k2b s LYS 169 Ca -0.25 -0.41 -0.22 0.00 -1.00 0.00 0.00 55.97 54.09 3k2b s LYS 169 Cb 0.04 0.57 0.05 0.00 -2.06 0.00 0.00 37.83 36.42 3k2b s LYS 169 CO 0.55 -0.52 0.84 0.20 0.10 0.00 0.00 175.35 176.53 3k2b s GLY 170 N -2.58 -0.04 0.06 0.59 0.00 0.29 -0.77 107.32 104.87 3k2b s GLY 170 Ca -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 44.72 44.45 3k2b s GLY 170 CO -0.10 0.15 0.03 -1.08 0.00 0.00 0.00 173.10 172.09 3k2b s THR 171 N -3.27 0.19 -0.05 0.90 -1.32 0.09 -3.49 115.64 108.68 3k2b s THR 171 Ca 0.13 -1.56 -0.12 0.00 -1.21 0.00 0.00 61.69 58.94 3k2b s THR 171 Cb -0.04 -1.35 0.02 0.00 -1.51 0.00 0.00 72.50 69.62 3k2b s THR 171 CO 0.06 -0.86 0.28 -0.32 -2.21 0.00 0.00 174.62 171.57 3k2b s MET 172 N -3.64 0.52 -0.05 7.08 0.00 -0.56 -1.55 119.30 121.09 3k2b s MET 172 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 55.69 55.74 3k2b s MET 172 Cb 0.05 0.23 0.02 0.00 0.00 0.00 0.00 34.83 35.14 3k2b s MET 172 CO -0.09 -0.12 -0.04 0.99 0.00 0.00 0.00 175.02 175.76 3k2b s THR 173 N -0.78 0.54 -0.28 10.11 2.01 -0.11 -0.89 115.64 126.24 3k2b s THR 173 Ca -0.09 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 61.78 3k2b s THR 173 Cb -0.04 -0.59 0.02 0.00 0.01 0.00 0.00 72.50 71.89 3k2b s THR 173 CO 0.02 0.24 0.02 0.28 -0.69 0.00 0.00 174.62 174.50 3k2b s THR 174 N 1.19 3.52 -0.64 -0.82 -1.32 -0.91 0.33 115.64 116.99 3k2b s THR 174 Ca -0.07 -0.83 -0.24 0.00 -1.21 0.00 0.00 61.69 59.35 3k2b s THR 174 Cb -0.14 -2.81 0.05 0.00 -1.51 0.00 0.00 72.50 68.10 3k2b s THR 174 CO -0.01 0.13 1.02 -0.89 -2.21 0.00 0.00 174.62 172.65 3k2b s THR 175 N 1.43 4.22 0.02 5.08 2.01 -0.64 -0.36 115.64 127.40 3k2b s THR 175 Ca 0.02 -0.04 0.01 0.00 0.31 0.00 0.00 61.69 61.99 3k2b s THR 175 Cb -0.17 -4.69 -0.04 0.00 0.01 0.00 0.00 72.50 67.61 3k2b s THR 175 CO -0.00 -1.44 0.04 -2.28 -0.69 0.00 0.00 174.62 170.25 3k2b s HIS 176 N 4.36 3.16 0.63 4.92 2.46 0.49 -2.27 115.29 129.04 3k2b s HIS 176 Ca 0.27 0.12 -0.17 0.00 0.47 0.00 0.00 55.06 55.75 3k2b s HIS 176 Cb -0.14 -1.68 -0.02 0.00 -0.13 0.00 0.00 32.58 30.62 3k2b s HIS 176 CO 0.14 0.50 1.14 -1.12 -2.47 0.00 0.00 174.74 172.93 3k2b s SER 177 N -1.81 5.17 0.79 9.88 0.01 -1.26 0.27 113.70 126.75 3k2b s SER 177 Ca 0.23 2.15 -0.10 0.00 1.31 0.00 0.00 55.95 59.54 3k2b s SER 177 Cb -0.12 -2.57 0.07 0.00 0.21 0.00 0.00 66.02 63.61 3k2b s SER 177 CO 0.14 -1.59 1.10 -0.72 0.41 0.00 0.00 173.24 172.58 3k2b s TYR 178 N -2.02 2.45 0.15 2.43 -0.85 -0.70 -4.70 117.35 114.11 3k2b s TYR 178 Ca 0.71 1.59 0.02 0.00 -0.52 0.00 0.00 57.07 58.87 3k2b s TYR 178 Cb -0.24 -3.09 -0.04 0.00 0.38 0.00 0.00 41.96 38.97 3k2b s TYR 178 CO 0.37 -1.93 -0.03 0.95 -1.52 0.00 0.00 175.55 173.38 3k2b s THR 179 N -2.86 0.78 0.62 -3.49 -4.23 -1.26 -4.70 115.64 100.49 3k2b s THR 179 Ca 0.62 -1.98 0.20 0.00 -1.18 0.00 0.00 61.69 59.35 3k2b s THR 179 Cb -0.18 -1.96 0.28 0.00 1.34 0.00 0.00 72.50 71.98 3k2b s THR 179 CO 0.56 -0.62 1.35 1.23 -0.54 0.00 0.00 174.62 176.60 3k2b h GLY 180 N 2.77 0.00 2.00 3.99 0.00 -1.98 0.25 103.07 110.10 3k2b h GLY 180 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3k2b h GLY 180 CO 0.63 0.00 0.00 -1.80 0.00 0.00 0.00 176.54 175.37 3k2b h ASP 181 N 0.00 0.00 -3.31 0.19 3.58 -1.98 -3.45 116.42 111.45 3k2b h ASP 181 Ca 0.29 0.00 -0.47 0.00 0.42 0.00 0.00 57.03 57.26 3k2b h ASP 181 Cb 2.28 0.00 0.04 0.00 1.72 0.00 0.00 39.33 43.37 3k2b h ASP 181 CO -0.00 0.00 0.07 -1.10 -2.88 0.00 0.00 179.24 175.32 3k2b s GLN 182 N -3.31 3.07 0.14 0.28 -0.21 0.88 -4.95 119.66 115.56 3k2b s GLN 182 Ca 0.06 -0.15 -0.10 0.00 0.02 0.00 0.00 55.36 55.19 3k2b s GLN 182 Cb 0.10 -2.39 -0.06 0.00 1.00 0.00 0.00 33.01 31.65 3k2b s GLN 182 CO 0.50 -0.46 0.47 1.03 -2.12 0.00 0.00 175.29 174.70 3k2b s ARG 183 N -4.79 3.80 0.14 2.91 1.81 -1.06 -4.96 118.95 116.80 3k2b s ARG 183 Ca 0.51 0.23 -0.05 0.00 -1.72 0.00 0.00 55.73 54.69 3k2b s ARG 183 Cb -0.10 -2.87 -0.04 0.00 -0.45 0.00 0.00 34.95 31.48 3k2b s ARG 183 CO 0.42 0.47 1.36 1.25 -0.68 0.00 0.00 175.30 178.12 3k2b h LEU 184 N 3.25 0.63 -8.31 2.53 5.85 -1.91 0.21 115.31 117.56 3k2b h LEU 184 Ca -0.48 -0.44 -0.23 0.00 0.84 0.00 0.00 57.88 57.58 3k2b h LEU 184 Cb 1.18 -0.19 -0.17 0.00 0.37 0.00 0.00 40.66 41.85 3k2b h LEU 184 CO 0.68 1.21 -0.71 -0.76 -0.34 0.00 0.00 178.44 178.52 3k2b s LEU 185 N -8.03 2.41 -0.39 2.25 1.43 -1.26 -4.06 118.68 111.03 3k2b s LEU 185 Ca -0.07 -0.83 -0.40 0.00 -1.03 0.00 0.00 54.13 51.81 3k2b s LEU 185 Cb 0.09 -0.06 -0.15 0.00 0.03 0.00 0.00 46.19 46.10 3k2b s LEU 185 CO 0.87 -0.39 2.04 0.47 0.23 0.00 0.00 176.35 179.57 3k2b n ASP 186 N 0.56 1.74 -3.65 2.29 9.92 -1.26 -4.42 116.55 121.73 3k2b n ASP 186 Ca -0.16 0.68 -0.10 0.00 -0.53 0.00 0.00 54.79 54.67 3k2b n ASP 186 Cb 0.58 -1.11 -0.04 0.00 -0.64 0.00 0.00 41.12 39.91 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 5.85 -0.95 0.14 2.24 0.00 -0.34 -4.96 121.76 123.74 3k2b s ALA 187 Ca 1.10 -0.07 -0.33 0.00 0.00 0.00 0.00 51.96 52.66 3k2b s ALA 187 Cb -1.13 0.74 -0.17 0.00 0.00 0.00 0.00 23.12 22.56 3k2b s ALA 187 CO 0.60 -0.68 0.95 0.43 0.00 0.00 0.00 175.76 177.06 3k2b n SER 188 N -0.26 0.24 -3.45 0.00 7.64 -1.26 -4.54 113.62 111.99 3k2b n SER 188 Ca -0.15 1.14 -0.13 0.00 1.01 0.00 0.00 58.87 60.74 3k2b n SER 188 Cb 0.64 -1.06 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 3k2b n SER 188 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3k2b s HIS 190 N -0.39 -0.56 0.14 1.43 5.04 -1.26 -4.92 115.29 114.76 3k2b s HIS 190 Ca 0.75 0.50 -0.03 0.00 -1.54 0.00 0.00 55.06 54.74 3k2b s HIS 190 Cb -0.99 0.52 -0.07 0.00 0.04 0.00 0.00 32.58 32.08 3k2b s HIS 190 CO 