#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 1.27 0.00 5.18 6.09 -2.07 -2.97 117.51 125.02 3ktj h ILE 19 Ca 0.00 -1.40 -0.00 0.00 -1.37 0.00 0.00 64.86 62.08 3ktj h ILE 19 Cb 0.00 1.21 -0.00 0.00 0.47 0.00 0.00 36.82 38.50 3ktj h ILE 19 CO 0.00 0.48 -0.01 1.88 -3.07 0.00 0.00 178.15 177.42 3ktj h TYR 20 N 0.79 0.00 -0.35 2.19 0.05 -2.00 -2.63 116.97 115.02 3ktj h TYR 20 Ca 0.10 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.72 3ktj h TYR 20 Cb 0.82 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 3ktj h TYR 20 CO 0.06 0.01 -0.41 0.77 -1.05 0.00 0.00 178.16 177.54 3ktj h SER 21 N 0.00 0.92 -0.60 3.88 0.02 -1.94 -2.67 113.55 113.16 3ktj h SER 21 Ca -0.00 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.48 3ktj h SER 21 Cb 0.53 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 3ktj h SER 21 CO 0.00 1.20 0.23 -0.09 -1.14 0.00 0.00 176.83 177.03 3ktj h ARG 22 N 0.69 0.94 -0.23 3.45 9.65 -1.45 -2.61 114.38 124.82 3ktj h ARG 22 Ca 0.05 -0.16 -0.12 0.00 -1.10 0.00 0.00 59.98 58.65 3ktj h ARG 22 Cb 0.99 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.40 3ktj h ARG 22 CO 0.10 0.78 -0.35 -0.07 2.80 0.00 0.00 179.97 183.23 3ktj h LEU 23 N 0.92 0.51 -1.40 3.80 3.38 -1.37 -2.67 115.31 118.48 3ktj h LEU 23 Ca 0.21 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 3ktj h LEU 23 Cb 0.21 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3ktj h LEU 23 CO -0.01 0.82 -0.28 0.25 0.09 0.00 0.00 178.44 179.30 3ktj h LEU 24 N 0.42 0.00 -1.92 1.67 5.85 -1.12 -1.44 115.31 118.76 3ktj h LEU 24 Ca 0.05 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3ktj h LEU 24 Cb 0.81 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.83 3ktj h LEU 24 CO 0.07 0.28 -0.12 0.11 -0.34 0.00 0.00 178.44 178.45 3ktj h LYS 25 N 0.00 0.00 -0.35 1.25 6.56 -1.23 -1.43 116.57 121.36 3ktj h LYS 25 Ca -0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.55 3ktj h LYS 25 Cb 0.59 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.23 3ktj h LYS 25 CO 0.04 0.12 0.02 -0.25 -2.06 0.00 0.00 179.45 177.31 3ktj n ASP 26 N -3.95 4.04 -3.27 0.86 9.92 -0.63 -4.99 116.55 118.53 3ktj n ASP 26 Ca -0.02 -3.12 -0.15 0.00 -0.53 0.00 0.00 54.79 50.97 3ktj n ASP 26 Cb 0.21 -0.59 0.08 0.00 -0.64 0.00 0.00 41.12 40.17 3ktj n ASP 26 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3ktj n ARG 27 N -0.42 -4.24 -3.79 -1.24 1.74 -0.54 -4.93 116.66 103.24 3ktj n ARG 27 Ca 0.25 0.83 -0.27 0.00 -0.77 0.00 0.00 57.85 57.90 3ktj n ARG 27 Cb 1.00 -5.73 -0.17 0.00 -1.02 0.00 0.00 32.46 26.54 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 -3.36 0.69 -0.07 0.55 1.01 -0.67 -1.81 121.20 117.54 3ktj s ILE 28 Ca 0.23 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 3ktj s ILE 28 Cb -0.03 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 3ktj s ILE 28 CO 0.71 -0.03 0.13 -0.63 0.00 0.00 0.00 174.94 175.13 3ktj s ILE 29 N 1.80 5.28 -0.25 2.92 1.01 0.18 -3.83 121.20 128.31 3ktj s ILE 29 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.59 3ktj s ILE 29 Cb -0.16 -3.36 0.01 0.00 0.01 0.00 0.00 42.46 38.96 3ktj s ILE 29 CO -0.07 0.50 -0.00 -0.32 0.00 0.00 0.00 174.94 175.05 3ktj s MET 30 N -1.37 3.15 -0.76 2.79 1.75 -1.26 -1.42 119.30 122.17 3ktj s MET 30 Ca 0.19 -0.79 -0.03 0.00 -1.25 0.00 0.00 55.69 53.81 3ktj s MET 30 Cb -0.12 -3.14 0.19 0.00 2.84 0.00 0.00 34.83 34.60 3ktj s MET 30 CO 0.09 -0.33 0.62 -1.17 -0.65 0.00 0.00 175.02 173.58 3ktj s LEU 31 N 1.45 5.47 -0.49 4.11 2.96 -0.59 -4.94 118.68 126.64 3ktj s LEU 31 Ca 0.03 -3.27 0.07 0.00 -0.22 0.00 0.00 54.13 50.74 3ktj s LEU 31 Cb -0.16 -1.90 0.37 0.00 0.50 0.00 0.00 46.19 45.01 3ktj s LEU 31 CO -0.01 -0.29 0.97 0.61 -1.32 0.00 0.00 176.35 176.31 3ktj n GLY 32 N 2.95 5.20 3.81 7.98 0.00 -1.26 -1.19 105.19 122.68 3ktj n GLY 32 Ca 0.15 -2.54 -0.05 0.00 0.00 0.00 0.00 46.02 43.57 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 -3.34 -0.22 0.59 1.61 1.04 -1.14 -4.86 113.70 107.39 3ktj s SER 33 Ca 0.46 -0.51 -0.19 0.00 0.48 0.00 0.00 55.95 56.19 3ktj s SER 33 Cb 0.34 0.61 -0.04 0.00 0.10 0.00 0.00 66.02 67.03 3ktj s SER 33 CO -0.13 -1.13 1.17 0.00 0.98 0.00 0.00 173.24 174.13 3ktj n ALA 34 N -0.47 0.85 -2.58 5.32 0.00 -1.26 -4.49 120.51 117.87 3ktj n ALA 34 Ca -0.05 0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 3ktj n ALA 34 Cb 0.60 -2.24 -0.05 0.00 0.00 0.00 0.00 19.45 17.75 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 -1.40 4.77 0.17 0.00 1.01 0.79 -4.88 121.20 121.66 3ktj s ILE 35 Ca 0.76 0.84 0.00 0.00 0.00 0.00 0.00 60.65 62.25 3ktj s ILE 35 Cb -0.41 -4.17 -0.04 0.00 0.01 0.00 0.00 42.46 37.84 3ktj s ILE 35 CO 0.46 -0.39 0.04 1.51 0.00 0.00 0.00 174.94 176.56 3ktj s ASP 36 N 1.81 0.77 0.47 3.58 -4.77 -1.26 -1.26 116.67 116.01 3ktj s ASP 36 Ca 0.30 -1.22 0.31 0.00 -3.30 0.00 0.00 52.55 48.64 3ktj s ASP 36 Cb -0.14 0.21 1.42 0.00 -1.09 0.00 0.00 42.92 43.33 3ktj s ASP 36 CO 0.16 -0.67 1.69 0.44 0.70 0.00 0.00 175.17 177.49 3ktj h ASP 37 N 2.73 0.21 0.40 2.11 3.45 -1.95 -1.72 116.42 121.64 3ktj h ASP 37 Ca -0.36 0.08 -0.02 0.00 0.43 0.00 0.00 57.03 57.16 3ktj h ASP 37 Cb 1.21 0.05 0.00 0.00 -0.56 0.00 0.00 39.33 40.04 3ktj h ASP 37 CO 0.60 -0.05 -0.19 0.78 -1.57 0.00 0.00 179.24 178.81 3ktj h ASN 38 N 0.13 -0.45 -0.76 6.45 2.35 -1.98 -0.79 115.58 120.53 3ktj h ASN 38 Ca 0.73 -0.09 0.11 0.00 -0.55 0.00 0.00 56.30 56.50 3ktj h ASN 38 Cb 2.42 0.12 -0.13 0.00 0.05 0.00 0.00 38.32 40.78 3ktj h ASN 38 CO -0.25 -0.02 -0.42 0.58 -1.65 0.00 0.00 177.43 175.68 3ktj h VAL 39 N -1.04 0.07 -0.11 2.81 2.07 -1.68 -0.47 116.25 117.90 3ktj h VAL 39 Ca -0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3ktj h VAL 39 Cb 0.52 0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 3ktj h VAL 39 CO 0.09 0.00 -0.25 0.00 0.02 0.00 0.00 177.57 177.43 3ktj h ALA 40 N 0.93 -0.26 -0.08 1.67 0.00 -1.34 0.14 