#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktc s THR 3 N 0.00 1.45 -0.01 0.00 -1.32 -1.26 -5.09 115.64 109.41 3ktc s THR 3 Ca 0.00 -0.86 0.04 0.00 -1.21 0.00 0.00 61.69 59.66 3ktc s THR 3 Cb 0.00 -1.22 -0.01 0.00 -1.51 0.00 0.00 72.50 69.76 3ktc s THR 3 CO 0.00 0.35 -0.14 -0.31 -2.21 0.00 0.00 174.62 172.31 3ktc s TYR 4 N -0.51 1.24 -0.85 9.09 2.02 -1.26 -5.07 117.35 122.01 3ktc s TYR 4 Ca 0.07 -0.24 -0.15 0.00 -0.37 0.00 0.00 57.07 56.37 3ktc s TYR 4 Cb -0.07 -0.79 0.20 0.00 -0.40 0.00 0.00 41.96 40.89 3ktc s TYR 4 CO -0.00 -0.02 0.85 -0.80 -1.57 0.00 0.00 175.55 174.01 3ktc s ASN 5 N -0.39 6.73 0.67 2.29 0.01 -1.26 -5.05 114.94 117.94 3ktc s ASN 5 Ca 0.05 -2.54 -0.16 0.00 -0.71 0.00 0.00 52.86 49.51 3ktc s ASN 5 Cb -0.06 -2.25 0.01 0.00 0.41 0.00 0.00 41.25 39.36 3ktc s ASN 5 CO -0.00 -0.69 1.16 -0.31 -1.51 0.00 0.00 177.10 175.74 3ktc s TYR 6 N 0.75 2.39 0.91 2.20 2.02 -1.26 -5.00 117.35 119.36 3ktc s TYR 6 Ca 0.21 1.57 -0.10 0.00 -0.37 0.00 0.00 57.07 58.38 3ktc s TYR 6 Cb -0.09 -3.32 0.14 0.00 -0.40 0.00 0.00 41.96 38.30 3ktc s TYR 6 CO -0.09 -2.07 1.15 -2.14 -1.57 0.00 0.00 175.55 170.83 3ktc s PRO 7 N -3.90 1.04 0.29 -1.71 0.02 -1.26 -4.98 135.00 124.50 3ktc s PRO 7 Ca 0.71 1.55 -0.29 0.00 0.02 0.00 0.00 61.00 62.99 3ktc s PRO 7 Cb -0.25 -1.73 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 3ktc s PRO 7 CO 0.41 -2.61 1.04 -1.21 -0.33 0.00 0.00 177.00 174.29 3ktc s GLU 8 N -4.65 4.64 0.08 5.54 2.02 -1.26 -4.95 118.70 120.12 3ktc s GLU 8 Ca 0.67 1.64 0.05 0.00 0.02 0.00 0.00 54.97 57.35 3ktc s GLU 8 Cb -0.23 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 3ktc s GLU 8 CO 0.58 0.26 -0.04 -0.06 0.02 0.00 0.00 175.26 176.02 3ktc s PHE 9 N -1.26 2.91 0.24 1.61 0.08 -1.26 -1.13 117.98 119.16 3ktc s PHE 9 Ca 0.46 -0.06 -0.05 0.00 0.12 0.00 0.00 56.93 57.39 3ktc s PHE 9 Cb -0.28 -1.52 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 3ktc s PHE 9 CO 0.36 0.45 0.32 0.20 -0.10 0.00 0.00 175.22 176.45 3ktc s GLY 10 N -2.14 1.13 -0.01 4.36 0.00 -0.50 -0.35 107.32 109.82 3ktc s GLY 10 Ca 0.23 -1.37 -0.15 0.00 0.00 0.00 0.00 44.72 43.43 3ktc s GLY 10 CO 0.15 -1.05 0.31 0.00 0.00 0.00 0.00 173.10 172.52 3ktc s ALA 11 N -3.92 -0.77 0.36 3.20 0.00 -0.83 -0.64 121.76 119.15 3ktc s ALA 11 Ca 0.31 0.29 -0.29 0.00 0.00 0.00 0.00 51.96 52.28 3ktc s ALA 11 Cb 0.03 0.10 -0.11 0.00 0.00 0.00 0.00 23.12 23.13 3ktc s ALA 11 CO 0.13 -0.27 1.53 0.20 0.00 0.00 0.00 175.76 177.34 3ktc s GLY 12 N -1.39 2.71 0.40 0.00 0.00 -0.22 -1.90 107.32 106.92 3ktc s GLY 12 Ca -0.13 1.60 0.07 0.00 0.00 0.00 0.00 44.72 46.25 3ktc s GLY 12 CO 0.04 2.37 2.05 -2.00 0.00 0.00 0.00 173.10 175.55 3ktc h LEU 13 N 3.49 0.47 -0.87 0.66 5.85 -1.26 -0.54 115.31 123.11 3ktc h LEU 13 Ca -0.50 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3ktc h LEU 13 Cb 1.23 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3ktc h LEU 13 CO 0.68 0.36 0.01 -2.67 -0.34 0.00 0.00 178.44 176.48 3ktc n TRP 14 N -4.46 0.44 0.25 1.25 2.14 -1.26 -0.78 117.44 115.02 3ktc n TRP 14 Ca 0.03 0.23 0.18 0.00 2.07 0.00 0.00 57.50 60.01 3ktc n TRP 14 Cb 0.07 -0.87 0.89 0.00 -0.81 0.00 0.00 31.31 30.60 3ktc n TRP 14 CO 0.00 0.00 0.00 1.25 2.07 0.00 0.00 177.69 181.01 3ktc h HIS 15 N 0.00 0.00 -0.29 -2.67 2.76 -1.25 -2.21 115.15 111.49 3ktc h HIS 15 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3ktc h HIS 15 Cb 0.01 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.97 3ktc h HIS 15 CO 0.00 0.00 0.00 1.19 -1.30 0.00 0.00 177.93 177.82 3ktc n PHE 16 N -3.57 0.51 -2.93 5.26 3.72 0.04 -4.71 117.46 115.77 3ktc n PHE 16 Ca 0.00 -0.59 -0.25 0.00 -0.05 0.00 0.00 57.45 56.56 3ktc n PHE 16 Cb 0.28 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 3ktc n PHE 16 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ktc s ALA 17 N -1.44 3.56 0.08 4.37 0.00 -0.83 -4.67 121.76 122.82 3ktc s ALA 17 Ca 0.25 -0.76 -0.03 0.00 0.00 0.00 0.00 51.96 51.42 3ktc s ALA 17 Cb 0.16 -2.34 -0.05 0.00 0.00 0.00 0.00 23.12 20.89 3ktc s ALA 17 CO 0.12 -0.29 0.27 -0.80 0.00 0.00 0.00 175.76 175.07 3ktc s ASN 18 N -4.12 6.42 0.50 0.00 0.01 -1.26 -4.96 114.94 111.53 3ktc s ASN 18 Ca 0.46 0.43 0.07 0.00 -0.71 0.00 0.00 52.86 53.10 3ktc s ASN 18 Cb -0.10 -2.03 0.02 0.00 0.41 0.00 0.00 41.25 39.55 3ktc s ASN 18 CO 0.41 0.15 0.41 -0.31 -1.51 0.00 0.00 177.10 176.24 3ktc s TYR 19 N -1.52 1.99 0.07 2.20 2.02 -1.26 -4.89 117.35 115.95 3ktc s TYR 19 Ca 0.36 -0.72 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 3ktc s TYR 19 Cb -0.13 -2.01 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 3ktc s TYR 19 CO 0.25 -0.38 -0.06 0.42 -1.57 0.00 0.00 175.55 174.20 3ktc s ILE 20 N -2.67 0.56 0.33 2.71 1.01 -1.26 -0.55 121.20 121.33 3ktc s ILE 20 Ca 0.41 -1.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.40 3ktc s ILE 20 Cb -0.02 -1.31 0.01 0.00 0.01 0.00 0.00 42.46 41.15 3ktc s ILE 20 CO 0.25 -0.74 0.45 -0.90 0.00 0.00 0.00 174.94 173.99 3ktc n ASP 21 N 0.46 -1.25 0.00 3.58 5.68 -1.22 -5.01 116.55 118.79 3ktc n ASP 21 Ca -0.16 -2.80 0.07 0.00 -0.50 0.00 0.00 54.79 51.40 3ktc n ASP 21 Cb 0.59 2.35 0.31 0.00 -1.14 0.00 0.00 41.12 43.23 3ktc n ASP 21 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3ktc n ARG 22 N -0.55 0.05 -0.05 0.11 1.85 -1.26 -3.51 116.66 113.31 3ktc n ARG 22 Ca 0.01 0.23 -0.06 0.00 -1.00 0.00 0.00 57.85 57.03 3ktc n ARG 22 Cb 0.55 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.44 3ktc n ARG 22 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3ktc n TYR 23 N -1.45 0.00 -1.97 2.89 4.01 -1.26 -4.67 117.16 114.72 3ktc n TYR 23 Ca 0.04 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.36 3ktc n TYR 23 Cb 0.15 -0.35 0.00 0.00 -0.31 0.00 0.00 39.34 38.83 3ktc n TYR 23 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ktc n ALA 24 N -4.17 5.22 0.56 -0.72 0.00 -1.25 -4.69 120.51 115.47 3ktc n ALA 24 Ca -0.10 -3.96 0.10 0.00 0.00 0.00 0.00 53.44 49.49 3ktc n ALA 24 Cb 0.37 -3.44 0.43 0.00 0.00 0.00 0.00 19.45 16.80 3ktc n ALA 24 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3ktc n VAL 25 N 4.96 0.74 0.69 0.00 0.24 -1.23 -1.38 118.33 122.36 3ktc n VAL 25 Ca 0.49 0.14 0.10 0.00 -2.04 0.00 0.00 64.34 63.03 3ktc n VAL 25 Cb 0.40 -0.92 0.27 0.00 -1.47 0.00 0.00 33.84 32.11 3ktc n VAL 25 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3ktc n ASP 26 N -1.85 2.49 0.00 -1.34 5.75 -1.26 -4.94 116.55 115.40 3ktc n ASP 26 Ca 0.04 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 3ktc n ASP 26 Cb 0.25 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 3ktc n ASP 26 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ktc n GLY 27 N 1.28 0.03 0.84 6.12 0.00 -0.48 -4.72 105.19 108.27 3ktc n GLY 27 Ca 0.17 -1.71 0.07 0.00 0.00 0.00 0.00 46.02 44.55 3ktc n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ktc n TYR 28 N 0.18 0.63 0.00 1.61 4.02 0.28 -4.96 117.16 118.92 3ktc n TYR 28 Ca 0.00 -0.30 0.00 0.00 -0.01 0.00 0.00 57.90 57.59 3ktc n TYR 28 Cb 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.30 3ktc n TYR 28 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ktc n GLY 29 N 1.14 0.61 3.79 2.72 0.00 -1.26 -4.89 105.19 107.31 3ktc n GLY 29 Ca 0.15 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.62 3ktc n GLY 29 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ktc s PRO 30 N -1.99 3.02 0.08 1.61 0.04 -1.26 -4.81 135.00 131.68 3ktc s PRO 30 Ca 0.00 1.23 -0.31 0.00 0.04 0.00 0.00 61.00 61.96 3ktc s PRO 30 Cb 0.00 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 3ktc s PRO 30 CO 0.00 -1.06 1.43 0.00 0.04 0.00 0.00 177.00 177.42 3ktc s ALA 31 N -2.53 3.61 -0.11 8.56 0.00 -1.26 -4.47 121.76 125.55 3ktc s ALA 31 Ca 0.64 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 53.66 3ktc s ALA 31 Cb -0.17 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 3ktc s ALA 31 CO 0.42 -0.76 -0.04 -0.51 0.00 0.00 0.00 175.76 174.87 3ktc s LEU 32 N 1.64 3.28 0.94 0.00 1.43 -1.26 -5.05 118.68 119.67 3ktc s LEU 32 Ca 0.66 -0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 53.59 3ktc s LEU 32 Cb -0.36 -1.76 0.16 0.00 0.03 0.00 0.00 46.19 44.26 3ktc s LEU 32 CO 0.29 0.27 1.12 -0.94 0.23 0.00 0.00 176.35 177.32 3ktc s SER 33 N -0.24 3.17 0.27 2.29 1.04 -1.26 -4.80 113.70 114.17 3ktc s SER 33 Ca 0.04 1.08 -0.00 0.00 0.48 0.00 0.00 55.95 57.55 3ktc s SER 33 Cb -0.13 -1.70 0.52 0.00 0.10 0.00 0.00 66.02 64.81 3ktc s SER 33 CO 0.02 -2.77 1.81 0.74 0.98 0.00 0.00 173.24 174.02 3ktc h THR 34 N -1.65 0.87 -0.22 2.02 2.02 -1.95 -0.58 112.91 113.41 3ktc h THR 34 Ca -0.52 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.28 3ktc h THR 34 Cb 1.33 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3ktc h THR 34 CO 0.60 0.16 -0.20 0.40 0.37 0.00 0.00 175.52 176.85 3ktc h ILE 35 N 0.87 1.32 -1.00 3.11 1.08 -1.96 -1.66 117.51 119.26 3ktc h ILE 35 Ca 0.47 -1.34 0.09 0.00 -0.39 0.00 0.00 64.86 63.69 3ktc h ILE 35 Cb 0.51 1.69 -0.08 0.00 -3.07 0.00 0.00 36.82 35.88 3ktc h ILE 35 CO -0.28 0.41 0.64 0.44 -0.69 0.00 0.00 178.15 178.67 3ktc h ASP 36 N 0.22 0.98 -0.49 1.72 3.32 -1.77 -0.56 116.42 119.86 3ktc h ASP 36 Ca 0.04 0.03 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 3ktc h ASP 36 Cb 0.74 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 3ktc h ASP 36 CO 0.05 0.58 -0.22 1.56 -1.72 0.00 0.00 179.24 179.49 3ktc h GLN 37 N 1.09 1.01 -0.59 3.56 4.20 -0.87 -0.42 115.11 123.09 3ktc h GLN 37 Ca 0.46 -0.43 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 3ktc h GLN 37 Cb 0.32 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 3ktc h GLN 37 CO -0.22 1.11 0.21 0.82 -0.67 0.00 0.00 178.83 180.09 3ktc h ILE 38 N 0.87 1.24 -0.78 2.54 2.04 -0.77 -0.56 117.51 122.08 3ktc h ILE 38 Ca 0.11 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 3ktc h ILE 38 Cb 0.80 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 3ktc h ILE 38 CO 0.07 0.29 0.41 0.78 0.00 0.00 0.00 178.15 179.70 3ktc h ASN 39 N 0.83 0.99 -0.38 1.72 2.35 -0.89 -1.34 115.58 118.86 3ktc h ASN 39 Ca 0.19 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 3ktc h ASN 39 Cb 0.25 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 3ktc h ASN 39 CO -0.01 0.81 0.18 0.00 -1.65 0.00 0.00 177.43 176.76 3ktc h ALA 40 N 1.35 0.48 -0.67 -0.83 0.00 -0.74 -2.79 119.26 116.06 3ktc h ALA 40 Ca 0.28 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.10 3ktc h ALA 40 Cb 0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3ktc h ALA 40 CO -0.04 0.05 0.44 0.00 0.00 0.00 0.00 179.25 179.70 3ktc h ALA 41 N 1.03 1.57 -0.86 0.00 0.00 -0.59 -0.70 119.26 119.71 3ktc h ALA 41 Ca 0.13 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3ktc h ALA 41 Cb 0.12 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 3ktc h ALA 41 CO -0.02 0.38 0.56 -0.22 0.00 0.00 0.00 179.25 179.96 3ktc h LYS 42 N 0.86 0.89 0.00 0.00 3.64 -0.99 -2.29 116.57 118.67 3ktc h LYS 42 Ca 0.25 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3ktc h LYS 42 Cb -0.03 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 3ktc h LYS 42 CO -0.06 0.59 0.00 0.39 -2.27 0.00 0.00 179.45 178.09 3ktc n GLU 43 N -4.50 0.05 -0.18 1.90 -0.58 -0.27 -2.61 120.64 114.44 3ktc n GLU 43 Ca 0.13 0.23 -0.08 0.00 -0.42 0.00 0.00 57.16 57.02 3ktc n GLU 43 Cb 0.24 -1.59 0.01 0.00 -0.57 0.00 0.00 31.44 29.54 3ktc n GLU 43 