0.55 -0.79 1.32 0.07 -2.34 0.00 0.00 174.74 173.55 3k2b h ARG 191 N 2.25 0.37 -5.86 2.88 0.11 -1.97 -3.40 114.38 108.76 3k2b h ARG 191 Ca -0.32 -0.40 -0.60 0.00 0.10 0.00 0.00 59.98 58.76 3k2b h ARG 191 Cb 1.27 0.11 -0.10 0.00 1.11 0.00 0.00 29.97 32.36 3k2b h ARG 191 CO 0.38 1.07 0.46 0.34 0.10 0.00 0.00 179.97 182.33 3k2b s ASP 192 N -7.05 6.68 0.00 0.08 -1.08 -1.26 -4.92 116.67 109.12 3k2b s ASP 192 Ca -0.05 0.67 0.12 0.00 -0.52 0.00 0.00 52.55 52.77 3k2b s ASP 192 Cb 0.09 -2.43 0.74 0.00 -1.46 0.00 0.00 42.92 39.87 3k2b s ASP 192 CO 0.86 -0.68 1.18 0.18 0.52 0.00 0.00 175.17 177.24 3k2b n LEU 193 N 6.34 0.00 -0.07 -1.34 4.77 -1.26 -2.56 117.00 122.89 3k2b n LEU 193 Ca 0.05 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.94 3k2b n LEU 193 Cb 0.48 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 3k2b n LEU 193 CO 0.52 0.00 -0.93 0.54 -1.33 0.00 0.00 177.39 176.19 3k2b n ARG 194 N -0.86 0.66 0.00 3.23 1.74 -1.26 -4.36 116.66 115.81 3k2b n ARG 194 Ca 0.09 0.07 0.09 0.00 -0.77 0.00 0.00 57.85 57.33 3k2b n ARG 194 Cb 0.04 -1.28 0.48 0.00 -1.02 0.00 0.00 32.46 30.68 3k2b n ARG 194 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k2b n ARG 195 N -2.82 0.37 0.00 5.56 1.74 -1.08 -1.98 116.66 118.44 3k2b n ARG 195 Ca -0.23 0.08 0.12 0.00 -0.77 0.00 0.00 57.85 57.05 3k2b n ARG 195 Cb 0.77 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.99 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 -1.18 3.47 -2.25 7.54 0.00 -1.06 -2.55 120.51 124.48 3k2b n ALA 196 Ca 0.10 -0.35 -0.36 0.00 0.00 0.00 0.00 53.44 52.84 3k2b n ALA 196 Cb 0.11 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.37 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 -2.96 4.09 -0.45 0.00 1.81 -0.84 -1.19 118.95 119.40 3k2b s ARG 197 Ca 0.12 0.64 -0.33 0.00 -1.72 0.00 0.00 55.73 54.44 3k2b s ARG 197 Cb 0.18 -2.91 -0.15 0.00 -0.45 0.00 0.00 34.95 31.62 3k2b s ARG 197 CO 0.68 0.44 1.76 0.00 -0.68 0.00 0.00 175.30 177.50 3k2b n ALA 198 N 0.76 0.18 -0.02 2.13 0.00 -1.26 -4.46 120.51 117.84 3k2b n ALA 198 Ca -0.04 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3k2b n ALA 198 Cb 0.52 -1.67 0.30 0.00 0.00 0.00 0.00 19.45 18.59 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 7.48 1.39 -0.14 0.00 0.00 -1.09 -2.80 119.26 124.11 3k2b h ALA 199 Ca -0.07 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3k2b h ALA 199 Cb 1.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3k2b h ALA 199 CO 0.90 0.43 0.00 0.00 0.00 0.00 0.00 179.25 180.58 3k2b n ALA 200 N -2.47 2.53 0.27 0.00 0.00 -1.26 -3.89 120.51 115.68 3k2b n ALA 200 Ca 0.02 -0.50 0.03 0.00 0.00 0.00 0.00 53.44 53.00 3k2b n ALA 200 Cb 0.21 -1.11 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 3k2b n ALA 200 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k2b n LEU 201 N 0.25 0.27 -4.27 0.00 4.77 -1.07 -4.79 117.00 112.16 3k2b n LEU 201 Ca 0.16 -0.42 -0.15 0.00 -0.03 0.00 0.00 56.01 55.58 3k2b n LEU 201 Cb 0.32 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.31 3k2b n LEU 201 CO 0.13 0.07 -0.32 0.20 -1.33 0.00 0.00 177.39 176.14 3k2b s ASN 202 N -1.84 1.35 -0.33 -1.43 -0.87 -1.15 -5.04 114.94 105.63 3k2b s ASN 202 Ca 0.02 -1.22 -0.14 0.00 -1.57 0.00 0.00 52.86 49.95 3k2b s ASN 202 Cb 0.05 0.10 -0.02 0.00 -0.02 0.00 0.00 41.25 41.36 3k2b s ASN 202 CO 0.28 -0.58 0.33 -0.63 -2.57 0.00 0.00 177.10 173.93 3k2b s ILE 203 N -3.62 5.20 -0.26 0.60 1.01 -1.26 -3.97 121.20 118.91 3k2b s ILE 203 Ca 0.27 0.07 0.01 0.00 0.00 0.00 0.00 60.65 61.00 3k2b s ILE 203 Cb 0.06 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.81 3k2b s ILE 203 CO 0.07 -0.02 -0.08 -0.69 0.00 0.00 0.00 174.94 174.21 3k2b s VAL 204 N 1.95 2.50 0.01 2.92 1.01 0.15 -4.91 120.40 124.03 3k2b s VAL 204 Ca 0.11 -1.37 -0.30 0.00 0.00 0.00 0.00 61.98 60.42 3k2b s VAL 204 Cb -0.17 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 3k2b s VAL 204 CO 0.11 0.06 1.06 -2.84 0.00 0.00 0.00 175.10 173.50 3k2b s PRO 205 N 1.21 4.50 0.05 2.72 0.02 -1.26 0.11 135.00 142.34 3k2b s PRO 205 Ca -0.05 1.54 0.00 0.00 0.02 0.00 0.00 61.00 62.52 3k2b s PRO 205 Cb -0.18 -3.44 -0.03 0.00 0.02 0.00 0.00 34.50 30.86 3k2b s PRO 205 CO -0.05 -0.16 -0.04 -0.08 -0.33 0.00 0.00 177.00 176.34 3k2b s THR 206 N 1.19 0.29 0.80 0.99 -1.32 -0.12 -4.80 115.64 112.67 3k2b s THR 206 Ca 0.54 -1.46 -0.12 0.00 -1.21 0.00 0.00 61.69 59.45 3k2b s THR 206 Cb -0.24 -1.03 0.07 0.00 -1.51 0.00 0.00 72.50 69.79 3k2b s THR 206 CO 0.27 -0.75 1.10 -0.94 -2.21 0.00 0.00 174.62 172.09 3k2b s SER 207 N -2.32 4.52 0.12 8.08 1.04 -1.26 -0.09 113.70 123.79 3k2b s SER 207 Ca -0.02 1.22 -0.04 0.00 0.48 0.00 0.00 55.95 57.60 3k2b s SER 207 Cb -0.00 -1.94 -0.03 0.00 0.10 0.00 0.00 66.02 64.15 3k2b s SER 207 CO -0.05 -1.94 0.12 0.28 0.98 0.00 0.00 173.24 172.63 3k2b s THR 208 N -3.22 0.12 -0.02 2.02 -1.32 -1.26 -4.64 115.64 107.32 3k2b s THR 208 Ca 0.61 -1.67 0.10 0.00 -1.21 0.00 0.00 61.69 59.52 3k2b s THR 208 Cb -0.14 -1.82 -0.15 0.00 -1.51 0.00 0.00 72.50 68.89 3k2b s THR 208 CO 0.54 -0.53 0.21 0.61 -2.21 0.00 0.00 174.62 173.24 3k2b n GLY 209 N -0.09 -0.42 0.27 6.08 0.00 -1.26 -4.63 105.19 105.14 3k2b n GLY 209 Ca -0.09 -0.23 0.26 0.00 0.00 0.00 0.00 46.02 45.97 3k2b n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b n ALA 210 N -1.82 0.85 0.14 4.61 0.00 -1.26 0.13 120.51 123.15 3k2b n ALA 210 Ca -0.02 0.86 -0.08 0.00 0.00 0.00 0.00 53.44 54.20 3k2b n ALA 210 Cb 0.25 -0.