#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2b n LYS 0 N 0.00 0.00 -2.43 0.00 0.00 -1.26 -4.79 118.16 109.68 3k2b n LYS 0 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 58.31 57.93 3k2b n LYS 0 Cb 0.00 -0.67 -0.03 0.00 0.00 0.00 0.00 35.03 34.33 3k2b n LYS 0 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3k2b s LEU 1 N -3.90 3.38 0.09 3.14 2.96 -1.17 -4.90 118.68 118.28 3k2b s LEU 1 Ca 0.00 -1.11 -0.31 0.00 -0.22 0.00 0.00 54.13 52.50 3k2b s LEU 1 Cb 0.00 -2.57 -0.17 0.00 0.50 0.00 0.00 46.19 43.96 3k2b s LEU 1 CO 0.00 -1.84 0.71 0.29 -1.32 0.00 0.00 176.35 174.19 3k2b n LYS 2 N 8.95 0.00 -4.33 1.98 4.76 -1.26 -3.62 118.16 124.64 3k2b n LYS 2 Ca 0.31 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.55 3k2b n LYS 2 Cb 0.50 -1.12 -0.13 0.00 -1.84 0.00 0.00 35.03 32.44 3k2b n LYS 2 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3k2b s VAL 3 N -0.45 1.17 0.44 -0.18 1.01 -0.76 -2.69 120.40 118.94 3k2b s VAL 3 Ca 0.70 -1.10 0.06 0.00 0.00 0.00 0.00 61.98 61.64 3k2b s VAL 3 Cb -0.99 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 3k2b s VAL 3 CO 0.51 -0.04 0.15 0.00 0.00 0.00 0.00 175.10 175.72 3k2b s ALA 4 N -0.95 3.68 -0.11 5.51 0.00 -0.24 -1.81 121.76 127.84 3k2b s ALA 4 Ca 0.01 -1.83 -0.03 0.00 0.00 0.00 0.00 51.96 50.11 3k2b s ALA 4 Cb -0.08 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.81 3k2b s ALA 4 CO 0.02 -0.17 0.07 0.42 0.00 0.00 0.00 175.76 176.10 3k2b s ILE 5 N -2.67 -0.09 -0.20 0.00 1.01 -0.22 -1.99 121.20 117.03 3k2b s ILE 5 Ca 0.35 0.13 -0.02 0.00 0.00 0.00 0.00 60.65 61.11 3k2b s ILE 5 Cb 0.04 -0.37 0.00 0.00 0.01 0.00 0.00 42.46 42.15 3k2b s ILE 5 CO 0.19 -0.05 -0.11 0.21 0.00 0.00 0.00 174.94 175.18 3k2b s ASN 6 N 2.15 3.83 0.00 3.58 2.47 -0.33 0.14 114.94 126.79 3k2b s ASN 6 Ca 0.03 -0.50 0.00 0.00 0.42 0.00 0.00 52.86 52.82 3k2b s ASN 6 Cb -0.14 -1.63 0.00 0.00 -1.45 0.00 0.00 41.25 38.03 3k2b s ASN 6 CO -0.06 -0.01 0.00 0.61 -3.72 0.00 0.00 177.10 173.92 3k2b n GLY 7 N 4.73 -1.34 2.64 1.21 0.00 -1.23 0.13 105.19 111.33 3k2b n GLY 7 Ca -0.19 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 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 0.28 3.09 -0.03 1.61 7.35 -1.26 -4.27 117.46 124.23 3k2b n PHE 8 Ca 0.00 -2.61 0.00 0.00 -0.76 0.00 0.00 57.45 54.08 3k2b n PHE 8 Cb 0.00 -1.07 0.00 0.00 0.35 0.00 0.00 39.48 38.76 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 -0.65 1.22 0.00 7.13 0.00 -1.26 -4.61 105.19 107.02 3k2b n GLY 9 Ca 0.54 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 0.00 -0.29 1.61 5.12 -1.26 -2.76 116.66 119.08 3k2b n ARG 10 Ca 0.00 0.52 0.11 0.00 -1.93 0.00 0.00 57.85 56.55 3k2b n ARG 10 Cb 0.00 -1.49 0.25 0.00 -1.16 0.00 0.00 32.46 30.06 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 0.32 -0.56 0.55 1.08 -1.93 -2.09 117.51 114.88 3k2b h ILE 11 Ca 0.00 -0.06 0.11 0.00 -0.39 0.00 0.00 64.86 64.52 3k2b h ILE 11 Cb 0.00 0.12 -0.11 0.00 -3.07 0.00 0.00 36.82 33.76 3k2b h ILE 11 CO 0.00 0.03 -0.17 1.23 -0.69 0.00 0.00 178.15 178.55 3k2b h GLY 12 N 0.18 0.32 2.00 5.37 0.00 -1.74 0.75 103.07 109.96 3k2b h GLY 12 Ca 0.51 0.23 -0.06 0.00 0.00 0.00 0.00 47.33 48.01 3k2b h GLY 12 CO -0.66 -0.22 -0.29 3.21 0.00 0.00 0.00 176.54 178.58 3k2b h ARG 13 N -0.04 0.00 0.00 4.80 3.08 -1.23 -3.06 114.38 117.93 3k2b h ARG 13 Ca 0.27 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.25 3k2b h ARG 13 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3k2b h ARG 13 CO -0.60 0.29 -0.30 -0.97 -1.07 0.00 0.00 179.97 177.32 3k2b h ASN 14 N 0.00 0.00 0.09 7.04 -0.73 -0.46 -2.35 115.58 119.17 3k2b h ASN 14 Ca -0.00 0.00 -0.27 0.00 1.87 0.00 0.00 56.30 57.90 3k2b h ASN 14 Cb 1.18 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.79 3k2b h ASN 14 CO 0.04 0.30 -1.09 0.15 -0.37 0.00 0.00 177.43 176.46 3k2b h PHE 15 N 0.00 0.98 0.00 0.67 3.57 -0.82 -2.57 116.94 118.77 3k2b h PHE 15 Ca -0.00 -0.56 -0.10 0.00 3.53 0.00 0.00 57.97 60.84 3k2b h PHE 15 Cb 0.72 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 3k2b h PHE 15 CO 0.00 1.39 -0.46 1.25 -2.23 0.00 0.00 178.31 178.27 3k2b h LEU 16 N 0.34 0.00 -0.05 0.59 6.46 -1.52 -1.28 115.31 119.86 3k2b h LEU 16 Ca -0.14 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.53 3k2b h LEU 16 Cb 1.75 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.68 3k2b h LEU 16 CO 0.21 0.46 -0.31 0.03 -0.62 0.00 0.00 178.44 178.21 3k2b h ARG 17 N 0.00 0.30 -0.44 1.25 2.47 -1.42 -1.84 114.38 114.70 3k2b h ARG 17 Ca -0.00 -0.26 -0.03 0.00 -1.26 0.00 0.00 59.98 58.43 3k2b h ARG 17 Cb 0.88 0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 29.23 3k2b h ARG 17 CO 0.06 0.91 0.14 0.00 0.56 0.00 0.00 179.97 181.65 3k2b h TRP 18 N 0.58 -0.11 0.00 0.00 7.01 -1.28 -2.22 115.95 119.93 3k2b h TRP 18 Ca 0.14 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 3k2b h TRP 18 Cb 0.25 0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.37 3k2b h TRP 18 CO 0.01 -0.07 -0.09 1.25 -2.79 0.00 0.00 178.44 176.74 3k2b h HIS 18 N -0.05 0.00 0.12 2.65 2.76 -1.25 -2.23 115.15 117.16 3k2b h HIS 18 Ca 0.04 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 57.93 3k2b h HIS 18 Cb 0.11 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.09 3k2b h HIS 18 CO -0.15 0.09 -1.22 0.78 -1.30 0.00 0.00 177.93 176.13 3k2b h GLY 19 N 0.39 0.45 -6.01 5.26 0.00 -1.30 -3.46 103.07 98.39 3k2b h GLY 19 Ca -0.00 -1.04 -0.77 0.00 0.00 0.00 0.00 47.33 45.52 3k2b h GLY 19 CO 0.01 0.91 0.25 0.54 0.00 0.00 0.00 176.54 178.25 3k2b n ARG 20 N -3.65 0.29 -1.18 4.80 5.12 -0.84 -4.73 116.66 116.47 3k2b n ARG 20 Ca -0.10 0.10 -0.39 0.00 -1.93 0.00 0.00 57.85 55.53 3k2b n ARG 20 Cb 0.99 -1.64 -0.04 0.00 -1.16 0.00 0.00 32.46 30.61 3k2b n ARG 20 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3k2b n LYS 21 N 2.15 1.93 -1.16 5.56 5.02 -1.26 -4.66 118.16 125.75 3k2b n LYS 21 Ca 0.21 -1.92 0.00 0.00 -2.02 0.00 0.00 58.31 54.58 3k2b n LYS 21 Cb 0.09 -2.89 0.00 0.00 -0.02 0.00 0.00 35.03 32.21 3k2b n LYS 21 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3k2b n ASP 22 N 6.47 -6.60 -3.89 4.39 4.64 -1.26 -5.10 116.55 115.19 3k2b n ASP 22 Ca 0.50 0.87 -0.09 0.00 -1.38 0.00 0.00 54.79 54.69 3k2b n ASP 22 Cb 0.34 -2.95 -0.08 0.00 -1.04 0.00 0.00 41.12 37.39 3k2b n ASP 22 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3k2b s SER 23 N -2.18 0.14 0.00 1.67 1.04 -1.26 -5.02 113.70 108.09 3k2b s SER 23 Ca 0.00 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.86 3k2b s SER 23 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 3k2b s SER 23 CO 0.00 -0.61 0.05 -2.65 0.98 0.00 0.00 173.24 171.01 3k2b n PRO 24 N 0.37 0.05 -4.17 4.02 -0.02 -1.26 -2.58 135.00 131.42 3k2b n PRO 24 Ca -0.17 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.06 3k2b n PRO 24 Cb 0.60 -1.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.02 3k2b n PRO 24 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k2b s LEU 25 N -0.89 3.55 -0.38 2.45 1.43 -1.26 -3.05 118.68 120.54 3k2b s LEU 25 Ca 0.00 -0.33 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 3k2b s LEU 25 Cb 0.00 -2.14 0.18 0.00 0.03 0.00 0.00 46.19 44.26 3k2b s LEU 25 CO 0.00 0.03 0.60 -0.62 0.23 0.00 0.00 176.35 176.60 3k2b s ASP 26 N -3.36 -1.39 0.13 2.29 3.68 -1.24 -3.90 116.67 112.89 3k2b s ASP 26 Ca 0.30 -0.59 -0.31 0.00 2.13 0.00 0.00 52.55 54.08 3k2b s ASP 26 Cb -0.09 1.90 -0.09 0.00 -1.45 0.00 0.00 42.92 43.20 3k2b s ASP 26 CO 0.22 -0.21 1.49 -0.51 0.13 0.00 0.00 175.17 176.29 3k2b s ILE 27 N 2.06 2.99 0.00 4.11 2.07 -1.26 -1.82 121.20 129.35 3k2b s ILE 27 Ca 0.15 0.68 0.00 0.00 -1.41 0.00 0.00 60.65 60.07 3k2b s ILE 27 Cb -0.06 -3.44 0.00 0.00 0.13 0.00 0.00 42.46 39.09 3k2b s ILE 27 CO -0.12 0.05 0.00 0.00 -1.91 0.00 0.00 174.94 172.96 3k2b n ILE 28 N 4.06 0.00 -4.79 2.00 3.06 -0.75 -4.85 119.36 118.09 3k2b n ILE 28 Ca 0.13 -0.06 -0.25 0.00 -2.50 0.00 0.00 62.75 60.07 3k2b n ILE 28 Cb 0.40 0.44 -0.15 0.00 0.54 0.00 0.00 39.64 40.88 3k2b n ILE 28 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3k2b s ALA 29 N -1.11 1.53 -0.05 1.51 0.00 -1.23 -1.76 121.76 120.64 3k2b s ALA 29 Ca 0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 3k2b s ALA 29 Cb 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 23.12 22.79 3k2b s ALA 29 CO 0.00 0.36 0.07 0.42 0.00 0.00 0.00 175.76 176.61 3k2b s ILE 30 N -0.53 -0.12 -1.18 0.00 1.01 -1.26 -1.06 121.20 118.07 3k2b s ILE 30 Ca 0.07 0.38 -0.08 0.00 0.00 0.00 0.00 60.65 61.02 3k2b s ILE 30 Cb -0.07 -0.19 0.23 0.00 0.01 0.00 0.00 42.46 42.44 3k2b s ILE 30 CO -0.00 0.15 1.54 -3.20 0.00 0.00 0.00 174.94 173.43 3k2b n ASN 31 N 5.30 5.63 -4.55 3.58 5.15 0.38 0.14 115.26 130.89 3k2b n ASN 31 Ca -0.03 -3.18 -0.43 0.00 -0.60 0.00 0.00 54.58 50.34 3k2b n ASN 31 Cb 0.50 -1.41 -0.03 0.00 -0.53 0.00 0.00 39.78 38.31 3k2b n ASN 31 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3k2b s ASP 32 N 0.42 6.42 0.00 1.20 -1.08 -1.26 -3.55 116.67 118.82 3k2b s ASP 32 Ca 0.36 -0.06 0.00 0.00 -0.52 0.00 0.00 52.55 52.33 3k2b s ASP 32 Cb 0.03 -2.49 0.00 0.00 -1.46 0.00 0.00 42.92 39.00 3k2b s ASP 32 CO 0.02 -1.29 0.35 0.41 0.52 0.00 0.00 175.17 175.18 3k2b n THR 33 N 6.45 0.00 -3.99 1.71 -1.04 -1.26 -4.47 114.28 111.68 3k2b n THR 33 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 3k2b n THR 33 Cb 0.48 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.07 3k2b n THR 33 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k2b n GLY 34 N -0.84 4.21 0.00 3.41 0.00 -1.26 -5.01 105.19 105.70 3k2b n GLY 34 Ca 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.93 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 3.97 -2.48 0.08 -0.02 0.00 -1.26 -4.88 105.19 100.61 3k2b n GLY 36 Ca 0.00 -1.42 -0.11 0.00 0.00 0.00 0.00 46.02 44.49 3k2b n GLY 36 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k2b h VAL 37 N -1.35 1.43 0.07 1.61 2.07 -1.95 -3.19 116.25 114.95 3k2b h VAL 37 Ca 0.00 -3.12 -0.00 0.00 0.82 0.00 0.00 66.70 64.39 3k2b h VAL 37 Cb 0.00 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 3k2b h VAL 37 CO 0.00 0.86 -0.03 0.11 0.02 0.00 0.00 177.57 178.53 3k2b h LYS 38 N 0.03 -0.09 -1.00 1.57 1.57 -1.97 -2.42 116.57 114.26 3k2b h LYS 38 Ca -0.12 0.01 0.21 0.00 -1.87 0.00 0.00 60.65 58.88 3k2b h LYS 38 Cb 1.90 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 34.12 3k2b h LYS 38 CO 0.14 0.39 0.62 1.96 -0.57 0.00 0.00 179.45 181.99 3k2b h GLN 39 N -0.61 0.63 0.00 3.15 4.20 -1.93 1.71 115.11 122.26 3k2b h GLN 39 Ca -0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3k2b h GLN 39 Cb 0.52 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3k2b h GLN 39 CO 0.02 0.42 -0.12 0.00 -0.67 0.00 0.00 178.83 178.47 3k2b n ALA 40 N -2.36 2.40 -0.09 3.87 0.00 -1.21 -2.91 120.51 120.23 3k2b n ALA 40 Ca 0.24 -0.06 -0.23 0.00 0.00 0.00 0.00 53.44 53.39 3k2b n ALA 40 Cb 0.66 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.58 3k2b n ALA 40 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3k2b n SER 41 N -2.25 1.97 0.20 0.00 2.88 0.23 -4.05 113.62 112.60 3k2b n SER 41 Ca 0.05 0.28 -0.12 0.00 -1.33 0.00 0.00 58.87 57.75 3k2b n SER 41 Cb 0.43 -0.84 -0.07 0.00 -0.75 0.00 0.00 64.21 62.98 3k2b n SER 41 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 3k2b h HIS 42 N -0.59 -0.52 0.00 0.66 6.17 0.20 -2.19 115.15 118.88 3k2b h HIS 42 Ca -0.47 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 60.60 3k2b h HIS 42 Cb 1.64 0.17 0.00 0.00 2.52 0.00 0.00 27.41 31.74 3k2b h HIS 42 CO 0.05 -0.20 0.00 1.28 0.71 0.00 0.00 177.93 179.77 3k2b n LEU 43 N -5.18 0.00 -0.23 0.26 4.77 -1.14 -0.43 117.00 115.05 3k2b n LEU 43 Ca -0.09 0.28 0.05 0.00 -0.03 0.00 0.00 56.01 56.22 3k2b n LEU 43 Cb 0.29 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3k2b n LEU 43 CO 0.27 -0.23 0.20 -0.11 -1.33 0.00 0.00 177.39 176.18 3k2b n LEU 44 N -1.28 1.21 -0.08 2.23 7.94 -1.17 -4.55 117.00 121.31 3k2b n LEU 44 Ca 0.02 -0.74 -0.11 0.00 -1.11 0.00 0.00 56.01 54.08 3k2b n LEU 44 Cb 0.04 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.91 3k2b n LEU 44 CO 0.04 0.24 -1.01 1.17 -1.11 0.00 0.00 177.39 176.73 3k2b n LYS 45 N -0.33 0.51 -4.05 1.96 3.00 0.43 -4.81 118.16 114.87 3k2b n LYS 45 Ca 0.04 0.08 -0.32 0.00 -0.00 0.00 0.00 58.31 58.11 3k2b n LYS 45 Cb 0.23 -1.31 -0.15 0.00 0.00 0.00 0.00 35.03 33.80 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 -2.31 3.26 -0.12 5.64 2.02 0.31 -0.59 117.35 125.55 3k2b s TYR 46 Ca -0.20 -2.24 0.02 0.00 -0.37 0.00 0.00 57.07 54.28 3k2b s TYR 46 Cb 0.05 -1.96 -0.01 0.00 -0.40 0.00 0.00 41.96 39.65 3k2b s TYR 46 CO 0.37 -0.87 -0.18 0.34 -1.57 0.00 0.00 175.55 173.64 3k2b s ASP 47 N 1.13 3.55 0.10 2.29 -1.08 0.36 -4.45 116.67 118.56 3k2b s ASP 47 Ca -0.08 -0.44 -0.21 0.00 -0.52 0.00 0.00 52.55 51.30 3k2b s ASP 47 Cb -0.20 -1.51 -0.10 0.00 -1.46 0.00 0.00 42.92 39.66 3k2b s ASP 47 CO -0.05 0.16 1.69 0.28 0.52 0.00 0.00 175.17 177.78 3k2b h SER 48 N 6.72 0.20 0.25 -0.34 0.02 -1.95 0.82 113.55 119.27 3k2b h SER 48 Ca -0.23 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.62 3k2b h SER 48 Cb 1.23 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.72 3k2b h SER 48 CO 0.51 0.23 -0.12 0.74 -1.14 0.00 0.00 176.83 177.05 3k2b h THR 49 N 0.15 0.76 -0.33 -2.27 2.02 -2.01 -3.23 112.91 107.99 3k2b h THR 49 Ca 0.06 -0.76 0.00 0.00 0.77 0.00 0.00 66.41 66.47 3k2b h THR 49 Cb 0.08 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3k2b h THR 49 CO -0.01 0.15 0.00 0.18 0.37 0.00 0.00 175.52 176.21 3k2b n LEU 50 N -5.06 1.98 0.00 2.58 4.77 -1.24 -5.04 117.00 114.99 3k2b n LEU 50 Ca -0.09 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 3k2b n LEU 50 Cb 0.26 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3k2b n LEU 50 CO 0.29 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 3k2b n GLY 51 N 0.96 0.76 3.68 -0.72 0.00 0.29 -4.76 105.19 105.39 3k2b n GLY 51 Ca 0.12 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 3k2b n GLY 51 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k2b s ILE 52 N 0.00 2.18 -0.16 -0.61 -4.36 -1.26 -0.49 121.20 116.51 3k2b s ILE 52 Ca 0.00 0.06 0.00 0.00 -0.26 0.00 0.00 60.65 60.45 3k2b s ILE 52 Cb 0.00 -2.53 0.03 0.00 1.25 0.00 0.00 42.46 41.20 3k2b s ILE 52 CO 0.00 -0.08 -0.14 -0.36 0.24 0.00 0.00 174.94 174.60 3k2b s PHE 53 N -2.94 2.26 -1.16 1.37 2.99 0.24 -4.82 117.98 115.92 3k2b s PHE 53 Ca 0.65 -1.32 -0.22 0.00 0.00 0.00 0.00 56.93 56.04 3k2b s PHE 53 Cb -0.19 -1.63 -0.05 0.00 0.00 0.00 0.00 43.02 41.15 3k2b s PHE 53 CO 0.58 -0.69 1.89 0.34 -0.00 0.00 0.00 175.22 177.33 3k2b s ASP 54 N 1.46 5.39 0.00 1.36 2.15 -1.26 -4.57 116.67 121.19 3k2b s ASP 54 Ca 0.04 -1.65 0.00 0.00 0.43 0.00 0.00 52.55 51.37 3k2b s ASP 54 Cb -0.13 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 3k2b s ASP 54 CO -0.11 -2.68 0.00 0.00 -0.17 0.00 0.00 175.17 172.22 3k2b n ALA 55 N 13.18 0.00 -1.24 3.66 0.00 -1.26 -5.10 120.51 129.75 3k2b n ALA 55 Ca 0.44 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.53 3k2b n ALA 55 Cb 0.47 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.79 3k2b n ALA 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3k2b n ASP 56 N 0.00 0.27 -4.43 0.00 9.92 -1.26 -4.75 116.55 116.30 3k2b n ASP 56 Ca 0.00 0.18 -0.39 0.00 -0.53 0.00 0.00 54.79 54.05 3k2b n ASP 56 Cb 0.00 -0.77 -0.12 0.00 -0.64 0.00 0.00 41.12 39.60 3k2b n ASP 56 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3k2b s VAL 57 N 7.35 4.59 0.17 2.53 1.01 -1.26 -2.73 120.40 132.06 3k2b s VAL 57 Ca 1.13 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.65 3k2b s VAL 57 Cb -1.06 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 31.93 3k2b s VAL 57 CO 0.42 0.03 0.11 2.29 0.00 0.00 0.00 175.10 177.94 3k2b n LYS 58 N 4.98 0.40 -2.73 2.72 2.85 -0.59 -4.92 118.16 120.87 3k2b n LYS 58 Ca -0.14 -1.60 -0.23 0.00 -1.05 0.00 0.00 58.31 55.30 3k2b n LYS 58 Cb 0.49 1.15 0.03 0.00 -0.65 0.00 0.00 35.03 36.04 3k2b n LYS 58 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 3k2b s PRO 59 N -2.68 2.78 -0.34 -1.58 0.04 -1.26 -0.68 135.00 131.27 3k2b s PRO 59 Ca 0.16 -0.56 0.01 0.00 0.04 0.00 0.00 61.00 60.65 3k2b s PRO 59 Cb 0.01 -2.48 0.14 0.00 0.04 0.00 0.00 34.50 32.21 3k2b s PRO 59 CO 0.11 -0.56 0.28 -1.12 0.04 0.00 0.00 177.00 175.75 3k2b s SER 60 N -4.33 2.08 1.34 6.66 0.01 -0.92 -4.05 113.70 114.49 3k2b s SER 60 Ca 0.53 -1.57 0.00 0.00 1.31 0.00 0.00 55.95 56.22 3k2b s SER 60 Cb -0.10 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.29 3k2b s SER 60 CO 0.39 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.33 3k2b n GLY 60 N 4.50 2.97 0.34 3.44 0.00 -1.26 -2.88 105.19 112.30 3k2b n GLY 60 Ca 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 12.67 0.00 0.00 1.61 1.02 -1.26 -4.87 120.64 129.81 3k2b n GLU 61 Ca 0.00 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 56.85 3k2b n GLU 61 Cb 0.00 -0.17 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 3k2b n GLU 61 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3k2b n THR 62 N 0.00 0.00 -4.17 2.62 5.66 -1.25 -4.89 114.28 112.26 3k2b n THR 62 Ca 0.00 -0.12 -0.16 0.00 -3.05 0.00 0.00 64.05 60.72 3k2b n THR 62 Cb 0.55 1.24 -0.05 0.00 -1.55 0.00 0.00 70.33 70.51 3k2b n THR 62 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3k2b n ALA 63 N -0.17 0.32 -2.45 1.79 0.00 -1.14 0.11 120.51 118.97 3k2b n ALA 63 Ca 0.00 -1.62 -0.09 0.00 0.00 0.00 0.00 53.44 51.73 3k2b n ALA 63 Cb 0.06 1.31 -0.08 0.00 0.00 0.00 0.00 19.45 20.74 3k2b n ALA 63 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3k2b s ILE 64 N -3.05 0.12 -0.11 0.00 -4.36 0.39 -2.16 121.20 112.04 3k2b s ILE 64 Ca 0.32 -1.49 -0.04 0.00 -0.26 0.00 0.00 60.65 59.18 3k2b s ILE 64 Cb 0.01 -1.67 -0.04 0.00 1.25 0.00 0.00 42.46 42.02 3k2b s ILE 64 CO 0.23 -0.56 0.06 -0.55 0.24 0.00 0.00 174.94 174.36 3k2b s SER 65 N -2.94 5.69 -0.42 4.36 0.15 0.14 -1.65 113.70 119.03 3k2b s SER 65 Ca 0.13 0.25 0.04 0.00 0.70 0.00 0.00 55.95 57.07 3k2b s SER 65 Cb 0.05 -1.75 0.17 0.00 -1.71 0.00 0.00 66.02 62.79 3k2b s SER 65 CO -0.05 0.36 0.40 -0.69 1.20 0.00 0.00 173.24 174.47 3k2b s VAL 66 N -0.78 0.04 -0.65 4.45 1.01 0.22 -1.54 120.40 123.15 3k2b s VAL 66 Ca 0.13 -2.18 -0.04 0.00 0.00 0.00 0.00 61.98 59.88 3k2b s VAL 66 Cb -0.12 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.29 3k2b s VAL 66 CO 0.03 -0.96 0.57 0.47 0.00 0.00 0.00 175.10 175.21 3k2b n ASP 67 N 3.03 -4.01 0.00 3.32 9.92 -1.11 -3.17 116.55 124.52 3k2b n ASP 67 Ca 0.25 -0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 3k2b n ASP 67 Cb 0.49 -2.69 0.00 0.00 -0.64 0.00 0.00 41.12 38.28 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 -1.22 2.79 3.61 0.44 0.00 -1.26 -4.99 105.19 104.56 3k2b n GLY 68 Ca -0.00 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 3k2b n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k2b s LYS 69 N 0.00 3.41 -1.07 1.61 2.20 -1.19 -4.90 119.74 119.80 3k2b s LYS 69 Ca 0.00 1.99 -0.04 0.00 -0.36 0.00 0.00 55.97 57.56 3k2b s LYS 69 Cb 0.00 -4.27 0.31 0.00 -1.51 0.00 0.00 37.83 32.36 3k2b s LYS 69 CO 0.00 -1.78 1.53 0.44 -0.36 0.00 0.00 175.35 175.18 3k2b n ILE 70 N 7.18 5.44 -1.69 5.43 -0.00 -1.25 0.73 119.36 135.20 3k2b n ILE 70 Ca 0.26 -5.95 -0.40 0.00 -0.00 0.00 0.00 62.75 56.66 3k2b n ILE 70 Cb 0.45 -2.00 0.03 0.00 -0.00 0.00 0.00 39.64 38.11 3k2b n ILE 70 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3k2b n ILE 71 N 1.12 3.16 -0.55 7.28 0.00 -0.66 -4.46 119.36 125.26 3k2b n ILE 71 Ca 0.29 -0.50 -0.30 0.00 0.00 0.00 0.00 62.75 62.24 3k2b n ILE 71 Cb 0.32 -1.49 0.27 0.00 0.00 0.00 0.00 39.64 38.75 3k2b n ILE 71 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 3k2b s GLN 72 N -2.51 -2.34 -0.45 9.51 2.00 -0.72 -0.46 119.66 124.68 3k2b s GLN 72 Ca 0.67 0.18 0.07 0.00 -2.00 0.00 0.00 55.36 54.28 3k2b s GLN 72 Cb -0.47 -1.44 0.18 0.00 0.80 0.00 0.00 33.01 32.08 3k2b s GLN 72 CO 0.53 -4.50 0.62 0.08 -0.50 0.00 0.00 175.29 171.52 3k2b s VAL 73 N -2.45 -0.80 0.00 1.34 1.01 0.30 -4.07 120.40 115.73 3k2b s VAL 73 Ca 0.69 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.88 3k2b s VAL 73 Cb -0.14 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.05 3k2b s VAL 73 CO 0.58 -0.18 0.00 1.33 0.00 0.00 0.00 175.10 176.83 3k2b n VAL 74 N 3.62 0.00 0.00 2.92 0.24 0.12 -4.42 118.33 120.81 3k2b n VAL 74 Ca 0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.46 3k2b n VAL 74 Cb 0.54 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.44 3k2b n VAL 74 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3k2b n SER 75 N 0.00 0.00 -3.65 -1.34 2.88 -1.26 -4.01 113.62 106.25 3k2b n SER 75 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3k2b n SER 75 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 3k2b n SER 75 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 3k2b s ASN 76 N 0.00 -0.79 0.35 -3.46 3.84 -1.26 -5.01 114.94 108.60 3k2b s ASN 76 Ca 0.00 1.40 0.26 0.00 0.21 0.00 0.00 52.86 54.73 3k2b s ASN 76 Cb 0.00 1.35 0.82 0.00 -0.55 0.00 0.00 41.25 42.87 3k2b s ASN 76 CO 0.00 -0.23 1.76 0.03 -2.79 0.00 0.00 177.10 175.86 3k2b h ARG 77 N 5.99 0.00 -4.75 0.43 3.08 -1.98 -3.42 114.38 113.73 3k2b h ARG 77 Ca -0.30 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.05 3k2b h ARG 77 Cb 1.19 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.05 3k2b h ARG 77 CO 0.12 0.00 -0.28 1.21 -1.07 0.00 0.00 179.97 179.95 3k2b s ASN 78 N -5.17 6.17 0.44 7.04 3.84 -1.26 -4.97 114.94 121.03 3k2b s ASN 78 Ca 0.07 -0.73 0.17 0.00 0.21 0.00 0.00 52.86 52.57 3k2b s ASN 78 Cb 0.09 -2.20 1.10 0.00 -0.55 0.00 0.00 41.25 39.68 3k2b s ASN 78 CO 0.57 -0.53 1.94 -0.65 -2.79 0.00 0.00 177.10 175.64 3k2b h PRO 79 N 8.69 0.35 -0.00 0.43 0.11 -1.89 -2.21 132.00 137.47 3k2b h PRO 79 Ca -0.27 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 3k2b h PRO 79 Cb 1.11 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3k2b h PRO 79 CO 0.77 0.23 -0.24 0.66 -0.21 0.00 0.00 178.00 179.21 3k2b h SER 80 N 0.36 0.01 1.19 -2.05 4.64 -1.87 -2.46 113.55 113.37 3k2b h SER 80 Ca 0.34 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3k2b h SER 80 Cb 0.81 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3k2b h SER 80 CO -0.09 0.25 -0.03 0.18 -0.87 0.00 0.00 176.83 176.26 3k2b n LEU 81 N -4.25 0.40 -4.74 5.97 4.77 -0.83 -4.65 117.00 113.66 3k2b n LEU 81 Ca -0.02 0.51 -0.42 0.00 -0.03 0.00 0.00 56.01 56.05 3k2b n LEU 81 Cb 0.29 -0.40 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 3k2b n LEU 81 CO 0.37 -0.08 1.29 -0.76 -1.33 0.00 0.00 177.39 176.88 3k2b s LEU 82 N -3.72 4.36 -0.68 2.23 1.43 -0.93 -4.85 118.68 116.52 3k2b s