119.26 120.33 3ktj h ALA 40 Ca 0.24 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.20 3ktj h ALA 40 Cb 0.56 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 3ktj h ALA 40 CO -0.81 -0.72 0.14 -0.91 0.00 0.00 0.00 179.25 176.95 3ktj h ASN 41 N -0.33 0.00 0.08 0.00 2.35 0.39 -2.25 115.58 115.82 3ktj h ASN 41 Ca 0.09 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 3ktj h ASN 41 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3ktj h ASN 41 CO -0.30 0.00 -0.04 -1.28 -1.65 0.00 0.00 177.43 174.17 3ktj h SER 42 N 0.00 -0.09 -0.67 5.81 0.87 0.32 -3.29 113.55 116.50 3ktj h SER 42 Ca 0.04 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.74 3ktj h SER 42 Cb 0.33 0.02 -0.11 0.00 -0.44 0.00 0.00 62.40 62.20 3ktj h SER 42 CO -0.00 0.32 0.03 0.40 -0.53 0.00 0.00 176.83 177.05 3ktj h ILE 43 N -0.87 0.46 -0.55 2.23 2.04 -1.01 -2.57 117.51 117.24 3ktj h ILE 43 Ca -0.01 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 65.89 3ktj h ILE 43 Cb 0.08 0.31 -0.10 0.00 -0.74 0.00 0.00 36.82 36.37 3ktj h ILE 43 CO 0.02 0.02 -0.45 0.58 0.00 0.00 0.00 178.15 178.33 3ktj h VAL 44 N 0.13 0.08 -0.27 1.67 2.07 -1.56 -2.40 116.25 115.97 3ktj h VAL 44 Ca 0.36 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.81 3ktj h VAL 44 Cb 0.60 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3ktj h VAL 44 CO -0.56 0.00 -0.13 0.77 0.02 0.00 0.00 177.57 177.67 3ktj h SER 45 N -0.25 0.44 -0.71 0.57 4.64 -1.53 -2.41 113.55 114.29 3ktj h SER 45 Ca 0.16 -0.11 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 3ktj h SER 45 Cb 0.57 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.51 3ktj h SER 45 CO -0.67 0.60 0.27 1.56 -0.87 0.00 0.00 176.83 177.73 3ktj h GLN 46 N 0.43 1.07 -0.44 4.77 4.20 -1.25 0.72 115.11 124.61 3ktj h GLN 46 Ca 0.08 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 3ktj h GLN 46 Cb 0.48 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 3ktj h GLN 46 CO 0.03 0.90 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.94 3ktj h LEU 47 N 1.03 0.75 -0.71 1.46 3.38 -1.28 -1.77 115.31 118.17 3ktj h LEU 47 Ca 0.24 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 3ktj h LEU 47 Cb 0.23 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3ktj h LEU 47 CO -0.02 0.87 -0.49 -0.07 0.09 0.00 0.00 178.44 178.82 3ktj h LEU 48 N 0.70 0.42 0.09 1.67 3.38 -0.89 -2.55 115.31 118.14 3ktj h LEU 48 Ca 0.13 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3ktj h LEU 48 Cb 0.54 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3ktj h LEU 48 CO 0.03 0.84 -0.04 0.15 0.09 0.00 0.00 178.44 179.51 3ktj h PHE 49 N 0.31 -0.11 -0.87 1.13 3.57 -0.59 -2.53 116.94 117.85 3ktj h PHE 49 Ca 0.02 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.60 3ktj h PHE 49 Cb 0.97 0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 3ktj h PHE 49 CO 0.03 0.29 0.52 -0.07 -2.23 0.00 0.00 178.31 176.85 3ktj h LEU 50 N -0.55 0.78 -0.65 0.59 3.38 -1.34 0.32 115.31 117.84 3ktj h LEU 50 Ca -0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3ktj h LEU 50 Cb 0.46 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3ktj h LEU 50 CO 0.02 0.46 0.00 0.00 0.09 0.00 0.00 178.44 179.02 3ktj h ALA 51 N 1.45 1.00 0.01 1.53 0.00 -1.48 -2.68 119.26 119.09 3ktj h ALA 51 Ca 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 3ktj h ALA 51 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3ktj h ALA 51 CO -0.22 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 178.94 3ktj h ALA 52 N 2.23 -0.00 0.27 0.00 0.00 -0.51 -3.14 119.26 118.12 3ktj h ALA 52 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3ktj h ALA 52 Cb 0.55 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3ktj h ALA 52 CO 0.00 -0.00 -0.32 0.93 0.00 0.00 0.00 179.25 179.86 3ktj h GLU 53 N -0.81 -0.61 -2.23 0.00 5.08 -1.24 -3.41 114.58 111.36 3ktj h GLU 53 Ca -0.01 0.04 -0.33 0.00 -1.00 0.00 0.00 59.36 58.06 3ktj h GLU 53 Cb 0.97 0.14 -0.34 0.00 0.50 0.00 0.00 28.75 30.02 3ktj h GLU 53 CO 0.02 -0.41 -0.63 0.34 -1.00 0.00 0.00 179.01 177.33 3ktj s ASP 54 N -4.68 1.62 0.00 1.42 2.15 -1.02 -5.03 116.67 111.14 3ktj s ASP 54 Ca -0.16 -0.62 0.00 0.00 0.43 0.00 0.00 52.55 52.19 3ktj s ASP 54 Cb 0.07 0.48 0.00 0.00 -0.30 0.00 0.00 42.92 43.17 3ktj s ASP 54 CO 0.64 -0.37 0.58 -0.81 -0.17 0.00 0.00 175.17 175.03 3ktj n PRO 55 N 5.31 0.64 -0.04 4.34 -0.04 -1.18 -3.39 135.00 140.64 3ktj n PRO 55 Ca -0.03 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.38 3ktj n PRO 55 Cb 0.47 -1.06 -0.04 0.00 -0.04 0.00 0.00 33.50 32.82 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 -0.37 0.88 -2.01 0.54 -0.58 -1.26 -3.64 120.64 114.20 3ktj n GLU 56 Ca 0.00 0.04 -0.37 0.00 -0.42 0.00 0.00 57.16 56.41 3ktj n GLU 56 Cb 0.03 -1.18 0.02 0.00 -0.57 0.00 0.00 31.44 29.75 3ktj n GLU 56 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3ktj s LYS 57 N -2.17 3.25 0.79 3.49 -0.14 -1.22 -4.83 119.74 118.91 3ktj s LYS 57 Ca -0.10 1.95 -0.11 0.00 -1.36 0.00 0.00 55.97 56.35 3ktj s LYS 57 Cb 0.03 -2.17 0.07 0.00 -1.68 0.00 0.00 37.83 34.08 3ktj s LYS 57 CO 0.22 -1.02 1.09 -2.00 -0.76 0.00 0.00 175.35 172.88 3ktj s GLU 58 N -3.01 2.10 0.03 1.68 2.12 -1.26 -4.53 118.70 115.82 3ktj s GLU 58 Ca 0.72 0.87 0.03 0.00 0.36 0.00 0.00 54.97 56.95 3ktj s GLU 58 Cb -0.33 -1.90 -0.02 0.00 0.26 0.00 0.00 34.13 32.14 3ktj s GLU 58 CO 0.38 -1.67 -0.09 0.42 -0.54 0.00 0.00 175.26 173.76 3ktj s ILE 59 N -3.02 0.68 -0.02 -3.70 1.01 -0.70 -4.90 121.20 110.55 3ktj s ILE 59 Ca 0.61 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 60.46 3ktj s ILE 59 Cb -0.16 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.64 3ktj s ILE 59 CO 0.55 -0.14 -0.15 -0.44 0.00 0.00 0.00 174.94 174.77 3ktj s SER 60 N -1.09 1.76 -0.25 3.58 0.01 -0.75 -1.78 113.70 115.19 3ktj s SER 60 Ca -0.04 -0.28 0.03 0.00 1.31 0.00 0.00 55.95 56.98 3ktj s SER 60 Cb -0.07 -0.29 