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 3k2b n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b h ALA 211 N 1.68 -0.94 0.00 0.00 0.00 -1.92 -1.71 119.26 116.36 3k2b h ALA 211 Ca 0.71 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.50 3k2b h ALA 211 Cb 1.86 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 20.09 3k2b h ALA 211 CO -0.65 -0.95 -0.15 0.87 0.00 0.00 0.00 179.25 178.36 3k2b h LYS 212 N -0.45 0.00 -0.31 0.00 1.57 -1.04 -3.09 116.57 113.25 3k2b h LYS 212 Ca -0.03 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 3k2b h LYS 212 Cb 0.39 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 3k2b h LYS 212 CO -0.02 0.15 -0.03 0.00 -0.57 0.00 0.00 179.45 178.99 3k2b h ALA 213 N 1.85 1.38 -0.08 3.86 0.00 0.12 -1.67 119.26 124.72 3k2b h ALA 213 Ca -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3k2b h ALA 213 Cb 0.89 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3k2b h ALA 213 CO 0.02 0.43 0.01 0.28 0.00 0.00 0.00 179.25 179.99 3k2b h VAL 214 N 0.47 1.05 -0.98 0.00 2.07 -1.22 -1.49 116.25 116.14 3k2b h VAL 214 Ca 0.10 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.54 3k2b h VAL 214 Cb 0.35 0.99 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 3k2b h VAL 214 CO 0.01 0.06 0.61 0.00 0.02 0.00 0.00 177.57 178.28 3k2b h ALA 215 N 1.91 1.44 0.00 1.67 0.00 -1.44 0.34 119.26 123.18 3k2b h ALA 215 Ca 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3k2b h ALA 215 Cb 0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3k2b h ALA 215 CO 0.00 0.26 -0.04 -0.07 0.00 0.00 0.00 179.25 179.40 3k2b h LEU 216 N 1.01 0.00 0.00 0.00 3.38 -1.36 -0.19 115.31 118.15 3k2b h LEU 216 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3k2b h LEU 216 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3k2b h LEU 216 CO -0.24 0.04 -1.58 1.33 0.09 0.00 0.00 178.44 178.08 3k2b n VAL 217 N -3.87 0.00 -3.35 1.22 0.24 -0.56 -4.64 118.33 107.38 3k2b n VAL 217 Ca -0.03 -0.33 -0.26 0.00 -2.04 0.00 0.00 64.34 61.68 3k2b n VAL 217 Cb 0.13 0.30 -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 0.18 -2.14 0.00 0.00 176.83 174.87 3k2b n LEU 218 N -1.95 -0.03 -0.42 1.34 4.77 0.00 -4.58 117.00 116.13 3k2b n LEU 218 Ca -0.02 -4.53 0.35 0.00 -0.03 0.00 0.00 56.01 51.78 3k2b n LEU 218 Cb 0.42 0.49 0.63 0.00 -2.33 0.00 0.00 43.42 42.62 3k2b n LEU 218 CO 0.37 1.93 1.21 -0.65 -1.33 0.00 0.00 177.39 178.91 3k2b h PRO 219 N 5.07 0.09 0.00 3.23 0.11 -1.27 0.55 132.00 139.79 3k2b h PRO 219 Ca 0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3k2b h PRO 219 Cb 0.89 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3k2b h PRO 219 CO 0.43 0.06 0.08 -0.97 -0.21 0.00 0.00 178.00 177.39 3k2b h ASN 220 N 0.10 0.00 0.06 -2.05 -1.24 -1.94 0.72 115.58 111.23 3k2b h ASN 220 Ca 0.82 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.83 3k2b h ASN 220 Cb 2.46 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.51 3k2b h ASN 220 CO -0.47 0.00 -0.13 0.18 -1.29 0.00 0.00 177.43 175.72 3k2b n LEU 221 N -2.82 1.62 -4.71 0.34 7.99 0.19 -4.92 117.00 114.69 3k2b n LEU 221 Ca -0.02 -0.52 -0.58 0.00 -0.01 0.00 0.00 56.01 54.88 3k2b n LEU 221 Cb 0.14 -0.04 -0.07 0.00 -0.11 0.00 0.00 43.42 43.34 3k2b n LEU 221 CO 0.16 0.28 1.30 1.17 -1.51 0.00 0.00 177.39 178.79 3k2b n LYS 222 N 0.06 1.12 -0.84 3.23 0.00 0.24 -0.59 118.16 121.38 3k2b n LYS 222 Ca 0.15 0.41 0.00 0.00 0.00 0.00 0.00 58.31 58.87 3k2b n LYS 222 Cb 0.40 -2.09 0.00 0.00 0.00 0.00 0.00 35.03 33.34 3k2b n LYS 222 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2b n GLY 223 N 4.10 1.11 0.08 3.14 0.00 -1.26 -4.88 105.19 107.47 3k2b n GLY 223 Ca 0.26 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.40 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 -2.00 0.58 -4.60 1.61 5.02 0.24 -4.98 118.16 114.03 3k2b n LYS 224 Ca 0.00 0.03 -0.27 0.00 -2.02 0.00 0.00 58.31 56.05 3k2b n LYS 224 Cb 0.00 -1.72 -0.11 0.00 -0.02 0.00 0.00 35.03 33.18 3k2b n LYS 224 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3k2b s LEU 225 N -4.97 2.82 -0.29 -0.35 1.43 -1.25 -0.54 118.68 115.51 3k2b s LEU 225 Ca -0.02 -1.35 -0.26 0.00 -1.03 0.00 0.00 54.13 51.47 3k2b s LEU 225 Cb 0.11 -0.88 0.19 0.00 0.03 0.00 0.00 46.19 45.65 3k2b s LEU 225 CO 0.82 -0.43 1.42 0.21 0.23 0.00 0.00 176.35 178.60 3k2b s ASN 226 N -3.68 -0.04 0.16 2.29 2.47 -1.23 -4.61 114.94 110.30 3k2b s ASN 226 Ca 0.35 0.07 -0.09 0.00 0.42 0.00 0.00 52.86 53.61 3k2b s ASN 226 Cb 0.09 0.06 0.03 0.00 -1.45 0.00 0.00 41.25 39.99 3k2b s ASN 226 CO 0.18 -0.02 0.44 0.61 -3.72 0.00 0.00 177.10 174.58 3k2b n GLY 227 N 1.20 1.30 3.29 1.21 0.00 -1.26 -1.50 105.19 109.43 3k2b n GLY 227 Ca -0.07 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.47 0.06 0.12 -0.61 -4.36 -0.07 -4.37 121.20 109.51 3k2b s ILE 228 Ca 0.09 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.56 3k2b s ILE 228 Cb -0.02 -2.49 -0.04 0.00 1.25 0.00 0.00 42.46 41.17 3k2b s ILE 228 CO 0.05 0.00 -0.18 0.00 0.24 0.00 0.00 174.94 175.05 3k2b s ALA 229 N -3.53 1.75 -0.30 2.27 0.00 0.87 -2.13 121.76 120.68 3k2b s ALA 229 Ca 0.39 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 3k2b s ALA 229 Cb 0.03 -0.18 0.10 0.00 0.00 0.00 0.00 23.12 23.07 3k2b s ALA 229 CO 0.24 0.25 0.09 -0.51 0.00 0.00 0.00 175.76 175.83 3k2b s LEU 230 N -2.25 2.10 0.06 0.00 1.43 0.51 -0.95 118.68 119.58 3k2b s LEU 230 Ca 0.09 -1.56 -0.31 0.00 -1.03 0.00 0.00 54.13 51.33 3k2b s LEU 230 Cb -0.08 -0.83 -0.06 0.00 0.03 0.00 0.00 46.19 45.26 3k2b s LEU 230 CO 0.05 -0.41 1.26 -0.13 0.23 0.00 0.00 176.35 177.35 3k2b s ARG 231 N 1.65 4.39 0.23 1.70 1.81 0.30 -0.38 118.95 128.65 3k2b s ARG 231 Ca 0.09 1.84 0.09 0.00 -1.72 0.00 0.00 55.73 56.03 3k2b s ARG 231 Cb -0.17 -3.37 -0.05 0.00 -0.45 0.00 0.00 34.95 30.91 3k2b s ARG 231 