LEU 82 Ca 0.12 2.89 -0.05 0.00 -1.03 0.00 0.00 54.13 56.07 3k2b s LEU 82 Cb 0.16 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.69 3k2b s LEU 82 CO 0.57 -0.93 2.04 -0.81 0.23 0.00 0.00 176.35 177.45 3k2b n PRO 83 N 3.00 1.75 0.11 1.29 -0.04 -1.26 -4.49 135.00 135.36 3k2b n PRO 83 Ca 0.12 -1.21 0.00 0.00 -0.04 0.00 0.00 63.50 62.37 3k2b n PRO 83 Cb 0.37 -2.29 -0.02 0.00 -0.04 0.00 0.00 33.50 31.52 3k2b n PRO 83 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k2b h TRP 84 N 6.05 0.00 -0.01 0.54 -0.00 -1.88 -3.05 115.95 117.60 3k2b h TRP 84 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.28 3k2b h TRP 84 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.43 3k2b h TRP 84 CO 1.86 0.62 -0.20 1.17 -0.00 0.00 0.00 178.44 181.89 3k2b n LYS 85 N -3.21 0.90 -0.13 0.49 4.81 0.75 -1.33 118.16 120.44 3k2b n LYS 85 Ca 0.00 -0.49 -0.21 0.00 -0.87 0.00 0.00 58.31 56.74 3k2b n LYS 85 Cb 0.79 -1.49 -0.12 0.00 0.02 0.00 0.00 35.03 34.24 3k2b n LYS 85 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3k2b n GLU 86 N -0.62 0.64 0.00 1.64 1.02 -1.22 -4.34 120.64 117.76 3k2b n GLU 86 Ca 0.13 0.17 0.14 0.00 -0.02 0.00 0.00 57.16 57.59 3k2b n GLU 86 Cb 0.33 -1.51 0.52 0.00 -0.02 0.00 0.00 31.44 30.76 3k2b n GLU 86 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3k2b n LEU 87 N -3.47 1.41 -1.09 -4.62 4.32 -1.15 -4.94 117.00 107.45 3k2b n LEU 87 Ca -0.48 -0.46 -0.11 0.00 -0.02 0.00 0.00 56.01 54.94 3k2b n LEU 87 Cb 0.97 -0.01 -0.02 0.00 -1.62 0.00 0.00 43.42 42.74 3k2b n LEU 87 CO 0.21 0.24 -0.13 0.61 -1.22 0.00 0.00 177.39 177.10 3k2b n GLY 88 N 1.19 0.35 3.65 -0.72 0.00 -1.10 -4.94 105.19 103.62 3k2b n GLY 88 Ca 0.18 -0.47 -0.55 0.00 0.00 0.00 0.00 46.02 45.18 3k2b n GLY 88 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k2b n ILE 89 N -3.57 0.16 -0.06 -0.61 2.08 -0.44 -4.82 119.36 112.09 3k2b n ILE 89 Ca -0.12 -0.03 -0.04 0.00 0.56 0.00 0.00 62.75 63.12 3k2b n ILE 89 Cb 0.52 -1.02 -0.01 0.00 -0.75 0.00 0.00 39.64 38.38 3k2b n ILE 89 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 3k2b h ASP 90 N 5.91 0.00 -3.21 4.38 3.32 -1.77 -3.15 116.42 121.91 3k2b h ASP 90 Ca -0.47 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 55.95 3k2b h ASP 90 Cb 1.33 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.53 3k2b h ASP 90 CO 0.87 0.67 -0.85 -0.51 -1.72 0.00 0.00 179.24 177.70 3k2b s ILE 91 N -2.10 1.79 -0.14 0.35 2.07 -1.18 0.57 121.20 122.56 3k2b s ILE 91 Ca -0.13 -0.81 -0.07 0.00 -1.41 0.00 0.00 60.65 58.23 3k2b s ILE 91 Cb 0.02 -1.61 -0.04 0.00 0.13 0.00 0.00 42.46 40.96 3k2b s ILE 91 CO 0.19 0.50 0.11 -0.69 -1.91 0.00 0.00 174.94 173.14 3k2b s VAL 92 N 0.97 5.27 -0.34 4.00 1.01 -0.21 -1.08 120.40 130.02 3k2b s VAL 92 Ca -0.05 0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.86 3k2b s VAL 92 Cb -0.15 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 3k2b s VAL 92 CO -0.03 0.55 0.60 -0.63 0.00 0.00 0.00 175.10 175.59 3k2b s ILE 93 N -0.49 4.93 -0.88 2.22 -1.09 -0.84 -2.36 121.20 122.70 3k2b s ILE 93 Ca 0.12 0.56 -0.23 0.00 -2.23 0.00 0.00 60.65 58.87 3k2b s ILE 93 Cb -0.12 -4.03 0.07 0.00 -1.58 0.00 0.00 42.46 36.80 3k2b s ILE 93 CO 0.02 -0.25 1.25 -1.61 -1.23 0.00 0.00 174.94 173.11 3k2b s GLU 94 N 2.60 3.43 -0.25 2.79 0.41 -1.19 -1.18 118.70 125.30 3k2b s GLU 94 Ca 0.23 -1.06 0.10 0.00 -0.41 0.00 0.00 54.97 53.83 3k2b s GLU 94 Cb -0.15 -4.82 0.45 0.00 -1.78 0.00 0.00 34.13 27.83 3k2b s GLU 94 CO 0.14 -2.02 1.19 0.41 -0.49 0.00 0.00 175.26 174.49 3k2b n GLY 95 N 5.97 5.42 0.06 -1.39 0.00 0.36 -2.81 105.19 112.79 3k2b n GLY 95 Ca 0.18 -2.08 0.03 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.76 0.69 -0.73 2.61 -2.24 -1.18 -4.13 114.28 108.54 3k2b n THR 96 Ca 0.32 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3k2b n THR 96 Cb 0.89 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 1.42 0.73 0.36 3.38 0.00 -1.26 -4.77 105.19 105.04 3k2b n GLY 97 Ca -0.13 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.00 0.41 -3.13 1.61 0.24 -1.26 -4.70 118.33 109.51 3k2b n VAL 98 Ca 0.00 -0.71 -0.22 0.00 -2.04 0.00 0.00 64.34 61.37 3k2b n VAL 98 Cb 0.00 0.89 -0.04 0.00 -1.47 0.00 0.00 33.84 33.21 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 0.33 1.68 1.12 6.34 3.72 -1.26 -4.89 117.46 124.49 3k2b n PHE 99 Ca 0.06 -3.88 0.12 0.00 -0.05 0.00 0.00 57.45 53.70 3k2b n PHE 99 Cb 0.26 -0.45 0.21 0.00 -0.94 0.00 0.00 39.48 38.57 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 0.31 0.00 -3.99 -4.37 0.24 -1.26 -4.02 118.33 105.23 3k2b n VAL 100 Ca 0.27 -0.13 -0.25 0.00 -2.04 0.00 0.00 64.34 62.19 3k2b n VAL 100 Cb 0.53 0.65 -0.03 0.00 -1.47 0.00 0.00 33.84 33.52 3k2b n VAL 100 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3k2b s ASP 101 N -2.62 6.10 0.32 -1.34 -1.08 -1.26 -1.65 116.67 115.14 3k2b s ASP 101 Ca 0.19 0.06 0.04 0.00 -0.52 0.00 0.00 52.55 52.32 3k2b s ASP 101 Cb 0.18 -1.76 0.64 0.00 -1.46 0.00 0.00 42.92 40.52 3k2b s ASP 101 CO 0.59 0.02 1.89 0.03 0.52 0.00 0.00 175.17 178.23 3k2b h ARG 102 N 1.95 0.87 -0.40 4.34 3.08 -1.91 0.26 114.38 122.58 3k2b h ARG 102 Ca -0.49 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.52 3k2b h ARG 102 Cb 1.21 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 3k2b h ARG 102 CO 0.65 0.58 0.25 1.49 -1.07 0.00 0.00 179.97 181.87 3k2b h GLU 103 N 0.90 0.50 -0.06 0.04 4.81 -1.97 1.44 114.58 120.24 3k2b h GLU 103 Ca 0.42 -0.03 -0.18 0.00 -0.13 0.00 0.00 59.36 59.44 3k2b h GLU 103 Cb 0.42 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.69 3k2b h GLU 103 CO -0.18 0.33 -0.68 0.78 -0.73 0.00 0.00 179.01 178.52 3k2b h GLY 104 N 0.52 0.63 2.00 1.92 0.00 -1.78 -3.15 103.07 103.21 3k2b h GLY 104 Ca 0.15 -0.99 0.00 0.00 0.00 0.00 0.00 47.33 46.49 3k2b h GLY 104 CO -0.04 0.88 0.00 0.00 0.00 0.00 0.00 176.54 177.38 3k2b h ALA 105 N 0.42 1.00 -0.06 3.60 0.00 -0.21 -2.75 119.26 121.26 3k2b h ALA 105 Ca -0.07 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.63 3k2b h ALA 105 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3k2b h ALA 105 CO 0.14 0.00 -0.82 0.78 0.00 0.00 0.00 179.25 179.35 3k2b h GLY 106 N 1.54 0.54 -0.10 0.00 0.00 0.20 -3.14 103.07 102.11 3k2b h GLY 106 Ca 0.00 -0.83 0.22 0.00 0.00 0.00 0.00 47.33 46.72 3k2b h GLY 106 CO 0.00 0.73 0.84 0.50 0.00 0.00 0.00 176.54 178.61 3k2b h LYS 107 N 0.31 0.00 0.39 4.80 1.57 -1.53 0.47 116.57 122.58 3k2b h LYS 107 Ca -0.06 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3k2b h LYS 107 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.74 3k2b h LYS 107 CO 0.15 0.00 -0.19 0.45 -0.57 0.00 0.00 179.45 179.29 3k2b h HIS 108 N 0.00 -0.49 -0.87 -1.35 3.86 -1.73 -3.22 115.15 111.35 3k2b h HIS 108 Ca 0.36 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 3k2b h HIS 108 Cb 2.03 0.16 -0.04 0.00 1.06 0.00 0.00 27.41 30.62 3k2b h HIS 108 CO 0.00 -0.29 0.55 0.97 0.86 0.00 0.00 177.93 180.02 3k2b h ILE 109 N -1.14 1.23 0.00 2.45 -0.00 -1.23 -2.25 117.51 116.58 3k2b h ILE 109 Ca -0.05 -0.47 -0.02 0.00 -0.00 0.00 0.00 64.86 64.32 3k2b h ILE 109 Cb 0.41 -0.02 -0.01 0.00 -0.00 0.00 0.00 36.82 37.20 3k2b h ILE 109 CO 0.09 0.24 -0.02 -0.62 -0.00 0.00 0.00 178.15 177.83 3k2b n GLU 110 N -4.38 0.85 0.00 2.19 1.02 0.15 -2.26 120.64 118.20 3k2b n GLU 110 Ca 0.10 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3k2b n GLU 110 Cb 0.04 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 3k2b n GLU 110 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k2b n ALA 111 N 1.75 0.00 0.00 0.62 0.00 -0.88 -4.81 120.51 117.20 3k2b n ALA 111 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3k2b n ALA 111 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 3k2b n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k2b n GLY 112 N 0.00 0.46 3.78 0.00 0.00 -0.96 -0.18 105.19 108.29 3k2b n GLY 112 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3k2b n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2b s ALA 113 N -0.25 3.25 -0.05 4.61 0.00 -1.02 -4.17 121.76 124.13 3k2b s ALA 113 Ca 0.00 0.47 0.20 0.00 0.00 0.00 0.00 51.96 52.63 3k2b s ALA 113 Cb 0.00 -3.12 -0.31 0.00 0.00 0.00 0.00 23.12 19.69 3k2b s ALA 113 CO 0.00 0.20 0.40 1.63 0.00 0.00 0.00 175.76 177.99 3k2b n LYS 114 N 0.64 0.66 -3.74 0.00 5.02 0.19 -3.97 118.16 116.96 3k2b n LYS 114 Ca 0.01 -0.16 -0.10 0.00 -2.02 0.00 0.00 58.31 56.04 3k2b n LYS 114 Cb 0.50 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.98 3k2b n LYS 114 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3k2b s LYS 115 N -3.29 1.25 -0.27 1.97 2.20 0.83 -4.78 119.74 117.65 3k2b s LYS 115 Ca -0.08 -0.87 -0.01 0.00 -0.36 0.00 0.00 55.97 54.65 3k2b s LYS 115 Cb 0.12 0.48 0.13 0.00 -1.51 0.00 0.00 37.83 37.06 3k2b s LYS 115 CO 0.84 -0.51 0.31 0.08 -0.36 0.00 0.00 175.35 175.72 3k2b s VAL 116 N -3.87 -0.46 -0.56 4.02 1.01 0.37 -1.04 120.40 119.87 3k2b s VAL 116 Ca 0.09 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 61.54 3k2b s VAL 116 Cb 0.01 -0.91 0.08 0.00 0.00 0.00 0.00 36.38 35.55 3k2b s VAL 116 CO -0.05 -0.34 0.71 0.27 0.00 0.00 0.00 175.10 175.69 3k2b s ILE 117 N 2.41 4.77 -0.33 2.22 -4.36 -0.99 -2.74 121.20 122.17 3k2b s ILE 117 Ca 0.10 -0.64 -0.29 0.00 -0.26 0.00 0.00 60.65 59.56 3k2b s ILE 117 Cb -0.14 -4.43 0.00 0.00 1.25 0.00 0.00 42.46 39.14 3k2b s ILE 117 CO -0.26 -1.02 1.32 -0.63 0.24 0.00 0.00 174.94 174.58 3k2b s ILE 118 N 2.88 4.09 -0.05 8.37 1.01 -1.21 -3.20 121.20 133.10 3k2b s ILE 118 Ca 0.15 1.20 -0.03 0.00 0.00 0.00 0.00 60.65 61.97 3k2b s ILE 118 Cb -0.21 -4.19 -0.13 0.00 0.01 0.00 0.00 42.46 37.95 3k2b s ILE 118 CO 0.10 -0.56 2.07 0.35 0.00 0.00 0.00 174.94 176.89 3k2b n THR 119 N 6.44 1.55 -3.70 2.92 -2.24 -1.12 -1.84 114.28 116.28 3k2b n THR 119 Ca 0.15 -0.79 0.01 0.00 -2.27 0.00 0.00 64.05 61.16 3k2b n THR 119 Cb 0.47 -1.77 -0.00 0.00 -2.10 0.00 0.00 70.33 66.93 3k2b n THR 119 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2b s ALA 120 N 2.09 -2.24 0.53 6.98 0.00 -1.10 -4.93 121.76 123.09 3k2b s ALA 120 Ca 0.34 0.52 -0.22 0.00 0.00 0.00 0.00 51.96 52.60 3k2b s ALA 120 Cb 0.16 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 3k2b s ALA 120 CO -0.00 -1.07 1.33 -2.14 0.00 0.00 0.00 175.76 173.87 3k2b s PRO 121 N -2.37 3.28 0.57 0.00 0.02 -1.08 -3.72 135.00 131.69 3k2b s PRO 121 Ca 0.17 2.16 -0.02 0.00 0.02 0.00 0.00 61.00 63.34 3k2b s PRO 121 Cb 0.03 -2.30 0.03 0.00 0.02 0.00 0.00 34.50 32.28 3k2b s PRO 121 CO -0.03 -1.06 0.82 0.20 -0.33 0.00 0.00 177.00 176.61 3k2b s GLY 122 N -1.01 1.72 -0.33 0.52 0.00 -1.26 -4.89 107.32 102.07 3k2b s GLY 122 Ca 0.70 -1.11 -0.11 0.00 0.00 0.00 0.00 44.72 44.20 3k2b s GLY 122 CO 0.46 -0.82 0.19 0.54 0.00 0.00 0.00 173.10 173.47 3k2b s LYS 122 N -4.86 3.30 3.12 2.90 -0.14 -0.66 -4.91 119.74 118.49 3k2b s LYS 122 Ca 0.56 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.41 3k2b s LYS 122 Cb -0.10 -3.68 0.00 0.00 -1.68 0.00 0.00 37.83 32.36 3k2b s LYS 122 CO 0.41 -0.48 0.00 0.41 -0.76 0.00 0.00 175.35 174.93 3k2b n GLY 123 N 5.03 1.70 2.70 -3.33 0.00 -1.26 -4.39 105.19 105.64 3k2b n GLY 123 Ca -0.13 0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 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 6.38 3.21 -4.16 1.61 2.03 -1.26 -5.05 116.55 119.31 3k2b n ASP 124 Ca 0.00 -3.28 -0.29 0.00 0.52 0.00 0.00 54.79 