#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktj h ILE 19 N 0.00 1.16 0.00 5.18 6.09 -2.06 -1.14 117.51 126.74 3ktj h ILE 19 Ca 0.00 -0.33 -0.04 0.00 -1.37 0.00 0.00 64.86 63.13 3ktj h ILE 19 Cb 0.00 0.35 -0.01 0.00 0.47 0.00 0.00 36.82 37.64 3ktj h ILE 19 CO 0.00 0.16 -0.17 1.88 -3.07 0.00 0.00 178.15 176.95 3ktj h TYR 20 N 0.77 0.00 -0.19 2.19 0.05 -1.99 -3.10 116.97 114.70 3ktj h TYR 20 Ca 0.20 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.85 3ktj h TYR 20 Cb -0.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.69 3ktj h TYR 20 CO 0.00 0.17 -0.41 0.77 -1.05 0.00 0.00 178.16 177.64 3ktj h SER 21 N 0.00 0.68 -0.22 3.88 0.02 -1.65 -2.61 113.55 113.65 3ktj h SER 21 Ca -0.00 -0.56 -0.00 0.00 -0.84 0.00 0.00 61.79 60.39 3ktj h SER 21 Cb 1.08 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 3ktj h SER 21 CO 0.02 1.11 0.13 -0.09 -1.14 0.00 0.00 176.83 176.87 3ktj h ARG 22 N 0.28 0.32 -0.64 3.45 9.65 -1.38 -2.26 114.38 123.81 3ktj h ARG 22 Ca 0.00 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 58.83 3ktj h ARG 22 Cb 1.01 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 29.49 3ktj h ARG 22 CO 0.09 0.24 0.29 -0.07 2.80 0.00 0.00 179.97 183.32 3ktj h LEU 23 N 0.33 0.85 -0.55 3.80 3.38 -1.39 -2.83 115.31 118.90 3ktj h LEU 23 Ca 0.09 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 3ktj h LEU 23 Cb 0.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3ktj h LEU 23 CO -0.02 0.76 -0.59 0.25 0.09 0.00 0.00 178.44 178.93 3ktj h LEU 24 N 0.88 0.48 -2.44 1.67 5.85 -1.19 0.29 115.31 120.85 3ktj h LEU 24 Ca 0.22 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.68 3ktj h LEU 24 Cb 0.15 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 3ktj h LEU 24 CO -0.02 0.96 0.16 0.50 -0.34 0.00 0.00 178.44 179.70 3ktj h LYS 25 N 0.32 0.00 -0.17 1.25 1.63 -1.19 0.17 116.57 118.58 3ktj h LYS 25 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3ktj h LYS 25 Cb 1.13 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.76 3ktj h LYS 25 CO 0.10 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.85 3ktj n ASP 26 N -3.29 3.03 -1.57 4.20 10.43 -1.13 -5.00 116.55 123.22 3ktj n ASP 26 Ca -0.01 -2.71 -0.09 0.00 2.57 0.00 0.00 54.79 54.55 3ktj n ASP 26 Cb 0.24 -0.38 0.02 0.00 1.84 0.00 0.00 41.12 42.85 3ktj n ASP 26 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3ktj n ARG 27 N -0.57 -2.69 -4.02 -1.24 1.74 0.59 -4.95 116.66 105.53 3ktj n ARG 27 Ca 0.15 0.34 -0.31 0.00 -0.77 0.00 0.00 57.85 57.26 3ktj n ARG 27 Cb 0.65 -3.92 -0.15 0.00 -1.02 0.00 0.00 32.46 28.01 3ktj n ARG 27 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ktj s ILE 28 N -3.00 1.97 0.06 0.55 1.01 1.00 -1.07 121.20 121.72 3ktj s ILE 28 Ca 0.19 -1.60 -0.12 0.00 0.00 0.00 0.00 60.65 59.12 3ktj s ILE 28 Cb -0.08 -2.18 -0.06 0.00 0.01 0.00 0.00 42.46 40.15 3ktj s ILE 28 CO 0.23 -0.13 0.42 -0.63 0.00 0.00 0.00 174.94 174.84 3ktj s ILE 29 N 1.17 5.04 -0.12 2.92 1.01 0.53 -3.50 121.20 128.24 3ktj s ILE 29 Ca -0.05 0.64 -0.02 0.00 0.00 0.00 0.00 60.65 61.22 3ktj s ILE 29 Cb -0.19 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 3ktj s ILE 29 CO -0.06 0.38 -0.06 -0.04 0.00 0.00 0.00 174.94 175.16 3ktj s MET 30 N -1.63 3.34 -0.51 2.79 -1.94 -1.26 -1.48 119.30 118.61 3ktj s MET 30 Ca 0.30 -0.55 0.03 0.00 -1.71 0.00 0.00 55.69 53.77 3ktj s MET 30 Cb -0.15 -2.77 0.15 0.00 2.01 0.00 0.00 34.83 34.07 3ktj s MET 30 CO 0.17 0.38 0.32 -1.17 -0.01 0.00 0.00 175.02 174.71 3ktj s LEU 31 N -0.03 3.10 -0.52 -0.03 2.96 -0.53 -4.98 118.68 118.65 3ktj s LEU 31 Ca 0.00 -3.05 0.06 0.00 -0.22 0.00 0.00 54.13 50.92 3ktj s LEU 31 Cb -0.13 -1.11 0.37 0.00 0.50 0.00 0.00 46.19 45.81 3ktj s LEU 31 CO 0.03 -0.20 0.99 0.61 -1.32 0.00 0.00 176.35 176.46 3ktj n GLY 32 N 2.98 5.54 3.63 7.98 0.00 -1.26 -1.57 105.19 122.49 3ktj n GLY 32 Ca 0.15 -2.69 -0.03 0.00 0.00 0.00 0.00 46.02 43.45 3ktj n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ktj s SER 33 N -3.44 -0.16 0.19 1.61 1.04 -1.17 -4.89 113.70 106.88 3ktj s SER 33 Ca 0.48 -0.15 -0.33 0.00 0.48 0.00 0.00 55.95 56.43 3ktj s SER 33 Cb 0.33 0.28 -0.14 0.00 0.10 0.00 0.00 66.02 66.59 3ktj s SER 33 CO -0.15 -0.49 1.50 0.00 0.98 0.00 0.00 173.24 175.08 3ktj n ALA 34 N -0.35 1.20 -2.49 5.32 0.00 -1.26 -4.56 120.51 118.37 3ktj n ALA 34 Ca -0.06 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.39 3ktj n ALA 34 Cb 0.61 -2.31 -0.02 0.00 0.00 0.00 0.00 19.45 17.72 3ktj n ALA 34 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ktj s ILE 35 N 0.49 4.36 0.16 0.00 1.01 0.21 -4.93 121.20 122.49 3ktj s ILE 35 Ca 0.74 1.66 -0.01 0.00 0.00 0.00 0.00 60.65 63.05 3ktj s ILE 35 Cb -0.67 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 37.69 3ktj s ILE 35 CO 0.43 -0.07 0.07 1.51 0.00 0.00 0.00 174.94 176.88 3ktj s ASP 36 N 1.58 0.43 0.58 3.58 -4.77 -1.26 -1.62 116.67 115.19 3ktj s ASP 36 Ca 0.53 -1.25 0.33 0.00 -3.30 0.00 0.00 52.55 48.87 3ktj s ASP 36 Cb -0.22 0.28 1.39 0.00 -1.09 0.00 0.00 42.92 43.29 3ktj s ASP 36 CO 0.17 -0.73 1.69 0.44 0.70 0.00 0.00 175.17 177.45 3ktj h ASP 37 N 2.77 0.00 0.06 2.11 3.45 -1.95 -1.63 116.42 121.23 3ktj h ASP 37 Ca -0.36 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.10 3ktj h ASP 37 Cb 1.