CO -0.24 -0.34 -0.17 0.14 -0.68 0.00 0.00 175.30 174.01 3k2b s VAL 232 N 1.30 2.03 -0.35 3.52 -7.23 0.14 0.33 120.40 120.14 3k2b s VAL 232 Ca 0.60 -2.29 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 3k2b s VAL 232 Cb -0.31 -2.14 -0.07 0.00 0.56 0.00 0.00 36.38 34.42 3k2b s VAL 232 CO 0.28 -0.52 1.75 -2.65 -0.31 0.00 0.00 175.10 173.66 3k2b n PRO 233 N -0.46 1.14 -4.44 4.82 -0.02 -1.25 -2.90 135.00 131.89 3k2b n PRO 233 Ca -0.07 -0.81 -0.22 0.00 -2.02 0.00 0.00 63.50 60.38 3k2b n PRO 233 Cb 0.60 -2.03 -0.16 0.00 -0.02 0.00 0.00 33.50 31.89 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 3.13 0.87 -0.78 3.45 -4.23 -1.26 -5.00 115.64 111.82 3k2b s THR 234 Ca 0.27 -0.38 0.17 0.00 -1.18 0.00 0.00 61.69 60.57 3k2b s THR 234 Cb 0.10 -0.79 0.16 0.00 1.34 0.00 0.00 72.50 73.31 3k2b s THR 234 CO -0.01 0.28 1.53 -0.81 -0.54 0.00 0.00 174.62 175.07 3k2b n PRO 235 N 3.48 0.07 -3.61 3.99 -0.04 -1.26 -1.71 135.00 135.92 3k2b n PRO 235 Ca -0.20 0.34 -0.05 0.00 -0.04 0.00 0.00 63.50 63.55 3k2b n PRO 235 Cb 0.53 -1.65 -0.04 0.00 -0.04 0.00 0.00 33.50 32.30 3k2b n PRO 235 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3k2b s ASN 236 N -3.48 -0.17 0.00 3.54 2.47 -1.26 -4.81 114.94 111.23 3k2b s ASN 236 Ca 0.05 0.15 0.00 0.00 0.42 0.00 0.00 52.86 53.48 3k2b s ASN 236 Cb 0.09 0.14 0.00 0.00 -1.45 0.00 0.00 41.25 40.03 3k2b s ASN 236 CO 0.29 -0.18 0.00 0.52 -3.72 0.00 0.00 177.10 174.01 3k2b n VAL 237 N 0.46 -1.13 -4.40 -5.21 0.31 -1.26 -4.90 118.33 102.20 3k2b n VAL 237 Ca -0.03 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.10 3k2b n VAL 237 Cb 0.58 -1.13 -0.10 0.00 -0.91 0.00 0.00 33.84 32.28 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 -0.07 1.94 0.00 4.52 0.01 -0.38 -4.11 113.70 115.61 3k2b s SER 238 Ca 0.00 -1.39 0.02 0.00 1.31 0.00 0.00 55.95 55.89 3k2b s SER 238 Cb 0.00 0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.26 3k2b s SER 238 CO 0.00 -0.67 -0.06 0.54 0.41 0.00 0.00 173.24 173.46 3k2b s VAL 239 N -3.47 0.48 -0.11 3.43 0.11 -0.96 -1.32 120.40 118.57 3k2b s VAL 239 Ca 0.37 -0.33 -0.01 0.00 -2.93 0.00 0.00 61.98 59.07 3k2b s VAL 239 Cb 0.08 -0.42 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 3k2b s VAL 239 CO 0.15 0.09 -0.06 0.68 -3.33 0.00 0.00 175.10 172.62 3k2b s VAL 240 N -0.25 3.71 -0.35 2.04 -7.23 -0.02 -1.63 120.40 116.67 3k2b s VAL 240 Ca 0.01 -0.45 -0.06 0.00 -1.81 0.00 0.00 61.98 59.68 3k2b s VAL 240 Cb -0.03 -2.57 0.05 0.00 0.56 0.00 0.00 36.38 34.39 3k2b s VAL 240 CO -0.00 0.54 0.12 -0.62 -0.31 0.00 0.00 175.10 174.83 3k2b s ASP 241 N -0.14 5.30 -0.08 4.85 2.15 0.15 -1.73 116.67 127.17 3k2b s ASP 241 Ca 0.02 -1.27 -0.03 0.00 0.43 0.00 0.00 52.55 51.71 3k2b s ASP 241 Cb -0.13 -1.86 -0.04 0.00 -0.30 0.00 0.00 42.92 40.59 3k2b s ASP 241 CO 0.03 -0.36 0.04 -0.22 -0.17 0.00 0.00 175.17 174.49 3k2b s LEU 242 N 1.37 3.79 -0.10 -1.34 2.96 0.10 -0.94 118.68 124.52 3k2b s LEU 242 Ca -0.01 0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 54.10 3k2b s LEU 242 Cb -0.20 -1.95 0.03 0.00 0.50 0.00 0.00 46.19 44.57 3k2b s LEU 242 CO 0.02 0.36 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.68 3k2b s VAL 243 N -0.97 0.75 0.04 1.68 1.01 -0.60 -0.58 120.40 121.72 3k2b s VAL 243 Ca 0.15 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.05 3k2b s VAL 243 Cb -0.12 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 3k2b s VAL 243 CO 0.05 0.32 -0.09 0.68 0.00 0.00 0.00 175.10 176.06 3k2b s VAL 244 N 1.82 0.64 -0.17 2.92 -7.23 0.10 -0.74 120.40 117.74 3k2b s VAL 244 Ca 0.05 -0.93 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 3k2b s VAL 244 Cb -0.12 -0.65 -0.05 0.00 0.56 0.00 0.00 36.38 36.12 3k2b s VAL 244 CO -0.07 -0.23 0.28 -1.58 -0.31 0.00 0.00 175.10 173.19 3k2b s GLN 245 N -1.27 4.24 0.54 4.82 0.74 0.05 -0.02 119.66 128.76 3k2b s GLN 245 Ca -0.06 0.05 0.04 0.00 0.05 0.00 0.00 55.36 55.44 3k2b s GLN 245 Cb -0.08 -3.44 0.04 0.00 1.10 0.00 0.00 33.01 30.63 3k2b s GLN 245 CO 0.01 0.21 0.33 1.33 -0.55 0.00 0.00 175.29 176.61 3k2b n VAL 246 N 3.67 0.00 -0.05 1.34 0.24 0.76 -1.43 118.33 122.85 3k2b n VAL 246 Ca -0.12 -2.22 -0.05 0.00 -2.04 0.00 0.00 64.34 59.91 3k2b n VAL 246 Cb 0.52 0.08 -0.02 0.00 -1.47 0.00 0.00 33.84 32.95 3k2b n VAL 246 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3k2b n SER 247 N -1.72 1.10 -4.68 -1.34 7.64 0.24 -4.77 113.62 110.09 3k2b n SER 247 Ca -0.06 0.24 -0.44 0.00 1.01 0.00 0.00 58.87 59.62 3k2b n SER 247 Cb 0.63 -0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 3k2b n SER 247 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3k2b n LYS 248 N -3.62 2.60 -1.96 1.43 4.81 -0.31 -4.90 118.16 116.21 3k2b n LYS 248 Ca -0.07 0.95 -0.39 0.00 -0.87 0.00 0.00 58.31 57.92 3k2b n LYS 248 Cb 0.27 -2.84 0.01 0.00 0.02 0.00 0.00 35.03 32.49 3k2b n LYS 248 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3k2b s LYS 249 N 3.43 3.81 0.36 1.64 1.02 -1.26 -4.87 119.74 123.87 3k2b s LYS 249 Ca 0.87 2.24 -0.02 0.00 0.02 0.00 0.00 55.97 59.08 3k2b s LYS 249 Cb -0.54 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.09 3k2b s LYS 249 CO 0.43 -0.65 0.49 -0.08 -0.92 0.00 0.00 175.35 174.62 3k2b s THR 250 N -1.25 0.00 0.05 2.17 -1.32 0.78 -5.03 115.64 111.04 3k2b s THR 250 Ca 0.59 -1.60 0.02 0.00 -1.21 0.00 0.00 61.69 59.50 3k2b s THR 250 Cb -0.40 -2.68 -0.03 0.00 -1.51 0.00 0.00 72.50 67.89 3k2b s THR 250 CO 0.51 0.00 -0.07 0.72 -2.21 0.00 0.00 174.62 173.56 3k2b s PHE 251 N -2.94 0.70 0.28 9.09 -0.71 -1.26 -4.47 117.98 118.66 3k2b s PHE 251 Ca 0.31 -0.59 -0.03 0.00 -1.04 0.00 0.00 56.93 55.58 3k2b s PHE 251 Cb -0.01 -0.42 