0.06 0.00 0.21 0.00 0.00 66.02 65.93 3ktj s SER 60 CO 0.01 0.16 -0.11 -0.22 0.41 0.00 0.00 173.24 173.49 3ktj s LEU 61 N -0.21 3.28 0.30 2.44 2.96 -0.85 0.51 118.68 127.12 3ktj s LEU 61 Ca 0.03 -1.34 -0.14 0.00 -0.22 0.00 0.00 54.13 52.46 3ktj s LEU 61 Cb -0.07 -1.50 -0.09 0.00 0.50 0.00 0.00 46.19 45.03 3ktj s LEU 61 CO 0.00 -0.19 0.70 -0.31 -1.32 0.00 0.00 176.35 175.24 3ktj s TYR 62 N 1.14 3.39 -0.03 5.38 2.02 -0.51 -2.34 117.35 126.41 3ktj s TYR 62 Ca -0.08 1.16 0.01 0.00 -0.37 0.00 0.00 57.07 57.79 3ktj s TYR 62 Cb -0.20 -2.49 0.02 0.00 -0.40 0.00 0.00 41.96 38.90 3ktj s TYR 62 CO -0.06 0.13 -0.02 0.42 -1.57 0.00 0.00 175.55 174.45 3ktj s ILE 63 N -1.94 0.31 -0.48 2.71 1.01 0.15 -1.55 121.20 121.42 3ktj s ILE 63 Ca 0.53 -0.04 0.06 0.00 0.00 0.00 0.00 60.65 61.20 3ktj s ILE 63 Cb -0.11 -0.35 0.20 0.00 0.01 0.00 0.00 42.46 42.22 3ktj s ILE 63 CO 0.18 0.15 0.66 -3.20 0.00 0.00 0.00 174.94 172.73 3ktj n ASN 64 N 3.79 -2.33 -4.08 3.58 5.15 -0.33 -1.65 115.26 119.39 3ktj n ASN 64 Ca -0.23 -2.86 -0.23 0.00 -0.60 0.00 0.00 54.58 50.66 3ktj n ASN 64 Cb 0.53 1.03 -0.16 0.00 -0.53 0.00 0.00 39.78 40.65 3ktj n ASN 64 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3ktj s SER 65 N -0.08 1.66 0.00 1.20 0.15 -0.95 -2.88 113.70 112.80 3ktj s SER 65 Ca 0.32 -0.26 0.24 0.00 0.70 0.00 0.00 55.95 56.95 3ktj s SER 65 Cb 0.08 -0.38 1.28 0.00 -1.71 0.00 0.00 66.02 65.28 3ktj s SER 65 CO -0.13 0.12 1.84 -0.81 1.20 0.00 0.00 173.24 175.47 3ktj n PRO 66 N 3.09 1.22 0.00 5.44 -0.04 -1.26 -2.50 135.00 140.95 3ktj n PRO 66 Ca -0.17 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.96 3ktj n PRO 66 Cb 0.54 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.97 -1.09 0.00 0.55 0.00 -1.22 -4.49 105.19 99.91 3ktj n GLY 67 Ca 0.18 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.39 3.70 -0.02 0.00 -1.26 -0.15 105.19 107.07 3ktj n GLY 68 Ca 0.00 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 3ktj n GLY 68 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ktj n SER 69 N 0.00 3.75 -0.16 1.61 2.88 -0.39 -4.81 113.62 116.50 3ktj n SER 69 Ca 0.00 1.05 -0.10 0.00 -1.33 0.00 0.00 58.87 58.50 3ktj n SER 69 Cb 0.00 -1.53 -0.00 0.00 -0.75 0.00 0.00 64.21 61.93 3ktj n SER 69 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3ktj h ILE 70 N 3.91 1.25 0.00 2.46 2.04 -1.99 -2.28 117.51 122.91 3ktj h ILE 70 Ca -0.44 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 64.41 3ktj h ILE 70 Cb 1.22 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3ktj h ILE 70 CO 0.94 0.34 -0.18 0.71 0.00 0.00 0.00 178.15 179.95 3ktj h THR 71 N 0.62 0.77 0.10 -0.27 1.35 -1.99 -2.27 112.91 111.22 3ktj h THR 71 Ca 0.13 -0.73 -0.15 0.00 -0.55 0.00 0.00 66.41 65.11 3ktj h THR 71 Cb 0.44 1.44 0.02 0.00 -1.73 0.00 0.00 68.15 68.32 3ktj h THR 71 CO 0.02 0.18 -0.64 0.00 -0.25 0.00 0.00 175.52 174.82 3ktj h ALA 72 N 1.82 -0.05 -0.70 6.62 0.00 -1.89 -3.14 119.26 121.91 3ktj h ALA 72 Ca -0.00 -0.64 0.10 0.00 0.00 0.00 0.00 54.91 54.36 3ktj h ALA 72 Cb 0.43 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3ktj h ALA 72 CO 0.02 0.31 0.34 0.78 0.00 0.00 0.00 179.25 180.70 3ktj h GLY 73 N -0.43 1.05 2.00 0.00 0.00 -1.18 -0.73 103.07 103.78 3ktj h GLY 73 Ca -0.11 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 3ktj h GLY 73 CO 0.12 0.04 -0.02 -0.33 0.00 0.00 0.00 176.54 176.36 3ktj h MET 74 N 0.58 0.00 -0.34 4.80 2.86 -1.50 -2.31 114.93 119.02 3ktj h MET 74 Ca 0.35 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.86 3ktj h MET 74 Cb 0.39 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 3ktj h MET 74 CO -0.28 0.02 -0.31 0.00 1.06 0.00 0.00 176.91 177.40 3ktj h ALA 75 N 1.98 0.83 0.22 6.32 0.00 -1.07 -2.30 119.26 125.23 3ktj h ALA 75 Ca -0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3ktj h ALA 75 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ktj h ALA 75 CO 0.00 0.64 -0.10 0.82 0.00 0.00 0.00 179.25 180.61 3ktj h ILE 76 N 0.61 0.71 -0.67 0.00 2.04 -1.37 -3.13 117.51 115.69 3ktj h ILE 76 Ca 0.07 -0.98 0.09 0.00 1.00 0.00 0.00 64.86 65.04 3ktj h ILE 76 Cb 0.82 1.16 -0.11 0.00 -0.74 0.00 0.00 36.82 37.95 3ktj h ILE 76 CO 0.07 0.17 -0.50 0.22 0.00 0.00 0.00 178.15 178.12 3ktj h TYR 77 N -0.88 -1.50 -0.94 1.37 3.20 -1.44 -0.68 116.97 116.09 3ktj h TYR 77 Ca -0.03 0.10 0.16 0.00 3.14 0.00 0.00 58.73 62.10 3ktj h TYR 77 Cb 0.51 0.75 -0.08 0.00 1.54 0.00 0.00 36.73 39.45 3ktj h TYR 77 CO 0.06 -0.43 0.60 -0.44 -1.64 0.00 0.00 178.16 176.31 3ktj h ASP 78 N -0.19 0.69 -0.14 -2.11 3.45 -1.52 -2.01 116.42 114.59 3ktj h ASP 78 Ca 0.17 0.05 -0.12 0.00 0.43 0.00 0.00 57.03 57.56 3ktj h ASP 78 Cb 0.54 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.24 3ktj h ASP 78 CO -0.75 0.32 -0.39 0.74 -1.57 0.00 0.00 179.24 177.59 3ktj h THR 79 N 0.71 1.36 -0.61 0.35 2.02 -1.12 -2.80 112.91 112.81 3ktj h THR 79 Ca 0.49 -1.67 0.08 0.00 0.77 0.00 0.00 66.41 66.08 3ktj h THR 79 Cb 0.80 2.05 -0.10 0.00 -1.74 0.00 0.00 68.15 69.16 3ktj h THR 79 CO -0.25 0.50 -0.48 0.24 0.37 0.00 0.00 175.52 175.90 3ktj h MET 80 N 0.12 -0.22 0.00 6.66 2.86 -0.43 -1.12 114.93 122.80 3ktj h MET 80 Ca -0.01 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3ktj h MET 80 Cb 1.00 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 3ktj h MET 80 CO 0.08 -0.15 -0.21 1.96 1.06 0.00 0.00 176.91 179.65 3ktj h GLN 81 N -0.23 0.00 -0.42 1.72 1.08 -1.55 -3.25 115.11 112.46 3ktj h GLN 81 Ca 0.16 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.24 3ktj h GLN 81 Cb 0.55 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 3ktj h GLN 81 CO -0.71 0.21 -0.19 0.35 -0.95 0.00 0.00 178.83 177.54 3ktj h PHE 82 N 0.00 1.00 -4.05 2.96 3.57 -0.92 -3.45 116.94 116.04 3ktj h PHE 82 Ca -0.00 -0.24 -0.47 0.00 3.53 0.00 0.00 57.97 60.79 3ktj h PHE 82 Cb 0.44 -0.23 0.02 0.00 2.79 0.00 0.00 35.95 38.96 3ktj h PHE 82 CO 