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 3ktj h ASP 37 CO 0.58 0.00 -0.03 0.78 -1.57 0.00 0.00 179.24 179.01 3ktj h ASN 38 N 0.00 -0.06 -0.83 6.45 2.35 -1.98 -2.80 115.58 118.70 3ktj h ASN 38 Ca 0.46 -0.51 0.06 0.00 -0.55 0.00 0.00 56.30 55.77 3ktj h ASN 38 Cb 2.20 0.02 -0.05 0.00 0.05 0.00 0.00 38.32 40.54 3ktj h ASN 38 CO -0.00 0.64 0.55 0.58 -1.65 0.00 0.00 177.43 177.54 3ktj h VAL 39 N -0.94 1.06 -0.27 2.81 2.07 -1.80 -2.58 116.25 116.60 3ktj h VAL 39 Ca -0.01 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 3ktj h VAL 39 Cb 0.57 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3ktj h VAL 39 CO 0.01 0.17 0.14 0.00 0.02 0.00 0.00 177.57 177.91 3ktj h ALA 40 N 1.54 0.34 -0.39 1.67 0.00 -1.39 -2.27 119.26 118.76 3ktj h ALA 40 Ca 0.36 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 3ktj h ALA 40 Cb 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3ktj h ALA 40 CO -0.13 -0.11 -0.16 -0.91 0.00 0.00 0.00 179.25 177.94 3ktj h ASN 41 N 0.31 0.73 0.10 0.00 2.35 -1.19 -2.32 115.58 115.56 3ktj h ASN 41 Ca 0.09 -0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.61 3ktj h ASN 41 Cb 0.09 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3ktj h ASN 41 CO -0.01 0.89 -0.05 -1.28 -1.65 0.00 0.00 177.43 175.33 3ktj h SER 42 N 0.65 -0.11 -0.49 5.81 0.87 -1.39 -2.38 113.55 116.50 3ktj h SER 42 Ca 0.10 -0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.61 3ktj h SER 42 Cb 0.63 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.60 3ktj h SER 42 CO 0.04 -0.01 0.33 0.40 -0.53 0.00 0.00 176.83 177.06 3ktj h ILE 43 N -0.21 1.12 -0.12 2.23 2.04 -1.31 -1.86 117.51 119.40 3ktj h ILE 43 Ca -0.01 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 3ktj h ILE 43 Cb 0.17 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3ktj h ILE 43 CO 0.02 0.12 -0.02 0.58 0.00 0.00 0.00 178.15 178.86 3ktj h VAL 44 N 0.66 1.28 -0.09 1.67 2.07 -1.22 -2.58 116.25 118.04 3ktj h VAL 44 Ca 0.18 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 3ktj h VAL 44 Cb -0.06 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3ktj h VAL 44 CO -0.04 0.26 0.06 0.77 0.02 0.00 0.00 177.57 178.64 3ktj h SER 45 N -0.06 0.11 -1.00 0.57 4.64 -1.11 -2.33 113.55 114.37 3ktj h SER 45 Ca 0.03 -0.05 0.13 0.00 -0.47 0.00 0.00 61.79 61.43 3ktj h SER 45 Cb 0.41 -0.03 -0.09 0.00 -0.31 0.00 0.00 62.40 62.39 3ktj h SER 45 CO 0.01 0.13 0.63 1.56 -0.87 0.00 0.00 176.83 178.29 3ktj h GLN 46 N 0.08 0.91 -0.09 4.77 4.20 -1.36 0.28 115.11 123.91 3ktj h GLN 46 Ca 0.03 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3ktj h GLN 46 Cb 0.04 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.61 3ktj h GLN 46 CO -0.01 0.60 0.04 -0.07 -0.67 0.00 0.00 178.83 178.73 3ktj h LEU 47 N 0.94 0.12 -1.60 1.46 3.38 -1.14 -2.11 115.31 116.36 3ktj h LEU 47 Ca 0.51 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.29 3ktj h LEU 47 Cb 0.57 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3ktj h LEU 47 CO -0.28 0.22 -0.22 -0.07 0.09 0.00 0.00 178.44 178.19 3ktj h LEU 48 N 0.01 0.00 0.45 1.67 3.38 -0.75 -2.51 115.31 117.56 3ktj h LEU 48 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3ktj h LEU 48 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3ktj h LEU 48 CO -0.00 0.22 -0.22 0.15 0.09 0.00 0.00 178.44 178.67 3ktj h PHE 49 N 0.00 -0.56 -0.10 1.13 3.57 -0.76 -2.97 116.94 117.25 3ktj h PHE 49 Ca -0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 3ktj h PHE 49 Cb 0.41 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 3ktj h PHE 49 CO 0.00 -0.26 0.15 -0.07 -2.23 0.00 0.00 178.31 175.90 3ktj h LEU 50 N -1.05 0.00 -0.22 0.59 3.38 -1.32 0.23 115.31 116.93 3ktj h LEU 50 Ca -0.06 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 3ktj h LEU 50 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3ktj h LEU 50 CO 0.10 0.00 -0.48 0.00 0.09 0.00 0.00 178.44 178.15 3ktj h ALA 51 N 1.79 0.73 0.08 1.53 0.00 -1.44 -3.29 119.26 118.67 3ktj h ALA 51 Ca 0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 3ktj h ALA 51 Cb 0.35 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3ktj h ALA 51 CO -0.00 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.82 3ktj h ALA 52 N 1.52 -0.11 -0.33 0.00 0.00 -0.38 -2.91 119.26 117.05 3ktj h ALA 52 Ca -0.00 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.73 3ktj h ALA 52 Cb 1.28 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3ktj h ALA 52 CO 0.06 -0.27 0.23 0.93 0.00 0.00 0.00 179.25 180.21 3ktj h GLU 53 N -0.69 0.06 -0.46 0.00 5.08 -1.60 -3.40 114.58 113.57 3ktj h GLU 53 Ca -0.01 -0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.49 3ktj h GLU 53 Cb 0.55 -0.01 -0.19 0.00 0.50 0.00 0.00 28.75 29.60 3ktj h GLU 53 CO 0.02 0.04 -0.14 0.34 -1.00 0.00 0.00 179.01 178.27 3ktj s ASP 54 N -6.56 -0.75 0.00 1.42 2.15 -1.24 -5.02 116.67 106.67 3ktj s ASP 54 Ca -0.05 0.01 0.06 0.00 0.43 0.00 0.00 52.55 52.99 3ktj s ASP 54 Cb 0.19 1.38 0.28 0.00 -0.30 0.00 0.00 42.92 44.46 3ktj s ASP 54 CO 0.71 -0.13 1.04 -0.81 -0.17 0.00 0.00 175.17 175.81 3ktj n PRO 55 N 4.97 0.07 -0.09 4.34 -0.04 -1.10 -3.39 135.00 139.75 3ktj n PRO 55 Ca 0.08 0.25 -0.14 0.00 -0.04 0.00 0.00 63.50 63.65 3ktj n PRO 55 Cb 0.58 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 3ktj n PRO 55 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3ktj n GLU 56 N -1.31 0.52 -1.72 0.54 -0.58 -1.26 -3.30 120.64 113.53 3ktj n GLU 56 Ca 0.02 0.50 -0.38 0.00 -0.42 0.00 0.00 57.16 56.89 3ktj n GLU 56 Cb 0.05 -1.67 0.06 0.00 -0.57 0.00 0.00 31.44 29.30 3ktj n GLU 56 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ktj n LYS 57 N -4.49 1.24 -2.14 3.49 5.02 -1.22 -4.71 118.16 115.35 3ktj n LYS 57 Ca -0.23 0.47 -0.28 0.00 -2.02 0.00 0.00 58.31 56.26 3ktj n LYS 57 Cb 0.52 -2.49 0.14 0.00 -0.02 0.00 0.00 35.03 33.18 3ktj n LYS 57 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3ktj s GLU 58 N -3.15 1.22 0.04 1.97 -1.05 -1.26 -4.60 118.70 111.87 3ktj s GLU 58 Ca 0.79 -0.54 0.03 0.00 -0.15 0.00 0.00 54.97 55.09 3ktj s GLU 58 Cb -0.40 -2.03 -0.02 0.00 -0.44 0.00 0.00 34.13 31.24 3ktj s GLU 58 CO 0.44 -1.94 -0.09 0.42 0.95 0.00 0.00 175.26 175.04 3ktj s ILE 59 N -3.58 0.66 -0.06 1.83 1.01 -0.90 -4.92 121.20 115.25 3ktj s ILE 59 Ca 0.69 -1.02 0.05 0.00 0.00 0.00 0.00 60.65 60.37 3ktj s ILE 59 Cb -0.06 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 3ktj s ILE 59 CO 0.49 -0.28 -0.21 -0.44 0.00 0.00 0.00 174.94 174.51 3ktj s SER 60 N -1.42 3.46 -0.36 3.58 0.01 -0.23 -0.80 113.70 117.95 3ktj s SER 60 Ca -0.07 -0.39 -0.00 0.00 1.31 0.00 0.00 55.95 56.80 3ktj s SER 60 Cb -0.09 -0.84 0.09 0.00 0.21 0.00 0.00 66.02 65.39 3ktj s SER 60 CO 0.01 0.28 0.09 -0.22 0.41 0.00 0.00 173.24 173.81 3ktj s LEU 61 N -0.36 4.71 0.02 2.44 2.96 0.32 -0.35 118.68 128.42 3ktj s LEU 61 