0.59 0.00 -1.21 0.00 0.00 43.02 41.98 3k2b s PHE 251 CO 0.21 -0.10 1.61 0.00 -1.34 0.00 0.00 175.22 175.60 3k2b h ALA 252 N 4.19 0.99 0.00 1.99 0.00 -1.89 -0.39 119.26 124.15 3k2b h ALA 252 Ca -0.36 0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3k2b h ALA 252 Cb 1.19 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 3k2b h ALA 252 CO 0.46 -0.48 -0.31 1.49 0.00 0.00 0.00 179.25 180.41 3k2b h GLU 253 N 0.09 0.00 -0.12 0.00 4.57 -1.97 -2.36 114.58 114.78 3k2b h GLU 253 Ca 0.50 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 58.45 3k2b h GLU 253 Cb 0.96 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.56 3k2b h GLU 253 CO -0.76 0.31 -0.83 1.49 -1.18 0.00 0.00 179.01 178.03 3k2b h GLU 254 N 0.00 0.75 -0.49 1.92 4.81 -1.51 -1.72 114.58 118.34 3k2b h GLU 254 Ca -0.00 -0.65 0.02 0.00 -0.13 0.00 0.00 59.36 58.60 3k2b h GLU 254 Cb 0.59 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 3k2b h GLU 254 CO 0.04 1.25 0.29 0.28 -0.73 0.00 0.00 179.01 180.14 3k2b h VAL 255 N 0.49 1.05 -0.36 0.32 2.07 -1.17 -0.65 116.25 118.01 3k2b h VAL 255 Ca -0.07 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 3k2b h VAL 255 Cb 1.46 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3k2b h VAL 255 CO 0.17 0.11 -0.09 0.78 0.02 0.00 0.00 177.57 178.56 3k2b h ASN 256 N 0.59 0.58 -0.31 0.57 -0.26 -1.36 -1.86 115.58 113.52 3k2b h ASN 256 Ca 0.20 -0.15 -0.06 0.00 -0.56 0.00 0.00 56.30 55.72 3k2b h ASN 256 Cb 0.01 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.10 3k2b h ASN 256 CO -0.09 0.71 0.00 0.00 -1.06 0.00 0.00 177.43 177.00 3k2b h ALA 257 N 1.35 1.23 0.22 -0.83 0.00 -0.65 -0.59 119.26 119.99 3k2b h ALA 257 Ca 0.10 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3k2b h ALA 257 Cb 0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3k2b h ALA 257 CO 0.03 0.51 -0.15 0.00 0.00 0.00 0.00 179.25 179.63 3k2b h ALA 258 N 1.38 -0.36 -0.64 0.00 0.00 -0.35 -0.77 119.26 118.52 3k2b h ALA 258 Ca 0.13 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3k2b h ALA 258 Cb 0.39 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3k2b h ALA 258 CO 0.01 -0.71 0.42 0.74 0.00 0.00 0.00 179.25 179.71 3k2b h PHE 259 N -0.38 0.79 -0.29 0.00 0.04 -0.90 -1.34 116.94 114.86 3k2b h PHE 259 Ca -0.02 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3k2b h PHE 259 Cb 0.32 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 3k2b h PHE 259 CO -0.10 0.49 0.15 0.00 -0.60 0.00 0.00 178.31 178.25 3k2b h ARG 260 N 0.85 0.41 -0.20 1.51 3.08 -0.93 0.49 114.38 119.58 3k2b h ARG 260 Ca 0.24 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.26 3k2b h ARG 260 Cb -0.08 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3k2b h ARG 260 CO -0.06 0.38 0.01 -0.44 -1.07 0.00 0.00 179.97 178.78 3k2b h ASP 261 N 0.34 -0.06 -0.14 7.04 3.32 -0.86 -0.95 116.42 125.12 3k2b h ASP 261 Ca 0.10 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3k2b h ASP 261 Cb 0.09 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3k2b h ASP 261 CO -0.01 -0.00 0.09 0.28 -1.72 0.00 0.00 179.24 177.87 3k2b h SER 262 N 0.08 0.16 1.15 6.45 0.02 -0.96 -0.37 113.55 120.07 3k2b h SER 262 Ca 0.09 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3k2b h SER 262 Cb 0.11 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 3k2b h SER 262 CO -0.15 0.12 -0.00 0.00 -1.14 0.00 0.00 176.83 175.65 3k2b h ALA 263 N 1.91 1.00 0.00 3.77 0.00 0.43 0.81 119.26 127.18 3k2b h ALA 263 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3k2b h ALA 263 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3k2b h ALA 263 CO -0.01 0.00 -1.12 0.39 0.00 0.00 0.00 179.25 178.51 3k2b n GLU 264 N -3.09 0.23 0.00 0.00 4.71 -0.22 -3.75 120.64 118.51 3k2b n GLU 264 Ca 0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 3k2b n GLU 264 Cb 0.33 -1.55 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 3k2b n GLU 264 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3k2b n LYS 265 N -1.82 0.00 0.00 3.49 5.02 -0.76 -4.74 118.16 119.35 3k2b n LYS 265 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3k2b n LYS 265 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 3k2b n LYS 265 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3k2b n GLU 266 N 0.00 0.00 -0.08 1.97 0.00 -1.23 -1.11 120.64 120.19 3k2b n GLU 266 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 57.16 57.50 3k2b n GLU 266 Cb 0.00 -1.53 0.04 0.00 0.00 0.00 0.00 31.44 29.94 3k2b n GLU 266 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3k2b n LEU 267 N -1.30 1.51 -4.50 -1.84 4.77 0.24 -4.98 117.00 110.90 3k2b n LEU 267 Ca 0.00 -1.83 -0.47 0.00 -0.03 0.00 0.00 56.01 53.68 3k2b n LEU 267 Cb 0.03 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 3k2b n LEU 267 CO 0.00 0.44 0.33 1.17 -1.33 0.00 0.00 177.39 178.00 3k2b n LYS 268 N -0.61 0.69 -0.16 3.23 4.81 -0.27 0.35 118.16 126.20 3k2b n LYS 268 Ca 0.04 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.73 3k2b n LYS 268 Cb 0.46 -1.47 0.00 0.00 0.02 0.00 0.00 35.03 34.04 3k2b n LYS 268 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k2b n GLY 269 N 1.65 1.47 0.28 3.14 0.00 -1.26 -4.70 105.19 105.76 3k2b n GLY 269 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3k2b n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k2b n ILE 270 N -2.00 0.61 -5.03 -0.61 2.08 0.16 -4.51 119.36 110.05 3k2b n ILE 270 Ca 0.00 -0.20 -0.32 0.00 0.56 0.00 0.00 62.75 62.79 3k2b n ILE 270 Cb 0.00 -1.17 -0.14 0.00 -0.75 0.00 0.00 39.64 37.58 3k2b n ILE 270 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3k2b s LEU 271 N -5.99 2.45 0.01 1.39 0.20 -0.67 0.25 118.68 116.32 3k2b s LEU 271 Ca -0.15 -0.33 0.01 0.00 0.69 0.00 0.00 54.13 54.35 3k2b s LEU 271 Cb 0.05 -1.46 -0.01 0.00 -0.43 0.00 0.00 46.19 44.33 3k2b s LEU 271 CO 0.23 0.33 -0.04 -0.62 -0.29 0.00 0.00 176.35 175.96 3k2b s ASP 272 N -0.76 0.39 -0.22 3.68 3.68 0.78 -4.51 116.67 119.71 3k2b s ASP 272 Ca 0.11 -0.26 -0.04 0.00 2.13 0.00 0.00 52.55 54.49 3k2b s ASP 272 Cb -0.10 0.02 -0.01 0.00 -1.45 0.00 0.00 42.92 41.37 3k2b s ASP 272 CO 0.00 -0.10 -0.02 -0.69 0.13 0.00 0.00 175.17 174.49 3k2b s VAL 273 N -0.68 3.58 -0.17 1.11 1.01 -1.26 0.11 120.40 124.09 3k2b s VAL 273 Ca -0.06 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 3k2b s VAL 273 Cb -0.05 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3k2b s VAL 273 CO -0.00 0.41 0.07 0.00 0.00 0.00 0.00 175.10 175.58 3k2b n ASP 275 N 3.37 2.51 -4.89 0.00 8.00 -1.26 -1.56 116.55 122.71 3k2b n ASP 275 Ca -0.17 -1.72 -0.32 0.00 0.71 0.00 0.00 54.79 53.29 3k2b n ASP 275 Cb 0.52 -0.07 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 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 -1.23 3.63 -1.24 -1.24 0.41 -1.26 -4.89 118.70 112.88 3k2b s GLU 276 Ca 0.21 -0.06 -0.19 0.00 -0.41 0.00 0.00 54.97 54.51 3k2b s GLU 276 Cb 0.14 -2.89 0.05 0.00 -1.78 0.00 0.00 34.13 29.65 3k2b s GLU 276 CO 0.20 0.49 1.71 -1.25 -0.49 0.00 0.00 175.26 175.93 3k2b s PRO 277 N -2.50 3.77 0.56 0.39 0.04 -1.26 -4.93 135.00 131.06 3k2b s PRO 277 Ca 0.39 -1.76 0.09 0.00 0.04 0.00 0.00 61.00 59.76 3k2b s PRO 277 Cb -0.12 -5.48 0.08 0.00 0.04 0.00 0.00 34.50 29.01 3k2b s PRO 277 CO 0.23 -2.42 0.77 -0.51 0.04 0.00 0.00 177.00 175.11 3k2b s LEU 278 N 5.04 3.19 0.45 -3.56 1.43 -1.26 -5.14 118.68 118.82 3k2b s LEU 278 Ca 0.54 -0.76 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 3k2b s LEU 278 Cb 0.03 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 3k2b s LEU 278 CO 0.05 -1.27 0.08 0.68 0.23 0.00 0.00 176.35 176.12 3k2b s VAL 279 N -2.63 0.83 0.26 -1.59 -7.23 -1.26 -5.03 120.40 103.74 3k2b s VAL 279 Ca 0.61 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.76 3k2b s VAL 279 Cb -0.06 -2.29 0.24 0.00 0.56 0.00 0.00 36.38 34.83 3k2b s VAL 279 CO 0.38 0.00 1.71 0.77 -0.31 0.00 0.00 175.10 177.65 3k2b h SER 280 N 1.62 0.22 0.47 4.85 4.64 -1.98 -1.50 113.55 121.87 3k2b h SER 280 Ca -0.39 0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.03 3k2b h SER 280 Cb 1.29 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.51 3k2b h SER 280 CO 0.64 0.04 -0.17 1.62 -0.87 0.00 0.00 176.83 178.08 3k2b h VAL 281 N 0.38 0.64 0.00 0.95 3.04 -1.96 -2.37 116.25 116.94 3k2b h VAL 281 Ca 0.46 -0.73 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 3k2b h VAL 281 Cb 0.77 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 3k2b h VAL 281 CO -0.47 0.16 0.00 0.47 -1.01 0.00 0.00 177.57 176.72 3k2b n ASP 282 N -3.65 0.00 -0.80 3.17 8.00 -0.57 -2.03 116.55 120.69 3k2b n ASP 282 Ca -0.01 0.20 0.08 0.00 0.71 0.00 0.00 54.79 55.76 3k2b n ASP 282 Cb 0.29 -0.33 0.16 0.00 -0.02 0.00 0.00 41.12 41.22 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 -1.33 0.39 -1.90 1.24 3.72 -0.89 -4.96 117.46 113.74 3k2b n PHE 283 Ca 0.05 -0.30 -0.42 0.00 -0.05 0.00 0.00 57.45 56.73 3k2b n PHE 283 Cb 0.11 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 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 -1.13 4.20 -0.52 -1.08 0.52 -0.86 -2.07 118.95 118.01 3k2b s ARG 284 Ca 0.27 2.40 0.00 0.00 -0.52 0.00 0.00 55.73 57.89 3k2b s ARG 284 Cb 0.16 -3.16 0.00 0.00 0.52 0.00 0.00 34.95 32.46 3k2b s ARG 284 CO 0.21 -0.64 0.00 0.00 0.02 0.00 0.00 175.30 174.89 3k2b s SER 286 N -2.92 7.15 0.00 0.00 0.15 -0.88 -4.91 113.70 112.29 3k2b s SER 286 Ca 0.00 2.07 0.29 0.00 0.70 0.00 0.00 55.95 59.01 3k2b s SER 286 Cb 0.00 -2.59 1.24 0.00 -1.71 0.00 0.00 66.02 62.96 3k2b s SER 286 CO 0.00 -0.36 1.91 0.47 1.20 0.00 0.00 173.24 176.46 3k2b n ASP 287 N 3.14 0.05 -4.78 5.45 8.00 -1.26 -3.70 116.55 123.45 3k2b n ASP 287 Ca 0.06 0.29 -0.37 0.00 0.71 0.00 0.00 54.79 55.48 3k2b n ASP 287 Cb 0.46 -0.39 -0.06 0.00 -0.02 0.00 0.00 41.12 41.10 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 -2.90 3.71 0.27 1.24 0.40 -1.26 -4.87 117.98 114.57 3k2b s PHE 288 Ca 0.17 1.77 0.08 0.00 -0.60 0.00 0.00 56.93 58.35 3k2b s PHE 288 Cb 0.19 -2.91 0.35 0.00 0.51 0.00 0.00 43.02 41.16 3k2b s PHE 288 CO 0.53 0.24 1.61 0.77 0.70 0.00 0.00 175.22 179.07 3k2b h SER 289 N 3.26 0.12 -3.28 1.36 0.02 -0.46 -3.42 113.55 111.15 3k2b h SER 289 Ca -0.47 -0.07 -0.11 0.00 -0.84 0.00 0.00 61.79 60.31 3k2b h SER 289 Cb 1.19 -0.03 -0.26 0.00 0.14 0.00 0.00 62.40 63.44 3k2b h SER 289 CO 0.65 0.67 -0.27 0.28 -1.14 0.00 0.00 176.83 177.02 3k2b s THR 290 N -3.75 -0.02 -0.20 -2.27 -1.32 -0.87 -4.02 115.64 103.19 3k2b s THR 290 Ca -0.03 0.08 0.01 0.00 -1.21 0.00 0.00 61.69 60.55 3k2b s THR 290 Cb 0.13 -0.63 0.03 0.00 -1.51 0.00 0.00 72.50 70.52 3k2b s THR 290 CO 0.77 0.03 -0.16 -0.89 -2.21 0.00 0.00 174.62 172.17 3k2b s THR 291 N 1.29 1.98 0.04 5.08 2.01 -0.59 -0.15 115.64 125.30 3k2b s THR 291 Ca -0.09 -1.11 -0.30 0.00 0.31 0.00 0.00 61.69 60.50 3k2b s THR 291 Cb -0.08 -1.92 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 3k2b s THR 291 CO -0.12 0.32 1.11 -0.63 -0.69 0.00 0.00 174.62 174.62 3k2b s ILE 292 N 1.27 4.34 -1.18 1.82 -1.09 0.30 -0.60 121.20 126.05 3k2b s ILE 292 Ca 0.00 1.69 -0.15 0.00 -2.23 0.00 0.00 60.65 59.96 3k2b s ILE 292 Cb -0.15 -4.08 0.15 0.00 -1.58 0.00 0.00 42.46 36.79 3k2b s ILE 292 CO -0.10 0.14 1.44 -0.62 -1.23 0.00 0.00 174.94 174.57 3k2b s ASP 293 N 1.00 6.97 0.26 3.58 -1.08 -0.40 0.55 116.67 127.54 3k2b