51.74 3k2b n ASP 124 Cb 0.00 -0.72 -0.17 0.00 -0.72 0.00 0.00 41.12 39.51 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 -1.82 1.72 -0.16 5.18 1.01 -1.26 -5.02 121.20 120.84 3k2b s ILE 125 Ca 0.31 -0.83 -0.34 0.00 0.00 0.00 0.00 60.65 59.78 3k2b s ILE 125 Cb 0.04 -1.50 -0.11 0.00 0.01 0.00 0.00 42.46 40.89 3k2b s ILE 125 CO -0.11 0.49 1.97 -2.65 0.00 0.00 0.00 174.94 174.64 3k2b n PRO 126 N 3.53 1.90 -3.68 2.79 -0.02 -1.24 -4.73 135.00 133.55 3k2b n PRO 126 Ca -0.20 0.66 -0.39 0.00 -2.02 0.00 0.00 63.50 61.55 3k2b n PRO 126 Cb 0.53 -2.65 -0.12 0.00 -0.02 0.00 0.00 33.50 31.24 3k2b n PRO 126 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3k2b s THR 127 N 5.14 4.33 -0.10 3.45 2.01 -1.26 0.81 115.64 130.02 3k2b s THR 127 Ca 0.97 -0.71 -0.00 0.00 0.31 0.00 0.00 61.69 62.26 3k2b s THR 127 Cb -0.70 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 3k2b s THR 127 CO 0.50 -0.05 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.98 3k2b s TYR 128 N 1.54 2.88 -0.24 4.92 2.02 0.16 -4.68 117.35 123.95 3k2b s TYR 128 Ca 0.02 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.48 3k2b s TYR 128 Cb -0.18 -1.79 0.06 0.00 -0.40 0.00 0.00 41.96 39.65 3k2b s TYR 128 CO 0.05 0.07 -0.07 0.08 -1.57 0.00 0.00 175.55 174.11 3k2b s VAL 129 N -0.20 1.75 0.07 0.71 1.01 -1.26 -4.20 120.40 118.28 3k2b s VAL 129 Ca 0.02 -1.35 -0.33 0.00 0.00 0.00 0.00 61.98 60.32 3k2b s VAL 129 Cb -0.13 -1.95 -0.12 0.00 0.00 0.00 0.00 36.38 34.17 3k2b s VAL 129 CO 0.03 -0.06 1.75 0.52 0.00 0.00 0.00 175.10 177.34 3k2b n VAL 130 N 4.59 0.29 0.00 2.92 0.31 -1.26 -0.89 118.33 124.30 3k2b n VAL 130 Ca -0.13 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 3k2b n VAL 130 Cb 0.43 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 3k2b n VAL 130 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k2b n GLY 131 N 3.98 3.03 0.85 2.92 0.00 -1.26 -4.88 105.19 109.83 3k2b n GLY 131 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.21 3k2b n GLY 131 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k2b n VAL 132 N -1.74 0.02 -1.50 1.61 0.31 -0.07 -4.89 118.33 112.07 3k2b n VAL 132 Ca 0.00 0.08 0.05 0.00 -0.01 0.00 0.00 64.34 64.45 3k2b n VAL 132 Cb 0.00 -1.08 0.06 0.00 -0.91 0.00 0.00 33.84 31.91 3k2b n VAL 132 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3k2b n ASN 133 N -2.51 1.11 0.22 4.52 2.04 -0.59 -4.81 115.26 115.23 3k2b n ASN 133 Ca -0.00 -2.46 0.18 0.00 -0.44 0.00 0.00 54.58 51.85 3k2b n ASN 133 Cb 0.00 -0.29 0.86 0.00 -2.53 0.00 0.00 39.78 37.81 3k2b n ASN 133 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3k2b h ALA 134 N 0.00 1.71 -0.01 -2.53 0.00 -1.78 -0.50 119.26 116.14 3k2b h ALA 134 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3k2b h ALA 134 Cb 1.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3k2b h ALA 134 CO 0.00 -0.30 -0.31 0.38 0.00 0.00 0.00 179.25 179.02 3k2b h ASP 135 N 0.00 0.02 0.07 0.00 3.04 -1.88 -2.89 116.42 114.79 3k2b h ASP 135 Ca 0.08 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.86 3k2b h ASP 135 Cb 0.51 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 3k2b h ASP 135 CO -0.00 0.33 0.00 0.00 -2.04 0.00 0.00 179.24 177.53 3k2b n ALA 136 N -2.48 1.75 -1.67 4.15 0.00 -0.20 -4.81 120.51 117.25 3k2b n ALA 136 Ca -0.02 -0.05 -0.47 0.00 0.00 0.00 0.00 53.44 52.90 3k2b n ALA 136 Cb 0.36 -1.15 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 3k2b n ALA 136 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3k2b n TYR 137 N -1.12 2.30 -3.62 0.00 9.36 -1.09 -4.96 117.16 118.02 3k2b n TYR 137 Ca 0.06 0.15 -0.38 0.00 3.32 0.00 0.00 57.90 61.05 3k2b n TYR 137 Cb 0.05 -2.59 -0.11 0.00 -0.63 0.00 0.00 39.34 36.05 3k2b n TYR 137 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3k2b s SER 138 N 2.21 5.83 0.00 2.98 0.15 -1.26 -4.95 113.70 118.66 3k2b s SER 138 Ca 0.84 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 57.41 3k2b s SER 138 Cb -0.68 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 3k2b s SER 138 CO 0.43 -0.06 0.19 1.57 1.20 0.00 0.00 173.24 176.57 3k2b n HIS 139 N 5.03 0.00 -3.19 3.44 -0.00 -1.26 -2.60 115.22 116.64 3k2b n HIS 139 Ca -0.14 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 57.82 3k2b n HIS 139 Cb 0.52 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 30.33 3k2b n HIS 139 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 3k2b n ASP 140 N -0.63 0.62 -3.59 0.26 8.00 -1.26 -4.96 116.55 114.99 3k2b n ASP 140 Ca 0.00 -2.85 -0.29 0.00 0.71 0.00 0.00 54.79 52.36 3k2b n ASP 140 Cb 0.00 -0.63 -0.14 0.00 -0.02 0.00 0.00 41.12 40.33 3k2b n ASP 140 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3k2b s GLU 141 N -1.72 0.66 0.57 -1.24 2.02 -1.07 -5.02 118.70 112.90 3k2b s GLU 141 Ca 0.37 -1.23 0.27 0.00 0.02 0.00 0.00 54.97 54.40 3k2b s GLU 141 Cb 0.24 -1.64 1.53 0.00 0.10 0.00 0.00 34.13 34.36 3k2b s GLU 141 CO -0.10 -1.11 2.04 -1.00 0.02 0.00 0.00 175.26 175.12 3k2b h PRO 142 N 7.51 0.00 -3.40 0.39 0.13 -1.91 -3.39 132.00 131.33 3k2b h PRO 142 Ca -0.06 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.59 3k2b h PRO 142 Cb 0.98 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.71 3k2b h PRO 142 CO 0.40 0.00 -0.76 0.42 -0.23 0.00 0.00 178.00 177.83 3k2b s ILE 143 N -4.76 0.27 0.00 -3.56 1.01 -1.26 -0.48 121.20 112.42 3k2b s ILE 143 Ca -0.05 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.33 3k2b s ILE 143 Cb 0.17 -0.76 0.00 0.00 0.01 0.00 0.00 42.46 41.87 3k2b s ILE 143 CO 0.60 -0.14 0.00 2.30 0.00 0.00 0.00 174.94 177.70 3k2b n ILE 144 N 5.15 0.00 -3.75 2.92 -5.35 -1.11 -3.67 119.36 113.56 3k2b n ILE 144 Ca -0.08 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.27 3k2b n ILE 144 Cb 0.48 -0.03 -0.10 0.00 -1.74 0.00 0.00 39.64 38.26 3k2b n ILE 144 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 3k2b s SER 145 N -0.05 -0.31 -0.15 7.28 0.15 0.24 -3.28 113.70 117.58 3k2b s SER 145 Ca 0.00 0.47 0.16 0.00 0.70 0.00 0.00 55.95 57.29 3k2b s SER 145 Cb 0.00 0.56 0.70 0.00 -1.71 0.00 0.00 66.02 65.57 3k2b s SER 145 CO 0.00 -0.26 1.61 -3.20 1.20 0.00 0.00 173.24 172.59 3k2b n ASN 146 N 2.20 4.80 0.00 5.45 2.85 -0.77 0.35 115.26 130.14 3k2b n ASN 146 Ca -0.17 -2.64 0.00 0.00 -0.11 0.00 0.00 54.58 51.66 3k2b n ASN 146 Cb 0.57 -0.58 0.00 0.00 1.24 0.00 0.00 39.78 41.01 3k2b n ASN 146 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3k2b n ALA 147 N 0.70 0.00 -2.42 5.20 0.00 -1.24 -4.75 120.51 117.99 3k2b n ALA 147 Ca 0.25 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.48 3k2b n ALA 147 Cb 0.95 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.30 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 2.59 0.36 0.00 1.04 -1.26 -2.62 113.70 109.80 3k2b s SER 148 Ca 0.00 -1.24 0.10 0.00 0.48 0.00 0.00 55.95 55.29 3k2b s SER 148 Cb 0.00 -0.13 0.85 0.00 0.10 0.00 0.00 66.02 66.84 3k2b s SER 148 CO 0.00 -0.42 1.84 0.00 0.98 0.00 0.00 173.24 175.64 3k2b h THR 150 N 0.65 0.00 -0.08 0.00 2.02 -1.95 -2.75 112.91 110.80 3k2b h THR 150 Ca 0.49 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 67.67 3k2b h THR 150 Cb 0.87 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 3k2b h THR 150 CO -0.24 0.00 0.27 0.74 0.37 0.00 0.00 175.52 176.66 3k2b h THR 151 N -0.23 0.11 0.00 3.16 2.02 -1.73 0.43 112.91 116.66 3k2b h THR 151 Ca -0.02 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.01 3k2b h THR 151 Cb 0.16 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 3k2b h THR 151 CO 0.04 0.00 -0.71 0.78 0.37 0.00 0.00 175.52 176.00 3k2b h ASN 152 N 0.00 0.00 0.00 4.18 4.21 -1.01 -2.81 115.58 120.15 3k2b h ASN 152 Ca 0.04 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.54 3k2b h ASN 152 Cb 0.57 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.77 3k2b h ASN 152 CO -0.00 0.71 -0.18 0.00 -1.29 0.00 0.00 177.43 176.67 3k2b h LEU 154 N -1.00 -1.31 -0.88 0.00 4.07 -1.61 -3.22 115.31 111.36 3k2b h LEU 154 Ca -0.01 0.14 0.11 0.00 0.08 0.00 0.00 57.88 58.21 3k2b h LEU 154 Cb 0.23 0.49 -0.13 0.00 1.08 0.00 0.00 40.66 42.34 3k2b h LEU 154 CO -0.01 -0.51 -0.41 0.00 -1.08 0.00 0.00 178.44 176.43 3k2b n ALA 155 N -2.85 -0.29 -0.05 1.53 0.00 -1.06 -0.18 120.51 117.61 3k2b n ALA 155 Ca -0.08 0.82 0.25 0.00 0.00 0.00 0.00 53.44 54.43 3k2b n ALA 155 Cb 0.39 -0.28 0.71 0.00 0.00 0.00 0.00 19.45 20.27 3k2b n ALA 155 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3k2b h PRO 156 N 0.00 0.00 0.00 0.00 0.11 -1.73 -2.37 132.00 128.01 3k2b h PRO 156 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 3k2b h PRO 156 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 3k2b h PRO 156 CO -0.85 0.00 -1.11 1.97 -0.21 0.00 0.00 178.00 177.80 3k2b n PHE 157 N -3.91 0.00 1.26 0.65 1.16 0.05 -4.16 117.46 112.50 3k2b n PHE 157 Ca 0.13 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.82 3k2b n PHE 157 Cb 0.84 -0.14 0.62 0.00 -1.61 0.00 0.00 39.48 39.19 3k2b n PHE 157 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 3k2b n VAL 158 N -1.63 0.12 -0.11 1.97 0.31 0.75 -1.08 118.33 118.67 3k2b n VAL 158 Ca -0.01 0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 64.21 3k2b n VAL 158 Cb 0.19 -0.68 -0.14 0.00 -0.91 0.00 0.00 33.84 32.30 3k2b n VAL 158 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3k2b n LYS 159 N -1.10 0.67 -0.03 5.55 4.81 -1.02 -3.22 118.16 123.82 3k2b n LYS 159 Ca 0.14 0.10 -0.15 0.00 -0.87 0.00 0.00 58.31 57.53 3k2b n LYS 159 Cb 0.11 -1.54 -0.04 0.00 0.02 0.00 0.00 35.03 33.58 3k2b n LYS 159 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3k2b h VAL 160 N 0.00 1.29 0.26 3.15 2.07 -1.54 -1.76 116.25 119.72 3k2b h VAL 160 Ca -0.55 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.08 3k2b h VAL 160 Cb 2.06 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.67 3k2b h VAL 160 CO -0.02 0.60 -0.13 -0.07 0.02 0.00 0.00 177.57 177.97 3k2b h LEU 161 N 0.56 -0.30 -1.55 2.57 3.38 -1.28 1.21 115.31 119.90 3k2b h LEU 161 Ca -0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 3k2b h LEU 161 Cb 1.28 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 3k2b h LEU 161 CO 0.14 0.02 0.07 -0.78 0.09 0.00 0.00 178.44 177.98 3k2b h ASP 162 N -0.63 0.33 0.37 -0.43 3.58 -1.63 -0.13 116.42 117.88 3k2b h ASP 162 Ca -0.04 -0.03 -0.32 0.00 0.42 0.00 0.00 57.03 57.06 3k2b h ASP 162 Cb 0.45 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 3k2b h ASP 162 CO 0.06 0.33 -1.66 1.56 -2.88 0.00 0.00 179.24 176.65 3k2b h GLN 163 N 0.37 0.24 0.00 0.28 4.20 -1.20 -2.68 115.11 116.31 3k2b h GLN 163 Ca 0.09 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.39 3k2b h GLN 163 Cb 0.13 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3k2b h GLN 163 CO -0.01 1.08 -0.55 1.63 -0.67 0.00 0.00 178.83 180.32 3k2b n LYS 164 N -3.42 0.28 0.00 1.46 4.01 0.42 -4.63 118.16 116.27 3k2b n LYS 164 Ca -0.20 0.10 0.00 0.00 -0.51 0.00 0.00 58.31 57.70 3k2b n LYS 164 Cb 1.05 -1.70 0.00 0.00 -0.51 0.00 0.00 35.03 33.87 3k2b n LYS 164 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 3k2b n PHE 165 N -2.11 0.00 -0.43 2.13 3.72 -0.15 -5.02 117.46 115.59 3k2b n PHE 165 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 3k2b n PHE 165 Cb 0.44 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 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 0.49 -0.66 3.56 1.37 0.00 -0.66 -2.45 105.19 106.84 3k2b n GLY 166 Ca 0.00 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 4.69 -0.02 -0.61 1.01 -1.26 -0.95 121.20 124.07 3k2b s ILE 167 Ca 0.00 0.63 -0.14 0.00 0.00 0.00 0.00 60.65 61.14 3k2b s ILE 167 Cb 0.00 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.13 3k2b s ILE 167 CO 0.00 -0.58 0.70 0.40 0.00 0.00 0.00 174.94 175.46 3k2b h ILE 168 N 5.88 0.00 -4.01 2.92 2.04 -1.74 -3.48 117.51 119.11 3k2b h ILE 168 Ca -0.25 -0.39 -0.11 0.00 1.00 0.00 0.00 64.86 65.11 3k2b h ILE 168 Cb 1.09 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 37.03 3k2b h ILE 168 CO 0.94 0.00 -0.48 -1.59 0.00 0.00 0.00 178.15 177.02 3k2b s LYS 169 N -3.32 0.84 0.15 2.37 -2.85 -1.26 -4.87 119.74 110.80 3k2b s LYS 169 Ca -0.08 -1.12 -0.25 0.00 -1.00 0.00 0.00 55.97 53.53 3k2b s LYS 169 Cb 0.01 0.30 0.07 0.00 -2.06 0.00 0.00 37.83 36.15 3k2b s LYS 169 CO 0.23 -0.25 1.01 0.20 0.10 0.00 0.00 175.35 176.64 3k2b s GLY 170 N -2.92 -0.15 -0.26 0.59 0.00 1.33 -0.48 107.32 105.44 3k2b s GLY 170 Ca 0.10 0.04 -0.25 0.00 0.00 0.00 0.00 44.72 44.60 3k2b s GLY 170 CO -0.08 0.67 0.82 -1.08 0.00 0.00 0.00 173.10 173.43 3k2b s THR 171 N -2.89 0.00 0.47 0.90 -1.32 -1.00 -2.94 115.64 108.86 3k2b s THR 171 Ca 0.15 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.66 3k2b s THR 171 Cb -0.01 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.96 3k2b s THR 171 CO 0.03 0.00 0.07 0.00 -2.21 0.00 0.00 174.62 172.51 3k2b s MET 172 N 0.22 2.08 -0.09 7.08 0.23 0.45 0.67 119.30 129.94 3k2b s MET 172 Ca 0.00 -2.31 -0.18 0.00 -1.03 0.00 0.00 55.69 52.18 3k2b s MET 172 Cb -0.05 -1.05 0.04 0.00 -1.53 0.00 0.00 34.83 32.24 3k2b s MET 172 CO -0.01 -0.44 0.44 0.99 -2.03 0.00 0.00 175.02 173.97 3k2b s THR 173 N -3.04 0.02 -0.11 3.16 2.01 0.14 -3.36 115.64 114.46 3k2b s THR 173 Ca 0.14 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 3k2b s THR 173 Cb 0.02 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 71.87 3k2b s THR 173 CO 0.09 -0.10 -0.03 0.28 -0.69 0.00 0.00 174.62 174.17 3k2b s THR 174 N -0.57 0.72 -0.82 -0.82 -1.32 -1.09 0.17 115.64 111.91 3k2b s THR 174 Ca -0.07 -0.21 -0.25 0.00 -1.21 0.00 0.00 61.69 59.95 3k2b s THR 174 Cb -0.03 -0.88 0.05 0.00 -1.51 0.00 0.00 72.50 70.12 3k2b s THR 174 CO 0.03 0.22 1.28 -0.89 -2.21 0.00 0.00 174.62 173.05 3k2b s THR 175 N 1.82 3.91 -0.09 5.08 2.01 -0.99 0.25 115.64 127.63 3k2b s THR 175 Ca 0.04 -0.13 -0.03 0.00 0.31 0.00 0.00 61.69 61.88 3k2b s THR 175 Cb -0.13 -4.92 -0.04 0.00 0.01 0.00 0.00 72.50 67.42 3k2b s THR 175 CO -0.07 -1.81 0.05 -2.28 -0.69 0.00 0.00 174.62 169.82 3k2b s HIS 176 N 5.14 3.31 1.31 4.92 5.04 1.45 -2.02 115.29 134.44 3k2b s HIS 176 Ca 0.36 0.30 -0.19 0.00 -1.54 0.00 0.00 55.06 53.99 3k2b s HIS 176 Cb -0.07 -1.83 0.33 0.00 0.04 0.00 0.00 32.58 31.05 3k2b s HIS 176 CO 0.06 0.56 0.99 -1.12 -2.34 0.00 0.00 174.74 172.89 3k2b s SER 177 N -1.02 -0.11 0.32 9.88 0.01 -1.26 0.15 113.70 121.67 3k2b s SER 177 Ca 0.15 0.99 -0.13 0.00 1.31 0.00 0.00 55.95 58.26 3k2b s SER 177 Cb -0.12 -1.46 -0.08 0.00 0.21 0.00 0.00 66.02 64.57 3k2b s SER 177 CO 0.04 -4.80 0.71 -0.72 0.41 0.00 0.00 173.24 168.88 3k2b s TYR 178 N -2.47 3.39 0.29 2.43 -0.85 -1.21 -4.31 117.35 114.63 3k2b s TYR 178 Ca 0.69 1.14 0.07 0.00 -0.52 0.00 0.00 57.07 58.45 3k2b s TYR 178 Cb -0.16 -2.48 -0.06 0.00 0.38 0.00 0.00 41.96 39.64 3k2b s TYR 178 CO 0.59 0.09 -0.06 0.99 -1.52 0.00 0.00 175.55 175.65 3k2b s THR 179 N -2.01 1.71 0.41 -3.49 2.01 -1.26 -4.84 115.64 108.17 3k2b s THR 179 Ca 0.53 -2.13 0.18 0.00 0.31 0.00 0.00 61.69 60.57 3k2b s THR 179 Cb -0.10 -2.48 0.18 0.00 0.01 0.00 0.00 72.50 70.11 3k2b s THR 179 CO 0.20 -0.28 1.49 1.23 -0.69 0.00 0.00 174.62 176.56 3k2b h GLY 180 N 2.25 0.00 2.00 4.40 0.00 -1.98 0.14 103.07 109.88 3k2b h GLY 180 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 3k2b h GLY 180 CO 0.68 0.00 0.00 -1.80 0.00 0.00 0.00 176.54 175.42 3k2b h ASP 181 N 0.00 0.00 -3.14 0.19 3.58 -1.97 -3.45 116.42 111.63 3k2b h ASP 181 Ca 0.00 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.91 3k2b h ASP 181 Cb 0.89 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.92 3k2b h ASP 181 CO 0.00 0.00 -0.22 -1.10 -2.88 0.00 0.00 179.24 175.04 3k2b s GLN 182 N -3.40 3.62 0.20 0.28 -0.21 0.49 -4.91 119.66 115.73 3k2b s GLN 182 Ca 0.05 -0.06 -0.30 0.00 0.02 0.00 0.00 55.36 55.06 3k2b s GLN 182 Cb 0.08 -2.74 -0.08 0.00 1.00 0.00 0.00 33.01 31.28 3k2b s GLN 182 CO 0.56 0.33 1.02 1.03 -2.12 0.00 0.00 175.29 176.11 3k2b s ARG 183 N -3.20 4.71 0.51 2.91 1.81 -0.99 -4.85 118.95 119.85 3k2b s ARG 183 Ca 0.42 1.61 0.18 0.00 -1.72 0.00 0.00 55.73 56.22 3k2b s ARG 183 Cb -0.11 -3.28 1.29 0.00 -0.45 0.00 0.00 34.95 32.39 3k2b s ARG 183 CO 0.27 0.26 2.12 1.25 -0.68 0.00 0.00 175.30 178.52 3k2b h LEU 184 N 4.69 0.00 -7.51 2.53 5.85 -1.93 0.11 115.31 119.05 3k2b h LEU 184 Ca -0.45 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.15 3k2b h LEU 184 Cb 1.21 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 42.02 3k2b h LEU 184 CO 0.70 0.06 -0.31 -0.76 -0.34 0.00 0.00 178.44 177.79 3k2b s LEU 185 N -8.64 0.90 -0.56 2.25 1.43 -1.26 -3.83 118.68 108.96 3k2b s LEU 185 Ca -0.05 0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 53.15 3k2b s LEU 185 Cb 0.16 1.17 -0.16 0.00 0.03 0.00 0.00 46.19 47.39 3k2b s LEU 185 CO 0.65 -0.36 1.34 0.47 0.23 0.00 0.00 176.35 178.68 3k2b n ASP 186 N 1.70 -0.38 0.00 2.29 9.92 -1.26 -4.53 116.55 124.29 3k2b n ASP 186 Ca -0.20 -0.12 0.00 0.00 -0.53 0.00 0.00 54.79 53.94 3k2b n ASP 186 Cb 0.56 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 3k2b n ASP 186 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3k2b n ALA 187 N 4.32 0.00 -2.68 2.24 0.00 -0.81 -4.98 120.51 118.60 3k2b n ALA 187 Ca 0.37 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.43 3k2b n ALA 187 Cb 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.43 3k2b n ALA 187 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k2b s SER 188 N 1.00 6.50 -0.14 0.00 1.04 -1.26 -4.83 113.70 116.01 3k2b s SER 188 Ca 0.00 0.60 -0.26 0.00 0.48 0.00 0.00 55.95 56.77 3k2b s SER 188 Cb 0.00 -2.25 0.06 0.00 0.10 0.00 0.00 66.02 63.93 3k2b s SER 188 CO 0.00 -0.07 0.64 -2.28 0.98 0.00 0.00 173.24 172.51 3k2b s HIS 190 N 1.19 -0.65 0.24 5.02 5.04 -1.26 -4.97 115.29 119.89 3k2b s HIS 190 Ca 0.21 1.35 -0.07 0.00 -1.54 0.00 0.00 55.06 55.01 3k2b s HIS 190 Cb -0.15 0.31 0.22 0.00 0.04 0.00 0.00 32.58 33.00 3k2b s HIS 190 CO 0.08 -0.47 1.89 0.07 -2.34 0.00 0.00 174.74 173.97 3k2b h ARG 191 N 4.03 1.26 -6.40 2.88 0.11 -1.97 -3.37 114.38 110.92 3k2b h ARG 191 Ca -0.28 -0.11 -0.55 0.00 0.10 0.00 0.00 59.98 59.14 3k2b h ARG 191 Cb 1.15 -0.26 -0.08 0.00 1.11 0.00 0.00 29.97 31.89 3k2b h ARG 191 CO 0.25 0.88 0.98 0.34 0.10 0.00 0.00 179.97 182.52 3k2b s ASP 192 N -6.15 6.29 0.00 0.08 -1.08 -1.26 -4.89 116.67 109.67 3k2b s ASP 192 Ca -0.13 -0.22 0.00 0.00 -0.52 0.00 0.00 52.55 51.68 3k2b s ASP 192 Cb 0.17 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 3k2b s ASP 192 CO 0.82 -1.64 0.14 0.18 0.52 0.00 0.00 175.17 175.19 3k2b n LEU 193 N 8.82 0.03 0.00 -1.34 4.77 -1.26 -1.14 117.00 126.89 3k2b n LEU 193 Ca 0.05 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3k2b n LEU 193 Cb 0.49 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3k2b n LEU 193 CO 0.71 0.01 -0.38 0.54 -1.33 0.00 0.00 177.39 176.93 3k2b n ARG 194 N -0.31 0.65 0.00 3.23 1.74 -1.26 -4.55 116.66 116.16 3k2b n ARG 194 Ca 0.00 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.19 3k2b n ARG 194 Cb 0.01 -0.88 0.54 0.00 -1.02 0.00 0.00 32.46 31.11 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 -2.14 0.21 0.00 5.56 1.74 -0.63 -2.25 116.66 119.14 3k2b n ARG 195 Ca 0.00 0.09 0.14 0.00 -0.77 0.00 0.00 57.85 57.31 3k2b n ARG 195 Cb 0.38 -1.50 0.64 0.00 -1.02 0.00 0.00 32.46 30.97 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 -1.37 2.71 -2.54 7.54 0.00 -0.29 -2.36 120.51 124.21 3k2b n ALA 196 Ca 0.09 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.95 3k2b n ALA 196 Cb 0.21 -1.37 -0.05 0.00 0.00 0.00 0.00 19.45 18.24 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 -2.49 3.78 -0.41 0.00 1.81 -0.95 -1.92 118.95 118.77 3k2b s ARG 197 Ca 0.29 0.21 -0.44 0.00 -1.72 0.00 0.00 55.73 54.07 3k2b s ARG 197 Cb 0.20 -2.94 -0.18 0.00 -0.45 0.00 0.00 34.95 31.58 3k2b s ARG 197 CO 0.47 0.52 1.74 0.00 -0.68 0.00 0.00 175.30 177.35 3k2b n ALA 198 N 0.72 -0.64 0.01 2.13 0.00 -1.24 -4.22 120.51 117.27 3k2b n ALA 198 Ca -0.06 0.40 -0.02 0.00 0.00 0.00 0.00 53.44 53.75 3k2b n ALA 198 Cb 0.52 -2.08 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 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 6.59 -0.60 0.00 0.00 0.00 -1.07 -3.03 119.26 121.16 3k2b h ALA 199 Ca -0.41 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3k2b h ALA 199 Cb 1.35 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.68 3k2b h ALA 199 CO 0.99 -0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.61 3k2b n ALA 200 N -2.54 2.01 0.01 0.00 0.00 -1.26 -3.31 120.51 115.43 3k2b n ALA 200 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.45 3k2b n ALA 200 Cb 0.06 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.47 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 0.06 0.01 -4.06 0.00 4.77 -1.14 -4.83 117.00 111.81 3k2b n LEU 201 Ca 0.00 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 3k2b n LEU 201 Cb 0.14 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 3k2b n LEU 201 CO 0.00 0.00 0.13 0.54 -1.33 0.00 0.00 177.39 176.73 3k2b s ASN 202 N -2.52 0.44 -0.31 -1.43 2.20 -1.21 -5.04 114.94 107.07 3k2b s ASN 202 Ca -0.02 -1.26 -0.16 0.00 -0.94 0.00 0.00 52.86 50.48 3k2b s ASN 202 Cb 0.03 0.61 -0.02 0.00 -2.00 0.00 0.00 41.25 39.87 3k2b s ASN 202 CO 0.21 -1.21 0.44 -0.63 -2.94 0.00 0.00 177.10 172.97 3k2b s ILE 203 N -3.49 5.11 -0.23 0.54 1.01 -1.25 -4.07 121.20 118.82 3k2b s ILE 203 Ca 0.28 0.43 -0.06 0.00 0.00 0.00 0.00 60.65 61.31 3k2b s ILE 203 Cb 0.00 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 3k2b s ILE 203 CO 0.15 -0.03 0.02 -0.69 0.00 0.00 0.00 174.94 174.40 3k2b s VAL 204 N 2.20 3.99 -0.45 2.92 1.01 0.32 -4.81 120.40 125.58 3k2b s VAL 204 Ca 0.16 -0.29 -0.22 0.00 0.00 0.00 0.00 61.98 61.64 3k2b s VAL 204 Cb -0.16 -2.83 0.03 0.00 0.00 0.00 0.00 36.38 33.41 3k2b s VAL 204 CO 0.11 0.39 0.73 -2.16 0.00 0.00 0.00 175.10 174.17 3k2b s PRO 205 N 1.36 3.35 0.26 2.72 0.04 -1.25 0.31 135.00 141.79 3k2b s PRO 205 Ca 0.05 -0.22 0.11 0.00 0.04 0.00 0.00 61.00 60.97 3k2b s PRO 205 Cb -0.15 -3.95 -0.05 0.00 0.04 0.00 0.00 34.50 30.40 3k2b s PRO 205 CO 0.01 -1.08 -0.12 -0.08 0.04 0.00 0.00 177.00 175.78 3k2b s THR 206 N 3.09 2.89 0.15 1.26 -1.32 -0.21 -4.84 115.64 116.67 3k2b s THR 206 Ca 0.27 -2.15 -0.30 0.00 -1.21 0.00 0.00 61.69 58.30 3k2b s THR 206 Cb -0.13 -2.52 -0.07 0.00 -1.51 0.00 0.00 72.50 68.27 3k2b s THR 206 CO 0.21 -0.35 1.13 -0.94 -2.21 0.00 0.00 174.62 172.45 3k2b s SER 207 N -3.48 7.21 -0.24 8.08 1.04 -1.26 -2.45 113.70 122.59 3k2b s SER 207 Ca 0.30 2.08 0.02 0.00 0.48 0.00 0.00 55.95 58.83 3k2b s SER 207 Cb -0.06 -2.60 0.06 0.00 0.10 0.00 0.00 66.02 63.52 3k2b s SER 207 CO 0.17 -0.29 -0.08 0.28 0.98 0.00 0.00 173.24 174.29 3k2b s THR 208 N 0.07 1.85 -0.05 2.02 -1.32 -1.26 -4.92 115.64 112.02 3k2b s THR 208 Ca 0.52 -1.41 0.00 0.00 -1.21 0.00 0.00 61.69 59.59 3k2b s THR 208 Cb -0.30 -2.02 0.05 0.00 -1.51 0.00 0.00 72.50 68.72 3k2b s THR 208 CO 0.34 -0.05 1.57 0.61 -2.21 0.00 0.00 174.62 174.88 3k2b n GLY 209 N 4.56 2.53 0.00 6.08 0.00 -1.26 -3.68 105.19 113.41 3k2b n GLY 209 Ca -0.13 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 0.85 4.16 0.04 4.61 0.00 -1.26 -2.10 120.51 126.81 3k2b n ALA 210 Ca 0.05 -0.48 0.03 0.00 0.00 0.00 0.00 53.44 53.05 3k2b n ALA 210 Cb 0.56 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.99 3k2b n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2b n ALA 211 N -1.51 2.10 0.01 0.00 0.00 -1.24 -3.18 120.51 116.70 3k2b n ALA 211 Ca 0.05 -0.52 -0.11 0.00 0.00 0.00 0.00 53.44 52.86 3k2b n ALA 211 Cb 0.33 -0.93 -0.14 0.00 0.00 0.00 0.00 19.45 18.72 3k2b n ALA 211 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3k2b h LYS 212 N 0.00 0.07 0.00 0.00 2.10 -1.83 -3.34 116.57 113.57 3k2b h LYS 212 Ca -0.14 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 58.39 3k2b h LYS 212 Cb 1.45 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 3k2b h LYS 212 CO 0.03 0.77 0.00 0.00 -2.00 0.00 0.00 179.45 178.25 3k2b h ALA 213 N 0.82 1.00 0.00 0.07 0.00 -1.53 -2.09 119.26 117.53 3k2b h ALA 213 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k2b h ALA 213 Cb 1.