Ca 0.03 -1.87 -0.25 0.00 -0.22 0.00 0.00 54.13 51.82 3ktj s LEU 61 Cb -0.12 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 3ktj s LEU 61 CO 0.02 -0.41 0.75 -0.31 -1.32 0.00 0.00 176.35 175.08 3ktj s TYR 62 N 1.09 3.71 0.03 5.38 1.51 -0.55 -1.15 117.35 127.37 3ktj s TYR 62 Ca 0.05 1.43 0.07 0.00 -1.01 0.00 0.00 57.07 57.61 3ktj s TYR 62 Cb -0.21 -2.82 -0.02 0.00 -0.11 0.00 0.00 41.96 38.80 3ktj s TYR 62 CO -0.05 0.24 -0.20 0.42 -1.11 0.00 0.00 175.55 174.85 3ktj s ILE 63 N 0.11 1.64 -0.41 2.71 1.01 0.26 -1.45 121.20 125.07 3ktj s ILE 63 Ca 0.38 -1.13 0.01 0.00 0.00 0.00 0.00 60.65 59.91 3ktj s ILE 63 Cb -0.20 -1.42 0.19 0.00 0.01 0.00 0.00 42.46 41.05 3ktj s ILE 63 CO 0.22 0.25 0.86 0.21 0.00 0.00 0.00 174.94 176.48 3ktj s ASN 64 N -1.04 -0.96 -0.02 3.58 2.47 -0.61 0.67 114.94 119.03 3ktj s ASN 64 Ca 0.07 -0.87 -0.02 0.00 0.42 0.00 0.00 52.86 52.46 3ktj s ASN 64 Cb -0.09 1.24 0.01 0.00 -1.45 0.00 0.00 41.25 40.96 3ktj s ASN 64 CO 0.01 -0.06 0.06 -0.55 -3.72 0.00 0.00 177.10 172.84 3ktj s SER 65 N 1.32 -0.05 0.00 -4.21 0.15 -0.94 -3.06 113.70 106.90 3ktj s SER 65 Ca 0.22 0.10 0.08 0.00 0.70 0.00 0.00 55.95 57.05 3ktj s SER 65 Cb 0.03 0.13 0.42 0.00 -1.71 0.00 0.00 66.02 64.89 3ktj s SER 65 CO -0.09 -0.04 1.28 -0.81 1.20 0.00 0.00 173.24 174.78 3ktj n PRO 66 N 2.96 1.09 0.00 5.44 -0.04 -1.26 -1.71 135.00 141.47 3ktj n PRO 66 Ca -0.13 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.20 3ktj n PRO 66 Cb 0.59 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 3ktj n PRO 66 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ktj n GLY 67 N 0.66 -1.05 0.00 0.55 0.00 -1.20 -4.52 105.19 99.62 3ktj n GLY 67 Ca 0.06 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.00 3ktj n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktj n GLY 68 N 0.00 -0.51 3.75 -0.02 0.00 -1.26 0.64 105.19 107.79 3ktj n GLY 68 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 3ktj n GLY 68 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ktj s SER 69 N -4.00 6.89 0.18 1.61 0.15 -0.64 -4.79 113.70 113.10 3ktj s SER 69 Ca 0.00 2.52 -0.10 0.00 0.70 0.00 0.00 55.95 59.07 3ktj s SER 69 Cb 0.00 -2.63 0.07 0.00 -1.71 0.00 0.00 66.02 61.75 3ktj s SER 69 CO 0.00 -0.48 1.66 0.40 1.20 0.00 0.00 173.24 176.02 3ktj h ILE 70 N 3.34 1.26 -0.20 6.45 2.04 -1.99 -1.90 117.51 126.52 3ktj h ILE 70 Ca -0.47 -1.04 -0.18 0.00 1.00 0.00 0.00 64.86 64.17 3ktj h ILE 70 Cb 1.22 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3ktj h ILE 70 CO 0.71 0.38 -0.61 0.71 0.00 0.00 0.00 178.15 179.34 3ktj h THR 71 N 0.92 1.30 -0.81 -0.27 1.35 -1.99 -1.85 112.91 111.56 3ktj h THR 71 Ca 0.18 -1.84 0.01 0.00 -0.55 0.00 0.00 66.41 64.20 3ktj h THR 71 Cb 0.46 1.79 -0.04 0.00 -1.73 0.00 0.00 68.15 68.63 3ktj h THR 71 CO 0.02 0.58 0.53 0.00 -0.25 0.00 0.00 175.52 176.40 3ktj h ALA 72 N 0.80 1.03 -0.48 6.62 0.00 -1.90 -2.77 119.26 122.56 3ktj h ALA 72 Ca -0.00 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 3ktj h ALA 72 Cb 1.19 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 3ktj h ALA 72 CO 0.12 0.45 -0.11 0.78 0.00 0.00 0.00 179.25 180.50 3ktj h GLY 73 N 1.10 0.96 1.82 0.00 0.00 -1.14 -3.21 103.07 102.59 3ktj h GLY 73 Ca 0.30 -0.74 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 3ktj h GLY 73 CO -0.06 0.68 -0.15 -0.33 0.00 0.00 0.00 176.54 176.67 3ktj h MET 74 N 0.80 0.22 0.09 4.80 2.86 -1.04 -2.39 114.93 120.26 3ktj h MET 74 Ca 0.13 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3ktj h MET 74 Cb 0.62 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3ktj h MET 74 CO 0.04 0.38 -0.04 0.00 1.06 0.00 0.00 176.91 178.35 3ktj h ALA 75 N 1.64 -0.12 -0.28 6.32 0.00 -1.55 0.99 119.26 126.26 3ktj h ALA 75 Ca 0.04 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.92 3ktj h ALA 75 Cb 0.40 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 3ktj h ALA 75 CO 0.02 -0.48 -0.21 0.82 0.00 0.00 0.00 179.25 179.40 3ktj h ILE 76 N -0.28 0.44 -0.35 0.00 2.04 -1.56 -1.18 117.51 116.62 3ktj h ILE 76 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 3ktj h ILE 76 Cb 0.23 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3ktj h ILE 76 CO 0.02 0.00 0.15 0.22 0.00 0.00 0.00 178.15 178.54 3ktj h TYR 77 N -0.19 0.28 -0.22 1.37 3.20 -1.24 -2.58 116.97 117.58 3ktj h TYR 77 Ca 0.15 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 3ktj h TYR 77 Cb 0.42 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 3ktj h TYR 77 CO -0.39 0.14 0.04 -0.44 -1.64 0.00 0.00 178.16 175.88 3ktj h ASP 78 N 0.32 0.28 0.96 -2.11 3.45 -0.09 -2.69 116.42 116.55 3ktj h ASP 78 Ca 0.15 -0.03 -0.20 0.00 0.43 0.00 0.00 57.03 57.38 3ktj h ASP 78 Cb 0.09 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 38.76 3ktj h ASP 78 CO -0.13 0.30 -0.95 0.74 -1.57 0.00 0.00 179.24 177.63 3ktj h THR 79 N 0.31 1.68 -0.09 0.35 2.02 -0.99 -3.01 112.91 113.18 3ktj h THR 79 Ca 0.08 -3.27 -0.04 0.00 0.77 0.00 0.00 66.41 63.94 3ktj h THR 79 Cb 0.14 2.77 -0.01 0.00 -1.74 0.00 0.00 68.15 69.31 3ktj h THR 79 CO -0.00 0.93 -0.15 0.24 0.37 0.00 0.00 175.52 176.91 3ktj h MET 80 N 0.00 0.13 0.00 6.66 2.86 -1.13 -2.45 114.93 121.00 3ktj h MET 80 Ca -0.01 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 3ktj h MET 80 Cb 1.69 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.32 3ktj h MET 80 CO 0.12 0.29 -0.37 1.96 1.06 0.00 0.00 176.91 179.97 3ktj h GLN 81 N 0.13 0.00 0.05 1.72 1.08 -1.47 -3.38 115.11 113.24 3ktj h GLN 81 Ca 0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 3ktj h GLN 81 Cb 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 3ktj h GLN 81 CO 0.02 0.30 -0.02 0.35 -0.95 0.00 0.00 178.83 178.52 3ktj h PHE 82 N 0.00 -0.06 -3.56 2.96 3.57 -1.31 -3.47 116.94 115.07 3ktj h PHE 82 Ca -0.01 -0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.94 3ktj h PHE 82 Cb 1.24 0.02 0.19 0.00 2.79 0.00 0.00 35.95 40.19 3ktj h PHE 82 CO 0.00 0.35 -0.16 0.44 -2.23 0.00 0.00 178.31 176.71 3ktj n ILE 83 N -4.77 1.88 0.09 1.41 -5.35 -1.18 -4.95 119.36 106.49 3ktj