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3ktc h VAL 44 N 0.00 1.22 0.00 2.62 2.07 -1.40 -3.47 116.25 117.29 3ktc h VAL 44 Ca 0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3ktc h VAL 44 Cb 0.35 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3ktc h VAL 44 CO 0.00 0.26 0.00 0.61 0.02 0.00 0.00 177.57 178.46 3ktc n GLY 45 N -0.78 2.70 0.27 2.17 0.00 -1.07 -4.87 105.19 103.61 3ktc n GLY 45 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.87 3ktc n GLY 45 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ktc n GLU 46 N 0.00 0.20 -3.09 1.61 4.07 -1.26 -5.00 120.64 117.17 3ktc n GLU 46 Ca 0.00 -0.98 -0.37 0.00 -0.06 0.00 0.00 57.16 55.75 3ktc n GLU 46 Cb 0.00 -1.13 -0.06 0.00 -0.06 0.00 0.00 31.44 30.19 3ktc n GLU 46 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 3ktc s LEU 47 N -0.59 4.41 -0.01 4.31 1.43 -1.26 -4.36 118.68 122.60 3ktc s LEU 47 Ca 0.08 1.45 0.07 0.00 -1.03 0.00 0.00 54.13 54.71 3ktc s LEU 47 Cb 0.06 -3.48 -0.11 0.00 0.03 0.00 0.00 46.19 42.69 3ktc s LEU 47 CO 0.08 0.08 0.17 -1.20 0.23 0.00 0.00 176.35 175.71 3ktc n SER 48 N 0.97 3.22 -4.02 2.29 7.64 0.53 -4.81 113.62 119.44 3ktc n SER 48 Ca -0.04 -0.03 -0.10 0.00 1.01 0.00 0.00 58.87 59.72 3ktc n SER 48 Cb 0.51 1.32 -0.11 0.00 -1.01 0.00 0.00 64.21 64.92 3ktc n SER 48 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3ktc s TYR 49 N -2.48 0.41 0.09 1.43 1.51 -1.08 -1.50 117.35 115.73 3ktc s TYR 49 Ca -0.02 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.49 3ktc s TYR 49 Cb 0.05 -0.27 -0.04 0.00 -0.11 0.00 0.00 41.96 41.59 3ktc s TYR 49 CO 0.30 -0.18 -0.09 0.14 -1.11 0.00 0.00 175.55 174.61 3ktc s VAL 50 N -1.72 0.88 -0.29 0.71 -7.23 -0.41 -1.97 120.40 110.37 3ktc s VAL 50 Ca -0.12 -1.64 -0.10 0.00 -1.81 0.00 0.00 61.98 58.31 3ktc s VAL 50 Cb -0.08 -1.35 -0.03 0.00 0.56 0.00 0.00 36.38 35.48 3ktc s VAL 50 CO -0.02 -0.59 0.15 -0.62 -0.31 0.00 0.00 175.10 173.72 3ktc s ASP 51 N -2.47 5.67 -0.24 4.85 -1.08 -0.80 -0.81 116.67 121.78 3ktc s ASP 51 Ca 0.05 -0.23 -0.10 0.00 -0.52 0.00 0.00 52.55 51.75 3ktc s ASP 51 Cb -0.02 -2.04 -0.05 0.00 -1.46 0.00 0.00 42.92 39.35 3ktc s ASP 51 CO -0.01 -0.10 0.15 -0.76 0.52 0.00 0.00 175.17 174.98 3ktc s LEU 52 N 1.68 4.03 0.54 -1.34 1.02 -0.67 -0.68 118.68 123.27 3ktc s LEU 52 Ca 0.06 0.06 -0.21 0.00 0.02 0.00 0.00 54.13 54.06 3ktc s LEU 52 Cb -0.16 -2.09 -0.05 0.00 0.02 0.00 0.00 46.19 43.91 3ktc s LEU 52 CO 0.08 0.04 1.30 -2.84 0.02 0.00 0.00 176.35 174.96 3ktc s PRO 53 N 1.19 3.18 -0.01 1.29 0.02 -1.26 -0.87 135.00 138.54 3ktc s PRO 53 Ca 0.07 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.20 3ktc s PRO 53 Cb -0.14 -2.22 0.01 0.00 0.02 0.00 0.00 34.50 32.17 3ktc s PRO 53 CO 0.05 -1.11 -0.01 -0.47 -0.33 0.00 0.00 177.00 175.13 3ktc s TYR 54 N -1.38 0.23 0.80 6.54 5.04 0.03 -4.10 117.35 124.52 3ktc s TYR 54 Ca 0.72 -0.02 -0.13 0.00 -2.44 0.00 0.00 57.07 55.20 3ktc s TYR 54 Cb -0.37 -0.22 0.08 0.00 0.35 0.00 0.00 41.96 41.80 3ktc s TYR 54 CO 0.43 -0.05 1.20 -2.14 -1.34 0.00 0.00 175.55 173.65 3ktc s PRO 55 N 0.33 1.68 0.95 4.97 0.02 -1.26 -0.48 135.00 141.21 3ktc s PRO 55 Ca -0.03 1.71 -0.12 0.00 0.02 0.00 0.00 61.00 62.58 3ktc s PRO 55 Cb -0.05 -1.79 0.16 0.00 0.02 0.00 0.00 34.50 32.84 3ktc s PRO 55 CO -0.01 -2.17 1.10 -0.06 -0.33 0.00 0.00 177.00 175.53 3ktc s PHE 56 N -2.20 2.27 0.86 6.54 0.08 -1.26 -4.94 117.98 119.33 3ktc s PHE 56 Ca 0.72 0.99 -0.12 0.00 0.12 0.00 0.00 56.93 58.64 3ktc s PHE 56 Cb -0.28 -3.28 0.11 0.00 -0.57 0.00 0.00 43.02 39.01 3ktc s PHE 56 CO 0.50 -2.64 1.18 0.25 -0.10 0.00 0.00 175.22 174.41 3ktc n THR 57 N -4.00 1.17 -1.61 0.64 -2.24 -1.26 -4.82 114.28 102.17 3ktc n THR 57 Ca 0.06 -0.12 -0.49 0.00 -2.27 0.00 0.00 64.05 61.22 3ktc n THR 57 Cb 0.57 -1.11 -0.05 0.00 -2.10 0.00 0.00 70.33 67.64 3ktc n THR 57 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3ktc n PRO 58 N -3.70 1.40 0.00 -0.78 -0.02 -1.26 -1.56 135.00 129.08 3ktc n PRO 58 Ca 0.13 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3ktc n PRO 58 Cb 0.51 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3ktc n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ktc n GLY 59 N 2.50 2.83 3.70 -1.23 0.00 -1.26 -5.02 105.19 106.71 3ktc n GLY 59 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3ktc n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ktc s VAL 60 N -1.96 4.73 0.28 1.61 1.01 -0.60 -5.04 120.40 120.42 3ktc s VAL 60 Ca 0.00 1.98 0.06 0.00 0.00 0.00 0.00 61.98 64.02 3ktc s VAL 60 Cb 0.00 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 3ktc s VAL 60 CO 0.00 0.08 0.34 0.42 0.00 0.00 0.00 175.10 175.93 3ktc s THR 61 N 1.55 4.56 0.27 3.92 -4.23 -1.26 -4.76 115.64 115.69 3ktc s THR 61 Ca 0.51 -1.14 -0.03 0.00 -1.18 0.00 0.00 61.69 59.85 3ktc s THR 61 Cb -0.21 -3.56 0.27 0.00 1.34 0.00 0.00 72.50 70.34 3ktc s THR 61 CO 0.23 -0.27 1.91 0.25 -0.54 0.00 0.00 174.62 176.20 3ktc h LEU 62 N 1.19 1.05 -0.51 4.79 5.85 -1.99 -1.25 115.31 124.45 3ktc h LEU 62 Ca -0.49 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 3ktc h LEU 62 Cb 1.24 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 3ktc h LEU 62 CO 0.59 0.71 0.30 0.28 -0.34 0.00 0.00 178.44 179.98 3ktc h SER 63 N 1.21 0.61 -0.74 1.25 0.02 -1.99 -0.41 113.55 113.50 3ktc h SER 63 Ca 0.39 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.24 3ktc h SER 63 Cb 0.03 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 3ktc h SER 63 CO -0.13 0.50 0.31 -0.33 -1.14 0.00 0.00 176.83 176.04 3ktc h GLU 64 N 0.68 1.12 -0.28 3.45 5.08 -1.82 -1.79 114.58 121.01 3ktc h GLU 64 Ca 0.18 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3ktc h GLU 64 Cb 0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 3ktc h GLU 64 CO -0.03 0.90 0.12 0.28 -1.00 0.00 0.00 179.01 179.28 3ktc h VAL 65 N 1.09 1.16 -0.67 3.13 2.07 -0.87 -1.01 116.25 121.16 3ktc h VAL 65 Ca 0.25 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 67.34 3ktc h VAL 65 Cb 0.19 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 3ktc h VAL 65 CO -0.02 0.17 0.38 0.11 0.02 0.00 0.00 177.57 178.22 3ktc h LYS 66 N 0.30 0.67 -0.43 1.57 1.57 -0.83 0.51 116.57 119.93 3ktc h LYS 66 Ca 0.09 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3ktc h LYS 66 Cb 0.15 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3ktc h LYS 66 CO -0.01 0.45 0.09 -0.44 -0.57 0.00 0.00 179.45 178.96 3ktc h ASP 67 N 0.70 0.67 -0.51 0.86 3.32 -1.12 -1.23 116.42 119.11 3ktc h ASP 67 Ca 0.30 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3ktc h ASP 67 Cb 0.19 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3ktc h ASP 67 CO -0.18 0.75 0.09 0.00 -1.72 0.00 0.00 179.24 178.18 3ktc h ALA 68 N 0.95 0.68 -0.19 3.45 0.00 -0.72 -0.58 119.26 122.85 3ktc h ALA 68 Ca 0.13 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ktc h ALA 68 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3ktc h ALA 68 CO 0.01 0.41 0.11 -0.07 0.00 0.00 0.00 179.25 179.70 3ktc h LEU 69 N 0.73 0.24 -0.50 0.00 3.38 -0.80 -1.17 115.31 117.18 3ktc h LEU 69 Ca 0.16 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3ktc h LEU 69 Cb 0.39 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3ktc h LEU 69 CO 0.01 0.26 0.32 0.50 0.09 0.00 0.00 178.44 179.62 3ktc h LYS 70 N 0.21 0.63 0.00 1.13 3.64 -1.04 -0.65 116.57 120.48 3ktc h LYS 70 Ca 0.07 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3ktc h LYS 70 Cb 0.07 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3ktc h LYS 70 CO -0.01 0.42 -0.20 -0.44 -2.27 0.00 0.00 179.45 176.94 3ktc h ASP 71 N 0.65 0.00 0.55 4.20 3.32 -0.92 -2.47 116.42 121.74 3ktc h ASP 71 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3ktc h ASP 71 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3ktc h ASP 71 CO -0.06 0.20 -0.27 0.00 -1.72 0.00 0.00 179.24 177.39 3ktc n ALA 72 N -2.32 3.04 -2.64 3.45 0.00 -0.46 -4.94 120.51 116.65 3ktc n ALA 72 Ca -0.01 -0.28 -0.14 0.00 0.00 0.00 0.00 53.44 53.01 3ktc n ALA 72 Cb 0.32 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.54 3ktc n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ktc n GLY 73 N 1.43 -0.07 3.41 0.00 0.00 -0.82 -4.74 105.19 104.39 3ktc n GLY 73 Ca 0.09 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 3ktc n GLY 73 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ktc s LEU 74 N -4.17 2.38 0.18 0.99 1.43 -0.31 -4.66 118.68 114.51 3ktc s LEU 74 Ca 0.15 -0.76 0.11 0.00 -1.03 0.00 0.00 54.13 52.59 3ktc s LEU 74 Cb -0.07 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 3ktc s LEU 74 CO 0.19 0.17 -0.23 -0.54 0.23 0.00 0.00 176.35 176.17 3ktc s LYS 75 N -2.21 1.43 -0.19 1.70 1.02 -0.56 -4.23 119.74 116.70 3ktc s LYS 75 Ca 0.16 -1.47 -0.27 0.00 0.02 0.00 0.00 55.97 54.40 3ktc s LYS 75 Cb -0.10 -1.69 -0.00 0.00 -0.52 0.00 0.00 37.83 35.52 3ktc s LYS 75 CO 0.07 0.36 0.95 0.00 -0.92 0.00 0.00 175.35 175.81 3ktc s ALA 76 N -1.71 3.57 -0.09 5.17 0.00 -1.26 -1.29 121.76 126.16 3ktc s ALA 76 Ca 0.18 0.14 0.14 0.00 0.00 0.00 0.00 51.96 52.43 3ktc s ALA 76 Cb -0.08 -3.40 -0.22 0.00 0.00 0.00 0.00 23.12 19.42 3ktc s ALA 76 CO 0.09 -0.83 0.56 1.51 0.00 0.00 0.00 175.76 177.09 3ktc n ILE 77 N 4.98 1.48 -3.73 0.00 0.13 0.01 -3.95 119.36 118.28 3ktc n ILE 77 Ca 0.08 -0.79 -0.10 0.00 -1.10 0.00 0.00 62.75 60.84 3ktc n ILE 77 Cb 0.48 -0.86 -0.05 0.00 -0.84 0.00 0.00 39.64 38.36 3ktc n ILE 77 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 3ktc s GLY 78 N -5.14 -0.08 -0.08 4.50 0.00 -1.25 -1.05 107.32 104.22 3ktc s GLY 78 Ca -0.06 -0.29 0.03 0.00 0.00 0.00 0.00 44.72 44.40 3ktc s GLY 78 CO 0.83 -0.46 -0.16 -0.42 0.00 0.00 0.00 173.10 172.88 3ktc s ILE 79 N -3.85 1.46 -0.43 0.90 -1.09 -0.86 -1.67 121.20 115.66 3ktc s ILE 79 Ca 0.06 -0.65 -0.05 0.00 -2.23 0.00 0.00 60.65 57.77 3ktc s ILE 79 Cb 0.02 -1.30 0.11 0.00 -1.58 0.00 0.00 42.46 39.71 3ktc s ILE 79 CO -0.09 0.43 0.26 -0.89 -1.23 0.00 0.00 174.94 173.42 3ktc s THR 80 N 0.66 3.65 0.27 2.92 2.01 -0.05 -0.31 115.64 124.79 3ktc s THR 80 Ca -0.14 -1.96 -0.30 0.00 0.31 0.00 0.00 61.69 59.60 3ktc s THR 80 Cb -0.16 -3.46 -0.11 0.00 0.01 0.00 0.00 72.50 68.78 3ktc s THR 80 CO 0.04 -0.73 1.56 -2.16 -0.69 0.00 0.00 174.62 172.64 3ktc s PRO 81 N 1.22 4.16 -1.32 4.92 0.04 -1.26 -0.79 135.00 141.98 3ktc s PRO 81 Ca 0.07 2.50 -0.13 0.00 0.04 0.00 0.00 61.00 63.49 3ktc s PRO 81 Cb -0.24 -3.05 0.12 0.00 0.04 0.00 0.00 34.50 31.36 3ktc s PRO 81 CO -0.03 -0.58 1.87 0.39 0.04 0.00 0.00 177.00 178.69 3ktc n GLU 82 N 2.38 3.29 -0.53 4.56 1.02 0.37 -4.73 120.64 127.00 3ktc n GLU 82 Ca 0.08 -3.29 0.01 0.00 -0.02 0.00 0.00 57.16 53.94 3ktc n GLU 82 Cb 0.38 -3.14 0.20 0.00 -0.02 0.00 0.00 31.44 28.87 3ktc n GLU 82 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3ktc n ILE 83 N 4.54 1.65 -0.53 -3.67 -5.35 -1.26 -3.74 119.36 111.00 3ktc n ILE 83 Ca 0.44 -0.82 0.01 0.00 -0.27 0.00 0.00 62.75 62.10 3ktc n ILE 83 Cb 0.40 -0.44 0.01 0.00 -1.74 0.00 0.00 39.64 37.87 3ktc n ILE 83 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ktc n TYR 84 N 0.21 0.00 -1.68 4.28 0.18 -1.26 -4.40 117.16 114.49 3ktc n TYR 84 Ca 0.18 -0.32 -0.29 0.00 1.88 0.00 0.00 57.90 59.35 3ktc n TYR 84 Cb 0.84 -0.04 0.17 0.00 -0.38 0.00 0.00 39.34 39.93 3ktc n TYR 84 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3ktc s LEU 85 N -0.70 2.15 0.29 -3.48 1.43 -1.25 -4.67 118.68 112.46 3ktc s LEU 85 Ca 0.02 0.58 0.03 0.00 -1.03 0.00 0.00 54.13 53.72 3ktc s LEU 85 Cb 0.02 -2.69 0.73 0.00 0.03 0.00 0.00 46.19 44.27 3ktc s LEU 85 CO 0.00 -2.82 1.66 -0.61 0.23 0.00 0.00 176.35 174.81 3ktc h GLN 86 N -1.69 0.25 -0.91 1.70 4.15 -1.97 0.19 115.11 116.82 3ktc h GLN 86 Ca -0.46 -0.02 0.19 0.00 0.77 0.00 0.00 58.65 59.13 3ktc h GLN 86 Cb 1.28 -0.06 -0.07 0.00 0.21 0.00 0.00 27.48 28.84 3ktc h GLN 86 CO 0.47 0.17 0.59 -0.22 -1.93 0.00 0.00 178.83 177.91 3ktc h LYS 87 N 0.26 0.50 -0.34 1.69 3.64 -1.97 -0.79 116.57 119.56 3ktc h LYS 87 Ca 0.56 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.75 3ktc h LYS 87 Cb 1.12 -0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 32.73 3ktc h LYS 87 CO -0.62 0.33 -0.08 0.91 -2.27 0.00 0.00 179.45 177.73 3ktc n TRP 88 N -4.56 1.05 0.29 1.91 8.01 0.58 -4.71 117.44 120.02 3ktc n TRP 88 Ca 0.19 -1.54 0.17 0.00 -1.31 0.00 0.00 57.50 55.02 3ktc n TRP 88 Cb 0.63 -0.47 0.87 0.00 -2.01 0.00 0.00 31.31 30.33 3ktc n TRP 88 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3ktc h SER 89 N 1.05 0.00 -0.34 -0.99 4.64 -0.36 0.49 113.55 118.04 3ktc h SER 89 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3ktc h SER 89 Cb 1.