#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kku s LYS 6 N 0.00 1.50 0.09 5.31 1.02 -1.26 -5.00 119.74 121.40 1kku s LYS 6 Ca 0.00 0.97 -0.22 0.00 0.02 0.00 0.00 55.97 56.74 1kku s LYS 6 Cb 0.00 -1.83 -0.07 0.00 -0.52 0.00 0.00 37.83 35.42 1kku s LYS 6 CO 0.00 -2.11 0.65 0.99 -0.92 0.00 0.00 175.35 173.95 1kku s THR 7 N -2.90 4.63 -0.09 2.17 2.01 -0.25 -4.79 115.64 116.43 1kku s THR 7 Ca 0.63 1.40 -0.24 0.00 0.31 0.00 0.00 61.69 63.78 1kku s THR 7 Cb -0.18 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 1kku s THR 7 CO 0.57 0.52 0.76 -1.61 -0.69 0.00 0.00 174.62 174.17 1kku s GLU 8 N -0.99 4.41 0.01 4.92 2.02 -1.26 -0.34 118.70 127.47 1kku s GLU 8 Ca 0.32 0.96 0.06 0.00 0.02 0.00 0.00 54.97 56.33 1kku s GLU 8 Cb -0.21 -3.48 -0.02 0.00 0.10 0.00 0.00 34.13 30.52 1kku s GLU 8 CO 0.21 -0.04 -0.20 0.08 0.02 0.00 0.00 175.26 175.34 1kku s VAL 9 N 1.15 1.55 -0.10 2.63 1.01 -0.65 -1.03 120.40 124.96 1kku s VAL 9 Ca 0.39 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 1kku s VAL 9 Cb -0.18 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1kku s VAL 9 CO 0.18 0.32 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 1kku s VAL 10 N -0.61 3.67 -0.28 2.92 1.01 0.45 -0.65 120.40 126.90 1kku s VAL 10 Ca 0.07 -0.47 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 1kku s VAL 10 Cb -0.08 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1kku s VAL 10 CO 0.00 0.56 0.23 -0.76 0.00 0.00 0.00 175.10 175.14 1kku s LEU 11 N -0.39 4.06 -0.20 3.92 1.43 -0.47 -0.56 118.68 126.48 1kku s LEU 11 Ca 0.06 0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.16 1kku s LEU 11 Cb -0.12 -2.19 0.01 0.00 0.03 0.00 0.00 46.19 43.92 1kku s LEU 11 CO 0.02 -0.09 -0.12 -0.22 0.23 0.00 0.00 176.35 176.16 1kku s LEU 12 N 1.82 2.53 -0.28 1.79 2.96 -0.67 0.63 118.68 127.47 1kku s LEU 12 Ca 0.09 -0.57 -0.03 0.00 -0.22 0.00 0.00 54.13 53.40 1kku s LEU 12 Cb -0.16 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 44.96 1kku s LEU 12 CO 0.11 -0.02 -0.01 0.00 -1.32 0.00 0.00 176.35 175.11 1kku s ALA 13 N 1.37 2.82 0.65 5.97 0.00 0.55 -1.63 121.76 131.49 1kku s ALA 13 Ca 0.05 -1.56 -0.06 0.00 0.00 0.00 0.00 51.96 50.39 1kku s ALA 13 Cb -0.14 -1.88 0.04 0.00 0.00 0.00 0.00 23.12 21.14 1kku s ALA 13 CO -0.08 -0.99 0.96 0.00 0.00 0.00 0.00 175.76 175.65 1kku n GLY 15 N -2.77 -0.12 0.08 0.00 0.00 -1.24 -4.92 105.19 96.22 1kku n GLY 15 Ca 0.07 -1.71 0.03 0.00 0.00 0.00 0.00 46.02 44.40 1kku n GLY 15 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kku n SER 16 N 3.00 0.47 -3.96 1.61 7.64 -1.26 -0.19 113.62 120.93 1kku n SER 16 Ca 0.00 0.20 -0.41 0.00 1.01 0.00 0.00 58.87 59.67 1kku n SER 16 Cb 0.00 0.84 0.02 0.00 -1.01 0.00 0.00 64.21 64.06 1kku n SER 16 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1kku n PHE 17 N -2.67 -1.58 -3.38 1.43 3.01 -1.26 -4.62 117.46 108.39 1kku n PHE 17 Ca -0.11 0.23 -0.27 0.00 1.01 0.00 0.00 57.45 58.31 1kku n PHE 17 Cb 0.78 -2.93 -0.08 0.00 -0.01 0.00 0.00 39.48 37.25 1kku n PHE 17 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1kku n ASN 18 N -2.29 3.20 -4.35 4.37 5.15 -1.26 -3.24 115.26 116.84 1kku n ASN 18 Ca -0.13 -3.33 -0.21 0.00 -0.60 0.00 0.00 54.58 50.31 1kku n ASN 18 Cb 0.58 -0.66 0.11 0.00 -0.53 0.00 0.00 39.78 39.28 1kku n ASN 18 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1kku n PRO 19 N 0.93 -0.06 -2.39 1.20 -0.02 -1.26 -4.73 135.00 128.66 1kku n PRO 19 Ca 0.29 -2.51 -0.35 0.00 -2.02 0.00 0.00 63.50 58.91 1kku n PRO 19 Cb 0.43 -0.62 -0.01 0.00 -0.02 0.00 0.00 33.50 33.28 1kku n PRO 19 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1kku s ILE 20 N -2.84 3.47 0.30 4.25 2.07 -1.20 -4.61 121.20 122.64 1kku s ILE 20 Ca 0.61 0.91 0.06 0.00 -1.41 0.00 0.00 60.65 60.82 1kku s ILE 20 Cb -0.03 -3.36 -0.02 0.00 0.13 0.00 0.00 42.46 39.17 1kku s ILE 20 CO 0.41 -0.20 0.28 0.35 -1.91 0.00 0.00 174.94 173.86 1kku n THR 21 N -1.16 0.00 -0.03 4.00 -2.24 -1.26 -4.90 114.28 108.68 1kku n THR 21 Ca 0.10 -2.11 0.06 0.00 -2.27 0.00 0.00 64.05 59.83 1kku n THR 21 Cb 0.52 1.08 0.44 0.00 -2.10 0.00 0.00 70.33 70.26 1kku n THR 21 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1kku h ASN 22 N 1.83 0.46 -0.50 3.42 2.35 -1.26 -2.45 115.58 119.44 1kku h ASN 22 Ca -0.22 -0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.58 1kku h ASN 22 Cb 1.08 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 39.29 1kku h ASN 22 CO 0.31 0.32 0.24 -0.03 -1.65 0.00 0.00 177.43 176.62 1kku h MET 23 N 0.54 0.45 -0.53 0.81 1.85 -1.80 0.12 114.93 116.36 1kku h MET 23 Ca 0.19 -0.03 -0.05 0.00 -0.61 0.00 0.00 59.70 59.21 1kku h MET 23 Cb 0.09 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.00 1kku h MET 23 CO -0.05 0.30 0.13 0.45 -0.40 0.00 0.00 176.91 177.34 1kku h HIS 24 N 0.46 0.84 -0.49 1.39 3.86 -1.75 -1.42 115.15 118.03 1kku h HIS 24 Ca 0.22 -0.07 -0.09 0.00 -1.16 0.00 0.00 60.37 59.27 1kku h HIS 24 Cb 0.16 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 1kku h HIS 24 CO -0.11 0.70 -0.06 -0.07 0.86 0.00 0.00 177.93 179.24 1kku h LEU 25 N 0.79 0.91 -0.60 2.43 3.38 -1.39 -3.02 115.31 117.80 1kku h LEU 25 Ca 0.17 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1kku h LEU 25 Cb 0.28 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1kku h LEU 25 CO -0.00 1.03 0.27 -0.09 0.09 0.00 0.00 178.44 179.74 1kku h ARG 26 N 0.77 0.87 -0.88 1.13 9.65 -0.35 -2.65 114.38 122.92 1kku h ARG 26 Ca 0.13 -0.14 0.18 0.00 -1.10 0.00 0.00 59.98 59.05 1kku h ARG 26 Cb 0.60 -0.15 -0.11 0.00 -1.39 0.00 0.00 29.97 28.92 1kku h ARG 26 CO 0.04 0.72 0.44 -0.07 2.80 0.00 0.00 179.97 183.89 1kku h LEU 27 N 0.82 0.47 -0.09 3.80 3.38 -1.14 0.01 115.31 122.56 1kku h LEU 27 Ca 0.20 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 1kku h LEU 27 Cb 0.15 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1kku h LEU 27 CO -0.02 0.14 0.05 -0.26 0.09 0.00 0.00 178.44 178.43 1kku h PHE 28 N 0.54 0.13 -0.57 1.13 -1.00 -1.43 -1.35 116.94 114.39 1kku h PHE 28 Ca 0.51 -0.00 -0.05 0.00 2.81 0.00 0.00 57.97 61.23 1kku h PHE 28 Cb 0.85 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.34 1kku h PHE 28 CO -0.10 0.18 0.14 0.93 -1.61 0.00 0.00 178.31 177.85 1kku h GLU 29 N 0.04 0.91 -0.46 1.51 4.39 -1.34 -1.19 114.58 118.44 1kku h GLU 29 Ca 0.03 -0.22 0.07 0.00 0.34 0.00 0.00 59.36 59.59 1kku h GLU 29 Cb 0.10 -0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 28.57 1kku h GLU 29 CO -0.00 0.84 0.09 1.25 -1.16 0.00 0.00 179.01 180.03 1kku h LEU 30 N 0.81 0.00 -0.24 1.33 5.85 -0.98 -1.10 115.31 120.98 1kku h LEU 30 Ca 0.18 0.08 -0.21 0.00 0.84 0.00 0.00 57.88 58.77 1kku h LEU 30 Cb 0.34 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1kku h LEU 30 CO 0.00 0.03 -0.90 0.00 -0.34 0.00 0.00 178.44 177.23 1kku h ALA 31 N 1.35 0.47 -0.21 1.25 0.00 -0.30 -1.94 119.26 119.89 1kku h ALA 31 Ca 0.22 -0.73 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 1kku h ALA 31 Cb 0.29 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1kku h ALA 31 CO -0.30 0.91 -0.23 -0.22 0.00 0.00 0.00 179.25 179.41 1kku h LYS 32 N 0.12 0.52 -1.00 0.00 3.64 -1.11 0.51 116.57 119.26 1kku h LYS 32 Ca -0.05 -0.29 0.15 0.00 -1.27 0.00 0.00 60.65 59.19 1kku h LYS 32 Cb 1.54 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.28 1kku h LYS 32 CO 0.14 0.87 0.62 -0.44 -2.27 0.00 0.00 179.45 178.38 1kku h ASP 33 N 0.20 0.86 0.19 4.20 5.19 -0.91 -0.71 116.42 125.44 1kku h ASP 33 Ca 0.03 0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1kku h ASP 33 Cb 0.79 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.20 1kku h ASP 33 CO 0.06 0.40 -0.09 0.22 -3.12 0.00 0.00 179.24 176.71 1kku h TYR 34 N 0.89 -0.24 -0.22 4.55 3.20 -0.94 -1.63 116.97 122.59 1kku h TYR 34 Ca 0.53 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.45 1kku h TYR 34 Cb 0.66 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.94 1kku h TYR 34 CO -0.00 0.15 -0.21 0.52 -1.64 0.00 0.00 178.16 176.98 1kku h MET 35 N -0.91 -0.21 0.00 1.82 2.86 -0.78 -0.65 114.93 117.06 1kku h MET 35 Ca -0.03 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1kku h MET 35 Cb 0.50 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 1kku h MET 35 CO 0.04 -0.14 -0.08 -0.91 1.06 0.00 0.00 176.91 176.88 1kku h ASN 36 N -0.22 0.00 -0.02 1.22 2.35 -1.13 -1.07 115.58 116.71 1kku h ASN 36 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1kku h ASN 36 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1kku h ASN 36 CO -0.35 0.08 0.00 0.61 -1.65 0.00 0.00 177.43 176.12 1kku n GLY 37 N -0.91 -0.35 0.18 2.83 0.00 -0.30 -3.36 105.19 103.28 1kku n GLY 37 Ca -0.02 -0.35 0.01 0.00 0.00 0.00 0.00 46.02 45.65 1kku n GLY 37 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1kku h THR 38 N 1.49 1.30 0.00 2.61 1.35 -0.64 -3.46 112.91 115.56 1kku h THR 38 Ca 0.00 -1.45 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 1kku h THR 38 Cb 0.32 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1kku h THR 38 CO 0.00 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 1kku n GLY 39 N -0.30 2.11 0.00 5.82 0.00 -1.21 -4.86 105.19 106.75 1kku n GLY 39 Ca -0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1kku n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kku n ARG 40 N -2.00 0.26 -4.23 1.61 1.74 -1.26 -4.81 116.66 107.96 1kku n ARG 40 Ca 0.00 -0.06 -0.13 0.00 -0.77 0.00 0.00 57.85 56.89 1kku n ARG 40 Cb 0.00 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.84 1kku n ARG 40 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1kku s TYR 41 N -3.14 1.22 -0.04 -1.55 1.51 -1.26 -1.09 117.35 113.00 1kku s TYR 41 Ca 0.03 -1.19 -0.01 0.00 -1.01 0.00 0.00 57.07 54.89 1kku s TYR 41 Cb 0.15 -0.68 0.03 0.00 -0.11 0.00 0.00 41.96 41.35 1kku s TYR 41 CO 0.87 -0.40 0.04 0.99 -1.11 0.00 0.00 175.55 175.95 1kku s THR 42 N -3.87 -0.02 -0.05 -0.71 2.01 0.54 -4.30 115.64 109.23 1kku s THR 42 Ca 0.31 0.34 -0.21 0.00 0.31 0.00 0.00 61.69 62.44 1kku s THR 42 Cb 0.07 -0.20 -0.04 0.00 0.01 0.00 0.00 72.50 72.34 1kku s THR 42 CO 0.08 0.18 0.61 -0.69 -0.69 0.00 0.00 174.62 174.11 1kku s VAL 43 N 1.92 5.02 -0.02 3.82 1.01 -1.26 -1.64 120.40 129.24 1kku s VAL 43 Ca 0.02 1.26 0.05 0.00 0.00 0.00 0.00 61.98 63.31 1kku s VAL 43 Cb -0.12 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.24 1kku s VAL 43 CO -0.03 0.34 0.07 0.52 0.00 0.00 0.00 175.10 176.00 1kku n VAL 44 N 3.32 0.14 -3.55 2.92 0.31 0.17 -4.90 118.33 116.73 1kku n VAL 44 Ca -0.05 -0.15 -0.14 0.00 -0.01 0.00 0.00 64.34 63.99 1kku n VAL 44 Cb 0.51 -0.14 -0.06 0.00 -0.91 0.00 0.00 33.84 33.25 1kku n VAL 44 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1kku s LYS 45 N -2.26 0.80 0.22 5.55 2.20 -1.25 -5.02 119.74 119.98 1kku s LYS 45 Ca -0.02 0.23 0.11 0.00 -0.36 0.00 0.00 55.97 55.93 1kku s LYS 45 Cb 0.03 0.38 -0.05 0.00 -1.51 0.00 0.00 37.83 36.68 1kku s LYS 45 CO 0.21 -0.24 -0.20 0.20 -0.36 0.00 0.00 175.35 174.96 1kku s GLY 46 N -1.07 1.75 -0.04 5.54 0.00 -0.20 -1.36 107.32 111.95 1kku s GLY 46 Ca -0.06 -1.67 -0.01 0.00 0.00 0.00 0.00 44.72 42.98 1kku s GLY 46 CO 0.05 -1.72 0.03 -0.42 0.00 0.00 0.00 173.10 171.05 1kku s ILE 47 N -1.91 0.03 -0.11 0.90 1.01 0.20 -1.10 121.20 120.23 1kku s ILE 47 Ca 0.24 0.25 -0.12 0.00 0.00 0.00 0.00 60.65 61.02 1kku s ILE 47 Cb -0.07 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.14 1kku s ILE 47 CO 0.12 0.16 0.28 -0.63 0.00 0.00 0.00 174.94 174.87 1kku s ILE 48 N 1.57 5.29 -0.32 2.92 1.01 -0.06 -0.33 121.20 131.26 1kku s ILE 48 Ca -0.02 0.53 -0.02 0.00 0.00 0.00 0.00 60.65 61.14 1kku s ILE 48 Cb -0.13 -3.59 0.12 0.00 0.01 0.00 0.00 42.46 38.88 1kku s ILE 48 CO -0.03 0.50 0.18 -0.55 0.00 0.00 0.00 174.94 175.04 1kku s SER 49 N -0.32 3.21 0.58 3.58 0.15 -0.09 -2.50 113.70 118.31 1kku s SER 49 Ca 0.18 -1.80 -0.19 0.00 0.70 0.00 0.00 55.95 54.84 1kku s SER 49 Cb -0.14 -0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 63.76 1kku s SER 49 CO 0.06 -0.37 1.18 -2.84 1.20 0.00 0.00 173.24 172.48 1kku s PRO 50 N 1.51 3.07 0.88 5.44 0.02 -1.26 -3.70 135.00 140.96 1kku s PRO 50 Ca 0.14 1.74 -0.12 0.00 0.02 0.00 0.00 61.00 62.79 1kku s PRO 50 Cb -0.20 -1.95 0.12 0.00 0.02 0.00 0.00 34.50 32.48 1kku s PRO 50 CO -0.15 -1.11 1.10 0.54 -0.33 0.00 0.00 177.00 177.05 1kku s VAL 51 N -1.69 2.67 0.33 3.83 0.11 0.73 -3.72 120.40 122.67 1kku s VAL 51 Ca 0.76 0.22 0.05 0.00 -2.93 0.00 0.00 61.98 60.07 1kku s VAL 51 Cb -0.28 -2.80 0.06 0.00 -1.53 0.00 0.00 36.38 31.83 1kku s VAL 51 CO 0.32 -0.29 0.46 0.61 -3.33 0.00 0.00 175.10 172.87 1kku n GLY 52 N -1.50 1.80 0.02 6.54 0.00 -1.26 -4.65 105.19 106.15 1kku n GLY 52 Ca 0.07 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 44.06 1kku n GLY 52 