s ASP 293 Ca 0.56 -2.75 -0.06 0.00 -0.52 0.00 0.00 52.55 49.78 3k2b s ASP 293 Cb -0.26 -2.43 0.46 0.00 -1.46 0.00 0.00 42.92 39.23 3k2b s ASP 293 CO 0.29 -0.87 1.43 -1.54 0.52 0.00 0.00 175.17 175.00 3k2b n SER 294 N 6.26 -0.30 0.00 -0.34 3.41 -0.60 0.46 113.62 122.52 3k2b n SER 294 Ca 0.37 1.57 0.05 0.00 -0.26 0.00 0.00 58.87 60.60 3k2b n SER 294 Cb 0.44 -0.49 0.28 0.00 -0.26 0.00 0.00 64.21 64.19 3k2b n SER 294 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k2b n SER 295 N -5.47 0.00 -0.01 4.04 3.41 -1.26 -2.15 113.62 112.18 3k2b n SER 295 Ca 0.16 -0.05 0.10 0.00 -0.26 0.00 0.00 58.87 58.82 3k2b n SER 295 Cb 0.49 -0.17 -0.15 0.00 -0.26 0.00 0.00 64.21 64.12 3k2b n SER 295 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k2b n LEU 296 N -1.17 0.32 -4.69 1.04 4.77 0.17 -4.94 117.00 112.51 3k2b n LEU 296 Ca 0.06 -0.16 -0.42 0.00 -0.03 0.00 0.00 56.01 55.46 3k2b n LEU 296 Cb 0.06 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3k2b n LEU 296 CO 0.07 0.08 1.50 -0.89 -1.33 0.00 0.00 177.39 176.82 3k2b s THR 297 N -3.32 2.59 0.01 -5.08 2.01 -0.91 -4.80 115.64 106.14 3k2b s THR 297 Ca -0.03 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.02 3k2b s THR 297 Cb 0.14 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.62 3k2b s THR 297 CO 0.88 -0.00 -0.04 0.00 -0.69 0.00 0.00 174.62 174.77 3k2b s MET 298 N 2.99 0.33 -0.09 4.92 0.23 -1.03 -4.87 119.30 121.78 3k2b s MET 298 Ca 0.82 -0.38 0.04 0.00 -1.03 0.00 0.00 55.69 55.14 3k2b s MET 298 Cb -0.46 -0.17 -0.00 0.00 -1.53 0.00 0.00 34.83 32.67 3k2b s MET 298 CO 0.37 0.04 -0.24 0.08 -2.03 0.00 0.00 175.02 173.24 3k2b s VAL 299 N -0.70 2.05 -0.14 5.16 1.01 -1.26 -1.56 120.40 124.95 3k2b s VAL 299 Ca -0.05 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.91 3k2b s VAL 299 Cb -0.05 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3k2b s VAL 299 CO -0.00 0.56 -0.15 -0.32 0.00 0.00 0.00 175.10 175.19 3k2b s MET 300 N 0.25 3.27 -1.29 2.72 0.00 0.32 -4.73 119.30 119.84 3k2b s MET 300 Ca -0.16 -0.73 -0.02 0.00 0.00 0.00 0.00 55.69 54.78 3k2b s MET 300 Cb -0.17 -2.61 0.01 0.00 0.00 0.00 0.00 34.83 32.05 3k2b s MET 300 CO 0.08 0.09 0.86 0.41 0.00 0.00 0.00 175.02 176.46 3k2b n GLY 301 N 3.85 -0.34 4.57 2.11 0.00 -1.26 -1.58 105.19 112.53 3k2b n GLY 301 Ca -0.19 0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.07 0.00 0.00 1.61 8.00 -1.26 -4.27 116.55 117.56 3k2b n ASP 302 Ca -0.25 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.25 3k2b n ASP 302 Cb 0.66 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 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 0.00 0.19 -4.35 -2.24 5.68 -1.21 -0.16 116.55 114.47 3k2b n ASP 303 Ca 0.00 -0.98 -0.43 0.00 -0.50 0.00 0.00 54.79 52.88 3k2b n ASP 303 Cb 0.00 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 3k2b n ASP 303 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 3k2b s MET 304 N -0.00 2.88 -0.16 0.11 1.75 -0.62 -0.17 119.30 123.08 3k2b s MET 304 Ca 0.00 -1.41 -0.07 0.00 -1.25 0.00 0.00 55.69 52.96 3k2b s MET 304 Cb 0.00 -4.05 -0.04 0.00 2.84 0.00 0.00 34.83 33.57 3k2b s MET 304 CO 0.00 -1.03 0.10 0.08 -0.65 0.00 0.00 175.02 173.51 3k2b s VAL 305 N 1.58 5.12 -0.13 10.11 1.01 0.97 -0.52 120.40 138.54 3k2b s VAL 305 Ca 0.04 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.12 3k2b s VAL 305 Cb -0.24 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.87 3k2b s VAL 305 CO 0.05 0.52 -0.21 -0.75 0.00 0.00 0.00 175.10 174.71 3k2b s LYS 306 N -0.17 2.85 0.01 2.72 2.20 -0.60 0.01 119.74 126.77 3k2b s LYS 306 Ca 0.09 -0.80 0.05 0.00 -0.36 0.00 0.00 55.97 54.96 3k2b s LYS 306 Cb -0.12 -2.31 -0.02 0.00 -1.51 0.00 0.00 37.83 33.87 3k2b s LYS 306 CO 0.01 -0.01 -0.16 0.08 -0.36 0.00 0.00 175.35 174.90 3k2b s VAL 307 N 0.82 1.27 -0.11 4.02 1.01 0.25 -2.47 120.40 125.20 3k2b s VAL 307 Ca -0.08 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.12 3k2b s VAL 307 Cb -0.16 -1.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 3k2b s VAL 307 CO -0.01 0.25 -0.23 -0.63 0.00 0.00 0.00 175.10 174.49 3k2b s ILE 308 N -0.54 2.17 -0.00 2.22 -1.09 -1.26 -0.73 121.20 121.97 3k2b s ILE 308 Ca 0.05 -0.97 0.03 0.00 -2.23 0.00 0.00 60.65 57.53 3k2b s ILE 308 Cb -0.07 -1.84 -0.01 0.00 -1.58 0.00 0.00 42.46 38.96 3k2b s ILE 308 CO 0.00 0.55 -0.10 0.00 -1.23 0.00 0.00 174.94 174.17 3k2b s ALA 309 N 0.41 0.81 0.25 9.38 0.00 -0.71 -1.28 121.76 130.62 3k2b s ALA 309 Ca -0.16 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 51.42 3k2b s ALA 309 Cb -0.17 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 3k2b s ALA 309 CO 0.07 0.19 0.27 -1.58 0.00 0.00 0.00 175.76 174.72 3k2b s TRP 310 N -0.27 3.25 -0.21 0.00 0.52 0.23 -0.84 118.94 121.61 3k2b s TRP 310 Ca 0.03 -0.08 -0.28 0.00 0.02 0.00 0.00 56.10 55.79 3k2b s TRP 310 Cb -0.04 -1.50 0.13 0.00 -1.15 0.00 0.00 33.47 30.91 3k2b s TRP 310 CO -0.00 0.46 1.04 1.52 0.02 0.00 0.00 176.95 179.99 3k2b s TYR 311 N -2.08 -0.38 -0.77 -1.98 1.13 -0.43 -1.55 117.35 111.29 3k2b s TYR 311 Ca 0.34 0.78 -0.22 0.00 -1.41 0.00 0.00 57.07 56.56 3k2b s TYR 311 Cb -0.08 0.42 0.09 0.00 -1.10 0.00 0.00 41.96 41.28 3k2b s TYR 311 CO 0.27 -0.28 1.05 0.34 -2.51 0.00 0.00 175.55 174.43 3k2b s ASP 312 N -0.58 6.33 0.58 -0.18 -1.08 -1.26 -1.25 116.67 119.23 3k2b s ASP 312 Ca 0.01 -1.33 0.29 0.00 -0.52 0.00 0.00 52.55 51.00 3k2b s ASP 312 Cb -0.02 -2.43 1.58 0.00 -1.46 0.00 0.00 42.92 40.59 3k2b s ASP 312 CO -0.02 -1.34 1.88 -0.55 0.52 0.00 0.00 175.17 175.65 3k2b h ASN 313 N 9.37 0.00 0.00 -0.34 -1.07 -1.91 0.17 115.58 121.81 3k2b h ASN 313 Ca -0.12 0.00 -0.17 0.00 0.07 0.00 