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 3ktc h SER 89 CO 0.37 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.87 3ktc n ARG 90 N -2.75 3.09 0.00 4.77 1.74 -1.26 -4.92 116.66 117.32 3ktc n ARG 90 Ca -0.01 -2.61 0.00 0.00 -0.77 0.00 0.00 57.85 54.45 3ktc n ARG 90 Cb 0.12 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 3ktc n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ktc n GLY 91 N 0.02 3.68 0.00 -0.13 0.00 0.16 -4.15 105.19 104.79 3ktc n GLY 91 Ca 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3ktc n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktc n ALA 92 N -1.30 0.39 0.22 4.61 0.00 -1.26 -3.95 120.51 119.22 3ktc n ALA 92 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3ktc n ALA 92 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 19.45 19.96 3ktc n ALA 92 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3ktc h PHE 93 N 0.00 0.00 -0.35 0.00 0.04 -1.92 -3.02 116.94 111.69 3ktc h PHE 93 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3ktc h PHE 93 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3ktc h PHE 93 CO 0.00 0.22 0.00 0.25 -0.60 0.00 0.00 178.31 178.18 3ktc n THR 94 N -4.14 1.62 -1.70 -1.55 -2.24 -1.26 -4.57 114.28 100.45 3ktc n THR 94 Ca -0.02 -1.37 -0.43 0.00 -2.27 0.00 0.00 64.05 59.95 3ktc n THR 94 Cb 0.28 0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.65 3ktc n THR 94 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3ktc n ASN 95 N 0.19 2.98 0.32 3.42 2.85 -1.14 -4.78 115.26 119.11 3ktc n ASN 95 Ca 0.17 1.17 0.20 0.00 -0.11 0.00 0.00 54.58 56.01 3ktc n ASN 95 Cb 0.67 -1.48 1.03 0.00 1.24 0.00 0.00 39.78 41.24 3ktc n ASN 95 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3ktc h PRO 96 N 3.70 0.00 -5.50 1.20 0.13 -1.91 -3.41 132.00 126.21 3ktc h PRO 96 Ca -0.46 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.04 3ktc h PRO 96 Cb 1.27 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.26 3ktc h PRO 96 CO 0.71 0.01 0.16 0.34 -0.23 0.00 0.00 178.00 178.99 3ktc s ASP 97 N -5.42 6.42 0.48 1.44 2.15 -1.26 -4.95 116.67 115.53 3ktc s ASP 97 Ca -0.03 0.10 0.18 0.00 0.43 0.00 0.00 52.55 53.23 3ktc s ASP 97 Cb 0.12 -2.33 1.18 0.00 -0.30 0.00 0.00 42.92 41.59 3ktc s ASP 97 CO 0.47 -0.63 2.01 -0.65 -0.17 0.00 0.00 175.17 176.20 3ktc h PRO 98 N 8.52 0.21 -0.53 4.34 0.11 -2.00 -0.98 132.00 141.67 3ktc h PRO 98 Ca -0.26 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.77 3ktc h PRO 98 Cb 1.11 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3ktc h PRO 98 CO 0.85 0.14 0.07 0.00 -0.21 0.00 0.00 178.00 178.85 3ktc h ALA 99 N 1.75 1.13 -0.53 -0.75 0.00 -1.95 -1.35 119.26 117.57 3ktc h ALA 99 Ca 0.23 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3ktc h ALA 99 Cb 0.60 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3ktc h ALA 99 CO -0.04 0.57 -0.04 0.00 0.00 0.00 0.00 179.25 179.74 3ktc h ALA 100 N 1.28 0.72 -0.80 0.00 0.00 -1.58 -1.21 119.26 117.67 3ktc h ALA 100 Ca 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3ktc h ALA 100 Cb 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3ktc h ALA 100 CO 0.01 0.57 0.46 0.00 0.00 0.00 0.00 179.25 180.29 3ktc h ARG 101 N 0.83 1.09 -0.48 0.00 3.08 -1.07 -0.50 114.38 117.33 3ktc h ARG 101 Ca 0.14 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 3ktc h ARG 101 Cb 0.58 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 3ktc h ARG 101 CO 0.03 0.79 0.09 0.00 -1.07 0.00 0.00 179.97 179.81 3ktc h ALA 102 N 1.25 0.64 -0.65 0.04 0.00 -1.12 -1.17 119.26 118.24 3ktc h ALA 102 Ca 0.28 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3ktc h ALA 102 Cb -0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3ktc h ALA 102 CO -0.05 0.36 0.15 0.00 0.00 0.00 0.00 179.25 179.71 3ktc h ALA 103 N 0.97 1.05 -0.33 0.00 0.00 -0.95 -0.92 119.26 119.08 3ktc h ALA 103 Ca 0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ktc h ALA 103 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3ktc h ALA 103 CO 0.01 0.62 0.20 0.00 0.00 0.00 0.00 179.25 180.09 3ktc h ALA 104 N 1.19 0.43 -0.43 0.00 0.00 -0.88 -1.83 119.26 117.74 3ktc h ALA 104 Ca 0.21 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.12 3ktc h ALA 104 Cb 0.35 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3ktc h ALA 104 CO 0.00 -0.08 0.15 0.35 0.00 0.00 0.00 179.25 179.67 3ktc h PHE 105 N 0.44 0.27 -0.76 0.00 3.04 -0.78 -2.60 116.94 116.54 3ktc h PHE 105 Ca 0.12 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.11 3ktc h PHE 105 Cb -0.00 -0.06 -0.04 0.00 2.56 0.00 0.00 35.95 38.41 3ktc h PHE 105 CO -0.04 0.11 0.49 0.93 -2.02 0.00 0.00 178.31 177.78 3ktc h GLU 106 N 0.32 0.95 -0.51 1.11 4.39 -0.86 0.19 114.58 120.18 3ktc h GLU 106 Ca 0.20 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3ktc h GLU 106 Cb 0.18 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 3ktc h GLU 106 CO -0.20 0.63 0.00 -0.11 -1.16 0.00 0.00 179.01 178.17 3ktc n LEU 107 N -4.59 0.26 0.00 1.33 7.94 -0.72 -1.44 117.00 119.78 3ktc n LEU 107 Ca 0.08 -0.13 0.00 0.00 -1.11 0.00 0.00 56.01 54.85 3ktc n LEU 107 Cb 0.05 -0.09 0.00 0.00 0.53 0.00 0.00 43.42 43.91 3ktc n LEU 107 CO 0.35 0.06 0.00 1.57 -1.11 0.00 0.00 177.39 178.25 3ktc n HIS 109 N 0.51 0.00 -0.29 1.96 -0.00 0.68 -0.80 115.22 117.27 3ktc n HIS 109 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.68 3ktc n HIS 109 Cb 0.06 0.00 0.11 0.00 -0.00 0.00 0.00 29.99 30.15 3ktc n HIS 109 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 3ktc h GLU 110 N 0.00 1.18 0.00 1.57 4.81 -1.48 -2.55 114.58 118.11 3ktc h GLU 110 Ca 0.00 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.02 3ktc h GLU 110 Cb 0.00 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 3ktc h GLU 110 CO 0.00 0.90 -0.21 0.77 -0.73 0.00 0.00 179.01 179.74 3ktc h SER 111 N 1.17 0.00 -0.41 1.04 0.02 -1.23 -1.17 113.55 112.97 3ktc h SER 111 Ca 0.29 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.14 3ktc h SER 111 Cb 0.10 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 3ktc h SER 111 CO -0.04 0.21 -0.07 0.00 -1.14 0.00 0.00 176.83 175.79 3ktc h ALA 112 N 1.79 0.97 -0.97 3.77 0.00 -1.73 -1.71 119.26 121.38 3ktc h ALA 112 Ca -0.00 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.62 3ktc h ALA 112 Cb 0.40 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3ktc h ALA 112 CO 0.03 0.61 0.64 0.78 0.00 0.00 0.00 179.25 181.31 3ktc h GLY 113 N 0.98 1.38 1.10 0.00 0.00 -1.07 -1.49 103.07 103.97 3ktc h GLY 113 Ca 0.14 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.87 3ktc h GLY 113 CO 0.03 0.47 -0.01 -2.22 0.00 0.00 0.00 176.54 174.81 3ktc h ILE 114 N 1.28 1.27 -0.58 2.60 1.08 -1.14 -0.61 117.51 121.40 3ktc h ILE 114 Ca 0.37 -1.17 0.06 0.00 -0.39 0.00 0.00 64.86 63.73 3ktc h ILE 114 Cb -0.09 0.81 -0.05 0.00 -3.07 0.00 0.00 36.82 34.41 3ktc h ILE 114 CO -0.09 0.42 0.30 0.58 -0.69 0.00 0.00 178.15 178.67 3ktc h VAL 115 N 0.97 0.93 -0.19 1.67 2.07 -0.89 -0.22 116.25 120.60 3ktc h VAL 115 Ca 0.17 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.50 3ktc h VAL 115 Cb 0.57 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 3ktc h VAL 115 CO 0.03 0.10 0.12 0.03 0.02 0.00 0.00 177.57 177.88 3ktc h ARG 116 N 0.56 0.25 -0.84 1.57 3.08 -0.87 -0.11 114.38 118.03 3ktc h ARG 116 Ca 0.27 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3ktc h ARG 116 Cb 0.19 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3ktc h ARG 116 CO -0.19 0.19 0.52 0.93 -1.07 0.00 0.00 179.97 180.35 3ktc h GLU 117 N 0.24 1.12 -0.02 0.04 4.39 -0.71 -2.97 114.58 116.67 3ktc h GLU 117 Ca 0.07 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3ktc h GLU 117 Cb -0.01 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.40 3ktc h GLU 117 CO -0.01 0.77 -0.02 1.28 -1.16 0.00 0.00 179.01 179.87 3ktc n LEU 118 N -4.47 2.03 -1.98 1.33 4.77 -0.13 -4.95 117.00 113.60 3ktc n LEU 118 Ca 0.09 -0.67 -0.17 0.00 -0.03 0.00 0.00 56.01 55.22 3ktc n LEU 118 Cb 0.04 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3ktc n LEU 118 CO 0.37 0.34 -0.20 0.61 -1.33 0.00 0.00 177.39 177.18 3ktc n GLY 119 N 1.25 -0.33 3.78 -0.72 0.00 -0.16 -4.53 105.19 104.48 3ktc n GLY 119 Ca 0.17 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3ktc n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktc s ALA 120 N -2.86 2.19 0.08 4.61 0.00 -0.57 -4.93 121.76 120.27 3ktc s ALA 120 Ca 0.02 -0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.87 3ktc s ALA 120 Cb -0.01 -3.18 -0.24 0.00 0.00 0.00 0.00 23.12 19.69 3ktc s ALA 120 CO 0.03 -1.77 1.16 -0.91 0.00 0.00 0.00 175.76 174.28 3ktc h ASN 121 N -1.12 0.76 -5.03 0.00 -0.26 -1.28 -3.46 115.58 105.20 3ktc h ASN 121 Ca -0.46 -0.68 -0.04 0.00 -0.56 0.00 0.00 56.30 54.56 3ktc h ASN 121 Cb 1.25 -0.24 -0.14 0.00 -1.06 0.00 0.00 38.32 38.14 3ktc h ASN 121 CO 0.56 1.49 0.08 -0.72 -1.06 0.00 0.00 177.43 177.78 3ktc s TYR 122 N -3.06 -0.42 -0.16 1.19 -0.85 -1.18 -4.23 117.35 108.65 3ktc s TYR 122 Ca -0.08 0.27 -0.26 0.00 -0.52 0.00 0.00 57.07 56.47 3ktc s TYR 122 Cb 0.07 0.41 -0.01 0.00 0.38 0.00 0.00 41.96 42.81 3ktc s TYR 122 CO 0.91 -0.74 0.89 0.08 -1.52 0.00 0.00 175.55 175.16 3ktc s VAL 123 N -3.33 4.84 -0.41 -3.49 1.01 0.09 -2.03 120.40 117.08 3ktc s VAL 123 Ca -0.01 1.75 -0.19 0.00 0.00 0.00 0.00 61.98 63.54 3ktc s VAL 123 Cb -0.00 -4.19 0.02 0.00 0.00 0.00 0.00 36.38 32.21 3ktc s VAL 123 CO -0.09 0.00 0.54 -0.75 0.00 0.00 0.00 175.10 174.81 3ktc s LYS 124 N 2.21 3.28 -0.36 2.72 2.36 0.58 -0.66 119.74 129.86 3ktc s LYS 124 Ca 0.41 -0.47 -0.13 0.00 -2.55 0.00 0.00 55.97 53.23 3ktc s LYS 124 Cb -0.17 -3.93 0.00 0.00 -1.05 0.00 0.00 37.83 32.69 3ktc s LYS 124 CO 0.13 -0.88 0.24 0.08 1.55 0.00 0.00 175.35 176.47 3ktc s VAL 125 N 2.49 5.05 -0.39 4.02 1.01 0.32 -4.05 120.40 128.86 3ktc s VAL 125 Ca 0.18 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.68 3ktc s VAL 125 Cb -0.15 -3.70 0.12 0.00 0.00 0.00 0.00 36.38 32.65 3ktc s VAL 125 CO 0.16 -0.13 0.18 0.86 0.00 0.00 0.00 175.10 176.17 3ktc s TRP 126 N 1.66 1.93 -1.33 5.22 -0.00 -1.26 -0.99 118.94 124.18 3ktc s TRP 126 Ca 0.05 -2.18 -0.08 0.00 -0.00 0.00 0.00 56.10 53.88 3ktc s TRP 126 Cb -0.18 -1.85 0.13 0.00 -0.00 0.00 0.00 33.47 31.57 3ktc s TRP 126 CO 0.09 -0.83 2.13 -0.35 -0.00 0.00 0.00 176.95 177.99 3ktc n PRO 127 N 4.06 3.89 0.07 5.86 -0.04 -1.26 -4.80 135.00 142.78 3ktc n PRO 127 Ca 0.05 -3.37 0.20 0.00 -0.04 0.00 0.00 63.50 60.33 3ktc n PRO 127 Cb 0.38 -2.85 0.74 0.00 -0.04 0.00 0.00 33.50 31.73 3ktc n PRO 127 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3ktc h GLY 128 N 7.21 0.00 -0.95 0.55 0.00 -1.91 -0.61 103.07 107.35 3ktc h GLY 128 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 3ktc h GLY 128 CO 1.61 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 177.09 3ktc n GLN 129 N -4.07 1.81 -3.30 4.80 1.13 -1.26 -3.69 117.38 112.80 3ktc n GLN 129 Ca 0.07 -1.21 -0.40 0.00 -1.94 0.00 0.00 57.00 53.52 3ktc n GLN 129 Cb 0.56 -1.41 -0.08 0.00 0.11 0.00 0.00 30.24 29.41 3ktc n GLN 129 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3ktc s ASP 130 N -1.60 6.31 0.00 1.08 1.11 -0.24 -3.31 116.67 120.02 3ktc s ASP 130 Ca 0.33 0.16 0.00 0.00 0.18 0.00 0.00 52.55 53.22 3ktc s ASP 130 Cb 0.18 -2.25 0.00 0.00 1.07 0.00 0.00 42.92 41.93 3ktc s ASP 130 CO 0.27 -0.34 0.00 0.61 1.18 0.00 0.00 175.17 176.89 3ktc n GLY 131 N 4.70 -0.33 3.29 0.21 0.00 -1.26 -1.12 105.19 110.69 3ktc n GLY 131 Ca -0.06 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.35 3ktc n GLY 131 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3ktc s TRP 132 N -2.93 -0.15 -0.07 1.61 1.48 -0.66 -4.95 118.94 113.27 3ktc s TRP 132 Ca 0.00 -0.12 0.08 0.00 -1.06 0.00 0.00 56.10 55.00 3ktc s TRP 132 Cb 0.00 0.19 -0.11 0.00 -1.16 0.00 0.00 33.47 32.39 3ktc s TRP 132 CO 0.00 -0.64 0.06 -0.25 -4.06 0.00 0.00 176.95 172.06 3ktc n ASP 133 N -0.01 2.95 -4.24 -2.66 8.00 -1.26 -1.71 116.55 117.62 3ktc n ASP 133 Ca -0.17 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.10 3ktc n ASP 133 Cb 0.63 0.82 -0.13 0.00 -0.02 0.00 0.00 41.12 42.42 3ktc n ASP 133 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3ktc s TYR 134 N -2.27 1.64 0.34 1.24 1.51 -1.26 -4.76 117.35 113.80 3ktc s TYR 134 Ca -0.04 -0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 55.35 3ktc s TYR 134 Cb 0.03 -0.94 -0.12 0.00 -0.11 0.00 0.00 41.96 40.82 3ktc s TYR 134 CO 0.35 0.13 1.15 -2.30 -1.11 0.00 0.00 175.55 173.76 3ktc n PRO 135 N 1.47 1.73 -0.68 -1.71 -0.02 -1.26 -1.94 135.00 132.60 3ktc n PRO 135 Ca -0.19 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3ktc n PRO 135 Cb 0.54 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3ktc n PRO 135 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ktc n PHE 136 N 0.12 0.00 0.19 6.00 3.72 -1.26 -4.88 117.46 121.35 3ktc n PHE 136 Ca 0.07 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.51 3ktc n PHE 136 Cb 0.35 -0.35 0.43 0.00 -0.94 0.00 0.00 39.48 38.97 3ktc n PHE 136 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 3ktc h GLN 137 N 2.07 0.04 -5.59 -1.08 4.15 -1.82 -3.44 115.11 109.44 3ktc h GLN 137 Ca 0.00 -0.01 -0.45 0.00 0.77 0.00 0.00 58.65 58.96 3ktc h GLN 137 Cb 0.00 -0.00 -0.18 0.00 0.21 0.00 0.00 27.48 27.51 3ktc h GLN 137 CO 0.00 0.29 -0.76 0.14 -1.93 0.00 0.00 178.83 176.56 3ktc s VAL 138 N -4.49 1.51 -0.35 2.39 -7.23 -1.26 -5.08 120.40 105.90 3ktc s VAL 138 Ca -0.04 -1.82 -0.29 0.00 -1.81 0.00 0.00 61.98 58.02 3ktc s VAL 138 Cb 0.15 -1.68 0.01 0.00 0.56 0.00 0.00 36.38 35.43 3ktc s VAL 138 CO 0.71 -0.40 1.25 -0.55 -0.31 0.00 0.00 175.10 175.80 3ktc s SER 139 N -2.59 6.67 0.26 4.85 0.15 -1.26 -4.93 113.70 116.85 3ktc s SER 139 Ca 0.12 1.01 -0.04 0.00 0.70 0.00 0.00 55.95 57.74 3ktc s SER 139 Cb -0.05 -2.54 0.32 0.00 -1.71 0.00 0.00 66.02 62.04 3ktc s SER 139 CO 0.04 -1.12 1.84 0.45 1.20 0.00 0.00 173.24 175.65 3ktc h HIS 140 N 9.25 1.02 0.02 3.44 -0.00 -1.99 0.06 115.15 126.97 3ktc h HIS 140 Ca -0.25 -0.06 -0.00 0.00 -0.00 0.00 0.00 60.37 60.06 3ktc h HIS 140 Cb 1.09 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 28.18 3ktc h HIS 140 CO 0.90 0.78 -0.01 -0.22 -0.00 0.00 0.00 177.93 179.38 3ktc h LYS 141 N 0.99 -0.03 -0.13 2.45 3.64 -2.00 -2.29 116.57 119.21 3ktc h LYS 141 Ca 0.23 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.44 3ktc h LYS 141 Cb 0.19 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3ktc h LYS 141 CO -0.02 0.04 -0.66 -0.91 -2.27 0.00 0.00 179.45 175.63 3ktc h ASN 142 N -0.09 0.60 -0.27 4.20 2.35 -1.88 -1.44 115.58 119.04 3ktc h ASN 142 Ca -0.00 -0.36 -0.01 0.00 -0.55 0.00 0.00 56.30 55.38 3ktc h ASN 142 Cb 0.08 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3ktc h ASN 142 CO 0.01 1.09 0.13 0.25 -1.65 0.00 0.00 177.43 177.25 3ktc h LEU 143 N 0.37 0.35 -0.81 1.61 5.85 -1.00 -1.20 115.31 120.48 3ktc h LEU 143 Ca -0.02 -0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.45 3ktc h LEU 143 Cb 1.22 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 3ktc h LEU 143 CO 0.12 0.39 -0.48 -0.25 -0.34 0.00 0.00 178.44 177.87 3ktc h TRP 144 N 0.30 0.32 -0.39 1.25 -0.00 -1.32 -1.69 115.95 114.41 3ktc h TRP 144 Ca 0.09 -0.10 -0.01 0.00 -0.00 0.00 0.00 58.89 58.87 3ktc h TRP 144 Cb 0.13 -0.07 -0.02 0.00 -0.00 0.00 0.00 29.16 29.20 3ktc h TRP 144 CO -0.02 0.70 0.21 -0.22 -0.00 0.00 0.00 178.44 179.11 3ktc h LYS 145 N 0.21 0.55 -0.75 2.65 3.64 -1.04 -0.81 116.57 121.02 3ktc h LYS 145 Ca 0.01 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 3ktc h LYS 145 Cb 0.93 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.60 3ktc h LYS 145 CO 0.08 0.45 0.47 -0.07 -2.27 0.00 0.00 179.45 178.11 3ktc h LEU 146 N 0.50 0.78 0.09 5.20 3.38 -0.88 0.15 115.31 124.53 3ktc h LEU 146 Ca 0.14 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3ktc h LEU 146 Cb 0.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3ktc h LEU 146 CO -0.02 0.54 -0.04 0.00 0.09 0.00 0.00 178.44 179.01 3ktc h ALA 147 N 1.31 -0.12 -0.10 1.53 0.00 -0.98 -0.49 119.26 120.42 3ktc h ALA 147 Ca 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 3ktc h ALA 147 Cb 0.01 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3ktc h ALA 147 CO -0.11 -0.56 -0.10 0.28 0.00 0.00 0.00 179.25 178.77 3ktc h VAL 148 N -0.13 1.36 -0.64 0.00 2.07 -0.99 -3.27 116.25 114.64 3ktc h VAL 148 Ca -0.01 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.22 3ktc h VAL 148 Cb 0.10 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 3ktc h VAL 148 CO 0.02 0.35 0.23 0.44 0.02 0.00 0.00 177.57 178.63 3ktc h ASP 149 N -0.16 0.91 0.00 0.57 3.32 -0.73 -1.05 116.42 119.28 3ktc h ASP 149 Ca 0.02 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3ktc h ASP 149 Cb 0.61 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3ktc h ASP 149 CO 0.02 0.86 0.00 0.61 -1.72 0.00 0.00 179.24 179.01 3ktc n GLY 150 N -0.78 0.23 0.84 2.75 0.00 -0.19 -0.68 105.19 107.36 3ktc n GLY 150 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3ktc n GLY 150 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3ktc n ARG 152 N 0.72 0.00 -0.18 1.61 0.63 -0.40 -1.89 116.66 117.16 3ktc n ARG 152 Ca 0.00 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.88 3ktc n ARG 152 Cb 0.05 0.00 0.05 0.00 0.45 0.00 0.00 32.46 33.01 3ktc n ARG 152 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3ktc h ASP 153 N 0.00 0.48 0.30 6.15 3.32 -1.17 0.17 116.42 125.68 3ktc h ASP 153 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3ktc h ASP 153 Cb 0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3ktc h ASP 153 CO 0.00 0.34 -0.15 0.25 -1.72 0.00 0.00 179.24 177.96 3ktc h LEU 154 N 0.61 -0.34 -0.78 1.55 5.85 -1.64 -2.62 115.31 117.93 3ktc h LEU 154 Ca 0.22 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 3ktc h LEU 154 Cb 0.06 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 3ktc h LEU 154 CO -0.11 -0.10 -0.01 0.00 -0.34 0.00 0.00 178.44 177.88 3ktc h ALA 155 N 0.05 0.97 0.00 1.25 0.00 -1.82 -2.68 119.26 117.05 3ktc h ALA 155 Ca -0.04 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 3ktc h ALA 155 Cb 0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3ktc h ALA 155 CO 0.07 0.62 -0.22 0.78 0.00 0.00 0.00 179.25 180.51 3ktc h GLY 156 N 0.99 0.00 1.69 0.00 0.00 -0.68 -2.10 103.07 102.97 3ktc h GLY 156 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3ktc h GLY 156 CO 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.54 3ktc n ALA 157 N -2.43 2.47 -3.16 3.60 0.00 -0.99 -4.21 120.51 115.80 3ktc n ALA 157 Ca -0.02 -0.14 -0.18 0.00 0.00 0.00 0.00 53.44 53.10 3ktc n ALA 157 Cb 0.29 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 3ktc n ALA 157 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ktc n ASN 158 N -1.36 0.49 0.29 0.00 3.02 -0.80 -4.98 115.26 111.92 3ktc n ASN 158 Ca 0.11 -3.00 0.19 0.00 -0.03 0.00 0.00 54.58 51.85 3ktc n ASN 158 Cb 0.29 -0.44 0.94 0.00 -0.61 0.00 0.00 39.78 39.96 3ktc n ASN 158 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3ktc h PRO 159 N 3.17 0.00 -0.00 3.52 0.13 -1.72 -1.97 132.00 135.14 3ktc h PRO 159 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3ktc h PRO 159 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3ktc h PRO 159 CO 0.47 0.00 -0.17 -0.40 -0.23 0.00 0.00 178.00 177.67 3ktc n ASP 160 N -2.94 0.49 -4.39 1.44 5.75 -1.26 -4.84 116.55 110.79 3ktc n ASP 160 Ca -0.01 -0.44 -0.32 0.00 -0.01 0.00 0.00 54.79 54.01 3ktc n ASP 160 Cb 0.15 -0.05 -0.15 0.00 -1.03 0.00 0.00 41.12 40.04 3ktc n ASP 160 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3ktc s VAL 161 N -2.62 2.50 0.17 2.12 1.01 -0.74 -5.12 120.40 117.72 3ktc s VAL 161 Ca 0.24 -0.98 -0.20 0.00 0.00 0.00 0.00 61.98 61.04 3ktc s VAL 161 Cb 0.19 -1.93 -0.08 0.00 0.00 0.00 0.00 36.38 34.56 3ktc s VAL 161 CO 0.52 0.56 0.68 -0.54 0.00 0.00 0.00 175.10 176.32 3ktc s LYS 162 N -0.75 4.26 -0.21 2.72 1.02 -1.26 -4.84 119.74 120.68 3ktc s LYS 162 Ca 0.11 0.85 0.02 0.00 0.02 0.00 0.00 55.97 56.96 3ktc s LYS 162 Cb -0.10 -3.02 0.04 0.00 -0.52 0.00 0.00 37.83 34.22 3ktc s LYS 162 CO 0.00 0.49 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.71 3ktc s PHE 163 N -1.37 2.88 -0.33 3.18 0.40 -0.18 -0.73 117.98 121.83 3ktc s PHE 163 Ca 0.38 -1.89 -0.10 0.00 -0.60 0.00 0.00 56.93 54.72 3ktc s PHE 163 Cb -0.18 -1.86 0.00 0.00 0.51 0.00 0.00 43.02 41.49 3ktc s PHE 163 CO 0.21 -0.82 0.18 0.00 0.70 0.00 0.00 175.22 175.49 3ktc s ALA 164 N 1.24 3.31 -0.23 5.36 0.00 0.16 -0.87 121.76 130.73 3ktc s ALA 164 Ca -0.02 -1.47 -0.25 0.00 0.00 0.00 0.00 51.96 50.22 3ktc s ALA 164 Cb -0.16 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 3ktc s ALA 164 CO -0.09 -1.03 0.84 0.42 0.00 0.00 0.00 175.76 175.90 3ktc s ILE 165 N 1.61 4.83 -0.70 0.00 1.01 0.24 -0.52 121.20 127.68 3ktc s ILE 165 Ca 0.04 1.61 -0.19 0.00 0.00 0.00 0.00 60.65 62.11 3ktc s ILE 165 Cb -0.18 -4.13 0.12 0.00 0.01 0.00 0.00 42.46 38.28 3ktc s ILE 165 CO 0.07 -0.07 0.83 -0.70 0.00 0.00 0.00 174.94 175.07 3ktc s GLU 166 N 2.78 3.23 0.68 2.79 2.12 -0.16 -0.81 118.70 129.33 3ktc s GLU 166 Ca 0.36 -1.49 -0.14 0.00 0.36 0.00 0.00 54.97 54.06 3ktc s GLU 166 Cb -0.15 -4.41 0.01 0.00 0.26 0.00 0.00 34.13 29.84 3ktc s GLU 166 CO 0.08 -1.59 1.11 1.52 -0.54 0.00 0.00 175.26 175.84 3ktc s TYR 167 N 2.54 2.59 -0.27 5.30 -0.85 -1.25 -4.75 117.35 120.66 3ktc s TYR 167 Ca 0.18 1.55 -0.21 0.00 -0.52 0.00 0.00 57.07 58.07 3ktc s TYR 167 Cb -0.18 -3.16 0.07 0.00 0.38 0.00 0.00 41.96 39.08 3ktc s TYR 167 CO 0.02 -1.74 0.71 0.21 -1.52 0.00 0.00 175.55 173.22 3ktc s LYS 168 N -4.24 0.78 0.22 -3.49 2.20 -0.43 -4.77 119.74 110.02 3ktc s LYS 168 Ca 0.66 1.11 -0.08 0.00 -0.36 0.00 0.00 55.97 57.29 3ktc s LYS 168 Cb -0.20 0.28 0.34 0.00 -1.51 0.00 0.00 37.83 36.74 3ktc s LYS 168 CO 0.44 -0.12 1.71 -1.35 -0.36 0.00 0.00 175.35 175.67 3ktc h PRO 169 N 5.92 0.30 0.00 4.03 0.11 -1.80 -3.35 132.00 137.22 3ktc h PRO 169 Ca -0.29 -0.02 0.11 0.00 0.11 0.00 0.00 66.00 65.91 3ktc h PRO 169 Cb 1.19 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3ktc h PRO 169 CO 0.10 0.20 0.33 2.89 -0.21 0.00 0.00 178.00 181.32 3ktc n ARG 170 N -5.09 0.20 -0.84 1.05 1.85 -1.26 -4.55 116.66 108.02 3ktc n ARG 170 Ca 0.10 -0.53 0.00 0.00 -1.00 0.00 0.00 57.85 56.43 3ktc n ARG 170 Cb 0.35 0.76 0.00 0.00 -1.05 0.00 0.00 32.46 32.52 3ktc n ARG 170 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 3ktc n GLU 171 N -0.37 -0.45 0.18 2.89 2.13 -1.26 -4.85 120.64 118.91 3ktc n GLU 171 Ca 0.00 0.78 0.14 0.00 0.66 0.00 0.00 57.16 58.74 3ktc n GLU 171 Cb 0.26 -0.57 0.49 0.00 0.27 0.00 0.00 31.44 31.90 3ktc n GLU 171 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3ktc h PRO 172 N 0.35 0.00 -7.50 5.31 0.13 -1.98 -3.48 132.00 124.83 3ktc h PRO 172 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 3ktc h PRO 172 Cb 0.00 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.22 3ktc h PRO 172 CO 0.00 0.00 0.40 1.03 -0.23 0.00 0.00 178.00 179.20 3ktc s ARG 173 N -3.35 2.54 0.34 0.86 1.81 -1.25 -4.95 118.95 114.95 3ktc s ARG 173 Ca 0.05 0.40 0.12 0.00 -1.72 0.00 0.00 55.73 54.59 3ktc s ARG 173 Cb 0.09 -1.99 0.61 0.00 -0.45 0.00 0.00 34.95 33.22 3ktc s ARG 173 CO 0.51 -1.25 1.76 0.28 -0.68 0.00 0.00 175.30 175.92 3ktc h VAL 174 N -0.81 1.30 -2.13 3.52 2.07 -1.74 -3.43 116.25 115.03 3ktc h VAL 174 Ca -0.46 -1.54 -0.02 0.00 0.82 0.00 0.00 66.70 65.50 3ktc h VAL 174 Cb 1.27 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.88 3ktc h VAL 174 CO 0.64 0.44 -0.01 1.17 0.02 0.00 0.00 177.57 179.83 3ktc n LYS 175 N -3.98 0.04 -0.11 1.57 3.00 -0.70 -4.72 118.16 113.28 3ktc n LYS 175 Ca -0.02 -0.18 -0.17 0.00 -0.00 0.00 0.00 58.31 57.95 3ktc n LYS 175 Cb 0.47 0.17 -0.06 0.00 0.00 0.00 0.00 35.03 35.62 3ktc n LYS 175 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 3ktc n THR 177 N -0.04 1.51 -2.98 3.15 -2.24 -0.28 -1.65 114.28 111.75 3ktc n THR 177 Ca 0.00 -0.06 -0.44 0.00 -2.27 0.00 0.00 64.05 61.28 3ktc n THR 177 Cb 0.04 -2.16 -0.00 0.00 -2.10 0.00 0.00 70.33 66.10 3ktc n THR 177 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 3ktc s TRP 178 N -2.67 3.57 -0.83 4.78 0.52 -1.26 -4.80 118.94 118.24 3ktc s TRP 178 Ca -0.31 -2.18 0.22 0.00 0.02 0.00 0.00 56.10 53.85 3ktc s TRP 178 Cb 0.08 -4.27 -0.13 0.00 -1.15 0.00 0.00 33.47 28.00 3ktc s TRP 178 CO 0.44 -1.35 0.92 -0.40 0.02 0.00 0.00 176.95 176.58 3ktc n ASP 179 N 5.38 0.77 -3.77 2.95 5.75 -1.26 -1.31 116.55 125.07 3ktc n ASP 179 Ca 0.35 -0.70 -0.10 0.00 -0.01 0.00 0.00 54.79 54.34 3ktc n ASP 179 Cb 0.43 1.02 -0.05 0.00 -1.03 0.00 0.00 41.12 41.49 3ktc n ASP 179 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3ktc s SER 180 N -3.30 -0.18 0.16 -1.12 1.04 -1.26 -2.98 113.70 106.04 3ktc s SER 180 Ca 0.06 -0.53 -0.16 0.00 0.48 0.00 0.00 55.95 55.80 3ktc s SER 180 Cb 0.16 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.83 3ktc s SER 180 CO 0.85 -0.97 1.81 0.00 0.98 0.00 0.00 173.24 175.91 3ktc h ALA 181 N 2.31 0.52 -0.33 5.32 0.00 -1.96 -1.34 119.26 123.79 3ktc h ALA 181 Ca -0.30 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 3ktc h ALA 181 Cb 1.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ktc h ALA 181 CO 0.42 -0.05 -0.11 0.00 0.00 0.00 0.00 179.25 179.51 3ktc h ALA 182 N 1.16 0.45 -0.49 0.00 0.00 -1.97 -0.91 119.26 117.51 3ktc h ALA 182 Ca 0.16 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3ktc h ALA 182 Cb -0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ktc h ALA 182 CO -0.05 0.32 0.20 -0.09 0.00 0.00 0.00 179.25 179.63 3ktc h ARG 183 N 0.43 0.70 -0.37 0.00 9.65 -1.95 -1.11 114.38 121.73 3ktc h ARG 183 Ca 0.08 -0.10 -0.11 0.00 -1.10 0.00 0.00 59.98 58.75 3ktc h ARG 183 Cb 0.63 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.07 3ktc h ARG 183 CO 0.04 0.57 -0.19 1.15 2.80 0.00 0.00 179.97 184.34 3ktc h THR 184 N 0.69 1.28 -0.57 0.20 2.02 -0.88 -1.41 112.91 114.25 3ktc h THR 184 Ca 0.17 -1.32 -0.06 0.00 0.77 0.00 0.00 66.41 65.96 3ktc h THR 184 Cb 0.13 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 3ktc h THR 184 CO -0.02 0.44 0.10 -0.07 0.37 0.00 0.00 175.52 176.34 3ktc h LEU 185 N 0.58 0.85 -0.40 2.58 3.38 -0.80 -0.03 115.31 121.46 3ktc h LEU 185 Ca 0.08 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3ktc h LEU 185 Cb 0.74 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 3ktc h LEU 185 CO 0.06 0.85 0.27 -0.07 0.09 0.00 0.00 178.44 179.64 3ktc h LEU 186 N 0.85 0.46 -0.82 1.67 3.38 -1.07 -1.28 115.31 118.51 3ktc h LEU 186 Ca 0.18 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3ktc h LEU 186 Cb 0.36 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3ktc h LEU 186 CO 0.01 0.34 0.48 1.23 0.09 0.00 0.00 178.44 180.58 3ktc h GLY 187 N 0.55 1.21 1.01 0.83 0.00 -0.89 -1.54 103.07 104.24 3ktc h GLY 187 Ca 0.15 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 3ktc h GLY 187 CO -0.03 0.51 0.33 -2.22 0.00 0.00 0.00 176.54 175.13 3ktc h ILE 188 N 1.14 1.23 -0.62 2.60 2.04 -0.76 0.14 117.51 123.28 3ktc h ILE 188 Ca 0.29 -0.66 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 3ktc h ILE 188 Cb -0.01 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 3ktc h ILE 188 CO -0.05 0.27 0.08 -0.08 0.00 0.00 0.00 178.15 178.37 3ktc h GLU 189 N 0.98 1.02 -0.55 2.37 4.57 -0.86 -2.07 114.58 120.04 3ktc h GLU 189 Ca 0.24 -0.27 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 3ktc h GLU 189 Cb 0.12 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 3ktc h GLU 189 CO -0.03 0.95 0.05 -0.44 -1.18 0.00 0.00 179.01 178.36 3ktc h ASP 190 N 0.95 0.91 -0.52 1.04 3.32 -0.71 -3.08 116.42 118.34 3ktc h ASP 190 Ca 0.19 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 56.98 3ktc h ASP 190 Cb 0.45 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 3ktc h ASP 190 CO 0.02 0.96 0.31 0.40 -1.72 0.00 0.00 179.24 179.21 3ktc h ILE 191 N 0.82 1.06 0.00 0.35 2.04 -0.51 -3.47 117.51 117.81 3ktc h ILE 191 Ca 0.16 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3ktc h ILE 191 Cb 0.47 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 3ktc h ILE 191 CO 0.02 0.11 0.00 0.61 0.00 0.00 0.00 178.15 178.89 3ktc n GLY 192 N -1.24 0.39 3.42 5.37 0.00 -0.80 -4.95 105.19 107.38 3ktc n GLY 192 Ca 0.04 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 3ktc n GLY 192 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ktc s LEU 193 N 0.00 2.49 0.51 0.99 1.43 -1.26 -5.04 118.68 117.80 3ktc s LEU 193 Ca 0.00 -0.39 0.30 0.00 -1.03 0.00 0.00 54.13 53.02 3ktc s LEU 193 Cb 0.00 -1.47 1.06 0.00 0.03 0.00 0.00 46.19 45.81 3ktc s LEU 193 CO 0.00 0.29 1.87 0.44 0.23 0.00 0.00 176.35 179.19 3ktc h ASP 194 N 4.98 0.00 -0.52 2.29 3.32 -1.96 -3.21 116.42 121.32 3ktc h ASP 194 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3ktc h ASP 194 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3ktc h ASP 194 CO 0.48 0.01 0.00 -0.46 -1.72 0.00 0.00 179.24 177.55 3ktc n ASN 195 N -3.11 3.11 -4.45 6.45 6.94 -1.26 -4.83 115.26 118.11 3ktc n ASN 195 Ca 0.01 -2.10 -0.33 0.00 -0.02 0.00 0.00 54.58 52.14 3ktc n ASN 195 Cb 0.38 -0.40 -0.13 0.00 -2.36 0.00 0.00 39.78 37.27 3ktc n ASN 195 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3ktc s VAL 196 N -1.44 3.58 0.00 3.53 1.01 -1.21 -1.01 120.40 124.85 3ktc s VAL 196 Ca 0.36 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.88 3ktc s VAL 196 Cb 0.20 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 34.03 3ktc s VAL 196 CO 0.22 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.43 3ktc n GLY 197 N 3.59 4.05 3.28 4.51 0.00 -0.05 -4.97 105.19 115.61 3ktc n GLY 197 Ca -0.18 -1.27 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 3ktc n GLY 197 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ktc s VAL 198 N -1.92 1.94 -0.41 1.61 1.01 0.86 -0.59 120.40 122.90 3ktc s VAL 198 Ca 0.00 -1.04 -0.12 0.00 0.00 0.00 0.00 61.98 60.82 3ktc s VAL 198 Cb 0.00 -1.61 0.04 0.00 0.00 0.00 0.00 36.38 34.81 3ktc s VAL 198 CO 0.00 0.55 0.27 -0.22 0.00 0.00 0.00 175.10 175.69 3ktc s LEU 199 N -0.50 5.03 -0.44 3.92 1.98 0.01 -1.11 118.68 127.58 3ktc s LEU 199 Ca 0.07 -1.13 -0.20 0.00 -2.89 0.00 0.00 54.13 49.98 3ktc s LEU 199 Cb -0.10 -2.07 0.02 0.00 0.66 0.00 0.00 46.19 44.70 3ktc s LEU 199 CO -0.00 -0.47 0.60 -0.22 -1.89 0.00 0.00 176.35 174.36 3ktc s LEU 200 N 1.57 4.60 -0.34 -0.68 0.20 -0.55 -3.94 118.68 119.54 3ktc s LEU 200 Ca 0.03 -0.44 -0.18 0.00 0.69 0.00 0.00 54.13 54.23 3ktc s LEU 200 Cb -0.21 -2.64 -0.00 0.00 -0.43 0.00 0.00 46.19 42.91 3ktc s LEU 200 CO 0.06 -0.74 0.53 -0.62 -0.29 0.00 0.00 176.35 175.30 3ktc s ASP 201 N 1.98 6.34 0.23 3.68 -1.08 -1.26 -1.34 116.67 125.22 3ktc s ASP 201 Ca 0.20 0.04 -0.06 0.00 -0.52 0.00 0.00 52.55 52.20 3ktc s ASP 201 Cb -0.15 -2.28 0.39 0.00 -1.46 0.00 0.00 42.92 39.43 3ktc s ASP 201 CO 0.18 -0.49 1.72 0.15 0.52 0.00 0.00 175.17 177.25 3ktc h PHE 202 N 8.43 0.40 -0.77 -5.34 3.57 -1.38 -1.33 116.94 120.52 3ktc h PHE 202 Ca -0.28 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.22 3ktc h PHE 202 Cb 1.12 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 3ktc h PHE 202 CO 0.73 0.03 0.33 0.78 -2.23 0.00 0.00 178.31 177.95 3ktc h GLY 203 N 0.38 1.21 0.93 2.40 0.00 -1.80 -0.31 103.07 105.89 3ktc h GLY 203 Ca 0.37 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 3ktc h GLY 203 CO -0.40 0.60 0.13 0.45 0.00 0.00 0.00 176.54 177.32 3ktc h HIS 204 N 1.11 0.61 -0.54 5.60 3.86 -1.67 -0.66 115.15 123.47 3ktc h HIS 204 Ca 0.26 -0.06 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 3ktc h HIS 204 Cb 0.17 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.44 3ktc h HIS 204 CO 0.02 0.57 0.35 0.00 0.86 0.00 0.00 177.93 179.73 3ktc h ALA 205 N 0.97 0.69 -0.02 2.45 0.00 -1.04 -0.87 119.26 121.44 3ktc h ALA 205 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ktc h ALA 205 Cb 0.24 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ktc h ALA 205 CO -0.01 0.12 0.01 1.25 0.00 0.00 0.00 179.25 180.62 3ktc h LEU 206 N 0.72 0.03 -0.05 0.00 5.85 -0.69 -1.21 115.31 119.96 3ktc h LEU 206 Ca 0.20 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3ktc h LEU 206 Cb -0.07 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3ktc h LEU 206 CO -0.05 0.22 0.00 0.00 -0.34 0.00 0.00 178.44 178.27 3ktc n TYR 207 N -4.98 0.68 1.48 1.25 4.11 -0.28 -2.10 117.16 117.32 3ktc n TYR 207 Ca -0.07 0.20 0.13 0.00 -0.00 0.00 0.00 57.90 58.16 3ktc n TYR 207 Cb 0.12 -0.83 0.72 0.00 -0.00 0.00 0.00 39.34 39.35 3ktc n TYR 207 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 3ktc n GLY 208 N 1.23 -0.88 1.69 -7.48 0.00 -0.34 -4.71 105.19 94.71 3ktc n GLY 208 Ca 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3ktc n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktc n GLY 209 N 0.65 0.75 3.89 -0.02 0.00 -0.89 -5.05 105.19 104.52 3ktc n GLY 209 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 3ktc n GLY 209 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ktc