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1kku n ASP 53 N -2.67 0.30 0.18 1.61 8.00 -1.26 -3.34 116.55 119.38 1kku n ASP 53 Ca 0.09 0.34 0.02 0.00 0.71 0.00 0.00 54.79 55.96 1kku n ASP 53 Cb 0.33 -0.36 0.36 0.00 -0.02 0.00 0.00 41.12 41.44 1kku n ASP 53 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1kku h ALA 54 N 2.87 1.40 -1.81 2.24 0.00 -1.86 -3.37 119.26 118.72 1kku h ALA 54 Ca 0.00 -0.33 -0.57 0.00 0.00 0.00 0.00 54.91 54.01 1kku h ALA 54 Cb 0.56 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1kku h ALA 54 CO 0.00 0.45 1.17 -0.47 0.00 0.00 0.00 179.25 180.40 1kku s TYR 55 N -4.23 2.11 -1.02 0.00 5.04 -1.21 -4.83 117.35 113.21 1kku s TYR 55 Ca -0.03 0.64 -0.11 0.00 -2.44 0.00 0.00 57.07 55.13 1kku s TYR 55 Cb 0.14 -4.23 0.25 0.00 0.35 0.00 0.00 41.96 38.47 1kku s TYR 55 CO 0.73 -2.43 1.01 0.15 -1.34 0.00 0.00 175.55 173.67 1kku s LYS 56 N 5.33 3.98 0.22 4.97 1.02 -1.26 -4.93 119.74 129.07 1kku s LYS 56 Ca 0.69 -2.89 0.04 0.00 0.02 0.00 0.00 55.97 53.83 1kku s LYS 56 Cb -0.17 -4.55 -0.03 0.00 -0.52 0.00 0.00 37.83 32.55 1kku s LYS 56 CO 0.33 -1.30 0.36 0.21 -0.92 0.00 0.00 175.35 174.02 1kku s LYS 57 N -0.53 3.45 0.26 1.68 2.20 -1.26 -5.08 119.74 120.46 1kku s LYS 57 Ca 0.27 -0.66 -0.29 0.00 -0.36 0.00 0.00 55.97 54.93 1kku s LYS 57 Cb -0.09 -2.89 -0.09 0.00 -1.51 0.00 0.00 37.83 33.25 1kku s LYS 57 CO -0.08 0.43 0.97 0.21 -0.36 0.00 0.00 175.35 176.51 1kku s LYS 58 N -3.78 4.77 0.00 4.03 2.20 -1.26 -3.01 119.74 122.69 1kku s LYS 58 Ca 0.35 1.51 0.00 0.00 -0.36 0.00 0.00 55.97 57.47 1kku s LYS 58 Cb -0.10 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1kku s LYS 58 CO 0.29 0.42 0.00 0.41 -0.36 0.00 0.00 175.35 176.12 1kku n GLY 59 N 1.28 2.90 3.62 5.54 0.00 -1.26 -4.99 105.19 112.28 1kku n GLY 59 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1kku n GLY 59 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1kku s LEU 60 N 0.00 3.79 0.63 0.99 2.96 -1.16 -5.01 118.68 120.88 1kku s LEU 60 Ca 0.00 0.87 -0.08 0.00 -0.22 0.00 0.00 54.13 54.70 1kku s LEU 60 Cb 0.00 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.16 1kku s LEU 60 CO 0.00 -1.10 0.97 0.27 -1.32 0.00 0.00 176.35 175.17 1kku s ILE 61 N 4.23 3.52 0.17 6.68 -4.36 -1.26 -4.88 121.20 125.31 1kku s ILE 61 Ca 0.50 0.14 -0.33 0.00 -0.26 0.00 0.00 60.65 60.70 1kku s ILE 61 Cb -0.12 -3.44 -0.15 0.00 1.25 0.00 0.00 42.46 40.01 1kku s ILE 61 CO 0.24 -0.49 1.32 -2.65 0.24 0.00 0.00 174.94 173.60 1kku n PRO 62 N -2.74 1.52 -0.46 0.37 -0.02 -1.26 -4.82 135.00 127.58 1kku n PRO 62 Ca 0.05 0.54 0.39 0.00 -2.02 0.00 0.00 63.50 62.47 1kku n PRO 62 Cb 0.58 -2.15 0.65 0.00 -0.02 0.00 0.00 33.50 32.55 1kku n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1kku n ALA 63 N 2.09 1.32 0.06 3.55 0.00 -1.26 -2.00 120.51 124.26 1kku n ALA 63 Ca 0.15 0.80 -0.08 0.00 0.00 0.00 0.00 53.44 54.31 1kku n ALA 63 Cb 0.26 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 18.77 1kku n ALA 63 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1kku h TYR 64 N 0.00 0.48 -0.66 0.00 -0.00 -1.97 0.53 116.97 115.35 1kku h TYR 64 Ca 0.83 -0.20 -0.06 0.00 -0.00 0.00 0.00 58.73 59.30 1kku h TYR 64 Cb 2.73 -0.08 -0.03 0.00 -0.00 0.00 0.00 36.73 39.36 1kku h TYR 64 CO -0.01 0.92 0.17 0.45 -0.00 0.00 0.00 178.16 179.70 1kku h HIS 65 N 0.26 1.10 -0.04 0.10 3.86 -1.75 -1.16 115.15 117.51 1kku h HIS 65 Ca -0.02 -0.13 -0.20 0.00 -1.16 0.00 0.00 60.37 58.86 1kku h HIS 65 Cb 1.22 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 29.37 1kku h HIS 65 CO 0.04 0.90 -0.83 0.00 0.86 0.00 0.00 177.93 178.90 1kku h ARG 66 N 0.97 0.41 -0.07 2.45 3.08 -0.95 -1.91 114.38 118.36 1kku h ARG 66 Ca 0.21 -0.38 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 1kku h ARG 66 Cb 0.35 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1kku h ARG 66 CO 0.00 1.03 0.04 0.28 -1.07 0.00 0.00 179.97 180.26 1kku h VAL 67 N 0.25 1.05 0.05 2.04 2.07 -0.01 -1.87 116.25 119.84 1kku h VAL 67 Ca -0.05 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.35 1kku h VAL 67 Cb 1.43 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 1kku h VAL 67 CO 0.14 0.05 -0.45 0.40 0.02 0.00 0.00 177.57 177.73 1kku h ILE 68 N 0.06 0.11 -0.50 4.57 1.08 -0.94 -0.06 117.51 121.83 1kku h ILE 68 Ca 0.03 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1kku h ILE 68 Cb 0.04 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 33.87 1kku h ILE 68 CO -0.00 0.00 0.29 0.24 -0.69 0.00 0.00 178.15 177.99 1kku h MET 69 N -0.64 0.68 -0.18 2.37 2.86 -1.31 1.27 114.93 119.98 1kku h MET 69 Ca 0.03 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1kku h MET 69 Cb 0.69 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 1kku h MET 69 CO -0.30 0.48 -0.29 0.00 1.06 0.00 0.00 176.91 177.86 1kku h ALA 70 N 1.63 1.18 -0.07 6.32 0.00 -0.73 0.14 119.26 127.73 1kku h ALA 70 Ca 0.18 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 1kku h ALA 70 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1kku h ALA 70 CO -0.03 0.53 -0.69 0.93 0.00 0.00 0.00 179.25 179.99 1kku h GLU 71 N 0.30 0.34 -0.29 0.00 5.08 0.32 -2.37 114.58 117.97 1kku h GLU 71 Ca 0.04 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 1kku h GLU 71 Cb 0.67 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1kku h GLU 71 CO 0.05 0.91 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.79 1kku h LEU 72 N 0.24 0.47 -0.86 1.33 3.38 0.51 -2.32 115.31 118.05 1kku h LEU 72 Ca -0.02 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 1kku h LEU 72 Cb 1.25 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1kku h LEU 72 CO 0.11 0.61 -0.50 0.00 0.09 0.00 0.00 178.44 178.76 1kku h ALA 73 N 1.44 1.04 -0.52 1.53 0.00 -0.53 -3.16 119.26 119.07 1kku h ALA 73 Ca 0.09 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1kku h ALA 73 Cb 0.46 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1kku h ALA 73 CO 0.03 0.65 0.00 0.25 0.00 0.00 0.00 179.25 180.17 1kku n THR 74 N -3.95 1.58 0.24 0.00 -2.24 -0.93 -4.77 114.28 104.21 1kku n THR 74 Ca -0.02 -1.23 0.14 0.00 -2.27 0.00 0.00 64.05 60.67 1kku n THR 74 Cb 0.53 0.21 0.79 0.00 -2.10 0.00 0.00 70.33 69.77 1kku n THR 74 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1kku h LYS 75 N 3.19 0.00 -0.02 -0.78 2.10 -1.39 -2.25 116.57 117.42 1kku h LYS 75 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1kku h LYS 