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.76 3k2b h ALA 213 CO 0.10 0.00 0.00 0.28 0.00 0.00 0.00 179.25 179.63 3k2b n VAL 214 N -3.04 0.04 0.99 0.00 0.31 -1.19 -1.81 118.33 113.63 3k2b n VAL 214 Ca 0.03 0.01 0.12 0.00 -0.01 0.00 0.00 64.34 64.49 3k2b n VAL 214 Cb 0.43 -0.53 0.21 0.00 -0.91 0.00 0.00 33.84 33.05 3k2b n VAL 214 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k2b n ALA 215 N -1.25 3.65 -0.04 3.52 0.00 -0.79 -2.65 120.51 122.95 3k2b n ALA 215 Ca 0.15 -0.37 -0.22 0.00 0.00 0.00 0.00 53.44 53.00 3k2b n ALA 215 Cb 0.22 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.45 3k2b n ALA 215 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k2b n LEU 216 N -1.51 2.43 0.02 0.00 4.77 -0.75 -2.76 117.00 119.20 3k2b n LEU 216 Ca 0.05 0.24 -0.05 0.00 -0.03 0.00 0.00 56.01 56.22 3k2b n LEU 216 Cb 0.34 -1.04 0.16 0.00 -2.33 0.00 0.00 43.42 40.55 3k2b n LEU 216 CO 0.36 0.70 0.67 -0.37 -1.33 0.00 0.00 177.39 177.41 3k2b h VAL 217 N -0.28 1.29 -2.64 4.08 -1.51 -1.64 -3.36 116.25 112.19 3k2b h VAL 217 Ca -0.44 -1.43 -0.60 0.00 -1.23 0.00 0.00 66.70 63.01 3k2b h VAL 217 Cb 1.81 1.48 -0.39 0.00 -2.13 0.00 0.00 31.29 32.05 3k2b h VAL 217 CO -0.04 0.45 -0.84 -0.76 -1.23 0.00 0.00 177.57 175.15 3k2b s LEU 218 N -8.55 2.07 0.61 4.19 1.43 -1.08 -4.51 118.68 112.84 3k2b s LEU 218 Ca -0.07 -2.90 0.26 0.00 -1.03 0.00 0.00 54.13 50.39 3k2b s LEU 218 Cb 0.13 -0.72 1.17 0.00 0.03 0.00 0.00 46.19 46.80 3k2b s LEU 218 CO 0.80 -0.21 1.61 -0.65 0.23 0.00 0.00 176.35 178.13 3k2b h PRO 219 N 6.13 0.00 0.00 1.29 0.11 -1.68 0.49 132.00 138.34 3k2b h PRO 219 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3k2b h PRO 219 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3k2b h PRO 219 CO 0.42 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 176.50 3k2b n ASN 220 N -3.33 0.00 -1.06 -2.05 5.15 -1.26 -2.24 115.26 110.47 3k2b n ASN 220 Ca 0.12 -0.02 0.08 0.00 -0.60 0.00 0.00 54.58 54.16 3k2b n ASN 220 Cb 0.97 -0.29 0.26 0.00 -0.53 0.00 0.00 39.78 40.19 3k2b n ASN 220 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3k2b n LEU 221 N -1.29 3.90 -4.72 1.20 7.99 0.16 -4.99 117.00 119.25 3k2b n LEU 221 Ca 0.10 -2.49 -0.42 0.00 -0.01 0.00 0.00 56.01 53.19 3k2b n LEU 221 Cb 0.18 -0.46 -0.03 0.00 -0.11 0.00 0.00 43.42 43.00 3k2b n LEU 221 CO 0.17 0.74 1.09 -0.75 -1.51 0.00 0.00 177.39 177.13 3k2b s LYS 222 N -1.90 4.30 -1.05 3.23 2.20 -0.95 -2.60 119.74 122.97 3k2b s LYS 222 Ca 0.39 2.16 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 3k2b s LYS 222 Cb 0.27 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 3k2b s LYS 222 CO 0.16 -0.45 0.00 0.41 -0.36 0.00 0.00 175.35 175.11 3k2b n GLY 223 N 3.30 0.10 0.00 5.54 0.00 -1.26 -4.88 105.19 107.99 3k2b n GLY 223 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.22 2.39 -4.22 1.61 5.02 -1.07 -4.96 118.16 114.72 3k2b n LYS 224 Ca -0.14 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.91 3k2b n LYS 224 Cb 0.57 -0.78 -0.08 0.00 -0.02 0.00 0.00 35.03 34.72 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 -2.30 3.09 0.00 -0.35 1.43 -1.23 0.40 118.68 119.71 3k2b s LEU 225 Ca 0.00 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 3k2b s LEU 225 Cb 0.00 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.76 3k2b s LEU 225 CO 0.00 -0.36 0.00 -3.20 0.23 0.00 0.00 176.35 173.02 3k2b n ASN 226 N -1.09 0.00 0.00 2.29 5.15 -1.15 -4.73 115.26 115.73 3k2b n ASN 226 Ca -0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 3k2b n ASN 226 Cb 0.63 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.88 3k2b n ASN 226 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k2b n GLY 227 N -0.20 -0.81 1.09 8.20 0.00 -1.26 -0.41 105.19 111.79 3k2b n GLY 227 Ca 0.00 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 45.00 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 4.97 0.00 -3.85 -0.61 -0.00 -1.21 -4.59 119.36 114.07 3k2b n ILE 228 Ca 0.00 -0.79 -0.13 0.00 -0.00 0.00 0.00 62.75 61.84 3k2b n ILE 228 Cb 0.00 0.32 -0.14 0.00 -0.00 0.00 0.00 39.64 39.81 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 -2.39 0.01 -0.25 -1.28 0.00 -1.03 -2.69 121.76 114.13 3k2b s ALA 229 Ca 0.09 0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.10 3k2b s ALA 229 Cb 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.10 3k2b s ALA 229 CO 0.06 -0.02 -0.06 -0.51 0.00 0.00 0.00 175.76 175.23 3k2b s LEU 230 N 0.19 3.20 -0.15 0.00 1.43 0.68 -1.04 118.68 122.99 3k2b s LEU 230 Ca -0.02 -0.89 -0.27 0.00 -1.03 0.00 0.00 54.13 51.93 3k2b s LEU 230 Cb -0.02 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 3k2b s LEU 230 CO -0.01 -0.13 0.89 -0.13 0.23 0.00 0.00 176.35 177.20 3k2b s ARG 231 N 1.32 4.33 -0.03 1.70 1.81 0.91 0.43 118.95 129.41 3k2b s ARG 231 Ca -0.00 1.14 0.05 0.00 -1.72 0.00 0.00 55.73 55.20 3k2b s ARG 231 Cb -0.17 -3.56 -0.01 0.00 -0.45 0.00 0.00 34.95 30.76 3k2b s ARG 231 CO -0.04 -0.33 -0.20 0.14 -0.68 0.00 0.00 175.30 174.19 3k2b s VAL 232 N 2.13 1.62 0.00 3.52 -7.23 0.40 0.12 120.40 120.95 3k2b s VAL 232 Ca 0.41 -0.85 0.00 0.00 -1.81 0.00 0.00 61.98 59.74 3k2b s VAL 232 Cb -0.17 -1.37 0.00 0.00 0.56 0.00 0.00 36.38 35.41 3k2b s VAL 232 CO 0.14 0.46 0.00 -2.65 -0.31 0.00 0.00 175.10 172.74 3k2b n PRO 233 N 2.86 0.00 -4.28 4.82 -0.02 -1.26 -3.37 135.00 133.75 3k2b n PRO 233 Ca -0.17 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.01 3k2b n PRO 233 Cb 0.53 -0.71 -0.10 0.00 -0.02 0.00 0.00 33.50 33.20 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 0.31 3.35 -0.01 3.45 -4.23 -1.26 -4.91 115.64 112.34 3k2b s THR 234 Ca 0.00 -1.23 -0.24 0.00 -1.18 0.00 0.00 61.69 59.04 3k2b s THR 234 Cb 0.00 -2.55 -0.16 0.00 1.34 0.00 0.00 72.50 71.13 3k2b s THR 234 CO 0.00 0.15 1.13 1.55 -0.54 0.00 0.00 174.62 176.91 3k2b h PRO 235 N 3.75 -0.33 0.00 3.99 0.13 -1.90 -3.19 132.00 134.44 3k2b h PRO 235 Ca -0.49 0.02 -0.53 0.00 -0.87 0.00 0.00 66.00 64.13 3k2b h PRO 235 Cb 1.17 0.08 -0.11 0.00 0.13 0.00 0.00 31.00 32.26 3k2b h PRO 235 CO 0.52 0.02 -0.43 -1.71 -0.23 0.00 0.00 178.00 176.16 3k2b n ASN 236 N -5.06 1.61 -1.17 1.44 5.15 -1.26 -4.41 115.26 111.55 3k2b n ASN 236 Ca -0.09 -3.02 0.00 0.00 -0.60 0.00 0.00 54.58 50.87 3k2b n ASN 236 Cb 0.26 0.84 0.00 0.00 -0.53 0.00 0.00 39.78 40.35 3k2b n ASN 236 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 3k2b n VAL 237 N -0.91 -2.92 -3.30 3.44 0.31 -1.26 -4.84 118.33 108.85 3k2b n VAL 237 Ca -0.08 1.35 0.00 0.00 -0.01 0.00 0.00 64.34 65.59 3k2b n VAL 237 Cb 0.57 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 3k2b n VAL 237 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3k2b n SER 238 N -1.80 0.00 -3.87 4.52 7.64 -1.00 -4.02 113.62 115.10 3k2b n SER 238 Ca 0.00 -0.71 -0.08 0.00 1.01 0.00 0.00 58.87 59.09 3k2b n SER 238 Cb 0.22 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 3k2b n SER 238 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3k2b s VAL 239 N -2.24 0.00 -0.02 0.44 0.11 -0.85 -3.19 120.40 114.65 3k2b s VAL 239 Ca 0.00 -1.05 -0.03 0.00 -2.93 0.00 0.00 61.98 57.97 3k2b s VAL 239 Cb 0.00 -1.96 0.00 0.00 -1.53 0.00 0.00 36.38 32.89 3k2b s VAL 239 CO 0.00 -0.02 0.07 0.68 -3.33 0.00 0.00 175.10 172.51 3k2b s VAL 240 N -3.94 0.04 -0.36 2.04 -7.23 0.36 -2.33 120.40 108.98 3k2b s VAL 240 Ca 0.14 -0.32 0.01 0.00 -1.81 0.00 0.00 61.98 60.00 3k2b s VAL 240 Cb -0.03 -0.22 0.11 0.00 0.56 0.00 0.00 36.38 36.80 3k2b s VAL 240 CO 0.05 -0.17 0.12 -0.62 -0.31 0.00 0.00 175.10 174.17 3k2b s ASP 241 N -0.53 4.15 -0.08 4.85 2.15 0.45 -0.39 116.67 127.26 3k2b s ASP 241 Ca -0.06 -2.05 -0.06 0.00 0.43 0.00 0.00 52.55 50.81 3k2b s ASP 241 Cb -0.04 -1.13 -0.04 0.00 -0.30 0.00 0.00 42.92 41.41 3k2b s ASP 241 CO 0.00 -0.37 0.17 -0.22 -0.17 0.00 0.00 175.17 174.59 3k2b s LEU 242 N 1.07 4.39 -0.44 -1.34 2.96 -0.93 0.24 118.68 124.63 3k2b s LEU 242 Ca 0.12 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 3k2b s LEU 242 Cb -0.20 -2.25 0.13 0.00 0.50 0.00 0.00 46.19 44.37 3k2b s LEU 242 CO -0.14 0.36 0.23 -0.69 -1.32 0.00 0.00 176.35 174.79 3k2b s VAL 243 N -1.11 1.53 0.25 1.68 1.01 0.21 -1.43 120.40 122.54 3k2b s VAL 243 Ca 0.19 -2.59 0.03 0.00 0.00 0.00 0.00 61.98 59.61 3k2b s VAL 243 Cb -0.12 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 3k2b s VAL 243 CO 0.08 -0.87 0.41 0.68 0.00 0.00 0.00 175.10 175.40 3k2b s VAL 244 N 0.35 5.21 -0.98 2.92 -7.23 -1.11 -2.37 120.40 117.18 3k2b s VAL 244 Ca 0.17 -0.71 -0.03 0.00 -1.81 0.00 0.00 61.98 59.60 3k2b s VAL 244 Cb -0.24 -3.83 0.27 0.00 0.56 0.00 0.00 36.38 33.14 3k2b s VAL 244 CO -0.01 -0.34 1.10 1.67 -0.31 0.00 0.00 175.10 177.21 3k2b n GLN 245 N -1.30 3.49 -1.01 4.82 7.27 0.37 -2.56 117.38 128.46 3k2b n GLN 245 Ca -0.07 -4.53 -0.33 0.00 0.07 0.00 0.00 57.00 52.14 3k2b n GLN 245 Cb 0.56 -2.46 0.13 0.00 2.41 0.00 0.00 30.24 30.88 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 1.86 1.49 0.79 1.69 0.24 -0.64 -2.16 118.33 121.60 3k2b n VAL 246 Ca 0.25 -0.18 0.09 0.00 -2.04 0.00 0.00 64.34 62.45 3k2b n VAL 246 Cb 0.37 -1.09 -0.10 0.00 -1.47 0.00 0.00 33.84 31.55 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 -3.11 0.84 -4.57 -1.34 3.41 -0.12 -4.69 113.62 104.04 3k2b n SER 247 Ca 0.13 -0.87 -0.40 0.00 -0.26 0.00 0.00 58.87 57.47 3k2b n SER 247 Cb 0.51 1.05 -0.10 0.00 -0.26 0.00 0.00 64.21 65.41 3k2b n SER 247 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3k2b s LYS 248 N -2.73 3.77 0.18 4.33 2.36 -1.03 -5.05 119.74 121.58 3k2b s LYS 248 Ca 0.06 -0.30 -0.31 0.00 -2.55 0.00 0.00 55.97 52.87 3k2b s LYS 248 Cb 0.13 -3.73 -0.10 0.00 -1.05 0.00 0.00 37.83 33.09 3k2b s LYS 248 CO 0.74 -0.36 1.52 0.15 1.55 0.00 0.00 175.35 178.95 3k2b s LYS 249 N 1.94 4.24 0.01 4.03 1.02 -1.26 -4.76 119.74 124.94 3k2b s LYS 249 Ca 0.11 2.32 -0.13 0.00 0.02 0.00 0.00 55.97 58.28 3k2b s LYS 249 Cb -0.16 -3.15 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 3k2b s LYS 249 CO 0.11 -0.55 0.28 -0.08 -0.92 0.00 0.00 175.35 174.19 3k2b s THR 250 N 0.90 0.07 -0.23 2.17 -1.32 -0.66 -5.03 115.64 111.55 3k2b s THR 250 Ca 0.67 -0.58 -0.15 0.00 -1.21 0.00 0.00 61.69 60.42 3k2b s THR 250 Cb -0.43 -0.