s GLU 210 N -0.33 3.06 -0.42 1.61 2.02 -0.49 -5.03 118.70 119.13 3ktc s GLU 210 Ca 0.00 0.42 -0.25 0.00 0.02 0.00 0.00 54.97 55.16 3ktc s GLU 210 Cb 0.00 -2.10 0.02 0.00 0.10 0.00 0.00 34.13 32.15 3ktc s GLU 210 CO 0.00 -0.84 0.90 0.45 0.02 0.00 0.00 175.26 175.80 3ktc s SER 211 N -4.30 6.56 0.34 -0.19 0.15 -1.26 -4.45 113.70 110.55 3ktc s SER 211 Ca 0.56 0.30 0.04 0.00 0.70 0.00 0.00 55.95 57.56 3ktc s SER 211 Cb -0.11 -2.45 0.68 0.00 -1.71 0.00 0.00 66.02 62.43 3ktc s SER 211 CO 0.51 -0.94 1.93 -0.65 1.20 0.00 0.00 173.24 175.29 3ktc h PRO 212 N 8.79 0.82 -0.34 5.44 0.11 -1.89 0.12 132.00 145.04 3ktc h PRO 212 Ca -0.24 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.84 3ktc h PRO 212 Cb 1.08 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 3ktc h PRO 212 CO 0.99 0.54 0.17 0.00 -0.21 0.00 0.00 178.00 179.50 3ktc h ALA 213 N 1.57 0.42 -0.65 -0.75 0.00 -1.86 -0.22 119.26 117.77 3ktc h ALA 213 Ca 0.36 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 3ktc h ALA 213 Cb 0.30 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3ktc h ALA 213 CO -0.13 -0.20 0.34 0.22 0.00 0.00 0.00 179.25 179.48 3ktc h ASP 214 N 0.36 0.82 -0.74 0.00 3.58 -1.71 -1.57 116.42 117.16 3ktc h ASP 214 Ca 0.14 -0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 3ktc h ASP 214 Cb 0.05 -0.21 -0.04 0.00 1.72 0.00 0.00 39.33 40.85 3ktc h ASP 214 CO -0.09 0.69 0.43 0.28 -2.88 0.00 0.00 179.24 177.67 3ktc h SER 215 N 0.89 0.90 -0.40 2.28 0.02 -0.65 0.12 113.55 116.71 3ktc h SER 215 Ca 0.23 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.13 3ktc h SER 215 Cb 0.06 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 3ktc h SER 215 CO -0.03 0.71 0.19 0.00 -1.14 0.00 0.00 176.83 176.56 3ktc h ALA 216 N 1.23 0.49 -0.40 3.77 0.00 -0.81 -1.13 119.26 122.41 3ktc h ALA 216 Ca 0.26 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3ktc h ALA 216 Cb -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3ktc h ALA 216 CO -0.05 -0.17 0.26 0.37 0.00 0.00 0.00 179.25 179.66 3ktc h GLN 217 N 0.39 0.53 -0.48 0.00 5.75 -0.53 -0.68 115.11 120.08 3ktc h GLN 217 Ca 0.17 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.66 3ktc h GLN 217 Cb 0.08 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.48 3ktc h GLN 217 CO -0.12 0.36 0.27 1.25 -2.65 0.00 0.00 178.83 177.94 3ktc h LEU 218 N 0.53 0.42 -0.26 -2.39 5.85 -0.52 0.56 115.31 119.51 3ktc h LEU 218 Ca 0.14 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 3ktc h LEU 218 Cb -0.05 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3ktc h LEU 218 CO -0.03 0.30 -0.20 0.40 -0.34 0.00 0.00 178.44 178.57 3ktc h ILE 219 N 0.54 1.31 -0.60 4.05 2.04 -1.12 -3.06 117.51 120.67 3ktc h ILE 219 Ca 0.20 -1.34 0.02 0.00 1.00 0.00 0.00 64.86 64.74 3ktc h ILE 219 Cb 0.06 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 3ktc h ILE 219 CO -0.11 0.42 0.40 0.40 0.00 0.00 0.00 178.15 179.26 3ktc h ILE 220 N 0.32 1.13 0.00 -0.67 2.04 -0.92 -1.91 117.51 117.49 3ktc h ILE 220 Ca 0.05 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 3ktc h ILE 220 Cb 0.74 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3ktc h ILE 220 CO 0.05 0.14 -0.01 0.44 0.00 0.00 0.00 178.15 178.78 3ktc h ASP 221 N 0.78 0.00 -0.46 1.72 3.32 -0.78 0.32 116.42 121.31 3ktc h ASP 221 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3ktc h ASP 221 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3ktc h ASP 221 CO -0.05 0.01 0.00 0.54 -1.72 0.00 0.00 179.24 178.01 3ktc n ARG 222 N -3.11 2.50 -2.16 3.56 1.74 -0.86 -4.98 116.66 113.36 3ktc n ARG 222 Ca -0.01 -2.29 -0.10 0.00 -0.77 0.00 0.00 57.85 54.69 3ktc n ARG 222 Cb 0.24 -1.46 -0.01 0.00 -1.02 0.00 0.00 32.46 30.21 3ktc n ARG 222 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ktc n GLY 223 N 1.30 -0.00 0.31 -0.13 0.00 0.10 -4.94 105.19 101.82 3ktc n GLY 223 Ca 0.19 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.77 3ktc n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktc n ARG 224 N -1.95 2.61 -2.89 1.61 5.12 -0.78 -4.91 116.66 115.48 3ktc n ARG 224 Ca -0.11 -2.05 -0.43 0.00 -1.93 0.00 0.00 57.85 53.32 3ktc n ARG 224 Cb 0.58 -1.29 -0.03 0.00 -1.16 0.00 0.00 32.46 30.56 3ktc n ARG 224 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3ktc s LEU 225 N -1.63 4.71 0.19 0.55 2.96 -1.26 -0.10 118.68 124.11 3ktc s LEU 225 Ca 0.18 -1.56 0.15 0.00 -0.22 0.00 0.00 54.13 52.69 3ktc s LEU 225 Cb 0.14 -2.41 -0.02 0.00 0.50 0.00 0.00 46.19 44.39 3ktc s LEU 225 CO 0.06 -1.24 1.20 -0.26 -1.32 0.00 0.00 176.35 174.78 3ktc h PHE 226 N 9.20 0.00 -0.25 5.38 -1.00 -1.47 -3.47 116.94 125.32 3ktc h PHE 226 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 3ktc h PHE 226 Cb 1.04 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.60 3ktc h PHE 226 CO 1.08 0.54 0.00 0.41 -1.61 0.00 0.00 178.31 178.73 3ktc n GLY 227 N 1.29 1.89 3.62 -1.45 0.00 -1.10 -5.00 105.19 104.44 3ktc n GLY 227 Ca -0.02 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 3ktc n GLY 227 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ktc s ASP 229 N 2.00 -0.62 0.19 1.61 1.01 -0.45 -1.48 116.67 118.93 3ktc s ASP 229 Ca 0.00 1.12 0.07 0.00 0.71 0.00 0.00 52.55 54.45 3ktc s ASP 229 Cb 0.00 1.10 -0.05 0.00 1.01 0.00 0.00 42.92 44.99 3ktc s ASP 229 CO 0.00 -0.27 -0.14 0.68 0.21 0.00 0.00 175.17 175.65 3ktc s VAL 230 N 0.04 1.68 -1.13 -1.27 -7.23 -0.15 -0.88 120.40 111.46 3ktc s VAL 230 Ca -0.01 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.01 3ktc s VAL 230 Cb -0.04 -1.99 0.00 0.00 0.56 0.00 0.00 36.38 34.91 3ktc s VAL 230 CO 0.00 -0.58 0.00 -0.46 -0.31 0.00 0.00 175.10 173.75 3ktc n ASN 231 N -0.28 0.00 -4.21 4.85 0.23 -1.26 -1.40 115.26 113.19 3ktc n ASN 231 Ca -0.09 0.00 -0.12 0.00 -0.53 0.00 0.00 54.58 53.84 3ktc n ASN 231 Cb 0.60 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.20 3ktc n ASN 231 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3ktc s ASP 232 N -1.53 0.62 0.35 0.53 -1.08 -0.04 -4.51 116.67 111.00 3ktc s ASP 232 Ca 0.00 -1.27 -0.17 0.00 -0.52 0.00 0.00 52.55 50.59 3ktc s ASP 232 Cb 0.00 0.25 0.05 0.00 -1.46 0.00 0.00 42.92 41.76 3ktc s ASP 232 CO 0.00 -0.72 0.79 0.54 0.52 0.00 0.00 175.17 176.30 3ktc s ASN 233 N -3.14 -0.05 -0.19 -0.34 2.20 -1.26 -0.83 114.94 111.32 3ktc s ASN 233 Ca 0.30 -1.01 0.10 0.00 -0.94 0.00 0.00 52.86 51.31 3ktc s ASN 233 Cb 0.07 0.81 0.61 0.00 -2.00 0.00 0.00 41.25 40.74 3ktc s ASN 233 CO 0.07 -1.58 1.46 0.18 -2.94 0.00 0.00 177.10 174.28 3ktc n LEU 234 N -0.52 4.67 0.00 3.54 4.32 -1.26 -4.81 117.00 122.94 3ktc n LEU 234 Ca -0.07 -2.38 0.00 0.00 -0.02 0.00 0.00 56.01 53.54 3ktc n LEU 234 Cb 0.60 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.75 3ktc n LEU 234 CO 0.24 0.56 0.00 -1.14 -1.22 0.00 0.00 177.39 175.83 3ktc n ARG 235 N 0.39 -0.65 -0.00 3.23 0.63 -1.26 -4.82 116.66 114.19 3ktc n ARG 235 Ca 0.23 0.16 0.02 0.00 -0.92 0.00 0.00 57.85 57.34 3ktc n ARG 235 Cb 1.00 -3.65 -0.03 0.00 0.45 0.00 0.00 32.46 30.23 3ktc n ARG 235 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3ktc n GLY 236 N -1.67 0.43 3.55 5.14 0.00 -1.26 -4.55 105.19 106.84 3ktc n GLY 236 Ca 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 3ktc n GLY 236 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3ktc s TRP 237 N -1.58 -0.31 -1.31 1.61 -0.11 -1.26 -5.06 118.94 110.92 3ktc s TRP 237 Ca 0.01 0.13 -0.16 0.00 1.22 0.00 0.00 56.10 57.30 3ktc s TRP 237 Cb 0.04 0.56 0.00 0.00 -1.50 0.00 0.00 33.47 32.57 3ktc s TRP 237 CO 0.20 -0.62 2.14 -3.47 -4.62 0.00 0.00 176.95 170.58 3ktc n ASP 238 N -0.30 3.64 0.23 5.86 2.03 -1.26 -4.57 116.55 122.19 3ktc n ASP 238 Ca -0.08 -2.81 0.08 0.00 0.52 0.00 0.00 54.79 52.50 3ktc n ASP 238 Cb 0.62 -1.56 0.57 0.00 -0.72 0.00 0.00 41.12 40.03 3ktc n ASP 238 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 3ktc h ASP 239 N 6.51 0.00 -5.94 1.67 3.32 -1.95 -3.47 116.42 116.57 3ktc h ASP 239 Ca 0.53 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 57.18 3ktc h ASP 239 Cb 0.66 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.31 3ktc h ASP 239 CO 1.87 0.20 -0.74 0.47 -1.72 0.00 0.00 179.24 179.33 3ktc n ASP 240 N -3.89 -4.37 -4.89 6.45 8.00 -1.15 -4.80 116.55 111.90 3ktc n ASP 240 Ca -0.02 -0.65 -0.29 0.00 0.71 0.00 0.00 54.79 54.54 3ktc n ASP 240 Cb 0.29 -4.68 0.03 0.00 -0.02 0.00 0.00 41.12 36.74 3ktc n ASP 240 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ktc s LEU 241 N -7.01 3.14 0.13 0.64 1.43 -0.01 -1.67 118.68 115.33 3ktc s LEU 241 Ca 0.39 1.10 -0.34 0.00 -1.03 0.00 0.00 54.13 54.25 3ktc s LEU 241 Cb -0.18 -3.99 -0.14 0.00 0.03 0.00 0.00 46.19 41.90 3ktc s LEU 241 CO 0.76 -1.07 1.55 0.52 0.23 0.00 0.00 176.35 178.34 3ktc n VAL 242 N -2.77 0.03 -1.69 -1.59 0.31 -1.26 -0.86 118.33 110.50 3ktc n VAL 242 Ca 0.05 -0.01 -0.44 0.00 -0.01 0.00 0.00 64.34 63.94 3ktc n VAL 242 Cb 0.56 -1.42 -0.02 0.00 -0.91 0.00 0.00 33.84 32.05 3ktc n VAL 242 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 3ktc n VAL 243 N 3.36 1.29 -0.63 2.52 3.14 -1.26 -3.10 118.33 123.65 3ktc n VAL 243 Ca 0.18 -0.32 0.00 0.00 -2.96 0.00 0.00 64.34 61.23 3ktc n VAL 243 Cb 0.27 -1.56 0.00 0.00 -1.06 0.00 0.00 33.84 31.49 3ktc n VAL 243 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ktc n GLY 244 N 1.72 0.72 0.00 7.55 0.00 -1.26 -4.81 105.19 109.11 3ktc n GLY 244 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 3ktc n GLY 244 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ktc n THR 245 N -2.46 0.01 0.00 2.61 -2.24 -1.18 -4.68 114.28 106.33 3ktc n THR 245 Ca 0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3ktc n THR 245 Cb 0.00 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 3ktc n THR 245 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3ktc n VAL 246 N -1.53 0.00 -5.00 2.28 0.31 -1.26 -5.13 118.33 108.00 3ktc n VAL 246 Ca 0.05 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.09 3ktc n VAL 246 Cb 0.34 -0.62 -0.16 0.00 -0.91 0.00 0.00 33.84 32.48 3ktc n VAL 246 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 3ktc s HIS 247 N -1.80 2.05 0.00 3.52 3.76 -1.26 -5.07 115.29 116.50 3ktc s HIS 247 Ca 0.00 -0.67 0.00 0.00 -0.15 0.00 0.00 55.06 54.24 3ktc s HIS 247 Cb 0.00 -1.38 0.00 0.00 1.11 0.00 0.00 32.58 32.31 3ktc s HIS 247 CO 0.00 -0.24 0.00 2.41 -0.85 0.00 0.00 174.74 176.06 3ktc n THR 249 N 3.24 0.00 0.13 1.30 -1.04 -1.26 -1.91 114.28 114.74 3ktc n THR 249 Ca -0.19 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.80 3ktc n THR 249 Cb 0.53 0.00 0.14 0.00 -1.82 0.00 0.00 70.33 69.17 3ktc n THR 249 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3ktc h GLU 250 N 0.00 0.00 -0.06 -2.82 5.08 -1.99 -0.72 114.58 114.07 3ktc h GLU 250 Ca 0.00 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 3ktc h GLU 250 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3ktc h GLU 250 CO 0.00 0.66 -0.68 -0.84 -1.00 0.00 0.00 179.01 177.16 3ktc h ILE 251 N 0.00 1.40 -0.80 3.13 -0.00 -1.81 -1.50 117.51 117.93 3ktc h ILE 251 Ca -0.01 -2.12 0.02 0.00 -0.00 0.00 0.00 64.86 62.75 3ktc h ILE 251 Cb 1.17 2.10 -0.04 0.00 -0.00 0.00 0.00 36.82 40.05 3ktc h ILE 251 CO 0.09 0.63 0.53 0.15 -0.00 0.00 0.00 178.15 179.54 3ktc h PHE 252 N 0.20 0.99 -0.80 0.16 3.57 -1.71 -1.79 116.94 117.56 3ktc h PHE 252 Ca -0.02 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3ktc h PHE 252 Cb 1.22 -0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 3ktc h PHE 252 CO 0.03 0.60 0.37 1.49 -2.23 0.00 0.00 178.31 178.57 3ktc h GLU 253 N 1.05 1.15 -0.08 1.11 4.81 -0.86 0.82 114.58 122.58 3ktc h GLU 253 Ca 0.31 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3ktc h GLU 253 Cb -0.07 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.10 3ktc h GLU 253 CO -0.08 0.89 0.04 0.35 -0.73 0.00 0.00 179.01 179.48 3ktc h PHE 254 N 1.14 0.10 -0.21 0.92 3.57 -0.82 -0.82 116.94 120.82 3ktc h PHE 254 Ca 0.27 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.67 3ktc h PHE 254 Cb 0.13 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3ktc h PHE 254 CO 0.01 0.12 -0.29 0.74 -2.23 0.00 0.00 178.31 176.66 3ktc h PHE 255 N 0.06 0.47 -0.41 0.41 0.04 -1.10 -2.09 116.94 114.32 3ktc h PHE 255 Ca 0.03 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.72 3ktc h PHE 255 Cb 0.05 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 3ktc h PHE 255 CO -0.06 0.67 0.22 -0.92 -0.60 0.00 0.00 178.31 177.62 3ktc h TYR 256 N 0.37 0.40 -0.78 -0.55 3.20 -0.48 -0.65 116.97 118.47 3ktc h TYR 256 Ca 0.05 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 3ktc h TYR 256 Cb 0.70 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 3ktc h TYR 256 CO 0.02 0.21 0.29 0.28 -1.64 0.00 0.00 178.16 177.33 3ktc h VAL 257 N 0.44 1.26 -0.81 1.81 2.07 -0.77 -1.11 116.25 119.14 3ktc h VAL 257 Ca 0.17 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.85 3ktc h VAL 257 Cb 0.06 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 3ktc h VAL 257 CO -0.11 0.34 0.52 -0.07 0.02 0.00 0.00 177.57 178.27 3ktc h LEU 258 N 1.14 0.95 0.15 2.57 3.38 -1.07 -2.47 115.31 119.96 3ktc h LEU 258 Ca 0.26 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 3ktc h LEU 258 Cb 0.24 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3ktc h LEU 258 CO -0.02 0.71 -0.07 0.50 0.09 0.00 0.00 178.44 179.65 3ktc h LYS 259 N 1.11 -0.20 0.00 1.13 3.64 -0.58 -1.53 116.57 120.15 3ktc h LYS 259 Ca 0.30 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 3ktc h LYS 259 Cb -0.09 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3ktc h LYS 259 CO -0.06 -0.09 -0.09 -0.84 -2.27 0.00 0.00 179.45 176.10 3ktc h ILE 260 N -0.25 0.24 -0.19 2.00 3.07 -1.08 -1.43 117.51 119.87 3ktc h ILE 260 Ca -0.02 -0.72 0.00 0.00 1.55 0.00 0.00 64.86 65.67 3ktc h ILE 260 Cb 0.20 1.58 0.00 0.00 -0.27 0.00 0.00 36.82 38.32 3ktc h ILE 260 CO 0.03 0.09 0.00 0.59 -1.05 0.00 0.00 178.15 177.81 3ktc n ASN 261 N -3.24 1.56 -2.43 2.16 3.02 -0.94 -4.92 115.26 110.46 3ktc n ASN 261 Ca 0.00 -1.76 -0.20 0.00 -0.03 0.00 0.00 54.58 52.59 3ktc n ASN 261 Cb 0.34 -0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.38 3ktc n ASN 261 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3ktc n ASN 262 N 0.27 -5.76 -4.61 6.41 5.15 -0.54 -4.93 115.26 111.25 3ktc n ASN 262 Ca 0.15 -0.01 -0.42 0.00 -0.60 0.00 0.00 54.58 53.70 3ktc n ASN 262 Cb 0.30 -4.79 -0.05 0.00 -0.53 0.00 0.00 39.78 34.70 3ktc n ASN 262 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 3ktc s TRP 263 N -3.01 3.20 -0.16 1.20 -0.00 -0.60 -5.03 118.94 114.54 3ktc s TRP 263 Ca 0.01 0.73 0.01 0.00 -0.00 0.00 0.00 56.10 56.85 3ktc s TRP 263 Cb -0.01 -3.16 0.00 0.00 -0.00 0.00 0.00 33.47 30.31 3ktc s TRP 263 CO 0.01 -0.55 -0.18 -0.65 -0.00 0.00 0.00 176.95 175.59 3ktc s GLN 264 N 2.86 3.13 0.32 5.86 -1.52 -1.26 -4.61 119.66 124.43 3ktc s GLN 264 Ca 0.30 -0.79 -0.19 0.00 -1.95 0.00 0.00 55.36 52.73 3ktc s GLN 264 Cb -0.14 -2.57 0.03 0.00 -0.22 0.00 0.00 33.01 30.11 3ktc s GLN 264 CO 0.13 -0.04 0.73 0.20 -0.25 0.00 0.00 175.29 176.06 3ktc s GLY 265 N 0.91 0.11 0.15 3.09 0.00 -1.26 -5.13 107.32 105.20 3ktc s GLY 265 Ca -0.04 -0.50 -0.30 0.00 0.00 0.00 0.00 44.72 43.88 3ktc s GLY 265 CO -0.03 -0.20 1.29 0.14 0.00 0.00 0.00 173.10 174.30 3ktc s VAL 266 N -3.36 3.44 -0.80 1.40 1.01 -1.26 -4.70 120.40 116.13 3ktc s VAL 266 Ca 0.13 1.13 -0.25 0.00 0.00 0.00 0.00 61.98 62.99 3ktc s VAL 266 Cb -0.05 -3.72 0.05 0.00 0.00 0.00 0.00 36.38 32.65 3ktc s VAL 266 CO 0.09 0.14 1.26 0.26 0.00 0.00 0.00 175.10 176.85 3ktc s TRP 267 N 0.46 2.44 0.03 5.22 0.52 -0.28 -4.90 118.94 122.43 3ktc s TRP 267 Ca 0.58 -0.38 -0.08 0.00 0.02 0.00 0.00 56.10 56.24 3ktc s TRP 267 Cb -0.35 -4.58 -0.05 0.00 -1.15 0.00 0.00 33.47 27.35 3ktc s TRP 267 CO 0.34 -1.95 0.31 -0.65 0.02 0.00 0.00 176.95 175.03 3ktc s GLN 268 N 5.15 3.65 -0.17 4.98 -0.21 -1.26 -1.41 119.66 130.39 3ktc s GLN 268 Ca 0.35 0.02 -0.08 0.00 0.02 0.00 0.00 55.36 55.68 3ktc s GLN 268 Cb -0.07 -3.06 -0.04 0.00 1.00 0.00 0.00 33.01 30.83 3ktc s GLN 268 CO 0.07 0.62 0.09 -0.51 -2.12 0.00 0.00 175.29 173.45 3ktc s LEU 269 N -1.78 4.04 -0.39 2.90 1.43 0.19 -0.97 118.68 124.09 3ktc s LEU 269 Ca 0.29 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.61 3ktc s LEU 269 Cb -0.14 -2.01 0.12 0.00 0.03 0.00 0.00 46.19 44.19 3ktc s LEU 269 CO 0.16 0.24 0.17 -0.62 0.23 0.00 0.00 176.35 176.53 3ktc s ASP 270 N 0.01 3.95 0.04 2.29 2.15 -0.49 -1.06 116.67 123.55 3ktc s ASP 270 Ca 0.08 -2.30 0.01 0.00 0.43 0.00 0.00 52.55 50.77 3ktc s ASP 270 Cb -0.12 -1.10 -0.03 0.00 -0.30 0.00 0.00 42.92 41.38 3ktc s ASP 270 CO 0.00 -0.32 -0.05 -1.10 -0.17 0.00 0.00 175.17 173.53 3ktc s GLN 271 N 0.76 0.47 -0.48 4.34 -0.21 -1.26 -4.53 119.66 118.74 3ktc s GLN 271 Ca 0.14 -0.80 0.03 0.00 0.02 0.00 0.00 55.36 54.76 3ktc s GLN 271 Cb -0.22 -0.06 0.14 0.00 1.00 0.00 0.00 33.01 33.87 3ktc s GLN 271 CO -0.08 -0.02 0.26 -0.06 -2.12 0.00 0.00 175.29 173.27 3ktc s PHE 272 N -1.88 2.50 -1.45 0.91 0.40 -0.67 -4.19 117.98 113.60 3ktc s PHE 272 Ca -0.09 -2.75 -0.13 0.00 -0.60 0.00 0.00 56.93 53.36 3ktc s PHE 272 Cb -0.07 -2.26 0.05 0.00 0.51 0.00 0.00 43.02 41.24 3ktc s PHE 272 CO -0.02 -0.76 2.24 -0.35 0.70 0.00 0.00 175.22 177.04 3ktc n PRO 273 N 3.29 2.99 -0.27 0.24 -0.04 -1.26 -4.82 135.00 135.13 3ktc n PRO 273 Ca 0.08 -2.68 -0.02 0.00 -0.04 0.00 0.00 63.50 60.85 3ktc n PRO 273 Cb 0.34 -3.22 0.05 0.00 -0.04 0.00 0.00 33.50 30.63 3ktc n PRO 273 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3ktc h PHE 274 N 5.90 -0.78 -0.18 0.54 -1.00 -1.95 -2.51 116.94 116.96 3ktc h PHE 274 Ca 0.57 0.08 0.00 0.00 2.81 0.00 0.00 57.97 61.43 3ktc h PHE 274 Cb 0.61 0.46 0.00 0.00 3.61 0.00 0.00 35.95 40.63 3ktc h PHE 274 CO 1.47 -0.37 0.00 0.54 -1.61 0.00 0.00 178.31 178.33 3ktc n ARG 275 N -5.47 1.65 -3.83 1.51 1.74 -1.26 -4.88 116.66 106.12 3ktc n ARG 275 Ca 0.08 -1.62 -0.22 0.00 -0.77 0.00 0.00 57.85 55.32 3ktc n ARG 275 Cb 0.38 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.46 30.51 3ktc n ARG 275 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3ktc s GLU 276 N -1.03 2.57 -0.11 5.56 8.01 -0.95 -5.06 118.70 127.69 3ktc s GLU 276 Ca 0.20 -1.44 -0.29 0.00 0.01 0.00 0.00 54.97 53.44 3ktc s GLU 276 Cb 0.12 -2.36 -0.05 0.00 -4.31 0.00 0.00 34.13 27.53 3ktc s GLU 276 CO 0.17 0.02 1.66 1.21 0.01 0.00 0.00 175.26 178.32 3ktc s ASN 277 N -3.99 6.54 0.14 -0.19 3.84 -1.26 -4.89 114.94 115.12 3ktc s ASN 277 Ca 0.42 2.03 -0.12 0.00 0.21 0.00 0.00 52.86 55.40 3ktc s ASN 277 Cb -0.04 -2.53 -0.03 0.00 -0.55 0.00 0.00 41.25 38.10 3ktc s ASN 277 CO 0.26 -1.06 1.50 0.45 -2.79 0.00 0.00 177.10 175.45 3ktc h HIS 278 N 10.08 1.03 -0.26 0.43 3.86 -1.89 -0.99 115.15 127.42 3ktc h HIS 278 Ca -0.37 -0.27 -0.01 0.00 -1.16 0.00 0.00 60.37 58.55 3ktc h HIS 278 Cb 1.17 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 3ktc h HIS 278 CO 0.89 1.07 0.13 0.28 0.86 0.00 0.00 177.93 181.16 3ktc h VAL 279 N 0.70 1.15 -0.39 2.45 2.07 -1.90 -2.09 116.25 118.23 3ktc h VAL 279 Ca 0.08 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 3ktc h VAL 279 Cb 0.83 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 3ktc h VAL 279 CO 0.07 0.15 0.15 -0.08 0.02 0.00 0.00 177.57 177.87 3ktc h GLU 280 N 0.29 0.55 -0.57 1.57 4.81 -1.93 -0.97 114.58 118.33 3ktc h GLU 280 Ca 0.09 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 3ktc h GLU 280 Cb 0.12 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3ktc h GLU 280 CO -0.01 0.46 0.27 0.00 -0.73 0.00 0.00 179.01 179.00 3ktc h ALA 281 N 1.62 0.73 -0.62 2.92 0.00 -0.82 -0.86 119.26 122.23 3ktc h ALA 281 Ca 0.13 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3ktc h ALA 281 Cb 0.13 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3ktc h ALA 281 CO -0.01 0.30 0.06 0.00 0.00 0.00 0.00 179.25 179.60 3ktc h ALA 282 N 1.10 0.94 -0.53 0.00 0.00 -0.78 -1.90 119.26 118.08 3ktc h ALA 282 Ca 0.19 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3ktc h ALA 282 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3ktc h ALA 282 CO -0.02 0.65 0.23 1.96 0.00 0.00 0.00 179.25 182.07 3ktc h GLN 283 N 0.97 0.79 -0.32 0.00 4.20 -0.83 -1.10 115.11 118.81 3ktc h GLN 283 Ca 0.19 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 3ktc h GLN 283 Cb 0.47 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 3ktc h GLN 283 CO 0.02 0.68 -0.11 1.25 -0.67 0.00 0.00 178.83 179.99 3ktc h LEU 284 N 0.72 0.52 -0.29 1.46 5.85 -0.98 -1.58 115.31 121.00 3ktc h LEU 284 Ca 0.18 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3ktc h LEU 284 Cb 0.17 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3ktc h LEU 284 CO -0.02 0.67 0.10 0.28 -0.34 0.00 0.00 178.44 179.13 3ktc h SER 285 N 0.50 0.42 -0.22 1.25 0.02 -0.92 -2.15 113.55 112.44 3ktc h SER 285 Ca 0.09 -0.19 -0.10 0.00 -0.84 0.00 0.00 61.79 60.75 3ktc h SER 285 Cb 0.50 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 3ktc h SER 285 CO 0.03 0.50 -0.17 0.40 -1.14 0.00 0.00 176.83 176.45 3ktc h ILE 286 N 0.32 1.26 -0.71 3.27 2.04 -0.95 -0.61 117.51 122.13 3ktc h ILE 286 Ca 0.10 -1.21 0.02 0.00 1.00 0.00 0.00 64.86 64.77 3ktc h ILE 286 Cb 0.22 1.18 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 3ktc h ILE 286 CO -0.00 0.40 0.45 -0.09 0.00 0.00 0.00 178.15 178.91 3ktc h ARG 287 N 0.59 0.87 -0.45 2.37 2.43 -1.11 -0.23 114.38 118.85 3ktc h ARG 287 Ca 0.09 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.09 3ktc h ARG 287 Cb 0.63 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 3ktc h ARG 287 CO 0.04 0.58 -0.20 0.35 -1.51 0.00 0.00 179.97 179.23 3ktc h PHE 288 N 0.90 1.07 -0.48 2.20 3.57 -0.92 -2.12 116.94 121.15 3ktc h PHE 288 Ca 0.28 -0.26 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 3ktc h PHE 288 Cb -0.02 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.45 3ktc h PHE 288 CO -0.04 1.06 0.06 -0.07 -2.23 0.00 0.00 178.31 177.09 3ktc h LEU 289 N 0.77 0.72 -0.96 0.59 3.38 -0.75 0.16 115.31 119.22 3ktc h LEU 289 Ca 0.10 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 3ktc h LEU 289 Cb 0.77 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3ktc h LEU 289 CO 0.06 0.76 0.14 0.11 0.09 0.00 0.00 178.44 179.59 3ktc h LYS 290 N 0.73 0.89 -0.37 1.13 1.57 -0.87 -0.89 116.57 118.76 3ktc h LYS 290 Ca 0.15 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3ktc h LYS 290 Cb 0.36 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 3ktc h LYS 290 CO 0.01 0.80 0.22 1.25 -0.57 0.00 0.00 179.45 181.16 3ktc h HIS 291 N 0.86 0.49 -0.76 -1.35 2.76 -0.65 -0.73 115.15 115.77 3ktc h HIS 291 Ca 0.19 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.46 3ktc h HIS 291 Cb 0.32 -0.16 -0.08 0.00 1.55 0.00 0.00 27.41 29.04 3ktc h HIS 291 CO 0.02 0.36 0.38 0.82 -1.30 0.00 0.00 177.93 178.22 