75 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1kku h LYS 75 CO 0.14 0.00 -0.20 0.09 -2.00 0.00 0.00 179.45 177.48 1kku n ASN 76 N -4.09 2.19 -4.72 7.07 3.02 -1.26 -4.95 115.26 112.51 1kku n ASN 76 Ca -0.01 -1.59 -0.41 0.00 -0.03 0.00 0.00 54.58 52.53 1kku n ASN 76 Cb 0.18 0.24 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 1kku n ASN 76 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1kku s SER 77 N -1.86 7.38 0.49 6.41 0.15 -0.85 -4.92 113.70 120.51 1kku s SER 77 Ca 0.19 1.82 0.25 0.00 0.70 0.00 0.00 55.95 58.91 1kku s SER 77 Cb 0.15 -2.58 1.29 0.00 -1.71 0.00 0.00 66.02 63.17 1kku s SER 77 CO 0.35 -0.19 2.02 0.11 1.20 0.00 0.00 173.24 176.74 1kku h LYS 78 N 5.98 0.00 0.00 5.44 6.56 -1.92 -3.39 116.57 129.23 1kku h LYS 78 Ca -0.42 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.17 1kku h LYS 78 Cb 1.21 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.87 1kku h LYS 78 CO 0.74 0.16 -0.47 -2.67 -2.06 0.00 0.00 179.45 175.14 1kku n TRP 79 N -3.72 0.00 -3.97 -1.35 4.27 -1.26 -5.05 117.44 106.36 1kku n TRP 79 Ca -0.02 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.23 1kku n TRP 79 Cb 0.27 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.15 1kku n TRP 79 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 1kku s VAL 80 N -0.98 5.19 0.16 -1.67 1.01 -1.26 -1.03 120.40 121.82 1kku s VAL 80 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1kku s VAL 80 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1kku s VAL 80 CO 0.00 0.58 0.07 -1.61 0.00 0.00 0.00 175.10 174.14 1kku s GLU 81 N -0.70 1.06 -0.14 2.72 2.02 -0.26 -4.81 118.70 118.58 1kku s GLU 81 Ca 0.13 -1.53 -0.03 0.00 0.02 0.00 0.00 54.97 53.56 1kku s GLU 81 Cb -0.12 0.12 -0.03 0.00 0.10 0.00 0.00 34.13 34.21 1kku s GLU 81 CO 0.03 -0.27 -0.06 0.08 0.02 0.00 0.00 175.26 175.06 1kku s VAL 82 N -3.99 3.72 -0.10 2.63 1.01 -1.26 -0.88 120.40 121.53 1kku s VAL 82 Ca 0.29 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1kku s VAL 82 Cb 0.07 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 1kku s VAL 82 CO 0.05 0.51 -0.23 -0.62 0.00 0.00 0.00 175.10 174.81 1kku s ASP 83 N 0.27 3.20 0.00 3.32 2.15 -1.04 -4.99 116.67 119.58 1kku s ASP 83 Ca -0.04 -0.52 0.18 0.00 0.43 0.00 0.00 52.55 52.59 1kku s ASP 83 Cb -0.14 -1.35 0.13 0.00 -0.30 0.00 0.00 42.92 41.25 1kku s ASP 83 CO 0.03 0.17 1.05 0.35 -0.17 0.00 0.00 175.17 176.61 1kku n THR 84 N 3.43 0.00 -0.06 1.71 -2.24 -1.26 -4.44 114.28 111.42 1kku n THR 84 Ca -0.19 -0.48 -0.07 0.00 -2.27 0.00 0.00 64.05 61.05 1kku n THR 84 Cb 0.53 1.36 -0.05 0.00 -2.10 0.00 0.00 70.33 70.07 1kku n THR 84 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1kku h TRP 85 N 3.37 -0.84 -0.51 4.78 7.01 -1.95 -0.81 115.95 126.99 1kku h TRP 85 Ca 0.00 0.04 0.05 0.00 2.11 0.00 0.00 58.89 61.09 1kku h TRP 85 Cb 0.74 0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 28.16 1kku h TRP 85 CO 0.00 -0.25 0.34 1.49 -2.79 0.00 0.00 178.44 177.23 1kku h GLU 86 N -0.22 0.50 0.00 2.65 4.81 -1.86 0.26 114.58 120.72 1kku h GLU 86 Ca 0.03 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1kku h GLU 86 Cb 0.30 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1kku h GLU 86 CO -0.28 0.33 -0.10 0.66 -0.73 0.00 0.00 179.01 178.89 1kku h SER 87 N 0.51 0.00 0.91 1.04 4.64 -1.28 -3.08 113.55 116.29 1kku h SER 87 Ca 0.22 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.32 1kku h SER 87 Cb 0.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 1kku h SER 87 CO -0.06 0.10 -1.15 -0.07 -0.87 0.00 0.00 176.83 174.79 1kku h LEU 88 N 0.00 0.00-10.09 5.97 3.38 0.69 -3.39 115.31 111.86 1kku h LEU 88 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 1kku h LEU 88 Cb 0.31 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.19 1kku h LEU 88 CO 0.01 0.90 0.50 -1.10 0.09 0.00 0.00 178.44 178.85 1kku s GLN 89 N -2.73 2.85 0.06 1.13 -1.52 -1.16 -4.92 119.66 113.36 1kku s GLN 89 Ca -0.00 1.96 0.04 0.00 -1.95 0.00 0.00 55.36 55.41 1kku s GLN 89 Cb 0.09 -1.94 -0.24 0.00 -0.22 0.00 0.00 33.01 30.70 1kku s GLN 89 CO 0.81 -1.34 1.05 0.87 -0.25 0.00 0.00 175.29 176.44 1kku h LYS 90 N 0.85 0.10 -5.98 2.91 1.57 -1.92 -3.44 116.57 110.66 1kku h LYS 90 Ca -0.51 -0.17 -0.67 0.00 -1.87 0.00 0.00 60.65 57.43 1kku h LYS 90 Cb 1.31 0.06 -0.13 0.00 0.08 0.00 0.00 32.23 33.55 1kku h LYS 90 CO 0.55 0.97 -0.61 -1.21 -0.57 0.00 0.00 179.45 178.58 1kku s GLU 91 N -2.66 3.00 0.39 3.15 2.02 -1.26 -4.77 118.70 118.56 1kku s GLU 91 Ca -0.03 -0.43 -0.28 0.00 0.02 0.00 0.00 54.97 54.25 1kku s GLU 91 Cb 0.08 -2.81 -0.11 0.00 0.10 0.00 0.00 34.13 31.39 1kku s GLU 91 CO 0.84 0.69 1.49 1.87 0.02 0.00 0.00 175.26 180.17 1kku n TRP 92 N 1.88 3.00 -4.76 1.61 -0.00 -1.26 -4.99 117.44 112.92 1kku n TRP 92 Ca -0.17 0.44 -0.33 0.00 -0.00 0.00 0.00 57.50 57.44 1kku n TRP 92 Cb 0.53 -2.53 -0.12 0.00 -0.00 0.00 0.00 31.31 29.19 1kku n TRP 92 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1kku s LYS 93 N -2.15 2.60 0.33 5.87 -0.14 -1.26 -5.09 119.74 119.91 1kku s LYS 93 Ca 0.54 -0.64 -0.17 0.00 -1.36 0.00 0.00 55.97 54.34 1kku s LYS 93 Cb -0.47 -2.47 -0.09 0.00 -1.68 0.00 0.00 37.83 33.12 1kku s LYS 93 CO 0.63 0.64 0.78 -1.21 -0.76 0.00 0.00 175.35 175.43 1kku s GLU 94 N -0.80 4.09 0.45 1.68 2.02 -1.26 -4.89 118.70 119.99 1kku s GLU 94 Ca 0.12 0.79 0.17 0.00 0.02 0.00 0.00 54.97 56.08 1kku s GLU 94 Cb -0.11 -2.44 1.12 0.00 0.10 0.00 0.00 34.13 32.80 1kku s GLU 94 CO 0.01 0.15 1.94 1.15 0.02 0.00 0.00 175.26 178.53 1kku h THR 95 N 2.05 0.79 -0.23 3.63 2.02 -1.99 0.40 112.91 119.58 1kku h THR 95 Ca -0.48 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 66.52 1kku h THR 95 Cb 1.18 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1kku h THR 95 CO 0.65 0.06 -0.15 0.25 0.37 0.00 0.00 175.52 176.69 1kku h LEU 96 N 0.33 0.38 -0.13 2.58 5.85 -1.95 0.24 115.31 122.62 1kku h LEU 96 Ca 0.34 -0.10 -0.21 0.00 0.84 0.00 0.00 57.88 58.75 1kku h LEU 96 Cb 0.86 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.80 1kku h LEU 96 CO -0.09 0.56 -0.73 0.11 -0.34 0.00 0.00 178.44 177.95 1kku h LYS 97 N 0.37 0.72 -0.81 1.25 1.57 -0.63 -1.71 116.57 117.32 1kku h LYS 97 Ca 0.07 -0.60 0.04 0.00 -1.87 0.00 0.00 60.65 58.28 1kku h LYS 97 Cb 0.49 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.88 1kku h LYS 97 CO 0.03 1.21 0.51 0.28 -0.57 0.00 0.00 