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.81 3k2b s THR 250 CO 0.34 -0.32 0.37 0.72 -2.21 0.00 0.00 174.62 173.52 3k2b s PHE 251 N -1.77 3.33 0.06 9.09 -0.71 -1.26 -4.52 117.98 122.21 3k2b s PHE 251 Ca -0.11 0.52 0.04 0.00 -1.04 0.00 0.00 56.93 56.34 3k2b s PHE 251 Cb -0.04 -2.52 0.23 0.00 -1.21 0.00 0.00 43.02 39.48 3k2b s PHE 251 CO 0.01 -0.07 0.28 0.00 -1.34 0.00 0.00 175.22 174.10 3k2b n ALA 252 N 4.72 0.18 0.31 1.99 0.00 -1.26 0.33 120.51 126.78 3k2b n ALA 252 Ca -0.09 0.18 0.16 0.00 0.00 0.00 0.00 53.44 53.69 3k2b n ALA 252 Cb 0.51 -0.18 0.61 0.00 0.00 0.00 0.00 19.45 20.39 3k2b n ALA 252 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3k2b h GLU 253 N 0.00 0.00 0.00 0.00 3.07 -1.93 -2.80 114.58 112.93 3k2b h GLU 253 Ca 0.15 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.96 3k2b h GLU 253 Cb 0.39 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 3k2b h GLU 253 CO -0.14 0.00 -0.25 1.49 -1.40 0.00 0.00 179.01 178.72 3k2b h GLU 254 N 0.00 0.00 0.02 2.33 4.81 0.50 -2.43 114.58 119.81 3k2b h GLU 254 Ca 0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 3k2b h GLU 254 Cb 0.50 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 3k2b h GLU 254 CO 0.00 0.25 -0.27 0.28 -0.73 0.00 0.00 179.01 178.53 3k2b h VAL 255 N 0.00 1.65 -0.45 0.32 2.07 -1.59 -2.72 116.25 115.52 3k2b h VAL 255 Ca -0.00 -2.35 -0.00 0.00 0.82 0.00 0.00 66.70 65.16 3k2b h VAL 255 Cb 1.03 3.23 -0.02 0.00 -1.52 0.00 0.00 31.29 34.01 3k2b h VAL 255 CO 0.03 0.59 0.28 0.78 0.02 0.00 0.00 177.57 179.28 3k2b h ASN 256 N -0.91 0.54 0.55 0.57 -0.26 -1.62 0.07 115.58 114.52 3k2b h ASN 256 Ca -0.06 -0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.63 3k2b h ASN 256 Cb 1.13 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 38.25 3k2b h ASN 256 CO -0.00 0.42 -0.01 0.00 -1.06 0.00 0.00 177.43 176.78 3k2b h ALA 257 N 1.14 1.02 -0.00 -0.83 0.00 -1.57 -0.70 119.26 118.30 3k2b h ALA 257 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3k2b h ALA 257 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3k2b h ALA 257 CO -0.03 0.01 -0.09 0.00 0.00 0.00 0.00 179.25 179.14 3k2b n ALA 258 N -2.10 2.72 0.39 0.00 0.00 -0.03 -3.52 120.51 117.98 3k2b n ALA 258 Ca -0.01 -0.26 0.08 0.00 0.00 0.00 0.00 53.44 53.24 3k2b n ALA 258 Cb 0.20 -1.35 -0.10 0.00 0.00 0.00 0.00 19.45 18.20 3k2b n ALA 258 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k2b n PHE 259 N -0.92 0.00 0.16 0.00 3.72 -0.28 -4.35 117.46 115.78 3k2b n PHE 259 Ca 0.15 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.60 3k2b n PHE 259 Cb 0.26 -0.16 0.13 0.00 -0.94 0.00 0.00 39.48 38.77 3k2b n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k2b h ARG 260 N 0.00 0.00 0.00 -1.08 3.08 -1.58 -2.77 114.38 112.03 3k2b h ARG 260 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 3k2b h ARG 260 Cb 0.52 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 3k2b h ARG 260 CO 0.00 0.44 -1.04 0.38 -1.07 0.00 0.00 179.97 178.68 3k2b h ASP 261 N 0.00 0.00 -0.00 7.04 -0.00 -1.78 -2.97 116.42 118.71 3k2b h ASP 261 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3k2b h ASP 261 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 40.55 3k2b h ASP 261 CO 0.06 0.64 0.00 0.28 -0.00 0.00 0.00 179.24 180.22 3k2b h SER 262 N 0.00 0.00 0.05 4.15 0.02 -1.74 -1.18 113.55 114.85 3k2b h SER 262 Ca -0.09 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.55 3k2b h SER 262 Cb 1.57 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.11 3k2b h SER 262 CO 0.07 0.30 -0.04 0.00 -1.14 0.00 0.00 176.83 176.02 3k2b h ALA 263 N 0.70 1.74 0.00 3.77 0.00 -1.56 0.66 119.26 124.56 3k2b h ALA 263 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 3k2b h ALA 263 Cb 0.30 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3k2b h ALA 263 CO 0.00 0.04 -1.60 0.39 0.00 0.00 0.00 179.25 178.08 3k2b n GLU 264 N -4.20 0.63 0.00 0.00 -0.58 -1.12 -3.09 120.64 112.28 3k2b n GLU 264 Ca -0.03 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 3k2b n GLU 264 Cb 0.12 -1.74 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 3k2b n GLU 264 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3k2b n LYS 265 N -2.79 0.00 -0.24 3.49 5.02 -0.46 -4.69 118.16 118.50 3k2b n LYS 265 Ca -0.12 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.20 3k2b n LYS 265 Cb 0.84 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 36.01 3k2b n LYS 265 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 3k2b h GLU 266 N 0.00 0.41 -0.45 1.97 9.09 -1.77 -2.00 114.58 121.82 3k2b h GLU 266 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3k2b h GLU 266 Cb 0.00 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 27.01 3k2b h GLU 266 CO 0.00 0.27 0.00 1.28 0.05 0.00 0.00 179.01 180.61 3k2b n LEU 267 N -5.01 2.39 -4.65 3.06 4.77 0.19 -4.95 117.00 112.80 3k2b n LEU 267 Ca 0.12 -1.20 -0.48 0.00 -0.03 0.00 0.00 56.01 54.42 3k2b n LEU 267 Cb 0.36 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 3k2b n LEU 267 CO 0.19 0.57 1.14 1.17 -1.33 0.00 0.00 177.39 179.13 3k2b n LYS 268 N 0.73 1.81 -0.85 3.23 3.00 -0.76 -0.15 118.16 125.18 3k2b n LYS 268 Ca 0.14 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 59.11 3k2b n LYS 268 Cb 0.39 -2.39 0.00 0.00 0.00 0.00 0.00 35.03 33.03 3k2b n LYS 268 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2b n GLY 269 N 3.27 1.28 0.00 3.14 0.00 -1.26 -4.76 105.19 106.86 3k2b n GLY 269 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3k2b n GLY 269 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k2b n ILE 270 N -2.00 0.09 -3.53 -0.61 2.08 0.79 -4.54 119.36 111.65 3k2b n ILE 270 Ca 0.00 -0.35 -0.01 0.00 0.56 0.00 0.00 62.75 62.95 3k2b n ILE 270 Cb 0.00 1.29 -0.05 0.00 -0.75 0.00 0.00 39.64 40.13 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 -0.09 -0.67 0.23 1.39 2.96 -0.69 -3.91 118.68 117.90 3k2b s LEU 271 Ca 0.00 0.97 0.11 0.00 -0.22 0.00 0.00 54.13 54.98 3k2b s LEU 271 Cb 0.00 1.83 -0.05 0.00 0.50 0.00 0.00 46.19 48.47 3k2b s LEU 271 CO 0.00 -0.14 -0.19 -0.62 -1.32 0.00 0.00 176.35 174.07 3k2b s ASP 272 N 2.15 3.23 -0.15 3.68 2.15 0.10 -4.23 116.67 123.59 3k2b s ASP 272 Ca -0.05 -0.97 -0.01 0.00 0.43 0.00 0.00 52.55 51.95 3k2b s ASP 272 Cb -0.06 -0.24 -0.01 0.00 -0.30 0.00 0.00 42.92 42.31 3k2b s ASP 272 CO -0.17 0.00 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.03 3k2b s VAL 273 N -2.36 3.08 -0.43 1.11 1.01 -1.26 -1.27 120.40 120.27 3k2b s VAL 273 Ca 0.25 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.60 3k2b s VAL 273 Cb -0.05 -2.31 0.12 0.00 0.00 0.00 0.00 36.38 34.14 3k2b s VAL 273 CO 0.11 0.51 0.19 0.00 0.00 0.00 0.00 175.10 175.91 3k2b n ASP 275 N 4.04 2.32 -4.80 0.00 5.75 -1.26 -2.22 116.55 120.38 3k2b n ASP 275 Ca 0.03 -2.20 -0.38 0.00 -0.01 0.00 0.00 54.79 52.23 3k2b n ASP 275 Cb 0.39 -0.39 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 3k2b n ASP 275 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3k2b s GLU 276 N -1.66 4.07 -0.93 0.11 0.41 -1.26 -4.72 118.70 114.72 3k2b s GLU 276 Ca 0.22 0.46 -0.24 0.00 -0.41 0.00 0.00 54.97 55.00 3k2b s GLU 276 Cb 0.14 -3.28 0.03 0.00 -1.78 0.00 0.00 34.13 29.24 3k2b s GLU 276 CO 0.10 0.54 1.50 -1.25 -0.49 0.00 0.00 175.26 175.67 3k2b s PRO 277 N -0.63 3.32 0.37 0.39 0.04 -1.26 -4.95 135.00 132.27 3k2b s PRO 277 Ca 0.25 -0.75 0.06 0.00 0.04 0.00 0.00 61.00 60.60 3k2b s PRO 277 Cb -0.17 -5.04 -0.03 0.00 0.04 0.00 0.00 34.50 29.31 3k2b s PRO 277 CO 0.13 -2.38 0.24 -0.51 0.04 0.00 0.00 177.00 174.52 3k2b s LEU 278 N 6.03 1.86 0.00 -3.56 1.43 -1.26 -5.17 118.68 118.00 3k2b s LEU 278 Ca 0.48 -1.77 0.00 0.00 -1.03 0.00 0.00 54.13 51.81 3k2b s LEU 278 Cb -0.03 0.35 0.00 0.00 0.03 0.00 0.00 46.19 46.54 3k2b s LEU 278 CO -0.02 -1.05 0.00 1.33 0.23 0.00 0.00 176.35 176.84 3k2b n VAL 279 N -0.76 0.00 -0.07 -1.59 0.24 -1.26 -5.05 118.33 109.84 3k2b n VAL 279 Ca 0.03 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.30 3k2b n VAL 279 Cb 0.63 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.84 3k2b n VAL 279 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3k2b n SER 280 N 0.00 0.06 0.02 -1.34 3.41 -1.26 -4.08 113.62 110.43 3k2b n SER 280 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 3k2b n SER 280 Cb 0.00 1.33 0.34 0.00 -0.26 0.00 0.00 64.21 65.62 3k2b n SER 280 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3k2b n VAL 281 N -2.58 0.96 0.70 -3.33 3.14 -1.26 -2.01 118.33 113.95 3k2b n VAL 281 Ca -0.23 0.24 0.12 0.00 -2.96 0.00 0.00 64.34 61.52 3k2b n VAL 281 Cb 0.95 -1.02 0.28 0.00 -1.06 0.00 0.00 33.84 32.99 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 -1.61 0.62 -1.48 6.55 8.00 -1.26 -3.72 116.55 123.64 3k2b n ASP 282 Ca 0.03 0.19 0.05 0.00 0.71 0.00 0.00 54.79 55.77 3k2b n ASP 282 Cb 0.18 -0.08 0.32 0.00 -0.02 0.00 0.00 41.12 41.52 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 -1.97 1.65 -3.19 1.24 3.72 -0.85 -4.93 117.46 113.12 3k2b n PHE 283 Ca 0.04 -0.90 -0.39 0.00 -0.05 0.00 0.00 57.45 56.15 3k2b n PHE 283 Cb 0.41 -0.46 -0.05 0.00 -0.94 0.00 0.00 39.48 38.43 3k2b n PHE 283 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3k2b s ARG 284 N -2.86 4.36 0.00 -1.08 1.70 -1.24 -3.55 118.95 116.29 3k2b s ARG 284 Ca 0.49 0.68 0.00 0.00 -0.47 0.00 0.00 55.73 56.43 3k2b s ARG 284 Cb 0.39 -3.41 0.00 0.00 -0.57 0.00 0.00 34.95 31.36 3k2b s ARG 284 CO 0.12 0.19 0.00 0.00 -1.08 0.00 0.00 175.30 174.53 3k2b s SER 286 N -2.69 6.23 0.37 0.00 0.15 -1.23 -4.93 113.70 111.60 3k2b s SER 286 Ca 0.00 -0.18 0.27 0.00 0.70 0.00 0.00 55.95 56.74 3k2b s SER 286 Cb 0.00 -2.22 1.00 0.00 -1.71 0.00 0.00 66.02 63.08 3k2b s SER 286 CO 0.00 -0.40 1.80 0.44 1.20 0.00 0.00 173.24 176.28 3k2b h ASP 287 N 8.47 0.00 -3.36 5.45 3.32 -1.95 -3.36 116.42 124.99 3k2b h ASP 287 Ca -0.29 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.21 3k2b h ASP 287 Cb 1.14 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 3k2b h ASP 287 CO 0.72 0.00 0.42 -0.36 -1.72 0.00 0.00 179.24 178.30 3k2b s PHE 288 N -3.38 3.60 -1.12 4.55 0.08 -1.26 -4.82 117.98 115.63 3k2b s PHE 288 Ca 0.05 1.63 0.15 0.00 0.12 0.00 0.00 56.93 58.88 3k2b s PHE 288 Cb 0.09 -3.12 0.70 0.00 -0.57 0.00 0.00 43.02 40.12 3k2b s PHE 288 CO 0.51 -0.08 1.48 0.45 -0.10 0.00 0.00 175.22 177.48 3k2b n SER 289 N 4.27 0.00 -3.61 1.36 2.88 -1.25 -4.47 113.62 112.80 3k2b n SER 289 Ca 0.06 0.37 -0.03 0.00 -1.33 0.00 0.00 58.87 57.95 3k2b n SER 289 Cb 0.50 -0.44 -0.06 0.00 -0.75 0.00 0.00 64.21 63.46 3k2b n SER 289 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3k2b s THR 290 N -2.88 -0.21 -0.29 2.46 -1.32 -1.24 -3.69 115.64 108.47 3k2b s THR 290 Ca 0.10 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.59 3k2b s THR 290 Cb 0.10 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 70.18 3k2b s THR 290 CO 0.27 0.00 0.02 -0.89 -2.21 0.00 0.00 174.62 171.81 3k2b s THR 291 N 1.81 1.70 -0.04 5.08 2.01 0.14 -0.73 115.64 125.61 3k2b s THR 291 Ca -0.08 -1.71 -0.30 0.00 0.31 0.00 0.00 61.69 59.91 3k2b s THR 291 Cb -0.05 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 3k2b