3ktc h ILE 292 N 0.48 0.83 -0.33 6.26 1.08 -0.51 0.15 117.51 125.46 3ktc h ILE 292 Ca 0.13 -0.22 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 3ktc h ILE 292 Cb 0.02 0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 33.90 3ktc h ILE 292 CO -0.02 0.11 0.16 0.22 -0.69 0.00 0.00 178.15 177.94 3ktc h TYR 293 N 0.63 0.47 -0.72 1.37 3.20 -0.66 0.61 116.97 121.86 3ktc h TYR 293 Ca 0.38 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.18 3ktc h TYR 293 Cb 0.43 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 3ktc h TYR 293 CO -0.10 0.40 0.26 0.00 -1.64 0.00 0.00 178.16 177.08 3ktc h ARG 294 N 0.40 1.09 -0.54 1.82 3.08 -0.53 -2.52 114.38 117.17 3ktc h ARG 294 Ca 0.11 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 3ktc h ARG 294 Cb 0.10 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 3ktc h ARG 294 CO -0.02 0.91 -0.00 0.00 -1.07 0.00 0.00 179.97 179.79 3ktc h ALA 295 N 1.22 0.97 -0.20 0.04 0.00 -0.34 -1.75 119.26 119.20 3ktc h ALA 295 Ca 0.24 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3ktc h ALA 295 Cb 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ktc h ALA 295 CO -0.01 0.63 0.07 -0.07 0.00 0.00 0.00 179.25 179.86 3ktc h LEU 296 N 0.86 0.24 -0.55 0.00 3.38 -0.54 -1.06 115.31 117.64 3ktc h LEU 296 Ca 0.16 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3ktc h LEU 296 Cb 0.51 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3ktc h LEU 296 CO 0.03 0.24 -0.06 -0.78 0.09 0.00 0.00 178.44 177.95 3ktc h ASP 297 N 0.28 0.00 0.75 -0.43 3.58 -0.93 -3.10 116.42 116.58 3ktc h ASP 297 Ca 0.07 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 3ktc h ASP 297 Cb 0.08 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 3ktc h ASP 297 CO -0.01 0.06 -1.30 0.29 -2.88 0.00 0.00 179.24 175.41 3ktc n LYS 298 N -3.13 0.62 -1.80 0.28 5.02 -0.79 -4.97 118.16 113.39 3ktc n LYS 298 Ca 0.02 0.11 -0.42 0.00 -2.02 0.00 0.00 58.31 56.00 3ktc n LYS 298 Cb 0.47 -1.77 -0.02 0.00 -0.02 0.00 0.00 35.03 33.68 3ktc n LYS 298 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3ktc s LEU 299 N -5.38 4.36 -1.10 -0.35 2.96 -0.47 -4.85 118.68 113.86 3ktc s LEU 299 Ca -0.02 2.85 -0.19 0.00 -0.22 0.00 0.00 54.13 56.55 3ktc s LEU 299 Cb 0.10 -3.61 0.10 0.00 0.50 0.00 0.00 46.19 43.28 3ktc s LEU 299 CO 0.81 -0.91 1.42 -0.62 -1.32 0.00 0.00 176.35 175.73 3ktc s ASP 300 N 0.84 6.73 0.12 3.68 -1.08 -1.26 -4.86 116.67 120.83 3ktc s ASP 300 Ca 0.68 -2.16 -0.17 0.00 -0.52 0.00 0.00 52.55 50.38 3ktc s ASP 300 Cb -0.48 -2.49 -0.03 0.00 -1.46 0.00 0.00 42.92 38.46 3ktc s ASP 300 CO 0.39 -1.15 1.63 0.40 0.52 0.00 0.00 175.17 176.96 3ktc h ILE 301 N 5.81 1.21 -0.93 4.11 2.04 -1.94 -0.75 117.51 127.07 3ktc h ILE 301 Ca 0.27 -0.70 0.05 0.00 1.00 0.00 0.00 64.86 65.48 3ktc h ILE 301 Cb 0.95 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.99 3ktc h ILE 301 CO 1.31 0.24 0.60 -0.65 0.00 0.00 0.00 178.15 179.65 3ktc h PRO 302 N 0.41 1.06 -0.34 2.37 0.11 -1.99 0.87 132.00 134.48 3ktc h PRO 302 Ca 0.11 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.08 3ktc h PRO 302 Cb 0.27 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 3ktc h PRO 302 CO -0.00 0.70 -0.07 0.00 -0.21 0.00 0.00 178.00 178.42 3ktc h ALA 303 N 1.49 0.47 -0.51 -0.75 0.00 -1.91 -1.41 119.26 116.64 3ktc h ALA 303 Ca 0.39 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3ktc h ALA 303 Cb 0.13 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3ktc h ALA 303 CO -0.14 0.30 0.27 1.25 0.00 0.00 0.00 179.25 180.94 3ktc h LEU 304 N 0.44 0.41 -1.00 0.00 5.85 -0.56 -1.55 115.31 118.91 3ktc h LEU 304 Ca 0.09 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 3ktc h LEU 304 Cb 0.56 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3ktc h LEU 304 CO 0.03 0.28 -0.19 1.56 -0.34 0.00 0.00 178.44 179.79 3ktc h GLN 305 N 0.53 0.50 -0.53 1.25 4.20 -0.68 0.12 115.11 120.51 3ktc h GLN 305 Ca 0.22 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 3ktc h GLN 305 Cb 0.10 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 3ktc h GLN 305 CO -0.14 0.67 0.29 0.00 -0.67 0.00 0.00 178.83 178.98 3ktc h ALA 306 N 1.35 0.68 -0.88 3.87 0.00 -0.97 -0.81 119.26 122.50 3ktc h ALA 306 Ca 0.08 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ktc h ALA 306 Cb 0.59 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3ktc h ALA 306 CO 0.04 0.20 0.53 0.00 0.00 0.00 0.00 179.25 180.03 3ktc h ALA 307 N 1.12 1.13 -0.42 0.00 0.00 -0.59 -2.46 119.26 118.05 3ktc h ALA 307 Ca 0.19 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3ktc h ALA 307 Cb 0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3ktc h ALA 307 CO -0.03 0.59 -0.09 1.96 0.00 0.00 0.00 179.25 181.67 3ktc h GLN 308 N 1.22 0.73 -0.09 0.00 4.20 -0.69 0.64 115.11 121.12 3ktc h GLN 308 Ca 0.32 -0.23 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 3ktc h GLN 308 Cb -0.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 3ktc h GLN 308 CO -0.06 0.81 -0.30 1.49 -0.67 0.00 0.00 178.83 180.09 3ktc h GLU 309 N 0.67 0.16 -0.00 1.46 4.81 -0.87 -1.29 114.58 119.52 3ktc h GLU 309 Ca 0.12 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3ktc h GLU 309 Cb 0.55 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3ktc h GLU 309 CO 0.03 0.46 -0.15 0.00 -0.73 0.00 0.00 179.01 178.62 3ktc n ALA 310 N -2.48 2.74 -3.65 2.92 0.00 -0.92 -4.93 120.51 114.19 3ktc n ALA 310 Ca -0.01 -0.20 -0.27 0.00 0.00 0.00 0.00 53.44 52.95 3ktc n ALA 310 Cb 0.38 -1.36 0.02 0.00 0.00 0.00 0.00 19.45 18.50 3ktc n ALA 310 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3ktc n GLN 311 N -1.38 -4.90 -3.17 0.00 6.02 0.07 -4.94 117.38 109.08 3ktc n GLN 311 Ca 0.09 0.61 -0.44 0.00 -0.01 0.00 0.00 57.00 57.25 3ktc n GLN 311 Cb 0.32 -5.45 -0.06 0.00 1.02 0.00 0.00 30.24 26.07 3ktc n GLN 311 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3ktc s ASN 312 N -3.06 6.20 0.45 1.08 3.84 -0.31 -4.92 114.94 118.22 3ktc s ASN 312 Ca 0.55 -1.11 0.25 0.00 0.21 0.00 0.00 52.86 52.77 3ktc s ASN 312 Cb -0.28 -2.28 0.77 0.00 -0.55 0.00 0.00 41.25 38.91 3ktc s ASN 312 CO 0.68 -0.93 1.76 1.55 -2.79 0.00 0.00 177.10 177.37 3ktc h PRO 313 N 9.02 0.00 0.00 0.43 0.13 -1.92 -1.94 132.00 137.72 3ktc h PRO 313 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3ktc h PRO 313 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3ktc h PRO 313 CO 1.00 0.12 -0.00 -0.07 -0.23 0.00 0.00 178.00 178.82 3ktc h LEU 314 N 0.00 -0.00 -0.37 1.56 3.38 -1.98 -0.06 115.31 117.84 3ktc h LEU 314 Ca -0.00 -0.55 0.02 0.00 0.09 0.00 0.00 57.88 57.44 3ktc h LEU 314 Cb 0.84 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 3ktc h LEU 314 CO 0.02 0.55 0.22 1.56 0.09 0.00 0.00 178.44 180.87 3ktc h GLN 315 N -0.56 0.43 -0.41 1.13 4.20 -1.95 -0.68 115.11 117.27 3ktc h GLN 315 Ca -0.00 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3ktc h GLN 315 Cb 0.55 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3ktc h GLN 315 CO 0.00 0.28 0.26 0.00 -0.67 0.00 0.00 178.83 178.70 3ktc h ALA 316 N 1.17 0.52 -0.37 3.87 0.00 -1.33 -1.98 119.26 121.14 3ktc h ALA 316 Ca 0.15 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3ktc h ALA 316 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3ktc h ALA 316 CO -0.07 -0.05 -0.24 1.96 0.00 0.00 0.00 179.25 180.85 3ktc h GLN 317 N 0.53 0.73 0.02 0.00 1.08 -0.90 -1.01 115.11 115.54 3ktc h GLN 317 Ca 0.15 -0.30 0.03 0.00 -1.45 0.00 0.00 58.65 57.09 3ktc h GLN 317 Cb -0.04 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.32 3ktc h GLN 317 CO -0.05 0.90 -0.22 -0.09 -0.95 0.00 0.00 178.83 178.42 3ktc h ARG 318 N 0.64 -0.34 -0.61 1.46 2.43 -0.85 0.14 114.38 117.24 3ktc h ARG 318 Ca 0.09 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3ktc h ARG 318 Cb 0.73 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.33 3ktc h ARG 318 CO 0.06 -0.23 0.36 0.82 -1.51 0.00 0.00 179.97 179.47 3ktc h ILE 319 N -0.36 1.18 -0.34 1.20 2.04 -1.08 -1.30 117.51 118.86 3ktc h ILE 319 Ca 0.06 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3ktc h ILE 319 Cb 0.43 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3ktc h ILE 319 CO -0.19 0.19 0.10 0.58 0.00 0.00 0.00 178.15 178.83 3ktc h VAL 320 N 0.83 1.21 -0.90 1.67 2.07 -0.96 -2.94 116.25 117.24 3ktc h VAL 320 Ca 0.22 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3ktc h VAL 320 Cb -0.01 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3ktc h VAL 320 CO -0.04 0.24 0.56 1.56 0.02 0.00 0.00 177.57 179.91 3ktc h GLN 321 N 0.39 1.21 -0.78 1.57 4.20 -0.33 0.54 115.11 121.91 3ktc h GLN 321 Ca 0.11 -0.10 0.06 0.00 0.06 0.00 0.00 58.65 58.78 3ktc h GLN 321 Cb 0.27 -0.26 -0.05 0.00 0.30 0.00 0.00 27.48 27.74 3ktc h GLN 321 CO -0.00 0.83 0.51 -0.44 -0.67 0.00 0.00 178.83 179.05 3ktc h ASP 322 N 1.23 0.75 0.11 1.46 3.32 -1.11 -0.07 116.42 122.11 3ktc h ASP 322 Ca 0.32 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.21 3ktc h ASP 322 Cb -0.09 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.32 3ktc h ASP 322 CO -0.06 0.49 -0.78 0.00 -1.72 0.00 0.00 179.24 177.17 3ktc h ALA 323 N 1.57 -0.03 -0.14 3.45 0.00 -1.21 -3.36 119.26 119.54 3ktc h ALA 323 Ca 0.33 -0.74 -0.20 0.00 0.00 0.00 0.00 54.91 54.30 3ktc h ALA 323 Cb 0.20 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ktc h ALA 323 CO -0.11 0.39 -0.73 1.25 0.00 0.00 0.00 179.25 180.05 3ktc h LEU 324 N -0.49 0.76 -0.48 0.00 5.85 -0.75 -3.21 115.31 117.00 3ktc h LEU 324 Ca -0.15 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.09 3ktc h LEU 324 Cb 1.54 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.35 3ktc h LEU 324 CO 0.10 1.26 0.00 0.18 -0.34 0.00 0.00 178.44 179.64 3ktc n LEU 325 N -3.91 0.71 -1.03 2.25 4.77 -0.05 -4.67 117.00 115.07 3ktc n LEU 325 Ca -0.06 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 3ktc n LEU 325 Cb 0.71 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 3ktc n LEU 325 CO 0.51 0.16 0.25 -1.54 -1.33 0.00 0.00 177.39 175.44 3ktc n SER 326 N -0.24 1.49 -1.27 -1.43 3.41 -1.21 -4.83 113.62 109.55 3ktc n SER 326 Ca 0.11 -0.99 -0.00 0.00 -0.26 0.00 0.00 58.87 57.72 3ktc n SER 326 Cb 0.15 -0.25 -0.00 0.00 -0.26 0.00 0.00 64.21 63.85 3ktc n SER 326 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ktc n SER 327 N 0.79 -3.41 0.05 4.04 2.88 -1.26 -4.91 113.62 111.80 3ktc n SER 327 Ca 0.00 0.36 -0.05 0.00 -1.33 0.00 0.00 58.87 57.85 3ktc n SER 327 Cb 0.24 -1.81 -0.09 0.00 -0.75 0.00 0.00 64.21 61.80 3ktc n SER 327 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 3ktc h ILE 328 N 0.82 1.18 0.00 2.46 2.10 -1.92 -3.32 117.51 118.83 3ktc h ILE 328 Ca -0.00 -2.83 0.00 0.00 1.08 0.00 0.00 64.86 63.11 3ktc h ILE 328 Cb 0.01 2.56 0.00 0.00 -1.09 0.00 0.00 36.82 38.29 3ktc h ILE 328 CO 0.00 0.68 0.00 0.35 -1.08 0.00 0.00 178.15 178.10 3ktc n THR 329 N -3.19 0.11 -3.56 2.19 -2.24 -1.26 -4.18 114.28 102.16 3ktc n THR 329 Ca -0.05 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.29 3ktc n THR 329 Cb 0.91 -0.53 -0.08 0.00 -2.10 0.00 0.00 70.33 68.54 3ktc n THR 329 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3ktc s VAL 330 N -3.02 4.29 -2.82 2.28 1.01 -1.25 -5.29 120.40 115.60 3ktc s VAL 330 Ca 0.13 -2.07 0.25 0.00 0.00 0.00 0.00 61.98 60.30 3ktc s VAL 330 Cb 0.18 -3.80 0.32 0.00 0.00 0.00 0.00 36.38 33.08 3ktc s VAL 330 CO 0.53 -0.82 1.43 -1.54 0.00 0.00 0.00 175.10 174.70