n ILE 83 Ca -0.05 -0.33 -0.08 0.00 -0.27 0.00 0.00 62.75 62.02 3ktj n ILE 83 Cb 0.22 -0.90 -0.02 0.00 -1.74 0.00 0.00 39.64 37.20 3ktj n ILE 83 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 3ktj h LYS 84 N -0.58 0.16 -6.87 6.28 1.57 -1.91 -3.46 116.57 111.76 3ktj h LYS 84 Ca -0.46 -0.18 -0.52 0.00 -1.87 0.00 0.00 60.65 57.62 3ktj h LYS 84 Cb 1.33 0.05 0.05 0.00 0.08 0.00 0.00 32.23 33.75 3ktj h LYS 84 CO 0.43 0.94 0.60 -2.14 -0.57 0.00 0.00 179.45 178.71 3ktj s PRO 85 N -3.14 4.39 0.17 3.15 0.02 -1.21 -4.93 135.00 133.46 3ktj s PRO 85 Ca -0.02 2.11 -0.30 0.00 0.02 0.00 0.00 61.00 62.80 3ktj s PRO 85 Cb 0.10 -3.07 -0.08 0.00 0.02 0.00 0.00 34.50 31.47 3ktj s PRO 85 CO 0.82 -0.11 1.17 0.15 -0.33 0.00 0.00 177.00 178.70 3ktj s LYS 86 N -1.76 4.51 -0.26 5.54 1.02 -1.26 -4.84 119.74 122.69 3ktj s LYS 86 Ca 0.48 1.83 -0.06 0.00 0.02 0.00 0.00 55.97 58.24 3ktj s LYS 86 Cb -0.38 -3.26 -0.01 0.00 -0.52 0.00 0.00 37.83 33.67 3ktj s LYS 86 CO 0.50 -0.06 0.05 0.08 -0.92 0.00 0.00 175.35 175.00 3ktj s VAL 87 N -0.03 3.96 0.27 3.17 1.01 -1.26 -2.11 120.40 125.42 3ktj s VAL 87 Ca 0.52 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 3ktj s VAL 87 Cb -0.32 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 3ktj s VAL 87 CO 0.36 0.24 0.49 -0.94 0.00 0.00 0.00 175.10 175.25 3ktj s SER 88 N 1.54 6.38 -0.01 3.32 1.04 0.02 -1.86 113.70 124.13 3ktj s SER 88 Ca 0.05 0.52 0.04 0.00 0.48 0.00 0.00 55.95 57.04 3ktj s SER 88 Cb -0.16 -2.06 -0.01 0.00 0.10 0.00 0.00 66.02 63.89 3ktj s SER 88 CO 0.02 -0.17 -0.13 0.42 0.98 0.00 0.00 173.24 174.36 3ktj s THR 89 N -2.07 1.03 -0.23 2.02 -4.23 -1.03 0.12 115.64 111.24 3ktj s THR 89 Ca 0.41 -0.59 -0.00 0.00 -1.18 0.00 0.00 61.69 60.33 3ktj s THR 89 Cb -0.10 -0.86 0.06 0.00 1.34 0.00 0.00 72.50 72.94 3ktj s THR 89 CO 0.31 0.27 -0.02 -0.63 -0.54 0.00 0.00 174.62 174.01 3ktj s ILE 90 N -0.35 1.20 -0.04 2.99 1.09 -0.30 0.05 121.20 125.85 3ktj s ILE 90 Ca 0.05 -1.06 -0.30 0.00 -1.10 0.00 0.00 60.65 58.24 3ktj s ILE 90 Cb -0.05 -1.58 -0.04 0.00 -1.06 0.00 0.00 42.46 39.73 3ktj s ILE 90 CO -0.00 -0.18 1.21 0.00 -0.10 0.00 0.00 174.94 175.87 3ktj s ILE 92 N 2.12 0.73 0.00 0.00 2.07 0.21 -3.07 121.20 123.27 3ktj s ILE 92 Ca 0.57 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.59 3ktj s ILE 92 Cb -0.25 -0.73 0.00 0.00 0.13 0.00 0.00 42.46 41.61 3ktj s ILE 92 CO 0.23 0.28 0.00 0.61 -1.91 0.00 0.00 174.94 174.14 3ktj n GLY 93 N 4.16 1.76 3.13 1.50 0.00 -1.26 -3.97 105.19 110.50 3ktj n GLY 93 Ca -0.22 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 3ktj n GLY 93 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ktj s MET 94 N 0.00 0.66 -0.42 1.61 -2.45 -1.26 -2.02 119.30 115.41 3ktj s MET 94 Ca 0.00 -0.95 0.05 0.00 -1.25 0.00 0.00 55.69 53.54 3ktj s MET 94 Cb 0.00 0.25 0.17 0.00 1.25 0.00 0.00 34.83 36.50 3ktj s MET 94 CO 0.00 -0.16 0.49 0.00 1.05 0.00 0.00 175.02 176.40 3ktj s ALA 95 N -3.33 -0.72 0.25 4.11 0.00 -0.71 -2.21 121.76 119.15 3ktj s ALA 95 Ca 0.01 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.98 3ktj s ALA 95 Cb 0.03 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 3ktj s ALA 95 CO -0.08 -2.15 0.42 0.00 0.00 0.00 0.00 175.76 173.95 3ktj s ALA 96 N 1.03 3.84 0.00 0.00 0.00 -0.70 -1.78 121.76 124.15 3ktj s ALA 96 Ca 0.24 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.19 3ktj s ALA 96 Cb -0.06 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.15 3ktj s ALA 96 CO -0.07 0.24 0.00 0.45 0.00 0.00 0.00 175.76 176.38 3ktj n SER 97 N -1.24 0.00 0.30 0.00 2.88 -0.41 0.06 113.62 115.22 3ktj n SER 97 Ca -0.06 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.65 3ktj n SER 97 Cb 0.56 0.00 0.92 0.00 -0.75 0.00 0.00 64.21 64.94 3ktj n SER 97 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 3ktj h MET 98 N 0.00 0.00 -0.28 -1.46 0.00 -1.88 -0.47 114.93 110.84 3ktj h MET 98 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 59.70 59.56 3ktj h MET 98 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 31.60 3ktj h MET 98 CO 0.00 0.00 -0.36 0.78 0.00 0.00 0.00 176.91 177.33 3ktj h GLY 99 N 0.00 0.80 2.00 8.32 0.00 -0.63 -3.01 103.07 110.55 3ktj h GLY 99 Ca 0.02 -0.87 -0.10 0.00 0.00 0.00 0.00 47.33 46.39 3ktj h GLY 99 CO -0.00 0.78 -0.48 0.00 0.00 0.00 0.00 176.54 176.84 3ktj h ALA 100 N 0.69 1.07 0.86 3.60 0.00 -0.98 -2.65 119.26 121.85 3ktj h ALA 100 Ca 0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 3ktj h ALA 100 Cb 0.94 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3ktj h ALA 100 CO 0.08 0.60 -0.42 0.35 0.00 0.00 0.00 179.25 179.86 3ktj h PHE 101 N 0.00 -1.10 -0.80 0.00 3.57 -1.42 -1.79 116.94 115.39 3ktj h PHE 101 Ca -0.00 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.58 3ktj h PHE 101 Cb 0.92 0.37 -0.08 0.00 2.79 0.00 0.00 35.95 39.95 3ktj h PHE 101 CO 0.00 -0.68 0.42 -0.07 -2.23 0.00 0.00 178.31 175.75 3ktj h LEU 102 N -1.17 0.56 -0.81 0.59 3.38 -1.57 0.16 115.31 116.44 3ktj h LEU 102 Ca -0.12 0.07 0.17 0.00 0.09 0.00 0.00 57.88 58.08 3ktj h LEU 102 Cb 0.90 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.52 3ktj h LEU 102 CO 0.19 0.29 0.34 0.25 0.09 0.00 0.00 178.44 179.60 3ktj h LEU 103 N 0.68 0.32 -0.56 1.67 5.85 -1.28 0.72 115.31 122.70 3ktj h LEU 103 Ca 0.40 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.25 3ktj h LEU 103 Cb 0.46 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3ktj h LEU 103 CO -0.29 0.09 0.00 0.00 -0.34 0.00 0.00 178.44 177.89 3ktj h ALA 104 N 1.60 1.00 0.00 1.25 0.00 0.18 -3.08 119.26 120.21 3ktj h ALA 104 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 3ktj h ALA 104 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3ktj h ALA 104 CO -0.44 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.81 3ktj n ALA 105 N -1.86 2.57 -1.51 0.00 0.00 0.25 -4.89 120.51 115.07 3ktj n ALA 105 Ca 0.03 -0.13 -0.31 0.00 0.00 0.00 0.00 53.44 53.02 3ktj n ALA 105 Cb 0.33 -1.35 0.06 0.00 0.00 0.00 0.00 19.45 18.49 3ktj n ALA 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ktj