179.45 180.92 1kku h VAL 98 N 0.42 1.09 -0.58 0.50 2.07 -0.63 0.21 116.25 119.33 1kku h VAL 98 Ca -0.06 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.13 1kku h VAL 98 Cb 1.37 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 1kku h VAL 98 CO 0.15 0.18 0.38 -0.07 0.02 0.00 0.00 177.57 178.23 1kku h LEU 99 N 0.98 0.66 -0.36 2.57 3.38 -0.43 -1.40 115.31 120.70 1kku h LEU 99 Ca 0.33 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.19 1kku h LEU 99 Cb 0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1kku h LEU 99 CO -0.13 0.48 -0.15 -0.09 0.09 0.00 0.00 178.44 178.64 1kku h ARG 100 N 0.78 0.75 -0.41 1.13 2.43 -0.47 -1.02 114.38 117.57 1kku h ARG 100 Ca 0.21 -0.32 0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1kku h ARG 100 Cb -0.09 -0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.36 1kku h ARG 100 CO -0.05 0.93 -0.11 1.25 -1.51 0.00 0.00 179.97 180.48 1kku h HIS 101 N 0.54 -0.25 0.00 2.20 2.76 -0.32 -0.40 115.15 119.68 1kku h HIS 101 Ca 0.08 0.04 -0.15 0.00 -2.20 0.00 0.00 60.37 58.14 1kku h HIS 101 Cb 0.69 0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.80 1kku h HIS 101 CO 0.06 -0.19 -0.71 0.45 -1.30 0.00 0.00 177.93 176.24 1kku h HIS 102 N -0.02 0.00 -0.25 5.26 3.86 -0.91 -2.57 115.15 120.51 1kku h HIS 102 Ca 0.20 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.35 1kku h HIS 102 Cb 0.31 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 1kku h HIS 102 CO -0.37 0.71 -0.07 0.37 0.86 0.00 0.00 177.93 179.43 1kku h GLN 103 N 0.00 0.50 -0.15 2.45 5.75 -0.70 -3.02 115.11 119.93 1kku h GLN 103 Ca -0.01 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.28 1kku h GLN 103 Cb 1.28 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.79 1kku h GLN 103 CO 0.09 0.72 -0.00 0.93 -2.65 0.00 0.00 178.83 177.92 1kku h GLU 104 N 0.24 0.22 0.00 1.69 5.08 -1.03 -1.83 114.58 118.94 1kku h GLU 104 Ca 0.06 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1kku h GLU 104 Cb 0.54 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1kku h GLU 104 CO 0.03 0.24 -0.27 -0.22 -1.00 0.00 0.00 179.01 177.79 1kku h LYS 105 N 0.22 0.00 0.01 2.33 3.64 -1.34 -2.54 116.57 118.90 1kku h LYS 105 Ca 0.05 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.18 1kku h LYS 105 Cb 0.16 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 1kku h LYS 105 CO 0.00 0.27 -1.31 -0.07 -2.27 0.00 0.00 179.45 176.08 1kku h LEU 106 N 0.00 0.04 -1.05 5.20 4.07 -1.27 -3.13 115.31 119.16 1kku h LEU 106 Ca -0.00 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1kku h LEU 106 Cb 0.58 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.31 1kku h LEU 106 CO 0.04 1.05 0.00 -0.33 -1.08 0.00 0.00 178.44 178.12 1kku h GLU 107 N 0.01 0.00 0.00 1.13 5.08 -1.12 -2.72 114.58 116.96 1kku h GLU 107 Ca -0.13 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1kku h GLU 107 Cb 1.88 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.13 1kku h GLU 107 CO 0.12 0.00 -0.68 0.00 -1.00 0.00 0.00 179.01 177.45 1kku h ALA 108 N 2.09 0.69 0.00 3.43 0.00 -1.41 -3.10 119.26 120.96 1kku h ALA 108 Ca 0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 1kku h ALA 108 Cb 0.53 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1kku h ALA 108 CO 0.00 0.12 -0.28 0.43 0.00 0.00 0.00 179.25 179.52 1kku n SER 109 N -2.87 4.62 0.00 0.00 7.64 -1.02 -5.12 113.62 116.86 1kku n SER 109 Ca 0.01 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.52 1kku n SER 109 Cb 0.58 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 1kku n SER 109 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1kku n ASP 110 N 2.54 0.00 -3.15 6.43 5.68 -1.18 -5.08 116.55 121.79 1kku n ASP 110 Ca 0.37 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.70 1kku n ASP 110 Cb 0.80 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.78 1kku n ASP 110 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1kku s VAL 148 N 0.00 -0.96 0.31 2.12 1.01 -1.26 -4.82 120.40 116.79 1kku s VAL 148 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 61.98 61.70 1kku s VAL 148 Cb 0.00 -0.97 -0.09 0.00 0.00 0.00 0.00 36.38 35.31 1kku s VAL 148 CO 0.00 0.00 1.04 -2.84 0.00 0.00 0.00 175.10 173.30 1kku s PRO 149 N 2.85 4.55 -0.20 2.72 0.02 -1.26 -4.82 135.00 138.85 1kku s PRO 149 Ca 0.14 1.62 -0.13 0.00 0.02 0.00 0.00 61.00 62.65 1kku s PRO 149 Cb -0.11 -2.99 -0.05 0.00 0.02 0.00 0.00 34.50 31.37 1kku s PRO 149 CO -0.24 0.18 0.25 0.15 -0.33 0.00 0.00 177.00 177.01 1kku s LYS 150 N -1.74 4.17 0.45 5.54 1.02 -0.19 -4.84 119.74 124.14 1kku s LYS 150 Ca 0.48 -0.05 -0.21 0.00 0.02 0.00 0.00 55.97 56.20 1kku s LYS 150 Cb -0.27 -3.49 -0.09 0.00 -0.52 0.00 0.00 37.83 33.46 1kku s LYS 150 CO 0.34 0.13 1.02 0.54 -0.92 0.00 0.00 175.35 176.46 1kku s VAL 151 N 0.84 3.91 0.00 3.17 0.11 -1.26 -0.41 120.40 126.76 1kku s VAL 151 Ca 0.13 1.26 -0.00 0.00 -2.93 0.00 0.00 61.98 60.44 1kku s VAL 151 Cb -0.13 -3.55 -0.01 0.00 -1.53 0.00 0.00 36.38 31.16 1kku s VAL 151 CO 0.04 -0.18 -0.00 -0.54 -3.33 0.00 0.00 175.10 171.09 1kku s LYS 152 N -3.00 0.13 -0.08 1.54 1.02 0.28 -4.61 119.74 115.01 1kku s LYS 152 Ca 0.63 -0.21 -0.27 0.00 0.02 0.00 0.00 55.97 56.14 1kku s LYS 152 Cb -0.16 0.05 -0.02 0.00 -0.52 0.00 0.00 37.83 37.17 1kku s LYS 152 CO 0.20 -0.02 0.90 -1.17 -0.92 0.00 0.00 175.35 174.34 1kku s LEU 153 N -0.53 4.28 -0.26 3.17 2.96 -0.66 -1.66 118.68 125.98 1kku s LEU 153 Ca -0.06 1.42 -0.11 0.00 -0.22 0.00 0.00 54.13 55.16 1kku s LEU 153 Cb -0.04 -3.39 -0.05 0.00 0.50 0.00 0.00 46.19 43.21 1kku s LEU 153 CO -0.00 -0.31 0.17 -0.22 -1.32 0.00 0.00 176.35 174.67 1kku s LEU 154 N 1.49 4.04 0.00 -0.68 2.96 -0.65 -0.34 118.68 125.50 1kku s LEU 154 Ca 0.45 0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 54.36 1kku s LEU 154 Cb -0.19 -2.10 0.02 0.00 0.50 0.00 0.00 46.19 44.42 1kku s LEU 154 CO 0.20 0.01 0.51 0.00 -1.32 0.00 0.00 176.35 175.74 1kku n GLY 156 N -0.54 5.01 0.09 0.00 0.00 -1.26 -1.82 105.19 106.67 1kku n GLY 156 Ca -0.01 -2.11 -0.12 0.00 0.00 0.00 0.00 46.02 43.78 1kku n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kku h ALA 157 N 0.66 -0.11 0.00 4.61 0.00 -1.94 -2.40 119.26 120.09 1kku h ALA 157 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1kku h ALA 157 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1kku h ALA 157 CO 0.00 -0.29 0.00 -3.47 0.00 0.00 0.00 179.25 