0.00 1.02 0.38 0.96 -2.23 0.00 0.00 178.31 178.44 3ktj s ILE 83 N -4.66 3.86 0.08 1.41 -4.36 -1.13 -4.99 121.20 111.41 3ktj s ILE 83 Ca -0.12 1.22 -0.30 0.00 -0.26 0.00 0.00 60.65 61.19 3ktj s ILE 83 Cb 0.11 -3.52 -0.17 0.00 1.25 0.00 0.00 42.46 40.12 3ktj s ILE 83 CO 0.85 -0.20 1.65 0.11 0.24 0.00 0.00 174.94 177.59 3ktj h LYS 84 N 1.82 -0.64 -6.41 0.37 1.57 -1.88 -3.44 116.57 107.95 3ktj h LYS 84 Ca -0.49 0.04 -0.59 0.00 -1.87 0.00 0.00 60.65 57.74 3ktj h LYS 84 Cb 1.21 0.15 0.16 0.00 0.08 0.00 0.00 32.23 33.83 3ktj h LYS 84 CO 0.60 -0.43 -0.46 -2.30 -0.57 0.00 0.00 179.45 176.29 3ktj n PRO 85 N -5.39 0.49 -2.66 3.15 -0.02 -1.24 -4.96 135.00 124.38 3ktj n PRO 85 Ca -0.12 0.19 -0.29 0.00 -2.02 0.00 0.00 63.50 61.26 3ktj n PRO 85 Cb 0.29 -1.59 -0.02 0.00 -0.02 0.00 0.00 33.50 32.16 3ktj n PRO 85 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ktj s LYS 86 N -1.84 3.68 -0.27 -0.52 1.02 -1.26 -4.92 119.74 115.63 3ktj s LYS 86 Ca 0.66 0.42 0.01 0.00 0.02 0.00 0.00 55.97 57.08 3ktj s LYS 86 Cb -0.49 -2.34 0.08 0.00 -0.52 0.00 0.00 37.83 34.55 3ktj s LYS 86 CO 0.57 -0.16 0.01 0.08 -0.92 0.00 0.00 175.35 174.93 3ktj s VAL 87 N -2.59 1.49 0.12 3.17 1.01 -1.26 -1.73 120.40 120.61 3ktj s VAL 87 Ca 0.51 -1.49 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 3ktj s VAL 87 Cb -0.10 -1.93 -0.07 0.00 0.00 0.00 0.00 36.38 34.28 3ktj s VAL 87 CO 0.38 -0.36 0.63 -0.94 0.00 0.00 0.00 175.10 174.81 3ktj s SER 88 N 1.36 7.10 0.04 3.32 1.04 -0.73 -1.52 113.70 124.30 3ktj s SER 88 Ca 0.02 1.33 0.08 0.00 0.48 0.00 0.00 55.95 57.86 3ktj s SER 88 Cb -0.18 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.52 3ktj s SER 88 CO -0.11 0.21 -0.22 0.42 0.98 0.00 0.00 173.24 174.51 3ktj s THR 89 N -1.22 2.48 -0.07 2.02 -4.23 -0.59 -2.01 115.64 112.01 3ktj s THR 89 Ca 0.33 -1.28 0.02 0.00 -1.18 0.00 0.00 61.69 59.58 3ktj s THR 89 Cb -0.19 -2.01 0.01 0.00 1.34 0.00 0.00 72.50 71.66 3ktj s THR 89 CO 0.21 0.35 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.89 3ktj s ILE 90 N -0.86 1.13 -0.48 2.99 1.01 -0.99 0.92 121.20 124.92 3ktj s ILE 90 Ca 0.13 -0.46 -0.14 0.00 0.00 0.00 0.00 60.65 60.18 3ktj s ILE 90 Cb -0.10 -1.04 0.09 0.00 0.01 0.00 0.00 42.46 41.42 3ktj s ILE 90 CO 0.04 0.36 0.39 0.00 0.00 0.00 0.00 174.94 175.72 3ktj s ILE 92 N 1.57 3.40 0.00 0.00 2.07 -0.66 -2.06 121.20 125.52 3ktj s ILE 92 Ca 0.04 -0.93 0.00 0.00 -1.41 0.00 0.00 60.65 58.35 3ktj s ILE 92 Cb -0.25 -2.77 0.00 0.00 0.13 0.00 0.00 42.46 39.56 3ktj s ILE 92 CO 0.04 0.10 0.00 0.61 -1.91 0.00 0.00 174.94 173.78 3ktj n GLY 93 N 4.76 1.01 2.87 1.50 0.00 -1.26 -4.17 105.19 109.89 3ktj n GLY 93 Ca -0.15 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 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 0.03 -0.38 1.61 -2.45 -1.26 -1.77 119.30 115.07 3ktj s MET 94 Ca 0.00 0.01 0.01 0.00 -1.25 0.00 0.00 55.69 54.45 3ktj s MET 94 Cb 0.00 -0.05 0.14 0.00 1.25 0.00 0.00 34.83 36.16 3ktj s MET 94 CO 0.00 -0.01 0.21 0.00 1.05 0.00 0.00 175.02 176.27 3ktj s ALA 95 N 0.10 1.42 0.27 4.11 0.00 -0.69 -2.25 121.76 124.73 3ktj s ALA 95 Ca -0.01 -2.12 0.08 0.00 0.00 0.00 0.00 51.96 49.91 3ktj s ALA 95 Cb -0.01 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 3ktj s ALA 95 CO -0.00 -2.06 0.14 0.00 0.00 0.00 0.00 175.76 173.83 3ktj s ALA 96 N 0.84 3.47 0.00 0.00 0.00 -1.04 -2.62 121.76 122.41 3ktj s ALA 96 Ca 0.17 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.58 3ktj s ALA 96 Cb -0.23 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.82 3ktj s ALA 96 CO -0.01 0.21 0.00 0.43 0.00 0.00 0.00 175.76 176.39 3ktj n SER 97 N -1.10 0.00 0.33 0.00 7.64 -0.39 0.56 113.62 120.66 3ktj n SER 97 Ca -0.06 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.00 3ktj n SER 97 Cb 0.59 0.00 0.96 0.00 -1.01 0.00 0.00 64.21 64.75 3ktj n SER 97 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 3ktj h MET 98 N 0.00 0.00 0.77 1.43 2.86 -1.89 -1.12 114.93 116.99 3ktj h MET 98 Ca 0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3ktj h MET 98 Cb 0.00 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.67 3ktj h MET 98 CO 0.00 0.00 -0.37 0.78 1.06 0.00 0.00 176.91 178.38 3ktj h GLY 99 N 0.00 -1.08 0.99 8.32 0.00 -0.15 -0.94 103.07 110.21 3ktj h GLY 99 Ca 0.00 0.40 0.14 0.00 0.00 0.00 0.00 47.33 47.87 3ktj h GLY 99 CO 0.00 -0.39 0.37 0.00 0.00 0.00 0.00 176.54 176.51 3ktj h ALA 100 N -1.27 2.42 0.01 3.60 0.00 -1.07 -2.05 119.26 120.90 3ktj h ALA 100 Ca -0.11 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ktj h ALA 100 Cb 0.80 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3ktj h ALA 100 CO 0.17 -0.62 -0.01 0.35 0.00 0.00 0.00 179.25 179.15 3ktj h PHE 101 N 0.00 -0.02 0.00 0.00 3.57 -0.91 -2.44 116.94 117.14 3ktj h PHE 101 Ca 0.23 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 3ktj h PHE 101 Cb 0.97 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 3ktj h PHE 101 CO 0.00 0.26 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.13 3ktj h LEU 102 N -0.29 0.00 0.78 0.59 3.38 -0.47 -2.55 115.31 116.74 3ktj h LEU 102 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3ktj h LEU 102 Cb 0.28 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.04 3ktj h LEU 102 CO 0.00 0.13 -0.37 0.25 0.09 0.00 0.00 178.44 178.54 3ktj h LEU 103 N 0.00 -0.88 -1.69 1.67 5.85 -1.32 -2.84 115.31 116.10 3ktj h LEU 103 Ca -0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3ktj h LEU 103 Cb 0.38 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3ktj h LEU 103 CO 0.02 -0.52 0.22 0.00 -0.34 0.00 0.00 178.44 177.82 3ktj h ALA 104 N -1.29 1.19 -0.35 1.25 0.00 -1.14 -1.52 119.26 117.40 3ktj h ALA 104 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ktj h ALA 104 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3ktj h ALA 104 CO 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.24 3ktj n ALA 