s GLY 106 N -1.73 1.72 0.18 0.00 0.00 -1.17 -4.95 107.32 101.37 3ktj s GLY 106 Ca 0.32 0.16 -0.33 0.00 0.00 0.00 0.00 44.72 44.87 3ktj s GLY 106 CO 0.25 0.48 1.38 -2.21 0.00 0.00 0.00 173.10 173.00 3ktj n GLU 107 N -3.10 1.71 -1.69 2.90 4.07 -0.78 -4.85 120.64 118.90 3ktj n GLU 107 Ca 0.08 0.61 -0.44 0.00 -0.06 0.00 0.00 57.16 57.35 3ktj n GLU 107 Cb 0.53 -2.26 -0.04 0.00 -0.06 0.00 0.00 31.44 29.62 3ktj n GLU 107 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 3ktj n LYS 108 N 2.40 2.45 -0.17 5.31 4.01 -1.26 -1.00 118.16 129.90 3ktj n LYS 108 Ca 0.15 0.89 0.00 0.00 -0.51 0.00 0.00 58.31 58.84 3ktj n LYS 108 Cb 0.27 -2.71 0.00 0.00 -0.51 0.00 0.00 35.03 32.08 3ktj n LYS 108 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3ktj n GLY 109 N 3.81 0.87 2.13 0.72 0.00 -1.26 -4.90 105.19 106.57 3ktj n GLY 109 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 3ktj n GLY 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ktj n LYS 110 N -2.00 2.10 -4.40 1.61 4.76 -0.17 -4.95 118.16 115.11 3ktj n LYS 110 Ca 0.00 -3.49 -0.33 0.00 -2.87 0.00 0.00 58.31 51.61 3ktj n LYS 110 Cb 0.00 -1.61 -0.15 0.00 -1.84 0.00 0.00 35.03 31.43 3ktj n LYS 110 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3ktj s ARG 111 N -3.14 3.19 0.20 1.97 0.52 -1.24 -2.47 118.95 117.98 3ktj s ARG 111 Ca 0.37 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.83 3ktj s ARG 111 Cb 0.37 -2.65 -0.00 0.00 0.52 0.00 0.00 34.95 33.18 3ktj s ARG 111 CO -0.04 -0.04 0.00 0.66 0.02 0.00 0.00 175.30 175.90 3ktj n TYR 112 N 4.22 0.47 0.00 -0.53 4.02 0.11 -1.14 117.16 124.30 3ktj n TYR 112 Ca -0.19 -1.00 0.00 0.00 -0.01 0.00 0.00 57.90 56.70 3ktj n TYR 112 Cb 0.51 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 3ktj n TYR 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3ktj n ALA 113 N -2.35 0.00 -1.97 -0.72 0.00 -1.19 -2.44 120.51 111.82 3ktj n ALA 113 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 3ktj n ALA 113 Cb 0.26 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.72 3ktj n ALA 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ktj s LEU 114 N 0.00 3.27 0.27 0.00 1.43 -1.17 -2.11 118.68 120.36 3ktj s LEU 114 Ca 0.00 1.22 -0.04 0.00 -1.03 0.00 0.00 54.13 54.28 3ktj s LEU 114 Cb 0.00 -4.20 0.55 0.00 0.03 0.00 0.00 46.19 42.57 3ktj s LEU 114 CO 0.00 -0.89 1.60 -0.65 0.23 0.00 0.00 176.35 176.65 3ktj h PRO 115 N -0.24 0.05 -0.57 1.29 0.11 -1.96 -1.89 132.00 128.80 3ktj h PRO 115 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3ktj h PRO 115 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ktj h PRO 115 CO 0.62 0.04 0.00 0.09 -0.21 0.00 0.00 178.00 178.54 3ktj n ASN 116 N -5.44 5.53 -4.78 -2.05 4.13 -1.26 -4.45 115.26 106.94 3ktj n ASN 116 Ca 0.17 -2.86 -0.33 0.00 1.68 0.00 0.00 54.58 53.24 3ktj n ASN 116 Cb 0.58 -0.66 0.04 0.00 -1.54 0.00 0.00 39.78 38.19 3ktj n ASN 116 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3ktj s SER 117 N -0.86 5.27 0.04 6.41 0.01 -0.71 -4.88 113.70 118.98 3ktj s SER 117 Ca 0.54 1.95 0.08 0.00 1.31 0.00 0.00 55.95 59.83 3ktj s SER 117 Cb 0.40 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 3ktj s SER 117 CO 0.17 -1.52 -0.22 -0.70 0.41 0.00 0.00 173.24 171.38 3ktj s GLU 118 N -4.10 1.52 -0.01 12.44 2.12 -0.86 -2.71 118.70 127.09 3ktj s GLU 118 Ca 0.66 -0.98 0.02 0.00 0.36 0.00 0.00 54.97 55.03 3ktj s GLU 118 Cb -0.19 -1.64 -0.00 0.00 0.26 0.00 0.00 34.13 32.56 3ktj s GLU 118 CO 0.41 0.42 -0.05 0.08 -0.54 0.00 0.00 175.26 175.57 3ktj s VAL 119 N -0.79 0.45 0.00 3.70 1.01 -0.58 -1.74 120.40 122.45 3ktj s VAL 119 Ca 0.09 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3ktj s VAL 119 Cb -0.09 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 3ktj s VAL 119 CO 0.02 0.14 -0.03 -0.32 0.00 0.00 0.00 175.10 174.91 3ktj s MET 120 N 0.03 0.20 0.12 2.72 0.00 -0.74 0.29 119.30 121.93 3ktj s MET 120 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 55.69 55.58 3ktj s MET 120 Cb -0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 34.83 34.61 3ktj s MET 120 CO -0.00 0.03 -0.16 0.96 0.00 0.00 0.00 175.02 175.85 3ktj s ILE 121 N -0.29 1.46 0.04 10.11 -4.36 -0.86 -1.29 121.20 126.01 3ktj s ILE 121 Ca -0.02 -1.64 -0.02 0.00 -0.26 0.00 0.00 60.65 58.71 3ktj s ILE 121 Cb -0.02 -1.51 0.01 0.00 1.25 0.00 0.00 42.46 42.19 3ktj s ILE 121 CO -0.00 -0.29 0.12 0.00 0.24 0.00 0.00 174.94 175.01 3ktj n HIS 122 N 0.74 -1.00 -3.84 1.37 1.44 -1.26 -1.71 115.22 110.97 3ktj n HIS 122 Ca -0.17 -0.22 -0.21 0.00 -2.01 0.00 0.00 57.72 55.11 3ktj n HIS 122 Cb 0.56 0.11 -0.02 0.00 0.12 0.00 0.00 29.99 30.76 3ktj n HIS 122 CO 0.00 0.00 0.00 1.14 -2.81 0.00 0.00 176.34 174.67 3ktj s GLN 123 N -2.01 3.37 0.75 -1.40 -2.07 -1.03 -4.94 119.66 112.34 3ktj s GLN 123 Ca 0.03 -0.79 -0.15 0.00 -1.82 0.00 0.00 55.36 52.62 3ktj s GLN 123 Cb -0.01 -2.86 0.02 0.00 -1.09 0.00 0.00 33.01 29.07 3ktj s GLN 123 CO 0.01 0.34 0.92 -2.30 -1.32 0.00 0.00 175.29 172.94 3ktj n PRO 124 N -1.48 0.38 -4.36 9.60 -0.02 -1.26 -5.04 135.00 132.82 3ktj n PRO 124 Ca -0.07 0.19 -0.27 0.00 -2.02 0.00 0.00 63.50 61.33 3ktj n PRO 124 Cb 0.57 -2.19 -0.13 0.00 -0.02 0.00 0.00 33.50 31.74 3ktj n PRO 124 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ktj s LEU 125 N -3.07 2.34 0.00 2.45 1.43 -1.26 -5.09 118.68 115.47 3ktj s LEU 125 Ca 0.71 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 3ktj s LEU 125 Cb -0.33 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 44.80 3ktj s LEU 125 CO 0.52 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.84 3ktj n GLY 126 N 0.84 0.65 3.54 -3.19 0.00 -1.26 -5.09 105.19 100.68 3ktj n GLY 126 Ca -0.17 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 3ktj n GLY 126 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ktj s GLY 127 N -2.61 0.28 -0.18 -0.02 0.00 -1.26 -5.17 107.32 98.35 3ktj s GLY 127 Ca 0.00 -0.63 -0.23 0.00 0.00 0.00 0.00 44.72 43.86 3ktj s GLY 127 CO 0.00 -0.51 0.62 0.00 0.00 0.00 0.00 173.10 173.22 3ktj s ALA 128 N -3.96 -1.56 