175.49 1kku n ASP 158 N -4.89 0.00 0.15 0.00 4.64 -1.26 0.22 116.55 115.41 1kku n ASP 158 Ca -0.08 0.00 -0.14 0.00 -1.38 0.00 0.00 54.79 53.19 1kku n ASP 158 Cb 0.27 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.28 1kku n ASP 158 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1kku h LEU 159 N 0.00 -0.86 -0.22 -2.67 7.12 -1.83 0.26 115.31 117.12 1kku h LEU 159 Ca 0.00 0.09 0.06 0.00 0.13 0.00 0.00 57.88 58.16 1kku h LEU 159 Cb 0.00 0.31 -0.07 0.00 -0.53 0.00 0.00 40.66 40.37 1kku h LEU 159 CO 0.00 -0.41 -0.28 -0.07 -0.13 0.00 0.00 178.44 177.54 1kku h LEU 160 N -0.58 -0.90 -0.74 2.25 3.38 0.26 0.55 115.31 119.53 1kku h LEU 160 Ca 0.01 0.15 0.17 0.00 0.09 0.00 0.00 57.88 58.29 1kku h LEU 160 Cb 0.57 0.41 -0.13 0.00 0.09 0.00 0.00 40.66 41.60 1kku h LEU 160 CO -0.13 -0.32 0.00 -0.08 0.09 0.00 0.00 178.44 178.01 1kku h GLU 161 N -0.31 0.10 -0.01 1.13 4.81 -0.30 0.30 114.58 120.30 1kku h GLU 161 Ca 0.12 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1kku h GLU 161 Cb 0.50 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 1kku h GLU 161 CO -0.39 0.07 -0.09 1.03 -0.73 0.00 0.00 179.01 178.89 1kku h SER 162 N 0.10 0.01 0.75 1.04 0.87 0.16 -2.11 113.55 114.37 1kku h SER 162 Ca 0.40 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 1kku h SER 162 Cb 0.69 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1kku h SER 162 CO -0.65 0.11 0.00 0.49 -0.53 0.00 0.00 176.83 176.25 1kku n PHE 163 N -4.42 0.76 0.19 2.24 0.99 0.09 -3.09 117.46 114.23 1kku n PHE 163 Ca -0.03 0.29 0.03 0.00 -0.00 0.00 0.00 57.45 57.75 1kku n PHE 163 Cb 0.17 -0.98 -0.04 0.00 -1.00 0.00 0.00 39.48 37.63 1kku n PHE 163 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1kku n ALA 164 N -1.76 2.63 -1.65 4.37 0.00 -0.80 -4.73 120.51 118.58 1kku n ALA 164 Ca 0.02 -0.18 -0.58 0.00 0.00 0.00 0.00 53.44 52.71 1kku n ALA 164 Cb 0.24 -0.24 -0.07 0.00 0.00 0.00 0.00 19.45 19.37 1kku n ALA 164 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1kku n VAL 165 N -1.38 0.11 -0.20 0.00 0.31 -1.18 -4.82 118.33 111.18 1kku n VAL 165 Ca 0.00 -0.02 -0.05 0.00 -0.01 0.00 0.00 64.34 64.26 1kku n VAL 165 Cb 0.13 -0.78 -0.05 0.00 -0.91 0.00 0.00 33.84 32.23 1kku n VAL 165 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1kku n PRO 166 N 3.64 -0.21 0.00 5.55 -0.04 -1.26 -1.78 135.00 140.90 1kku n PRO 166 Ca 0.24 1.05 0.09 0.00 -0.04 0.00 0.00 63.50 64.84 1kku n PRO 166 Cb 0.11 -1.56 0.06 0.00 -0.04 0.00 0.00 33.50 32.07 1kku n PRO 166 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1kku n ASN 167 N -4.14 2.30 -0.12 3.54 3.02 -1.26 -4.77 115.26 113.83 1kku n ASN 167 Ca 0.01 -1.65 -0.10 0.00 -0.03 0.00 0.00 54.58 52.81 1kku n ASN 167 Cb 0.13 0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 1kku n ASN 167 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1kku h LEU 168 N 3.13 0.57 -9.23 3.41 5.85 -1.70 -3.43 115.31 113.91 1kku h LEU 168 Ca 0.00 -0.26 -0.67 0.00 0.84 0.00 0.00 57.88 57.79 1kku h LEU 168 Cb 0.70 -0.15 -0.16 0.00 0.37 0.00 0.00 40.66 41.42 1kku h LEU 168 CO 0.00 0.69 -0.75 0.26 -0.34 0.00 0.00 178.44 178.30 1kku s TRP 169 N -5.17 2.71 -0.20 1.25 0.52 -1.26 -5.10 118.94 111.69 1kku s TRP 169 Ca -0.13 -0.17 -0.29 0.00 0.02 0.00 0.00 56.10 55.53 1kku s TRP 169 Cb 0.09 -1.42 0.00 0.00 -1.15 0.00 0.00 33.47 30.99 1kku s TRP 169 CO 0.77 0.41 1.02 0.15 0.02 0.00 0.00 176.95 179.32 1kku s LYS 170 N -2.16 4.30 0.46 4.98 1.02 -1.26 -4.94 119.74 122.13 1kku s LYS 170 Ca 0.21 1.34 0.27 0.00 0.02 0.00 0.00 55.97 57.80 1kku s LYS 170 Cb -0.11 -3.61 1.31 0.00 -0.52 0.00 0.00 37.83 34.90 1kku s LYS 170 CO 0.13 -0.54 1.77 0.66 -0.92 0.00 0.00 175.35 176.45 1kku h SER 171 N 7.37 0.25 0.91 2.83 4.64 -1.98 0.29 113.55 127.86 1kku h SER 171 Ca -0.22 0.05 -0.16 0.00 -0.47 0.00 0.00 61.79 60.99 1kku h SER 171 Cb 1.08 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 1kku h SER 171 CO 0.94 0.03 -0.75 -0.33 -0.87 0.00 0.00 176.83 175.85 1kku h GLU 172 N 0.21 0.00 -0.11 4.77 5.08 -1.98 -1.14 114.58 121.40 1kku h GLU 172 Ca 0.60 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.86 1kku h GLU 172 Cb 1.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.14 1kku h GLU 172 CO -0.19 0.75 -0.32 -0.44 -1.00 0.00 0.00 179.01 177.81 1kku h ASP 173 N 0.00 0.47 -0.82 1.42 5.19 -0.86 -1.10 116.42 120.73 1kku h ASP 173 Ca -0.01 -0.60 0.14 0.00 -0.62 0.00 0.00 57.03 55.95 1kku h ASP 173 Cb 1.40 -0.14 -0.06 0.00 0.18 0.00 0.00 39.33 40.72 1kku h ASP 173 CO 0.10 0.99 0.54 0.40 -3.12 0.00 0.00 179.24 178.14 1kku h ILE 174 N -0.01 0.82 -0.11 0.35 2.04 -1.28 -1.72 117.51 117.59 1kku h ILE 174 Ca -0.01 -0.19 -0.20 0.00 1.00 0.00 0.00 64.86 65.46 1kku h ILE 174 Cb 0.94 0.21 0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1kku h ILE 174 CO 0.07 0.10 -0.72 0.74 0.00 0.00 0.00 178.15 178.34 1kku h THR 175 N 0.56 1.31 -0.43 -0.27 2.02 -0.84 -1.61 112.91 113.65 1kku h THR 175 Ca 0.41 -1.97 -0.10 0.00 0.77 0.00 0.00 66.41 65.52 1kku h THR 175 Cb 0.77 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 1kku h THR 175 CO -0.16 0.61 -0.10 1.56 0.37 0.00 0.00 175.52 177.80 1kku h GLN 176 N 0.36 0.83 0.24 6.66 4.20 -0.39 0.66 115.11 127.67 1kku h GLN 176 Ca -0.06 -0.32 -0.00 0.00 0.06 0.00 0.00 58.65 58.33 1kku h GLN 176 Cb 1.36 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.08 1kku h GLN 176 CO 0.15 0.95 -0.17 0.82 -0.67 0.00 0.00 178.83 179.90 1kku h ILE 177 N 0.66 0.63 -0.22 2.54 2.04 -1.29 0.56 117.51 122.44 1kku h ILE 177 Ca 0.11 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.93 1kku h ILE 177 Cb 0.64 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1kku h ILE 177 CO 0.04 0.00 -0.01 1.62 0.00 0.00 0.00 178.15 179.80 1kku h VAL 178 N -0.41 1.26 0.15 1.67 3.04 -1.09 -2.25 116.25 118.61 1kku h VAL 178 Ca -0.02 -0.92 -0.30 0.00 -1.01 0.00 0.00 66.70 64.46 1kku h VAL 178 Cb 0.36 1.43 0.02 0.00 -2.01 0.00 0.00 31.29 31.09 1kku h VAL 178 CO 0.00 0.28 -1.29 0.00 -1.01 0.00 0.00 177.57 175.56 1kku h ALA 179 N 0.79 0.00 0.00 3.17 0.00 -0.73 -2.92 119.26 119.57 1kku h ALA 179 Ca 0.06 -0.81 -0.20 0.00 0.00 0.00 0.00 54.91 53.96 1kku h ALA 179 Cb 0.42 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1kku h ALA 179 CO 0.01 0.76 -1.22 -0.91 0.00 0.00 0.00 179.25 177.89 1kku h ASN 180 N 0.20 0.00 0.00 0.00 2.35 0.11 -3.43 115.58 114.80 1kku