s THR 291 CO -0.17 -0.42 1.30 -0.63 -0.69 0.00 0.00 174.62 174.01 3k2b s ILE 292 N 1.24 4.01 -0.87 1.82 -1.09 -0.40 -0.08 121.20 125.83 3k2b s ILE 292 Ca 0.04 1.35 -0.20 0.00 -2.23 0.00 0.00 60.65 59.60 3k2b s ILE 292 Cb -0.19 -3.87 0.10 0.00 -1.58 0.00 0.00 42.46 36.93 3k2b s ILE 292 CO -0.11 -0.01 1.13 -0.62 -1.23 0.00 0.00 174.94 174.09 3k2b s ASP 293 N 1.71 6.49 0.10 3.58 -1.08 0.28 0.13 116.67 127.88 3k2b s ASP 293 Ca 0.60 -1.68 -0.35 0.00 -0.52 0.00 0.00 52.55 50.59 3k2b s ASP 293 Cb -0.28 -2.43 -0.15 0.00 -1.46 0.00 0.00 42.92 38.61 3k2b s ASP 293 CO 0.24 -1.23 1.56 0.77 0.52 0.00 0.00 175.17 177.03 3k2b h SER 294 N 9.16 -1.58 -0.29 -0.34 4.64 -1.75 -1.71 113.55 121.68 3k2b h SER 294 Ca 0.04 0.16 0.08 0.00 -0.47 0.00 0.00 61.79 61.61 3k2b h SER 294 Cb 1.03 0.58 -0.01 0.00 -0.31 0.00 0.00 62.40 63.69 3k2b h SER 294 CO 1.17 -0.57 0.76 0.77 -0.87 0.00 0.00 176.83 178.09 3k2b h SER 295 N -0.79 0.00 0.18 4.97 4.64 -1.85 -0.21 113.55 120.50 3k2b h SER 295 Ca -0.01 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.96 3k2b h SER 295 Cb 0.78 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.82 3k2b h SER 295 CO -0.27 0.00 -2.08 0.18 -0.87 0.00 0.00 176.83 173.79 3k2b n LEU 296 N -2.97 1.79 -4.76 5.97 4.77 -0.68 -4.96 117.00 116.15 3k2b n LEU 296 Ca 0.06 0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.79 3k2b n LEU 296 Cb 0.87 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 3k2b n LEU 296 CO 0.13 0.68 1.17 -0.89 -1.33 0.00 0.00 177.39 177.16 3k2b s THR 297 N -2.55 2.14 0.35 -5.08 2.01 -0.09 -4.95 115.64 107.47 3k2b s THR 297 Ca -0.18 0.13 0.04 0.00 0.31 0.00 0.00 61.69 61.99 3k2b s THR 297 Cb 0.07 -3.08 -0.01 0.00 0.01 0.00 0.00 72.50 69.49 3k2b s THR 297 CO 0.76 0.03 0.38 0.00 -0.69 0.00 0.00 174.62 175.10 3k2b s MET 298 N -1.33 1.89 -0.15 4.92 0.23 -1.21 -4.84 119.30 118.80 3k2b s MET 298 Ca 0.57 -1.94 -0.06 0.00 -1.03 0.00 0.00 55.69 53.23 3k2b s MET 298 Cb -0.46 0.39 0.07 0.00 -1.53 0.00 0.00 34.83 33.30 3k2b s MET 298 CO 0.55 -0.74 0.32 0.08 -2.03 0.00 0.00 175.02 173.20 3k2b s VAL 299 N -3.15 -0.47 -0.13 5.16 1.01 -1.26 -1.88 120.40 119.67 3k2b s VAL 299 Ca 0.36 0.23 -0.11 0.00 0.00 0.00 0.00 61.98 62.46 3k2b s VAL 299 Cb 0.01 -0.52 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 3k2b s VAL 299 CO 0.26 0.10 0.23 -0.04 0.00 0.00 0.00 175.10 175.64 3k2b s MET 300 N 2.42 3.96 -1.87 2.72 -1.94 0.23 -4.37 119.30 120.44 3k2b s MET 300 Ca -0.00 0.00 0.00 0.00 -1.71 0.00 0.00 55.69 53.98 3k2b s MET 300 Cb -0.12 -3.33 0.00 0.00 2.01 0.00 0.00 34.83 33.39 3k2b s MET 300 CO -0.10 0.47 0.00 0.41 -0.01 0.00 0.00 175.02 175.79 3k2b n GLY 301 N 2.79 0.23 4.55 -0.03 0.00 -1.26 -0.56 105.19 110.91 3k2b n GLY 301 Ca -0.15 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.72 0.00 -0.38 1.61 8.00 -1.26 -4.50 116.55 118.30 3k2b n ASP 302 Ca -0.23 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.31 3k2b n ASP 302 Cb 0.68 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.85 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 0.52 2.17 -4.13 -2.24 5.68 -1.19 -1.65 116.55 115.72 3k2b n ASP 303 Ca 0.00 -1.68 -0.34 0.00 -0.50 0.00 0.00 54.79 52.27 3k2b n ASP 303 Cb 0.00 -0.08 -0.13 0.00 -1.14 0.00 0.00 41.12 39.76 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 -0.83 2.19 -0.12 0.11 1.75 0.27 -1.63 119.30 121.03 3k2b s MET 304 Ca 0.13 -1.49 -0.04 0.00 -1.25 0.00 0.00 55.69 53.04 3k2b s MET 304 Cb 0.08 -3.26 -0.04 0.00 2.84 0.00 0.00 34.83 34.45 3k2b s MET 304 CO 0.10 -0.77 0.03 0.08 -0.65 0.00 0.00 175.02 173.82 3k2b s VAL 305 N 1.17 4.57 -0.14 10.11 1.01 -1.06 0.75 120.40 136.81 3k2b s VAL 305 Ca -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 61.81 3k2b s VAL 305 Cb -0.20 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 3k2b s VAL 305 CO -0.03 0.56 -0.05 -0.75 0.00 0.00 0.00 175.10 174.83 3k2b s LYS 306 N -0.44 3.55 -0.18 2.72 2.20 -0.79 -2.76 119.74 124.04 3k2b s LYS 306 Ca 0.09 -0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 55.16 3k2b s LYS 306 Cb -0.12 -2.85 0.04 0.00 -1.51 0.00 0.00 37.83 33.39 3k2b s LYS 306 CO 0.02 0.29 -0.06 0.14 -0.36 0.00 0.00 175.35 175.38 3k2b s VAL 307 N 0.22 1.25 -0.44 4.02 -7.23 -0.52 -3.35 120.40 114.36 3k2b s VAL 307 Ca -0.03 -0.77 -0.16 0.00 -1.81 0.00 0.00 61.98 59.21 3k2b s VAL 307 Cb -0.14 -1.43 0.04 0.00 0.56 0.00 0.00 36.38 35.41 3k2b s VAL 307 CO 0.03 0.10 0.37 -0.63 -0.31 0.00 0.00 175.10 174.66 3k2b s ILE 308 N 1.56 5.21 -0.01 -0.62 -1.09 -1.25 -2.20 121.20 122.81 3k2b s ILE 308 Ca -0.00 -0.74 0.08 0.00 -2.23 0.00 0.00 60.65 57.76 3k2b s ILE 308 Cb -0.16 -4.03 -0.02 0.00 -1.58 0.00 0.00 42.46 36.67 3k2b s ILE 308 CO -0.08 -0.44 -0.25 0.00 -1.23 0.00 0.00 174.94 172.95 3k2b s ALA 309 N 1.78 2.07 0.19 9.38 0.00 0.48 -0.56 121.76 135.10 3k2b s ALA 309 Ca 0.06 -1.09 0.06 0.00 0.00 0.00 0.00 51.96 50.98 3k2b s ALA 309 Cb -0.20 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 3k2b s ALA 309 CO 0.10 0.51 0.14 -1.58 0.00 0.00 0.00 175.76 174.92 3k2b s TRP 310 N -0.62 3.12 -0.29 0.00 0.52 0.88 0.13 118.94 122.69 3k2b s TRP 310 Ca 0.10 -0.05 -0.17 0.00 0.02 0.00 0.00 56.10 56.00 3k2b s TRP 310 Cb -0.10 -1.47 0.13 0.00 -1.15 0.00 0.00 33.47 30.89 3k2b s TRP 310 CO -0.00 0.52 0.94 1.52 0.02 0.00 0.00 176.95 179.95 3k2b s TYR 311 N -1.86 -0.63 -1.06 -1.98 1.13 -1.19 0.23 117.35 111.99 3k2b s TYR 311 Ca 0.31 1.28 -0.14 0.00 -1.41 0.00 0.00 57.07 57.12 3k2b s TYR 311 Cb -0.09 0.38 -0.08 0.00 -1.10 0.00 0.00 41.96 41.07 3k2b s TYR 311 CO 0.23 -0.31 2.18 -3.47 -2.51 0.00 0.00 175.55 171.67 3k2b n ASP 312 N 3.65 4.39 -0.25 -0.18 -0.08 -1.26 -2.39 116.55 120.43 3k2b n ASP 312 Ca -0.18 -2.58 0.20 0.00 -1.51 0.00 0.00 54.79 50.72 3k2b n ASP 312 Cb 0.58 -1.27 0.31 0.00 2.34 0.00 0.00 41.12 43.08 3k2b n ASP 312 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3k2b n ASN 313 N 5.63 0.04 -0.09 1.67 6.94 -1.26 0.38 115.26 128.56 3k2b n ASN 313 Ca 0.52 0.48 -0.13 0.00 -0.02 0.00 0.00 54.58 55.43 3k2b n ASN 313 Cb 0.29 -0.24 -0.05 0.00 -2.36 0.00 0.00 39.78 37.42 3k2b n ASN 313 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 3k2b n GLU 314 N -3.07 0.52 0.02 -3.83 2.13 -1.26 -4.23 120.64 110.92 3k2b n GLU 314 Ca 0.18 0.37 -0.19 0.00 0.66 0.00 0.00 57.16 58.18 3k2b n GLU 314 Cb 0.76 -1.57 -0.12 0.00 0.27 0.00 0.00 31.44 30.78 3k2b n GLU 314 CO 0.00 0.00 0.00 2.35 -0.41 0.00 0.00 177.13 179.07 3k2b h TRP 315 N -1.00 0.70 0.08 4.31 2.91 -1.41 -3.17 115.95 118.38 3k2b h TRP 315 Ca -0.17 -0.41 -0.00 0.00 1.13 0.00 0.00 58.89 59.44 3k2b h TRP 315 Cb 0.99 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.57 3k2b h TRP 315 CO -0.23 1.24 -0.04 0.78 -1.03 0.00 0.00 178.44 179.16 3k2b h GLY 316 N -0.03 -0.12 0.25 2.65 0.00 -0.23 -1.81 103.07 103.77 3k2b h GLY 316 Ca -0.10 0.04 0.17 0.00 0.00 0.00 0.00 47.33 47.44 3k2b h GLY 316 CO 0.15 -0.04 0.62 -1.82 0.00 0.00 0.00 176.54 175.44 3k2b h TYR 317 N -0.22 1.06 0.00 5.60 3.20 -1.70 0.64 116.97 125.54 3k2b h TYR 317 Ca -0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3k2b h TYR 317 Cb 0.18 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 3k2b h TYR 317 CO -0.04 0.30 -0.07 0.77 -1.64 0.00 0.00 178.16 177.48 3k2b h SER 318 N 0.81 0.00 1.28 -2.11 0.02 -1.43 -0.82 113.55 111.30 3k2b h SER 318 Ca 0.55 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.39 3k2b h SER 318 Cb 0.79 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.32 3k2b h SER 318 CO -0.33 0.07 -0.52 1.56 -1.14 0.00 0.00 176.83 176.46 3k2b h GLN 319 N 0.00 0.00 0.08 3.45 1.08 0.11 -3.10 115.11 116.73 3k2b h GLN 319 Ca -0.00 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.95 3k2b h GLN 319 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 3k2b h GLN 319 CO 0.01 0.52 -1.12 0.00 -0.95 0.00 0.00 178.83 177.29 3k2b h ARG 320 N 0.00 0.27 0.00 1.46 2.47 -0.19 -3.14 114.38 115.25 3k2b h ARG 320 Ca -0.01 -0.40 -0.01 0.00 -1.26 0.00 0.00 59.98 58.31 3k2b h ARG 320 Cb 1.31 0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 29.76 3k2b h ARG 320 CO 0.07 1.15 -0.04 0.28 0.56 0.00 0.00 179.97 181.99 3k2b h VAL 321 N 0.11 0.11 0.07 2.04 2.07 -1.19 -1.97 116.25 117.48 3k2b h VAL 321 Ca -0.10 -0.58 -0.25 0.00 0.82 0.00 0.00 66.70 66.59 3k2b h VAL 321 Cb 1.82 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 3k2b h VAL 321 CO 0.18 0.04 -1.14 0.58 0.02 0.00 0.00 177.57 177.25 3k2b h VAL 322 N 0.00 1.59 -0.22 2.57 2.07 -1.50 -2.58 116.25 118.17 3k2b h VAL 322 Ca -0.00 -3.23 -0.09 0.00 0.82 0.00 0.00 66.70 64.20 3k2b h VAL 322 Cb 0.51 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 33.17 3k2b h VAL 322 CO 0.01 0.93 -0.23 0.44 0.02 0.00 0.00 177.57 178.73 3k2b h ASP 323 N 0.04 0.59 -0.27 0.57 3.32 -1.41 -2.40 116.42 116.85 3k2b h ASP 323 Ca -0.08 -0.48 -0.05 0.00 0.02 0.00 0.00 57.03 56.44 3k2b h ASP 323 Cb 1.88 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 41.25 3k2b h ASP 323 CO 0.17 0.95 0.03 0.25 -1.72 0.00 0.00 179.24 178.91 3k2b h LEU 324 N 0.24 0.53 -0.39 1.55 5.85 -1.45 -0.19 115.31 121.45 3k2b h LEU 324 Ca 0.03 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3k2b h LEU 324 Cb 0.79 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.68 3k2b h LEU 324 CO 0.06 0.58 0.00 0.00 -0.34 0.00 0.00 178.44 178.73 3k2b h ALA 325 N 1.49 1.00 0.01 1.25 0.00 -1.38 -2.83 119.26 118.80 3k2b h ALA 325 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.77 3k2b h ALA 325 Cb 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3k2b h ALA 325 CO 0.01 0.00 -1.40 -0.44 0.00 0.00 0.00 179.25 177.41 3k2b h ASP 326 N 0.00 0.03 0.16 0.00 3.32 -0.54 -3.22 116.42 116.17 3k2b h ASP 326 Ca 0.00 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 3k2b h ASP 326 Cb 0.61 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.15 3k2b h ASP 326 CO 0.00 1.03 -0.08 0.40 -1.72 0.00 0.00 179.24 178.88 3k2b h ILE 327 N 0.00 0.96 -0.65 0.35 2.04 -1.07 0.13 117.51 119.28 3k2b h ILE 327 Ca -0.17 -0.59 0.12 0.00 1.00 0.00 0.00 64.86 65.22 3k2b h ILE 327 Cb 1.91 1.32 -0.12 0.00 -0.74 0.00 0.00 36.82 39.19 3k2b h ILE 327 CO 0.11 0.14 -0.26 0.58 0.00 0.00 0.00 178.15 178.72 3k2b h VAL 328 N -0.50 0.23 -0.50 1.67 2.07 -1.65 0.68 116.25 118.25 3k2b h VAL 328 Ca -0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 3k2b h VAL 328 Cb 0.39 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3k2b h VAL 328 CO 0.04 0.00 0.27 0.00 0.02 0.00 0.00 177.57 177.90 3k2b h ALA 329 N 1.35 0.64 0.00 1.67 0.00 -1.52 0.35 119.26 121.75 3k2b h ALA 329 Ca 0.29 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3k2b h ALA 329 Cb 0.53 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3k2b h ALA 329 CO -0.70 0.17 -0.20 -0.91 0.00 0.00 0.00 179.25 177.60 3k2b h ASN 330 N 0.66 0.00 -0.42 0.00 -0.26 0.19 -1.86 115.58 113.90 3k2b h ASN 330 Ca 0.18 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.92 3k2b h ASN 330 Cb 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 3k2b h ASN 330 CO -0.03 0.20 0.00 0.59 -1.06 0.00 0.00 177.43 177.13 3k2b n ASN 331 N -3.57 3.51 -0.60 5.81 4.13 0.21 -5.06 115.26 119.68 3k2b n ASN 331 Ca -0.01 -2.27 0.13 0.00 1.68 0.00 0.00 54.58 54.12 3k2b n ASN 331 Cb 0.35 -0.37 0.42 0.00 -1.54 0.00 0.00 39.78 38.63 3k2b n ASN 331 CO 0.00 0.00 0.00 1.87 0.28 0.00 0.00 177.26 179.41