0.02 3.20 0.00 -1.26 -5.00 121.76 113.19 3ktj s ALA 128 Ca 0.16 1.60 -0.06 0.00 0.00 0.00 0.00 51.96 53.67 3ktj s ALA 128 Cb -0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 3ktj s ALA 128 CO 0.04 -0.31 0.10 -1.14 0.00 0.00 0.00 175.76 174.44 3ktj s GLN 129 N -0.09 0.48 0.00 0.00 2.00 -1.26 -5.02 119.66 115.78 3ktj s GLN 129 Ca -0.03 -0.53 0.00 0.00 -2.00 0.00 0.00 55.36 52.80 3ktj s GLN 129 Cb -0.04 0.19 0.00 0.00 0.80 0.00 0.00 33.01 33.97 3ktj s GLN 129 CO 0.03 -0.11 0.00 0.41 -0.50 0.00 0.00 175.29 175.12 3ktj n GLY 130 N 1.29 0.23 3.79 2.59 0.00 -1.26 -4.67 105.19 107.16 3ktj n GLY 130 Ca -0.22 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 3ktj n GLY 130 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktj s GLN 131 N 0.00 3.82 0.34 1.61 -0.21 -1.26 -4.84 119.66 119.13 3ktj s GLN 131 Ca 0.00 1.46 0.15 0.00 0.02 0.00 0.00 55.36 56.99 3ktj s GLN 131 Cb 0.00 -2.20 1.12 0.00 1.00 0.00 0.00 33.01 32.93 3ktj s GLN 131 CO 0.00 -0.43 1.65 0.00 -2.12 0.00 0.00 175.29 174.39 3ktj h ALA 132 N 1.75 1.97 -0.22 6.09 0.00 -2.00 0.36 119.26 127.22 3ktj h ALA 132 Ca -0.49 0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 3ktj h ALA 132 Cb 1.23 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3ktj h ALA 132 CO 0.60 -0.63 -0.19 1.15 0.00 0.00 0.00 179.25 180.17 3ktj h THR 133 N 0.27 1.23 -0.04 0.00 2.02 -2.00 -2.58 112.91 111.82 3ktj h THR 133 Ca 0.75 -1.08 -0.24 0.00 0.77 0.00 0.00 66.41 66.61 3ktj h THR 133 Cb 1.75 1.28 0.02 0.00 -1.74 0.00 0.00 68.15 69.46 3ktj h THR 133 CO -0.64 0.34 -0.92 -0.33 0.37 0.00 0.00 175.52 174.35 3ktj h GLU 134 N 0.35 0.68 0.00 6.66 5.08 -0.66 -2.98 114.58 123.72 3ktj h GLU 134 Ca 0.06 -0.69 -0.04 0.00 -1.00 0.00 0.00 59.36 57.69 3ktj h GLU 134 Cb 0.54 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3ktj h GLU 134 CO 0.04 1.28 -0.19 0.82 -1.00 0.00 0.00 179.01 179.95 3ktj h ILE 135 N 0.36 0.71 0.02 3.13 2.04 -1.33 -2.79 117.51 119.65 3ktj h ILE 135 Ca -0.10 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 64.95 3ktj h ILE 135 Cb 1.57 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 39.16 3ktj h ILE 135 CO 0.18 0.19 -0.01 -0.08 0.00 0.00 0.00 178.15 178.43 3ktj h GLU 136 N 0.00 -0.03 -0.94 2.37 4.81 -1.40 -1.36 114.58 118.03 3ktj h GLU 136 Ca -0.00 0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.39 3ktj h GLU 136 Cb 0.49 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.79 3ktj h GLU 136 CO 0.03 0.44 0.60 0.82 -0.73 0.00 0.00 179.01 180.16 3ktj h ILE 137 N -0.51 0.80 -0.18 2.32 2.04 -1.34 -0.70 117.51 119.94 3ktj h ILE 137 Ca -0.00 -0.25 -0.09 0.00 1.00 0.00 0.00 64.86 65.52 3ktj h ILE 137 Cb 0.48 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3ktj h ILE 137 CO 0.01 0.13 -0.24 0.00 0.00 0.00 0.00 178.15 178.05 3ktj h ALA 138 N 1.60 0.27 -0.90 1.87 0.00 -1.44 -2.49 119.26 118.16 3ktj h ALA 138 Ca 0.49 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3ktj h ALA 138 Cb 0.78 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 3ktj h ALA 138 CO -0.25 0.24 0.59 0.00 0.00 0.00 0.00 179.25 179.83 3ktj h ALA 139 N 0.61 1.17 -0.43 0.00 0.00 -0.17 -0.92 119.26 119.51 3ktj h ALA 139 Ca 0.02 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3ktj h ALA 139 Cb 0.81 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3ktj h ALA 139 CO 0.06 0.50 -0.09 0.87 0.00 0.00 0.00 179.25 180.58 3ktj h LYS 140 N 1.18 0.83 0.05 0.00 1.57 -1.15 -1.79 116.57 117.26 3ktj h LYS 140 Ca 0.34 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3ktj h LYS 140 Cb -0.07 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.19 3ktj h LYS 140 CO -0.09 0.93 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.61 3ktj h ARG 141 N 0.66 -0.06 -0.27 3.15 2.43 -1.17 -1.91 114.38 117.20 3ktj h ARG 141 Ca 0.11 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.35 3ktj h ARG 141 Cb 0.62 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 3ktj h ARG 141 CO 0.04 0.28 -0.13 0.97 -1.51 0.00 0.00 179.97 179.62 3ktj h ILE 142 N -0.41 0.60 -0.11 1.20 6.09 -1.17 -0.42 117.51 123.29 3ktj h ILE 142 Ca -0.01 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.44 3ktj h ILE 142 Cb 0.37 0.60 -0.01 0.00 0.47 0.00 0.00 36.82 38.25 3ktj h ILE 142 CO 0.01 0.00 -0.14 -0.07 -3.07 0.00 0.00 178.15 174.89 3ktj h LEU 143 N -0.09 0.16 -0.56 2.19 3.38 -1.36 -2.57 115.31 116.46 3ktj h LEU 143 Ca 0.14 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 3ktj h LEU 143 Cb 0.30 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3ktj h LEU 143 CO -0.33 0.32 -0.20 -0.07 0.09 0.00 0.00 178.44 178.25 3ktj h LEU 144 N 0.16 0.96 -0.62 1.67 3.38 -0.27 -2.60 115.31 117.99 3ktj h LEU 144 Ca 0.03 -0.35 -0.12 0.00 0.09 0.00 0.00 57.88 57.53 3ktj h LEU 144 Cb 0.35 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3ktj h LEU 144 CO 0.02 1.13 -0.20 -0.07 0.09 0.00 0.00 178.44 179.41 3ktj h LEU 145 N 0.82 0.89 -2.13 1.67 3.38 -1.03 -1.88 115.31 117.03 3ktj h LEU 145 Ca 0.11 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.80 3ktj h LEU 145 Cb 0.76 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3ktj h LEU 145 CO 0.06 1.06 0.12 -0.09 0.09 0.00 0.00 178.44 179.68 3ktj h ARG 146 N 0.76 0.00 0.14 1.13 2.43 -1.30 -1.37 114.38 116.17 3ktj h ARG 146 Ca 0.11 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.02 3ktj h ARG 146 Cb 0.74 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.31 3ktj h ARG 146 CO 0.06 0.00 -1.10 0.22 -1.51 0.00 0.00 179.97 177.64 3ktj h ASP 147 N 0.00 0.73 0.19 -3.80 3.58 -0.97 -2.93 116.42 113.22 3ktj h ASP 147 Ca 0.07 -0.87 -0.16 0.00 0.42 0.00 0.00 57.03 56.49 3ktj h ASP 147 Cb 0.30 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 3ktj h ASP 147 CO -0.00 1.53 -0.60 0.50 -2.88 0.00 0.00 179.24 177.79 3ktj h LYS 148 N 0.04 0.41 -0.31 0.28 3.64 -0.99 -2.74 116.57 116.89 3ktj h LYS 148 Ca -0.18 -0.28 -0.09 0.00 -1.27 0.00 0.00 60.65 58.84 3ktj h LYS 148 Cb 1.82 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 3ktj h LYS 148 CO 0.21 0.88 -0.16 -0.07 -2.27 0.00 0.00 179.45 178.04 3ktj h LEU 149 N 0.30 0.68 -1.05 5.20 3.38 -1.38 -3.02 115.31 119.44 3ktj h LEU 149 Ca -0.00 -0.41 -0.08 0.00 0.09 0.00 0.00 57.88 57.48 3ktj h LEU 149 Cb 1.