h ASN 180 Ca -0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1kku h ASN 180 Cb 1.97 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.34 1kku h ASN 180 CO 0.24 0.78 -0.16 -1.22 -1.65 0.00 0.00 177.43 175.41 1kku n TYR 181 N -3.11 0.00 0.00 1.19 4.02 -0.89 -5.03 117.16 113.34 1kku n TYR 181 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 1kku n TYR 181 Cb 0.90 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 40.14 1kku n TYR 181 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1kku n GLY 182 N 2.57 3.32 3.52 2.72 0.00 -0.93 -4.66 105.19 111.74 1kku n GLY 182 Ca -0.02 -1.76 -0.32 0.00 0.00 0.00 0.00 46.02 43.92 1kku n GLY 182 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kku s LEU 183 N 0.00 2.88 -0.30 0.99 1.43 -0.80 -1.66 118.68 121.22 1kku s LEU 183 Ca 0.00 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1kku s LEU 183 Cb 0.00 -1.64 0.08 0.00 0.03 0.00 0.00 46.19 44.66 1kku s LEU 183 CO 0.00 0.30 -0.03 -0.63 0.23 0.00 0.00 176.35 176.22 1kku s ILE 184 N -0.88 2.24 -0.51 -0.59 1.01 0.53 -0.27 121.20 122.73 1kku s ILE 184 Ca 0.14 -2.01 -0.16 0.00 0.00 0.00 0.00 60.65 58.63 1kku s ILE 184 Cb -0.11 -2.50 0.11 0.00 0.01 0.00 0.00 42.46 39.97 1kku s ILE 184 CO 0.04 -0.33 0.46 0.00 0.00 0.00 0.00 174.94 175.11 1kku s VAL 186 N 1.62 5.22 0.14 0.00 1.01 -0.76 0.80 120.40 128.42 1kku s VAL 186 Ca 0.03 0.83 -0.24 0.00 0.00 0.00 0.00 61.98 62.60 1kku s VAL 186 Cb -0.28 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.41 1kku s VAL 186 CO 0.04 0.34 0.70 0.28 0.00 0.00 0.00 175.10 176.46 1kku s THR 187 N 0.62 0.00 -2.18 3.92 -1.32 0.13 -4.38 115.64 112.43 1kku s THR 187 Ca 0.23 -0.16 0.18 0.00 -1.21 0.00 0.00 61.69 60.73 1kku s THR 187 Cb -0.14 -1.18 0.43 0.00 -1.51 0.00 0.00 72.50 70.10 1kku s THR 187 CO 0.08 0.00 1.42 -1.14 -2.21 0.00 0.00 174.62 172.78 1kku n ARG 188 N -0.36 2.01 -2.74 7.08 0.63 -1.26 -1.01 116.66 121.00 1kku n ARG 188 Ca -0.13 -1.54 -0.10 0.00 -0.92 0.00 0.00 57.85 55.16 1kku n ARG 188 Cb 0.63 -1.39 0.03 0.00 0.45 0.00 0.00 32.46 32.17 1kku n ARG 188 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1kku n ALA 189 N 0.75 3.05 0.21 5.13 0.00 -1.26 -4.92 120.51 123.47 1kku n ALA 189 Ca 0.16 -3.06 0.10 0.00 0.00 0.00 0.00 53.44 50.65 1kku n ALA 189 Cb 0.40 -0.94 0.16 0.00 0.00 0.00 0.00 19.45 19.07 1kku n ALA 189 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1kku h GLY 190 N 2.95 0.00 0.38 0.00 0.00 -1.93 0.48 103.07 104.95 1kku h GLY 190 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.33 1kku h GLY 190 CO 0.47 0.00 0.05 3.43 0.00 0.00 0.00 176.54 180.49 1kku h ASN 191 N 0.00 -0.08 -0.32 0.19 -0.26 -1.95 0.66 115.58 113.82 1kku h ASN 191 Ca -0.00 0.09 0.03 0.00 -0.56 0.00 0.00 56.30 55.86 1kku h ASN 191 Cb 1.05 0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 38.42 1kku h ASN 191 CO 0.01 -0.00 0.13 0.44 -1.06 0.00 0.00 177.43 176.95 1kku h ASP 192 N 0.17 0.17 -0.13 5.81 3.32 -0.51 -2.81 116.42 122.43 1kku h ASP 192 Ca 0.21 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.34 1kku h ASP 192 Cb 0.29 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 1kku h ASP 192 CO -0.31 0.13 -0.35 0.00 -1.72 0.00 0.00 179.24 176.98 1kku h ALA 193 N 1.19 -0.44 -0.57 3.45 0.00 0.23 -0.96 119.26 122.16 1kku h ALA 193 Ca 0.14 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1kku h ALA 193 Cb 0.09 0.67 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1kku h ALA 193 CO -0.13 -0.84 0.38 1.96 0.00 0.00 0.00 179.25 180.62 1kku h GLN 194 N -0.43 0.66 -0.36 0.00 1.08 0.32 -1.59 115.11 114.80 1kku h GLN 194 Ca 0.09 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.22 1kku h GLN 194 Cb 0.58 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.84 1kku h GLN 194 CO -0.37 0.44 0.09 -0.22 -0.95 0.00 0.00 178.83 177.82 1kku h LYS 195 N 0.68 0.57 -0.70 1.46 3.64 -0.96 -1.37 116.57 119.90 1kku h LYS 195 Ca 0.22 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1kku h LYS 195 Cb 0.05 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1kku h LYS 195 CO -0.06 0.61 0.39 0.74 -2.27 0.00 0.00 179.45 178.87 1kku h PHE 196 N 0.43 0.94 -0.99 1.91 -1.00 -0.34 0.12 116.94 118.02 1kku h PHE 196 Ca 0.11 -0.01 0.01 0.00 2.81 0.00 0.00 57.97 60.89 1kku h PHE 196 Cb 0.30 -0.31 -0.05 0.00 3.61 0.00 0.00 35.95 39.50 1kku h PHE 196 CO 0.02 0.65 0.64 0.82 -1.61 0.00 0.00 178.31 178.83 1kku h ILE 197 N 0.98 1.26 -0.03 -0.55 2.04 -1.09 -2.78 117.51 117.35 1kku h ILE 197 Ca 0.25 -0.50 -0.16 0.00 1.00 0.00 0.00 64.86 65.46 1kku h ILE 197 Cb 0.01 -0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 35.90 1kku h ILE 197 CO -0.04 0.26 -0.69 0.22 0.00 0.00 0.00 178.15 177.89 1kku h TYR 198 N 1.35 0.18 0.00 1.37 3.20 0.03 -2.90 116.97 120.19 1kku h TYR 198 Ca 0.36 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.15 1kku h TYR 198 Cb -0.13 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.12 1kku h TYR 198 CO 0.00 0.78 0.00 0.39 -1.64 0.00 0.00 178.16 177.69 1kku n GLU 199 N -3.77 0.23 -4.59 1.82 1.02 -0.13 -4.76 120.64 110.46 1kku n GLU 199 Ca -0.02 0.07 -0.30 0.00 -0.02 0.00 0.00 57.16 56.89 1kku n GLU 199 Cb 0.68 -1.50 -0.17 0.00 -0.02 0.00 0.00 31.44 30.43 1kku n GLU 199 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1kku s SER 200 N -2.72 2.68 0.31 1.62 0.15 -1.10 -5.00 113.70 109.64 1kku s SER 200 Ca 0.19 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.37 1kku s SER 200 Cb 0.16 -1.22 0.51 0.00 -1.71 0.00 0.00 66.02 63.76 1kku s SER 200 CO 0.39 0.05 1.85 0.44 1.20 0.00 0.00 173.24 177.17 1kku h ASP 201 N 7.32 0.63 -0.05 5.45 5.19 -1.85 0.26 116.42 133.36 1kku h ASP 201 Ca -0.31 -0.11 -0.02 0.00 -0.62 0.00 0.00 57.03 55.97 1kku h ASP 201 Cb 1.18 -0.16 -0.00 0.00 0.18 0.00 0.00 39.33 40.53 1kku h ASP 201 CO 0.51 0.66 -0.06 0.58 -3.12 0.00 0.00 179.24 177.80 1kku h VAL 202 N 0.65 1.38 -0.36 -1.35 2.07 -1.94 0.26 116.25 116.96 1kku h VAL 202 Ca 0.14 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.40 1kku h VAL 202 Cb 0.31 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1kku h VAL 202 CO 0.00 0.34 0.17 -0.07 0.02 0.00 0.00 177.57 178.03 1kku h LEU 203 N -0.32 0.48 -0.77 2.57 3.38 -1.76 -2.74 115.31 116.15 1kku h LEU 203 Ca 0.01 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 57.89 1kku h LEU 203 Cb 0.58 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1kku h LEU 203 CO 0.01 0.48 0.47 -0.25 0.09 0.00 0.00 178.44 179.25 1kku h TRP 204 N 0.44 0.88 -0.49 1.13 2.91 -0.39 0.22 115.95 120.65 1kku h TRP 204 Ca 0.12 0.03 0.09 0.00 1.13 0.00 0.00 58.89 60.26 1kku h TRP 204 Cb 0.13 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 28.47 1kku h TRP 204 CO -0.01 0.46 0.33 -0.22 -1.03 0.00 0.00 178.44 177.97 1kku h LYS 205 N 0.88 0.28 -0.20 2.65 3.64 -0.18 -1.72 116.57 121.93 1kku h LYS 205 Ca 0.33 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1kku h LYS 205 Cb 0.