0.00 56.30 56.08 3k2b h ASN 313 Cb 1.05 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 37.28 3k2b h ASN 313 CO 1.18 0.00 -1.48 -0.62 0.07 0.00 0.00 177.43 176.58 3k2b n GLU 314 N -2.73 0.54 -0.03 4.14 1.02 -1.26 -4.36 120.64 117.96 3k2b n GLU 314 Ca -0.02 0.27 -0.14 0.00 -0.02 0.00 0.00 57.16 57.25 3k2b n GLU 314 Cb 0.29 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.11 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 -1.00 0.20 0.13 -0.32 2.91 -1.87 -2.77 115.95 113.23 3k2b h TRP 315 Ca -0.25 -0.10 0.02 0.00 1.13 0.00 0.00 58.89 59.69 3k2b h TRP 315 Cb 1.18 -0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 29.76 3k2b h TRP 315 CO -0.27 0.85 -0.38 0.78 -1.03 0.00 0.00 178.44 178.39 3k2b h GLY 316 N -0.51 -0.75 0.00 2.65 0.00 -0.74 0.33 103.07 104.05 3k2b h GLY 316 Ca -0.02 0.45 0.09 0.00 0.00 0.00 0.00 47.33 47.86 3k2b h GLY 316 CO 0.03 -0.26 -0.18 -1.82 0.00 0.00 0.00 176.54 174.31 3k2b h TYR 317 N -0.62 -0.43 -0.74 5.60 3.20 -1.66 -0.88 116.97 121.44 3k2b h TYR 317 Ca 0.02 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.94 3k2b h TYR 317 Cb 0.64 0.26 -0.04 0.00 1.54 0.00 0.00 36.73 39.13 3k2b h TYR 317 CO -0.33 -0.26 0.46 0.77 -1.64 0.00 0.00 178.16 177.16 3k2b h SER 318 N -0.08 0.86 -0.05 -2.11 0.02 -1.16 0.17 113.55 111.21 3k2b h SER 318 Ca 0.21 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3k2b h SER 318 Cb 0.41 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3k2b h SER 318 CO -0.50 0.65 -0.00 1.56 -1.14 0.00 0.00 176.83 177.40 3k2b h GLN 319 N 1.01 0.15 -0.21 3.45 1.08 0.42 -1.03 115.11 119.97 3k2b h GLN 319 Ca 0.27 -0.02 -0.18 0.00 -1.45 0.00 0.00 58.65 57.27 3k2b h GLN 319 Cb -0.07 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.33 3k2b h GLN 319 CO -0.05 0.17 -0.56 0.00 -0.95 0.00 0.00 178.83 177.44 3k2b h ARG 320 N 0.15 0.74 -0.24 1.46 2.47 0.10 -0.98 114.38 118.08 3k2b h ARG 320 Ca 0.04 -0.52 0.02 0.00 -1.26 0.00 0.00 59.98 58.25 3k2b h ARG 320 Cb 0.11 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 3k2b h ARG 320 CO 0.00 1.14 0.12 0.28 0.56 0.00 0.00 179.97 182.07 3k2b h VAL 321 N 0.47 0.99 -0.65 2.04 2.07 -0.27 0.51 116.25 121.41 3k2b h VAL 321 Ca -0.01 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.46 3k2b h VAL 321 Cb 1.17 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 3k2b h VAL 321 CO 0.12 0.05 0.43 0.58 0.02 0.00 0.00 177.57 178.76 3k2b h VAL 322 N 0.25 1.07 -0.42 2.57 2.07 -1.15 0.18 116.25 120.82 3k2b h VAL 322 Ca 0.10 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 3k2b h VAL 322 Cb 0.03 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 3k2b h VAL 322 CO -0.07 0.14 0.00 0.44 0.02 0.00 0.00 177.57 178.10 3k2b h ASP 323 N 0.75 0.73 0.72 0.57 3.32 0.53 -1.74 116.42 121.29 3k2b h ASP 323 Ca 0.26 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3k2b h ASP 323 Cb 0.11 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.47 3k2b h ASP 323 CO -0.07 0.85 -0.34 0.25 -1.72 0.00 0.00 179.24 178.21 3k2b h LEU 324 N 0.58 -0.81 -1.64 1.55 5.85 0.11 -1.82 115.31 119.12 3k2b h LEU 324 Ca 0.12 0.01 0.27 0.00 0.84 0.00 0.00 57.88 59.12 3k2b h LEU 324 Cb 0.48 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 3k2b h LEU 324 CO 0.02 -0.54 0.69 0.00 -0.34 0.00 0.00 178.44 178.27 3k2b h ALA 325 N -0.77 2.52 -0.52 1.25 0.00 -1.01 0.70 119.26 121.42 3k2b h ALA 325 Ca -0.10 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3k2b h ALA 325 Cb 0.75 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3k2b h ALA 325 CO 0.16 -0.86 -0.09 -0.44 0.00 0.00 0.00 179.25 178.02 3k2b h ASP 326 N 0.24 0.98 0.48 0.00 5.19 -0.85 0.46 116.42 122.92 3k2b h ASP 326 Ca 0.53 -0.35 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 3k2b h ASP 326 Cb 1.63 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.88 3k2b h ASP 326 CO -0.16 1.10 -0.23 0.40 -3.12 0.00 0.00 179.24 177.23 3k2b h ILE 327 N 0.85 0.51 -0.57 0.35 2.04 0.11 0.34 117.51 121.14 3k2b h ILE 327 Ca 0.14 -0.18 0.17 0.00 1.00 0.00 0.00 64.86 65.98 3k2b h ILE 327 Cb 0.65 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 3k2b h ILE 327 CO 0.04 0.03 0.53 0.58 0.00 0.00 0.00 178.15 179.33 3k2b h VAL 328 N -0.75 0.42 0.12 1.67 2.07 -0.73 0.97 116.25 120.02 3k2b h VAL 328 Ca -0.07 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 3k2b h VAL 328 Cb 0.55 0.60 0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3k2b h VAL 328 CO 0.11 0.00 -0.77 0.00 0.02 0.00 0.00 177.57 176.93 3k2b h ALA 329 N 1.48 -0.05 0.00 1.67 0.00 0.15 -3.16 119.26 119.35 3k2b h ALA 329 Ca 0.27 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3k2b h ALA 329 Cb 1.32 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.24 3k2b h ALA 329 CO -0.00 0.37 0.00 0.09 0.00 0.00 0.00 179.25 179.71 3k2b n ASN 330 N -4.17 0.00 -0.29 0.00 5.03 0.11 -2.49 115.26 113.45 3k2b n ASN 330 Ca -0.15 -0.17 0.03 0.00 0.87 0.00 0.00 54.58 55.16 3k2b n ASN 330 Cb 0.78 -0.24 0.08 0.00 -1.02 0.00 0.00 39.78 39.38 3k2b n ASN 330 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3k2b n ASN 331 N -1.24 2.45 -4.75 6.41 3.02 -0.33 -5.03 115.26 115.79 3k2b n ASN 331 Ca 0.12 -2.09 -0.41 0.00 -0.03 0.00 0.00 54.58 52.18 3k2b n ASN 331 Cb 0.17 -0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 3k2b n ASN 331 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3k2b s TRP 332 N -1.15 3.18 0.00 3.10 -0.11 -1.04 -4.69 118.94 118.23 3k2b s TRP 332 Ca 0.12 1.27 0.00 0.00 1.22 0.00 0.00 56.10 58.71 3k2b s TRP 332 Cb 0.07 -3.64 0.00 0.00 -1.50 0.00 0.00 33.47 28.40 3k2b s TRP 332 CO 0.07 -1.93 0.46 1.63 -4.62 0.00 0.00 176.95 172.56