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3ktj h LEU 149 CO 0.10 0.94 -0.13 0.78 0.09 0.00 0.00 178.44 180.23 3ktj h ASN 150 N 0.42 0.51 0.47 -0.43 2.35 -1.51 -2.28 115.58 115.11 3ktj h ASN 150 Ca 0.07 -0.14 -0.13 0.00 -0.55 0.00 0.00 56.30 55.55 3ktj h ASN 150 Cb 0.69 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 3ktj h ASN 150 CO 0.05 0.68 -0.59 0.11 -1.65 0.00 0.00 177.43 176.02 3ktj h LYS 151 N 0.49 0.12 0.16 0.81 1.57 -1.43 -2.19 116.57 116.10 3ktj h LYS 151 Ca 0.09 -0.08 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 3ktj h LYS 151 Cb 0.52 0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.87 3ktj h LYS 151 CO 0.03 0.68 -1.32 0.28 -0.57 0.00 0.00 179.45 178.55 3ktj h VAL 152 N 0.09 1.29 -0.50 0.50 2.07 -1.48 -2.97 116.25 115.25 3ktj h VAL 152 Ca -0.01 -2.56 0.08 0.00 0.82 0.00 0.00 66.70 65.04 3ktj h VAL 152 Cb 1.07 2.81 -0.07 0.00 -1.52 0.00 0.00 31.29 33.59 3ktj h VAL 152 CO 0.08 0.77 0.12 0.25 0.02 0.00 0.00 177.57 178.82 3ktj h LEU 153 N 0.23 0.04 -1.89 2.57 6.46 -1.36 -0.87 115.31 120.49 3ktj h LEU 153 Ca -0.21 0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.63 3ktj h LEU 153 Cb 2.00 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 42.04 3ktj h LEU 153 CO 0.25 0.05 -0.01 0.00 -0.62 0.00 0.00 178.44 178.11 3ktj h ALA 154 N 1.38 1.01 0.00 1.25 0.00 -1.43 -0.16 119.26 121.31 3ktj h ALA 154 Ca 0.25 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.92 3ktj h ALA 154 Cb 0.32 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3ktj h ALA 154 CO -0.31 0.02 -1.39 0.93 0.00 0.00 0.00 179.25 178.49 3ktj h GLU 155 N 0.00 0.00 0.20 0.00 5.08 -1.04 -2.67 114.58 116.15 3ktj h GLU 155 Ca -0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 3ktj h GLU 155 Cb 0.37 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.64 3ktj h GLU 155 CO 0.00 0.52 -1.51 0.00 -1.00 0.00 0.00 179.01 177.03 3ktj h ARG 156 N 0.00 0.42 0.01 2.33 2.47 -0.92 -3.35 114.38 115.33 3ktj h ARG 156 Ca -0.18 -0.72 -0.26 0.00 -1.26 0.00 0.00 59.98 57.57 3ktj h ARG 156 Cb 1.79 0.27 -0.04 0.00 -1.65 0.00 0.00 29.97 30.34 3ktj h ARG 156 CO 0.08 1.33 -1.39 1.79 0.56 0.00 0.00 179.97 182.33 3ktj h THR 157 N 0.11 1.24 0.00 2.04 1.35 -1.19 -3.47 112.91 113.00 3ktj h THR 157 Ca -0.25 -3.02 0.00 0.00 -0.55 0.00 0.00 66.41 62.59 3ktj h THR 157 Cb 2.10 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 71.14 3ktj h THR 157 CO 0.23 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 3ktj n GLY 158 N 1.47 0.83 3.79 5.82 0.00 -1.01 -4.57 105.19 111.52 3ktj n GLY 158 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 3ktj n GLY 158 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktj s GLN 159 N -0.70 3.48 0.44 1.61 -1.52 -1.23 -5.00 119.66 116.74 3ktj s GLN 159 Ca 0.00 1.41 -0.22 0.00 -1.95 0.00 0.00 55.36 54.60 3ktj s GLN 159 Cb 0.00 -2.04 -0.09 0.00 -0.22 0.00 0.00 33.01 30.65 3ktj s GLN 159 CO 0.00 -0.71 1.01 -1.25 -0.25 0.00 0.00 175.29 174.09 3ktj s PRO 160 N -3.49 4.05 0.24 2.91 0.04 -1.26 -4.64 135.00 132.85 3ktj s PRO 160 Ca 0.68 1.31 -0.04 0.00 0.04 0.00 0.00 61.00 62.99 3ktj s PRO 160 Cb -0.19 -2.25 0.41 0.00 0.04 0.00 0.00 34.50 32.52 3ktj s PRO 160 CO 0.27 -0.21 1.78 1.25 0.04 0.00 0.00 177.00 180.14 3ktj h LEU 161 N 1.94 0.55 -1.37 -3.56 5.85 -1.92 -1.22 115.31 115.59 3ktj h LEU 161 Ca -0.49 0.07 0.17 0.00 0.84 0.00 0.00 57.88 58.46 3ktj h LEU 161 Cb 1.21 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 3ktj h LEU 161 CO 0.61 0.29 0.58 -0.08 -0.34 0.00 0.00 178.44 179.49 3ktj h GLU 162 N 0.67 0.56 -0.08 1.25 4.57 -1.99 -1.52 114.58 118.05 3ktj h GLU 162 Ca 0.40 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.50 3ktj h GLU 162 Cb 0.45 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 3ktj h GLU 162 CO -0.29 0.37 -0.12 0.28 -1.18 0.00 0.00 179.01 178.07 3ktj h VAL 163 N 0.58 1.39 -0.37 0.32 2.07 -1.61 -2.81 116.25 115.82 3ktj h VAL 163 Ca 0.46 -1.36 0.06 0.00 0.82 0.00 0.00 66.70 66.67 3ktj h VAL 163 Cb 0.88 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 3ktj h VAL 163 CO -0.20 0.38 0.08 0.40 0.02 0.00 0.00 177.57 178.25 3ktj h ILE 164 N -0.25 0.81 0.16 4.57 1.08 -1.18 0.12 117.51 122.83 3ktj h ILE 164 Ca 0.01 -0.07 0.02 0.00 -0.39 0.00 0.00 64.86 64.42 3ktj h ILE 164 Cb 0.67 0.59 -0.04 0.00 -3.07 0.00 0.00 36.82 34.98 3ktj h ILE 164 CO 0.03 0.04 -0.37 -0.33 -0.69 0.00 0.00 178.15 176.83 3ktj h GLU 165 N 0.20 -0.60 -0.53 2.37 5.08 -1.32 -2.33 114.58 117.46 3ktj h GLU 165 Ca 0.18 0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.49 3ktj h GLU 165 Cb 0.21 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 3ktj h GLU 165 CO -0.23 -0.40 -0.03 -0.09 -1.00 0.00 0.00 179.01 177.26 3ktj h ARG 166 N -0.63 0.91 0.00 2.33 2.43 -1.34 -2.98 114.38 115.11 3ktj h ARG 166 Ca 0.02 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 3ktj h ARG 166 Cb 0.64 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 3ktj h ARG 166 CO -0.19 0.92 0.00 -0.25 -1.51 0.00 0.00 179.97 178.94 3ktj n ASP 167 N -4.18 0.00 -0.56 -3.80 8.00 0.02 -2.80 116.55 113.23 3ktj n ASP 167 Ca 0.02 0.46 0.06 0.00 0.71 0.00 0.00 54.79 56.04 3ktj n ASP 167 Cb 0.34 -0.48 0.16 0.00 -0.02 0.00 0.00 41.12 41.12 3ktj n ASP 167 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3ktj n THR 168 N -1.48 1.47 0.25 -3.53 -2.24 -0.89 -4.65 114.28 103.21 3ktj n THR 168 Ca 0.04 -1.38 0.09 0.00 -2.27 0.00 0.00 64.05 60.52 3ktj n THR 168 Cb 0.18 0.20 0.64 0.00 -2.10 0.00 0.00 70.33 69.25 3ktj n THR 168 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3ktj h ASP 169 N 1.45 0.00 -5.55 3.42 -0.00 -1.57 -2.72 116.42 111.45 3ktj h ASP 169 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.03 56.77 3ktj h ASP 169 Cb 0.93 0.00 -0.11 0.00 -0.00 0.00 0.00 39.33 40.16 3ktj h ASP 169 CO 0.07 0.09 -0.32 -0.13 -0.00 