105 N -1.80 2.54 -1.77 0.00 0.00 -0.99 -4.89 120.51 113.60 3ktj n ALA 105 Ca -0.02 -0.66 -0.31 0.00 0.00 0.00 0.00 53.44 52.45 3ktj n ALA 105 Cb 0.26 -0.98 0.02 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.91 1.72 -0.16 0.00 0.00 -0.57 -4.92 107.32 102.47 3ktj s GLY 106 Ca 0.24 0.01 -0.39 0.00 0.00 0.00 0.00 44.72 44.57 3ktj s GLY 106 CO 0.15 0.29 1.58 -2.21 0.00 0.00 0.00 173.10 172.91 3ktj n GLU 107 N -2.71 1.06 -1.64 2.90 4.07 -0.58 -4.79 120.64 118.95 3ktj n GLU 107 Ca 0.07 0.39 -0.47 0.00 -0.06 0.00 0.00 57.16 57.08 3ktj n GLU 107 Cb 0.54 -2.04 -0.04 0.00 -0.06 0.00 0.00 31.44 29.84 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 4.26 1.76 -0.16 5.31 4.01 -1.26 -0.19 118.16 131.89 3ktj n LYS 108 Ca 0.24 0.63 0.00 0.00 -0.51 0.00 0.00 58.31 58.67 3ktj n LYS 108 Cb 0.14 -2.31 0.00 0.00 -0.51 0.00 0.00 35.03 32.35 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 2.67 0.95 2.57 0.72 0.00 -1.26 -4.91 105.19 105.92 3ktj n GLY 109 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 2.19 -4.06 1.61 4.76 0.74 -4.94 118.16 116.46 3ktj n LYS 110 Ca 0.00 -3.74 -0.32 0.00 -2.87 0.00 0.00 58.31 51.38 3ktj n LYS 110 Cb 0.00 -1.72 -0.15 0.00 -1.84 0.00 0.00 35.03 31.31 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 -3.46 2.38 0.38 1.97 0.52 -1.25 -1.55 118.95 117.93 3ktj s ARG 111 Ca 0.35 -1.09 0.08 0.00 -0.52 0.00 0.00 55.73 54.56 3ktj s ARG 111 Cb 0.40 -2.69 -0.06 0.00 0.52 0.00 0.00 34.95 33.12 3ktj s ARG 111 CO -0.03 -0.44 0.05 0.71 0.02 0.00 0.00 175.30 175.60 3ktj s TYR 112 N 1.22 2.54 -0.19 -0.53 1.51 0.26 0.69 117.35 122.86 3ktj s TYR 112 Ca -0.03 -0.55 -0.22 0.00 -1.01 0.00 0.00 57.07 55.26 3ktj s TYR 112 Cb -0.17 -1.69 0.06 0.00 -0.11 0.00 0.00 41.96 40.04 3ktj s TYR 112 CO -0.08 0.40 0.58 0.00 -1.11 0.00 0.00 175.55 175.35 3ktj s ALA 113 N -2.61 -1.46 0.66 3.71 0.00 -1.14 -0.77 121.76 120.15 3ktj s ALA 113 Ca 0.36 1.54 -0.11 0.00 0.00 0.00 0.00 51.96 53.75 3ktj s ALA 113 Cb 0.04 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.37 3ktj s ALA 113 CO 0.20 -0.29 1.05 -0.51 0.00 0.00 0.00 175.76 176.20 3ktj s LEU 114 N 0.01 3.15 0.30 0.00 1.43 -0.87 -2.13 118.68 120.57 3ktj s LEU 114 Ca -0.02 1.49 0.01 0.00 -1.03 0.00 0.00 54.13 54.58 3ktj s LEU 114 Cb -0.04 -4.44 0.72 0.00 0.03 0.00 0.00 46.19 42.47 3ktj s LEU 114 CO 0.02 -1.18 1.60 -0.65 0.23 0.00 0.00 176.35 176.37 3ktj h PRO 115 N -0.54 0.07 -0.43 1.29 0.11 -1.93 -2.42 132.00 128.15 3ktj h PRO 115 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ktj h PRO 115 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ktj h PRO 115 CO 0.60 0.04 0.00 0.09 -0.21 0.00 0.00 178.00 178.52 3ktj n ASN 116 N -5.40 3.29 -4.34 -2.05 4.13 -1.26 -4.57 115.26 105.05 3ktj n ASN 116 Ca 0.22 -1.94 -0.32 0.00 1.68 0.00 0.00 54.58 54.22 3ktj n ASN 116 Cb 0.72 -0.28 0.15 0.00 -1.54 0.00 0.00 39.78 38.84 3ktj n ASN 116 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3ktj n SER 117 N 1.18 -2.22 -4.08 6.41 7.64 -0.91 -4.85 113.62 116.79 3ktj n SER 117 Ca 0.17 0.07 -0.14 0.00 1.01 0.00 0.00 58.87 59.99 3ktj n SER 117 Cb 0.53 -1.08 -0.11 0.00 -1.01 0.00 0.00 64.21 62.54 3ktj n SER 117 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3ktj s GLU 118 N -3.56 0.58 -0.04 1.43 2.12 -0.73 -3.27 118.70 115.22 3ktj s GLU 118 Ca 0.57 -0.79 0.01 0.00 0.36 0.00 0.00 54.97 55.12 3ktj s GLU 118 Cb -0.16 -0.39 0.02 0.00 0.26 0.00 0.00 34.13 33.86 3ktj s GLU 118 CO 0.67 0.07 -0.06 0.08 -0.54 0.00 0.00 175.26 175.48 3ktj s VAL 119 N -1.37 0.64 -0.12 3.70 1.01 0.24 -1.70 120.40 122.81 3ktj s VAL 119 Ca -0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 3ktj s VAL 119 Cb -0.10 -0.63 0.04 0.00 0.00 0.00 0.00 36.38 35.69 3ktj s VAL 119 CO 0.01 0.24 -0.01 -0.32 0.00 0.00 0.00 175.10 175.02 3ktj s MET 120 N 0.71 0.85 -0.07 2.72 0.00 -1.08 0.14 119.30 122.57 3ktj s MET 120 Ca -0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 55.69 55.44 3ktj s MET 120 Cb -0.13 -1.47 -0.03 0.00 0.00 0.00 0.00 34.83 33.20 3ktj s MET 120 CO 0.01 -0.40 -0.03 0.96 0.00 0.00 0.00 175.02 175.56 3ktj s ILE 121 N 1.87 4.00 0.00 10.11 -4.36 -0.39 -1.26 121.20 131.17 3ktj s ILE 121 Ca 0.03 -0.41 0.00 0.00 -0.26 0.00 0.00 60.65 60.01 3ktj s ILE 121 Cb -0.14 -2.67 0.00 0.00 1.25 0.00 0.00 42.46 40.90 3ktj s ILE 121 CO -0.07 0.57 0.00 0.00 0.24 0.00 0.00 174.94 175.68 3ktj n HIS 122 N 2.08 -0.52 -3.81 1.37 1.44 -1.26 -2.18 115.22 112.34 3ktj n HIS 122 Ca -0.18 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.23 3ktj n HIS 122 Cb 0.53 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.60 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 -1.18 3.51 0.78 -1.40 -2.07 -0.60 -4.88 119.66 113.81 3ktj s GLN 123 Ca 0.00 -0.31 -0.15 0.00 -1.82 0.00 0.00 55.36 53.08 3ktj s GLN 123 Cb 0.00 -2.95 0.01 0.00 -1.09 0.00 0.00 33.01 28.98 3ktj s GLN 123 CO 0.00 0.54 0.77 -2.30 -1.32 0.00 0.00 175.29 172.98 3ktj n PRO 124 N 0.10 0.23 -4.82 9.60 -0.02 -1.26 -5.03 135.00 133.80 3ktj n PRO 124 Ca -0.04 0.13 -0.31 0.00 -2.02 0.00 0.00 63.50 61.27 3ktj n PRO 124 Cb 0.52 -2.07 -0.14 0.00 -0.02 0.00 0.00 33.50 31.79 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 -2.31 2.43 0.00 2.45 1.43 -1.26 -5.10 118.68 116.31 3ktj s LEU 125 Ca 0.68 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 53.32 3ktj s LEU 125 Cb -0.31 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.48 3ktj s LEU 125 CO 0.56 0.27 0.00 0.61 0.23 0.00 0.00 176.35 178.02 3ktj n GLY 126 N 1.78 1.64 3.29 -3.19 0.00 -1.26 -5.10 105.19 102.36 3ktj n GLY 126 Ca -0.16 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.43 -0.20 -0.11 -0.02 0.00 -1.26 -5.15 107.32 99.14 3ktj s GLY 127 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 44.72 44.65 3ktj s GLY 127 CO 0.00 -0.26 0.25 0.00 0.00 0.00 0.00 173.10 173.08 3ktj s ALA 128 N -3.26 -0.54 0.00 3.20 0.00 -1.26 -4.97 121.76 114.93 3ktj s ALA 128 Ca -0.00 0.97 0.01 0.00 0.00 0.00 0.00 51.96 52.94 3ktj s ALA 128 Cb 0.01 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 3ktj s ALA 128 CO -0.08 -0.34 -0.05 -1.14 0.00 0.00 0.00 175.76 174.15 3ktj s GLN 129 N 1.63 0.39 0.00 0.00 2.00 -1.26 -4.97 119.66 117.44 3ktj s GLN 129 Ca -0.06 -0.24 0.00 0.00 -2.00 0.00 0.00 55.36 53.06 3ktj s GLN 129 Cb -0.11 -0.34 0.00 0.00 0.80 0.00 0.00 33.01 33.36 3ktj s GLN 129 CO -0.08 0.09 0.00 0.41 -0.50 0.00 0.00 175.29 175.21 3ktj n GLY 130 N 2.78 0.21 3.89 2.59 0.00 -1.26 -4.74 105.19 108.65 3ktj n GLY 130 Ca -0.14 -1.64 -0.29 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.81 3.06 0.47 1.61 -0.21 -1.26 -4.87 119.66 117.65 3ktj s GLN 131 Ca 0.00 0.39 0.17 0.00 0.02 0.00 0.00 55.36 55.94 3ktj s GLN 131 Cb 0.00 -2.11 1.16 0.00 1.00 0.00 0.00 33.01 33.06 3ktj s GLN 131 CO 0.00 -0.82 2.02 0.00 -2.12 0.00 0.00 175.29 174.37 3ktj h ALA 132 N -0.42 2.13 0.04 6.09 0.00 -1.99 -1.08 119.26 124.02 3ktj h ALA 132 Ca -0.45 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.22 3ktj h ALA 132 Cb 1.24 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 3ktj h ALA 132 CO 0.63 -0.24 -1.00 1.15 0.00 0.00 0.00 179.25 179.78 3ktj h THR 133 N 0.24 1.47 -0.20 0.00 2.02 -2.00 -3.00 112.91 111.44 3ktj h THR 133 Ca 0.22 -2.71 -0.14 0.00 0.77 0.00 0.00 66.41 64.55 3ktj h THR 133 Cb 0.55 2.60 0.00 0.00 -1.74 0.00 0.00 68.15 69.56 3ktj h THR 133 CO -0.04 0.80 -0.41 -0.33 0.37 0.00 0.00 175.52 175.90 3ktj h GLU 134 N 0.14 0.64 -0.62 6.66 5.08 -1.72 -2.84 114.58 121.91 3ktj h GLU 134 Ca -0.08 -0.42 0.04 0.00 -1.00 0.00 0.00 59.36 57.91 3ktj h GLU 134 Cb 1.67 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.94 3ktj h GLU 134 CO 0.16 1.03 0.41 0.82 -1.00 0.00 0.00 179.01 180.44 3ktj h ILE 135 N 0.33 1.06 -0.16 3.13 2.04 -1.30 -1.78 117.51 120.83 3ktj h ILE 135 Ca 0.01 -0.24 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 3ktj h ILE 135 Cb 1.02 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 3ktj h ILE 135 CO 0.09 0.13 -0.47 -0.08 0.00 0.00 0.00 178.15 177.82 3ktj h GLU 136 N 0.70 0.40 0.00 2.37 4.81 -1.44 -1.27 114.58 120.15 3ktj h GLU 136 Ca 0.26 -0.22 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 3ktj h GLU 136 Cb 0.14 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 3ktj h GLU 136 CO -0.07 0.79 -0.36 0.82 -0.73 0.00 0.00 179.01 179.45 3ktj h ILE 137 N 0.32 1.15 0.22 2.32 2.04 -1.08 -1.55 117.51 120.94 3ktj h ILE 137 Ca 0.02 -1.29 -0.34 0.00 1.00 0.00 0.00 64.86 64.24 3ktj h ILE 137 Cb 0.95 1.72 0.02 0.00 -0.74 0.00 0.00 36.82 38.77 3ktj h ILE 137 CO 0.08 0.36 -1.61 0.00 0.00 0.00 0.00 178.15 176.97 3ktj h ALA 138 N 1.64 -0.01 -0.57 1.87 0.00 -1.34 -3.05 119.26 117.80 3ktj h ALA 138 Ca -0.00 -1.00 0.07 0.00 0.00 0.00 0.00 54.91 53.98 3ktj h ALA 138 Cb 0.69 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 3ktj h ALA 138 CO 0.05 0.86 0.24 0.00 0.00 0.00 0.00 179.25 180.40 3ktj h ALA 139 N 0.14 0.74 -0.59 0.00 0.00 -1.03 -2.17 119.26 116.35 3ktj h ALA 139 Ca -0.30 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3ktj h ALA 139 Cb 2.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.90 3ktj h ALA 139 CO 0.23 -0.14 0.12 0.87 0.00 0.00 0.00 179.25 180.33 3ktj h LYS 140 N 0.46 0.96 -0.43 0.00 1.57 -1.38 -2.12 116.57 115.63 3ktj h LYS 140 Ca 0.27 -0.25 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 3ktj h LYS 140 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 3ktj h LYS 140 CO -0.24 0.90 -0.19 -0.09 -0.57 0.00 0.00 179.45 179.26 3ktj h ARG 141 N 0.87 0.84 0.04 3.15 2.43 -1.35 -2.23 114.38 118.13 3ktj h ARG 141 Ca 0.18 -0.33 -0.22 0.00 -0.81 0.00 0.00 59.98 58.80 3ktj h ARG 141 Cb 0.39 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 3ktj h ARG 141 CO 0.01 0.96 -1.03 0.97 -1.51 0.00 0.00 179.97 179.37 3ktj h ILE 142 N 0.74 1.57 0.00 1.20 2.10 -1.38 -2.36 117.51 119.37 3ktj h ILE 142 Ca 0.11 -3.01 -0.09 0.00 1.08 0.00 0.00 64.86 62.95 3ktj h ILE 142 Cb 0.71 2.73 -0.01 0.00 -1.09 0.00 0.00 36.82 39.16 3ktj h ILE 142 CO 0.05 0.87 -0.42 -0.07 -1.08 0.00 0.00 178.15 177.50 3ktj h LEU 143 N 0.06 0.00 0.22 2.19 3.38 -1.37 -1.72 115.31 118.07 3ktj h LEU 143 Ca -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3ktj h LEU 143 Cb 1.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.48 3ktj h LEU 143 CO 0.15 0.42 -0.11 -0.07 0.09 0.00 0.00 178.44 178.93 3ktj h LEU 144 N 0.00 -0.25 -1.43 1.67 3.38 -1.30 -3.00 115.31 114.38 3ktj h LEU 144 Ca -0.00 -0.27 0.09 0.00 0.09 0.00 0.00 57.88 57.79 3ktj h LEU 144 Cb 0.84 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 3ktj h LEU 144 CO 0.05 0.19 0.48 -0.07 0.09 0.00 0.00 178.44 179.18 3ktj h LEU 145 N -0.75 0.58 -1.49 1.67 3.38 -1.35 0.11 115.31 117.45 3ktj h LEU 145 Ca -0.03 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3ktj h LEU 145 Cb 0.50 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3ktj h LEU 145 CO 0.05 0.35 -0.25 -0.09 0.09 0.00 0.00 178.44 178.58 3ktj h ARG 146 N 0.64 0.00 0.16 1.13 2.43 -1.33 -1.32 114.38 116.10 3ktj h ARG 146 Ca 0.33 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 59.26 3ktj h ARG 146 Cb 0.45 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.02 3ktj h ARG 146 CO -0.12 0.25 -1.10 0.22 -1.51 0.00 0.00 179.97 177.72 3ktj h ASP 147 N 0.00 0.53 0.02 -3.80 3.58 -0.70 -2.45 116.42 113.61 3ktj h ASP 147 Ca -0.00 -0.93 -0.06 0.00 0.42 0.00 0.00 57.03 56.46 3ktj h ASP 147 Cb 0.53 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 3ktj h ASP 147 CO 0.03 1.52 -0.16 0.50 -2.88 0.00 0.00 179.24 178.25 3ktj h LYS 148 N -0.24 0.27 0.07 0.28 3.64 -1.06 -2.44 116.57 117.09 3ktj h LYS 148 Ca -0.21 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 58.89 3ktj h LYS 148 Cb 1.79 -0.03 0.02 0.00 -0.41 0.00 0.00 32.23 33.59 3ktj h LYS 148 CO 0.16 0.43 -0.89 -0.07 -2.27 0.00 0.00 179.45 176.81 3ktj h LEU 149 N 0.26 0.65 -1.52 5.20 3.38 -1.34 -3.13 115.31 118.82 3ktj h LEU 149 Ca 0.05 -0.83 -0.03 0.00 0.09 0.00 0.00 57.88 57.16 3ktj h LEU 149 Cb 0.44 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3ktj h LEU 149 CO 0.03 1.41 -0.00 0.78 0.09 0.00 0.00 178.44 180.74 3ktj h ASN 150 N -0.02 0.27 -0.12 -0.43 2.35 -1.30 -1.85 115.58 114.49 3ktj h ASN 150 Ca -0.13 -0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.51 3ktj h ASN 150 Cb 1.61 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.91 3ktj h ASN 150 CO 0.17 0.33 -0.22 0.11 -1.65 0.00 0.00 177.43 176.18 3ktj h LYS 151 N 0.30 0.36 -0.59 0.81 1.57 -1.51 -2.33 116.57 115.18 3ktj h LYS 151 Ca 0.07 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 3ktj h LYS 151 Cb 0.21 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 3ktj h LYS 151 CO 0.00 0.82 0.31 0.28 -0.57 0.00 0.00 179.45 180.29 3ktj h VAL 152 N -0.06 1.18 -0.18 0.50 2.07 -1.45 0.83 116.25 119.15 3ktj h VAL 152 Ca 0.01 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 3ktj h VAL 152 Cb 0.80 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3ktj h VAL 152 CO 0.05 0.21 -0.09 -0.07 0.02 0.00 0.00 177.57 177.69 3ktj h LEU 153 N 0.82 0.26 0.06 2.57 3.38 -1.26 -1.98 115.31 119.15 3ktj h LEU 153 Ca 0.21 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3ktj h LEU 153 Cb 0.05 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3ktj h LEU 153 CO -0.03 0.38 -0.03 0.00 0.09 0.00 0.00 178.44 178.85 3ktj h ALA 154 N 1.65 -0.08 -0.28 1.53 0.00 -0.29 -1.53 119.26 120.26 3ktj h ALA 154 Ca 0.06 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3ktj h ALA 154 Cb 0.32 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3ktj h ALA 154 CO 0.02 -0.41 0.17 0.93 0.00 0.00 0.00 179.25 179.95 3ktj h GLU 155 N -0.35 0.33 -0.58 0.00 5.08 -1.14 0.22 114.58 118.14 3ktj h GLU 155 Ca -0.01 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 3ktj h GLU 155 Cb 0.31 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3ktj h GLU 155 CO 0.01 0.22 -0.02 0.00 -1.00 0.00 0.00 179.01 178.23 3ktj h ARG 156 N 0.34 1.01 0.13 2.33 2.47 -1.38 -3.31 114.38 115.97 3ktj h ARG 156 Ca 0.11 -0.32 -0.27 0.00 -1.26 0.00 0.00 59.98 58.24 3ktj h ARG 156 Cb -0.01 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.22 3ktj h ARG 156 CO -0.04 1.00 -1.35 1.79 0.56 0.00 0.00 179.97 181.92 3ktj h THR 157 N 0.93 1.10 0.00 2.04 1.35 -1.22 -3.47 112.91 113.64 3ktj h THR 157 Ca 0.16 -2.44 0.00 0.00 -0.55 0.00 0.00 66.41 63.59 3ktj h THR 157 Cb 0.56 2.80 0.00 0.00 -1.73 0.00 0.00 68.15 69.78 3ktj h THR 157 CO 0.03 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.63 3ktj n GLY 158 N 1.74 0.57 3.77 5.82 0.00 0.76 -4.60 105.19 113.25 3ktj n GLY 158 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.63 3.78 0.22 1.61 -1.52 -1.21 -4.99 119.66 116.93 3ktj s GLN 159 Ca 0.00 1.75 -0.30 0.00 -1.95 0.00 0.00 55.36 54.86 3ktj s GLN 159 Cb 0.00 -2.41 -0.09 0.00 -0.22 0.00 0.00 33.01 30.30 3ktj s GLN 159 CO 0.00 -0.52 1.14 -1.25 -0.25 0.00 0.00 175.29 174.41 3ktj s PRO 160 N -2.70 4.56 0.31 2.91 0.04 -1.26 -4.60 135.00 134.27 3ktj s PRO 160 Ca 0.63 1.83 0.05 0.00 0.04 0.00 0.00 61.00 63.55 3ktj s PRO 160 Cb -0.28 -3.22 0.84 0.00 0.04 0.00 0.00 34.50 31.87 3ktj s PRO 160 CO 0.34 0.06 1.52 -0.11 0.04 0.00 0.00 177.00 178.85 3ktj n LEU 161 N 1.92 -0.04 0.26 -3.56 7.94 -1.26 0.60 117.00 122.87 3ktj n LEU 161 Ca 0.02 1.64 0.10 0.00 -1.11 0.00 0.00 56.01 56.66 3ktj n LEU 161 Cb 0.45 -0.63 0.70 0.00 0.53 0.00 0.00 43.42 44.47 3ktj n LEU 161 CO 0.55 -1.69 1.05 -0.08 -1.11 0.00 0.00 177.39 176.10 3ktj h GLU 162 N 0.00 0.00 0.03 1.96 4.57 -1.98 -0.74 114.58 118.43 3ktj h GLU 162 Ca 0.63 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 58.58 3ktj h GLU 162 Cb 1.37 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.96 3ktj h GLU 162 CO -0.89 0.04 -0.99 0.28 -1.18 0.00 0.00 179.01 176.27 3ktj h VAL 163 N 0.00 1.46 -0.16 0.32 2.07 -0.20 -3.13 116.25 116.61 3ktj h VAL 163 Ca -0.00 -2.66 -0.15 0.00 0.82 0.00 0.00 66.70 64.71 3ktj h VAL 163 Cb 0.08 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 3ktj h VAL 163 CO 0.01 0.78 -0.53 0.40 0.02 0.00 0.00 177.57 178.25 3ktj h ILE 164 N 0.15 1.33 -0.09 4.57 1.08 -0.81 -2.75 117.51 120.99 3ktj h ILE 164 Ca -0.08 -1.79 -0.18 0.00 -0.39 0.00 0.00 64.86 62.42 3ktj h ILE 164 Cb 1.65 1.79 -0.01 0.00 -3.07 0.00 0.00 36.82 37.19 3ktj h ILE 164 CO 0.16 0.55 -0.69 -0.33 -0.69 0.00 0.00 178.15 177.15 3ktj h GLU 165 N 0.35 0.41 0.00 2.37 5.08 -1.28 -2.33 114.58 119.19 3ktj h GLU 165 Ca 0.01 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3ktj h GLU 165 Cb 1.05 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3ktj h GLU 165 CO 0.09 0.95 -0.24 -2.13 -1.00 0.00 0.00 179.01 176.69 3ktj n ARG 166 N -3.86 0.27 -0.01 2.33 0.63 -1.18 -3.76 116.66 111.09 3ktj n ARG 166 Ca -0.04 0.16 -0.02 0.00 -0.92 0.00 0.00 57.85 57.04 3ktj n ARG 166 Cb 0.69 -1.76 -0.11 0.00 0.45 0.00 0.00 32.46 31.73 3ktj n ARG 166 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3ktj n ASP 167 N -2.19 0.59 -1.49 6.15 9.92 -1.04 -4.10 116.55 124.39 3ktj n ASP 167 Ca 0.05 0.26 0.08 0.00 -0.53 0.00 0.00 54.79 54.65 3ktj n ASP 167 Cb 0.43 0.51 0.32 0.00 -0.64 0.00 0.00 41.12 41.74 3ktj n ASP 167 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3ktj n THR 168 N -2.81 1.78 0.05 -3.53 -2.24 -0.88 -4.34 114.28 102.31 3ktj n THR 168 Ca -0.15 -1.06 -0.05 0.00 -2.27 0.00 0.00 64.05 60.53 3ktj n THR 168 Cb 0.90 -0.03 0.15 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 3.51 0.40 -5.26 3.42 -0.00 -1.71 -1.60 116.42 115.18 3ktj h ASP 169 Ca 0.00 -0.18 -0.14 0.00 -0.00 0.00 0.00 57.03 56.70 3ktj h ASP 169 Cb 1.41 -0.11 -0.15 0.00 -0.00 0.00 0.00 39.33 40.48 3ktj h ASP 169 CO 0.26 0.80 -0.67 -0.13 -0.00 0.00 0.00 179.24 179.50 3ktj s ARG 170 N -4.10 0.72 -0.46 0.28 0.52 -1.26 -4.78 118.95 109.86 3ktj s ARG 170 Ca -0.06 -1.29 -0.44 0.00 -0.52 0.00 0.00 55.73 53.42 3ktj s ARG 170 Cb 0.13 0.20 -0.18 0.00 0.52 0.00 0.00 34.95 35.61 3ktj s ARG 170 CO 0.80 -0.15 1.89 -0.25 0.02 0.00 0.00 175.30 177.61 3ktj n ASP 171 N 0.04 1.23 -4.16 0.23 8.00 -1.26 -4.75 116.55 115.87 3ktj n ASP 171 Ca -0.11 0.90 -0.35 0.00 0.71 0.00 0.00 54.79 55.94 3ktj n ASP 171 Cb 0.62 -0.95 -0.14 0.00 -0.02 0.00 0.00 41.12 40.63 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 4.67 4.87 -0.17 -2.24 3.04 -0.93 -5.04 114.94 119.15 3ktj s ASN 172 Ca 1.11 -1.33 -0.12 0.00 0.04 0.00 0.00 52.86 52.55 3ktj s ASN 172 Cb -1.40 -1.70 -0.05 0.00 -1.54 0.00 0.00 41.25 36.56 3ktj s ASN 172 CO 0.71 -0.27 0.24 -0.36 -3.04 0.00 0.00 177.10 174.38 3ktj s PHE 173 N 1.23 3.46 0.06 0.43 0.08 -1.26 -1.26 117.98 120.71 3ktj s PHE 173 Ca -0.05 0.53 0.05 0.00 0.12 0.00 0.00 56.93 57.57 3ktj s PHE 173 Cb -0.20 -2.27 -0.03 0.00 -0.57 0.00 0.00 43.02 39.96 3ktj s PHE 173 CO -0.02 0.29 -0.13 0.15 -0.10 0.00 0.00 175.22 175.41 3ktj s LYS 174 N 0.33 0.79 0.63 0.44 1.02 0.36 -4.98 119.74 118.33 3ktj s LYS 174 Ca 0.14 -0.88 -0.07 0.00 0.02 0.00 0.00 55.97 55.18 3ktj s LYS 174 Cb -0.12 -0.77 0.02 0.00 -0.52 0.00 0.00 37.83 36.43 3ktj s LYS 174 CO 0.02 0.17 0.96 -1.54 -0.92 0.00 0.00 175.35 174.05 3ktj s SER 175 N -1.58 5.46 0.31 2.83 1.04 -1.26 -0.59 113.70 119.91 3ktj s SER 175 Ca -0.02 0.77 0.03 0.00 0.48 0.00 0.00 55.95 57.21 3ktj s SER 175 Cb -0.09 -1.68 0.63 0.00 0.10 0.00 0.00 66.02 64.97 3ktj s SER 175 CO 0.02 -1.20 1.88 0.00 0.98 0.00 0.00 173.24 174.93 3ktj h ALA 176 N -0.34 1.61 -0.72 5.32 0.00 -1.79 0.33 119.26 123.68 3ktj h ALA 176 Ca -0.45 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3ktj h ALA 176 Cb 1.26 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3ktj h ALA 176 CO 0.61 0.19 0.25 0.93 0.00 0.00 0.00 179.25 181.23 3ktj h GLU 177 N 0.91 1.09 0.00 0.00 3.07 -1.91 -1.40 114.58 116.34 3ktj h GLU 177 Ca 0.43 -0.21 -0.05 0.00 -0.50 0.00 0.00 59.36 59.03 3ktj h GLU 177 Cb 0.42 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 3ktj h GLU 177 CO -0.19 0.91 -0.22 0.93 -1.40 0.00 0.00 179.01 179.04 3ktj h GLU 178 N 1.05 0.00 -0.11 2.33 5.08 -1.33 -2.10 114.58 119.51 3ktj h GLU 178 Ca 0.24 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.39 3ktj h GLU 178 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3ktj h GLU 178 CO -0.01 0.22 -0.76 0.00 -1.00 0.00 0.00 179.01 177.45 3ktj h ALA 179 N 1.78 0.47 -0.10 3.43 0.00 0.11 -1.60 119.26 123.35 3ktj h ALA 179 Ca -0.00 -0.61 -0.20 0.00 0.00 0.00 0.00 54.91 54.10 3ktj h ALA 179 Cb 1.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3ktj h ALA 179 CO 0.03 0.73 -0.75 1.25 0.00 0.00 0.00 179.25 180.51 3ktj h LEU 180 N 0.38 0.65 -0.37 0.00 5.85 -1.23 0.20 115.31 120.78 3ktj h LEU 180 Ca -0.04 -0.43 -0.12 0.00 0.84 0.00 0.00 57.88 58.13 3ktj h LEU 180 Cb 1.36 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 3ktj h LEU 180 CO 0.14 1.19 -0.24 -0.33 -0.34 0.00 0.00 178.44 178.86 3ktj h GLU 181 N 0.37 0.82 -0.04 1.25 5.08 -1.35 -3.03 114.58 117.69 3ktj h GLU 181 Ca -0.04 -0.39 -0.09 0.00 -1.00 0.00 0.00 59.36 57.84 3ktj h GLU 181 Cb 1.35 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 3ktj h GLU 181 CO 0.14 1.02 -0.41 -0.92 -1.00 0.00 0.00 179.01 177.83 3ktj h TYR 182 N 0.62 0.10 0.00 4.33 3.20 -1.32 -3.47 116.97 120.42 3ktj h TYR 182 Ca 0.08 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3ktj h TYR 182 Cb 0.81 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.06 3ktj h TYR 182 CO 0.06 0.49 0.00 0.41 -1.64 0.00 0.00 178.16 177.48 3ktj n GLY 183 N -0.28 1.32 0.09 1.82 0.00 -0.86 -4.66 105.19 102.64 3ktj n GLY 183 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 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 0.30 -8.71 0.99 3.38 -0.88 -3.37 115.31 107.02 3ktj h LEU 184 Ca 0.00 -0.33 -0.57 0.00 0.09 0.00 0.00 57.88 57.06 3ktj h LEU 184 Cb 0.00 -0.10 -0.21 0.00 0.09 0.00 0.00 40.66 40.44 3ktj h LEU 184 CO 0.00 1.27 -0.83 0.27 0.09 0.00 0.00 178.44 179.24 3ktj s ILE 185 N -2.66 1.79 -0.02 1.22 -4.36 -1.16 -4.12 121.20 111.89 3ktj s ILE 185 Ca -0.03 -1.60 0.11 0.00 -0.26 0.00 0.00 60.65 58.87 3ktj s ILE 185 Cb 0.08 -1.63 -0.23 0.00 1.25 0.00 0.00 42.46 41.93 3ktj s ILE 185 CO 0.86 -0.06 0.75 0.44 0.24 0.00 0.00 174.94 177.16 3ktj h ASP 186 N 3.98 0.01 -3.47 4.36 3.32 -0.08 -3.41 116.42 121.14 3ktj h ASP 186 Ca -0.46 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.53 3ktj h ASP 186 Cb 1.18 -0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.51 3ktj h ASP 186 CO 0.40 1.03 0.00 -0.75 -1.72 0.00 0.00 179.24 178.20 3ktj s LYS 187 N -2.61 0.70 -0.39 3.56 2.20 -0.52 -4.96 119.74 117.73 3ktj s LYS 187 Ca -0.04 1.04 -0.22 0.00 -0.36 0.00 0.00 55.97 56.38 3ktj s LYS 187 Cb 0.08 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.64 3ktj s LYS 187 CO 0.82 -0.12 0.75 0.42 -0.36 0.00 0.00 175.35 176.86 3ktj s ILE 188 N 1.02 4.75 -0.04 5.43 1.01 -1.26 -2.91 121.20 129.21 3ktj s ILE 188 Ca -0.05 0.67 -0.30 0.00 0.00 0.00 0.00 60.65 60.97 3ktj s ILE 188 Cb -0.05 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 38.15 3ktj s ILE 188 CO -0.10 -0.49 1.59 -0.76 0.00 0.00 0.00 174.94 175.18 3ktj s LEU 189 N 3.05 4.32 0.00 2.97 1.43 -0.91 -4.96 118.68 124.58 3ktj s LEU 189 Ca 0.29 2.21 0.02 0.00 -1.03 0.00 0.00 54.13 55.62 3ktj s LEU 189 Cb -0.13 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.57 3ktj s LEU 189 CO 0.18 -0.88 0.20 0.41 0.23 0.00 0.00 176.35 176.49 3ktj n THR 190 N 5.24 0.00 1.77 5.49 -1.04 -1.26 -4.07 114.28 120.41 3ktj n THR 190 Ca 0.16 -0.62 0.14 0.00 -2.04 0.00 0.00 64.05 61.69 3ktj n THR 190 Cb 0.43 -0.65 0.84 0.00 -1.82 0.00 0.00 70.33 69.13 3ktj n THR 190 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43