0.00 0.00 179.24 178.94 3ktj s ARG 170 N -4.74 1.66 0.16 0.28 0.52 -1.26 -4.83 118.95 110.74 3ktj s ARG 170 Ca -0.04 -1.68 -0.34 0.00 -0.52 0.00 0.00 55.73 53.15 3ktj s ARG 170 Cb 0.16 0.39 -0.13 0.00 0.52 0.00 0.00 34.95 35.88 3ktj s ARG 170 CO 0.65 -0.65 1.61 -0.25 0.02 0.00 0.00 175.30 176.69 3ktj n ASP 171 N -0.99 3.27 -3.91 0.23 8.00 -1.26 -4.64 116.55 117.25 3ktj n ASP 171 Ca 0.02 1.07 -0.30 0.00 0.71 0.00 0.00 54.79 56.29 3ktj n ASP 171 Cb 0.63 -1.45 -0.15 0.00 -0.02 0.00 0.00 41.12 40.13 3ktj n ASP 171 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3ktj s ASN 172 N 1.08 4.34 -0.07 -2.24 3.04 -0.69 -5.01 114.94 115.39 3ktj s ASN 172 Ca 0.79 -1.78 -0.20 0.00 0.04 0.00 0.00 52.86 51.71 3ktj s ASN 172 Cb -0.65 -1.29 -0.04 0.00 -1.54 0.00 0.00 41.25 37.73 3ktj s ASN 172 CO 0.37 -0.36 0.58 -0.36 -3.04 0.00 0.00 177.10 174.29 3ktj s PHE 173 N 1.24 3.58 -0.00 0.43 0.08 -1.26 -2.03 117.98 120.02 3ktj s PHE 173 Ca 0.07 1.09 0.05 0.00 0.12 0.00 0.00 56.93 58.26 3ktj s PHE 173 Cb -0.18 -2.64 -0.01 0.00 -0.57 0.00 0.00 43.02 39.61 3ktj s PHE 173 CO -0.13 0.20 -0.17 0.15 -0.10 0.00 0.00 175.22 175.17 3ktj s LYS 174 N 0.42 1.29 0.85 0.44 1.02 0.15 -5.00 119.74 118.91 3ktj s LYS 174 Ca 0.31 -0.64 -0.12 0.00 0.02 0.00 0.00 55.97 55.54 3ktj s LYS 174 Cb -0.17 -1.27 0.10 0.00 -0.52 0.00 0.00 37.83 35.98 3ktj s LYS 174 CO 0.15 0.34 1.14 -1.54 -0.92 0.00 0.00 175.35 174.52 3ktj s SER 175 N -0.54 4.08 0.43 2.83 1.04 -1.26 -1.52 113.70 118.77 3ktj s SER 175 Ca 0.06 0.97 0.13 0.00 0.48 0.00 0.00 55.95 57.60 3ktj s SER 175 Cb -0.07 -1.57 0.95 0.00 0.10 0.00 0.00 66.02 65.43 3ktj s SER 175 CO -0.00 -2.19 1.97 0.00 0.98 0.00 0.00 173.24 174.00 3ktj h ALA 176 N -1.25 1.65 -0.14 5.32 0.00 -1.73 0.20 119.26 123.32 3ktj h ALA 176 Ca -0.48 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.11 3ktj h ALA 176 Cb 1.32 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3ktj h ALA 176 CO 0.63 0.26 -0.47 0.93 0.00 0.00 0.00 179.25 180.60 3ktj h GLU 177 N 0.06 0.56 0.00 0.00 5.08 -1.90 -1.73 114.58 116.65 3ktj h GLU 177 Ca 0.01 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3ktj h GLU 177 Cb 0.33 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3ktj h GLU 177 CO 0.02 1.04 0.00 0.93 -1.00 0.00 0.00 179.01 180.00 3ktj h GLU 178 N 0.20 0.00 0.05 2.33 5.08 -1.68 -1.90 114.58 118.65 3ktj h GLU 178 Ca -0.02 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 3ktj h GLU 178 Cb 1.09 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.35 3ktj h GLU 178 CO 0.10 0.00 -0.41 0.00 -1.00 0.00 0.00 179.01 177.70 3ktj h ALA 179 N 2.03 -0.01 -0.36 3.43 0.00 -0.35 -2.78 119.26 121.22 3ktj h ALA 179 Ca 0.00 -0.56 0.03 0.00 0.00 0.00 0.00 54.91 54.38 3ktj h ALA 179 Cb 0.32 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ktj h ALA 179 CO 0.00 0.19 0.15 1.25 0.00 0.00 0.00 179.25 180.84 3ktj h LEU 180 N -0.54 0.20 -1.35 0.00 5.85 -0.79 -2.17 115.31 116.51 3ktj h LEU 180 Ca -0.06 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 3ktj h LEU 180 Cb 1.25 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 3ktj h LEU 180 CO 0.08 0.16 -0.31 -0.33 -0.34 0.00 0.00 178.44 177.69 3ktj h GLU 181 N 0.32 0.02 0.00 1.25 5.08 -1.47 -2.80 114.58 116.99 3ktj h GLU 181 Ca 0.16 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3ktj h GLU 181 Cb 0.10 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3ktj h GLU 181 CO -0.13 0.33 0.00 -0.92 -1.00 0.00 0.00 179.01 177.29 3ktj h TYR 182 N 0.02 0.00 0.00 4.33 3.20 -1.23 -3.47 116.97 119.81 3ktj h TYR 182 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3ktj h TYR 182 Cb 0.56 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.83 3ktj h TYR 182 CO 0.00 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.93 3ktj n GLY 183 N 1.05 0.77 0.17 1.82 0.00 -1.02 -4.73 105.19 103.26 3ktj n GLY 183 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 3ktj n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ktj h LEU 184 N 0.00 0.31 -9.51 0.99 3.38 -1.63 -3.37 115.31 105.48 3ktj h LEU 184 Ca 0.00 -0.18 -0.57 0.00 0.09 0.00 0.00 57.88 57.22 3ktj h LEU 184 Cb 0.00 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 40.53 3ktj h LEU 184 CO 0.00 0.86 -0.53 0.27 0.09 0.00 0.00 178.44 179.13 3ktj s ILE 185 N -3.73 0.81 -0.01 1.22 -4.36 -1.23 -4.21 121.20 109.70 3ktj s ILE 185 Ca -0.04 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.38 3ktj s ILE 185 Cb 0.12 -2.40 -0.04 0.00 1.25 0.00 0.00 42.46 41.38 3ktj s ILE 185 CO 0.81 0.00 0.06 0.47 0.24 0.00 0.00 174.94 176.51 3ktj n ASP 186 N -1.19 4.31 -3.63 4.36 8.00 -0.29 -4.68 116.55 123.42 3ktj n ASP 186 Ca -0.07 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.31 3ktj n ASP 186 Cb 0.66 1.04 -0.07 0.00 -0.02 0.00 0.00 41.12 42.73 3ktj n ASP 186 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ktj s LYS 187 N -2.19 0.68 -0.10 -1.24 2.20 -0.92 -4.98 119.74 113.20 3ktj s LYS 187 Ca -0.01 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.23 3ktj s LYS 187 Cb 0.02 0.33 -0.05 0.00 -1.51 0.00 0.00 37.83 36.62 3ktj s LYS 187 CO 0.12 -0.10 0.25 0.42 -0.36 0.00 0.00 175.35 175.69 3ktj s ILE 188 N 0.17 5.32 -0.33 5.43 1.01 -1.26 -3.19 121.20 128.34 3ktj s ILE 188 Ca 0.01 0.47 -0.18 0.00 0.00 0.00 0.00 60.65 60.94 3ktj s ILE 188 Cb -0.05 -3.55 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 3ktj s ILE 188 CO -0.02 0.55 0.52 -0.76 0.00 0.00 0.00 174.94 175.23 3ktj s LEU 189 N -0.65 4.28 0.00 2.97 1.43 -0.90 -4.96 118.68 120.84 3ktj s LEU 189 Ca 0.17 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 3ktj s LEU 189 Cb -0.14 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.47 3ktj s LEU 189 CO 0.06 -0.45 0.00 0.35 0.23 0.00 0.00 176.35 176.54 3ktj n THR 190 N 5.39 0.00 0.00 5.49 -2.24 -1.26 -4.09 114.28 117.57 3ktj n THR 190 Ca -0.04 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3ktj n THR 190 Cb 0.49 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 3ktj n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50