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1kku h LYS 205 CO -0.15 0.18 0.00 0.72 -2.27 0.00 0.00 179.45 177.93 1kku n HIS 206 N -4.46 0.53 -0.36 1.91 8.25 0.55 -4.64 115.22 116.99 1kku n HIS 206 Ca 0.07 -0.76 0.37 0.00 -0.26 0.00 0.00 57.72 57.14 1kku n HIS 206 Cb 0.35 -0.18 0.76 0.00 1.12 0.00 0.00 29.99 32.04 1kku n HIS 206 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1kku h ARG 207 N 1.29 0.00 0.00 -0.41 0.11 0.06 0.23 114.38 115.66 1kku h ARG 207 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1kku h ARG 207 Cb 1.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.15 1kku h ARG 207 CO 0.10 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 179.04 1kku n SER 208 N -4.13 0.02 -0.96 0.08 3.41 -1.26 -1.29 113.62 109.50 1kku n SER 208 Ca 0.27 0.51 0.08 0.00 -0.26 0.00 0.00 58.87 59.47 1kku n SER 208 Cb 1.33 -0.51 0.23 0.00 -0.26 0.00 0.00 64.21 65.00 1kku n SER 208 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1kku n ASN 209 N -1.53 3.54 -4.29 4.04 5.15 0.81 -4.91 115.26 118.07 1kku n ASN 209 Ca 0.03 -2.20 -0.32 0.00 -0.60 0.00 0.00 54.58 51.49 1kku n ASN 209 Cb 0.16 -0.38 -0.16 0.00 -0.53 0.00 0.00 39.78 38.88 1kku n ASN 209 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1kku s ILE 210 N -1.37 2.36 -0.20 -1.44 1.01 -0.41 -1.90 121.20 119.25 1kku s ILE 210 Ca 0.35 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 1kku s ILE 210 Cb 0.21 -1.91 0.01 0.00 0.01 0.00 0.00 42.46 40.78 1kku s ILE 210 CO 0.20 0.56 -0.13 -1.00 0.00 0.00 0.00 174.94 174.56 1kku s HIS 211 N 0.09 2.88 -0.23 3.97 3.76 0.63 -4.95 115.29 121.45 1kku s HIS 211 Ca -0.10 -1.43 -0.18 0.00 -0.15 0.00 0.00 55.06 53.21 1kku s HIS 211 Cb -0.16 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.51 1kku s HIS 211 CO 0.06 -0.72 0.51 0.08 -0.85 0.00 0.00 174.74 173.82 1kku s VAL 212 N 1.35 5.10 -0.18 -0.90 1.01 -1.26 -0.79 120.40 124.72 1kku s VAL 212 Ca 0.04 0.90 -0.02 0.00 0.00 0.00 0.00 61.98 62.91 1kku s VAL 212 Cb -0.14 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 1kku s VAL 212 CO -0.09 0.14 -0.09 -0.69 0.00 0.00 0.00 175.10 174.37 1kku s VAL 213 N 1.92 3.14 0.14 2.92 1.01 0.24 -4.97 120.40 124.79 1kku s VAL 213 Ca 0.22 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 1kku s VAL 213 Cb -0.15 -2.38 -0.07 0.00 0.00 0.00 0.00 36.38 33.78 1kku s VAL 213 CO 0.09 0.47 1.00 0.20 0.00 0.00 0.00 175.10 176.86 1kku s ASN 214 N 1.04 7.45 -0.34 3.32 0.01 -1.26 -0.70 114.94 124.47 1kku s ASN 214 Ca -0.00 1.89 -0.11 0.00 -0.71 0.00 0.00 52.86 53.92 1kku s ASN 214 Cb -0.15 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.92 1kku s ASN 214 CO -0.01 -0.09 0.20 -0.70 -1.51 0.00 0.00 177.10 174.99 1kku s GLU 215 N -0.20 3.22 0.00 -0.60 2.56 -0.18 -4.87 118.70 118.64 1kku s GLU 215 Ca 0.47 -0.81 0.26 0.00 0.00 0.00 0.00 54.97 54.89 1kku s GLU 215 Cb -0.25 -3.70 0.61 0.00 2.00 0.00 0.00 34.13 32.79 1kku s GLU 215 CO 0.31 -0.52 1.49 0.91 -0.56 0.00 0.00 175.26 176.89 1kku n TRP 216 N 5.03 0.01 -3.68 5.30 7.02 -1.26 -4.55 117.44 125.31 1kku n TRP 216 Ca -0.13 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 55.97 1kku n TRP 216 Cb 0.48 -0.29 -0.10 0.00 -2.42 0.00 0.00 31.31 28.98 1kku n TRP 216 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1kku s PHE 217 N -3.00 3.46 0.10 -5.99 0.40 -1.26 -5.06 117.98 106.63 1kku s PHE 217 Ca 0.11 -2.00 -0.33 0.00 -0.60 0.00 0.00 56.93 54.11 1kku s PHE 217 Cb 0.18 -3.16 -0.13 0.00 0.51 0.00 0.00 43.02 40.42 1kku s PHE 217 CO 0.68 -0.94 1.70 0.00 0.70 0.00 0.00 175.22 177.36 1kku n ALA 218 N 4.77 1.49 -2.91 5.36 0.00 -1.26 -4.90 120.51 123.06 1kku n ALA 218 Ca -0.07 0.38 -0.13 0.00 0.00 0.00 0.00 53.44 53.63 1kku n ALA 218 Cb 0.42 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1kku n ALA 218 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1kku n ASN 219 N 4.55 -1.98 -3.71 0.00 0.23 -1.26 -5.05 115.26 108.04 1kku n ASN 219 Ca 0.18 -3.04 -0.42 0.00 -0.53 0.00 0.00 54.58 50.78 1kku n ASN 219 Cb 0.31 1.00 -0.00 0.00 -2.08 0.00 0.00 39.78 39.01 1kku n ASN 219 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1kku n ASP 220 N 1.81 4.87 -4.35 0.53 8.00 -1.26 -4.64 116.55 121.51 1kku n ASP 220 Ca 0.15 -2.89 -0.46 0.00 0.71 0.00 0.00 54.79 52.30 1kku n ASP 220 Cb 0.58 -1.59 -0.01 0.00 -0.02 0.00 0.00 41.12 40.08 1kku n ASP 220 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1kku s ILE 221 N 2.20 5.64 0.41 0.53 1.01 -1.26 -5.03 121.20 124.71 1kku s ILE 221 Ca 0.48 -2.75 -0.14 0.00 0.00 0.00 0.00 60.65 58.24 1kku s ILE 221 Cb 0.14 -4.58 -0.08 0.00 0.01 0.00 0.00 42.46 37.95 1kku s ILE 221 CO -0.06 -1.17 0.83 -0.94 0.00 0.00 0.00 174.94 173.60 1kku s SER 222 N 2.04 6.65 0.19 3.58 1.04 -1.26 -4.56 113.70 121.38 1kku s SER 222 Ca 0.26 1.34 -0.12 0.00 0.48 0.00 0.00 55.95 57.91 1kku s SER 222 Cb -0.09 -2.41 0.19 0.00 0.10 0.00 0.00 66.02 63.82 1kku s SER 222 CO -0.08 -0.39 1.77 0.28 0.98 0.00 0.00 173.24 175.79 1kku h SER 223 N 1.49 0.31 -0.52 7.02 0.02 -1.89 -1.18 113.55 118.80 1kku h SER 223 Ca -0.47 0.05 0.10 0.00 -0.84 0.00 0.00 61.79 60.62 1kku h SER 223 Cb 1.18 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.64 1kku h SER 223 CO 0.63 0.20 0.07 0.74 -1.14 0.00 0.00 176.83 177.33 1kku h THR 224 N 0.46 0.66 -0.12 -2.27 2.02 -1.93 0.29 112.91 112.03 1kku h THR 224 Ca 0.26 -0.07 -0.08 0.00 0.77 0.00 0.00 66.41 67.29 1kku h THR 224 Cb 0.23 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1kku h THR 224 CO -0.22 0.04 -0.30 0.11 0.37 0.00 0.00 175.52 175.52 1kku h LYS 225 N 0.19 0.22 -0.22 6.66 1.57 -1.72 -1.04 116.57 122.23 1kku h LYS 225 Ca 0.26 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1kku h LYS 225 Cb 0.38 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1kku h LYS 225 CO -0.38 0.50 -0.08 0.82 -0.57 0.00 0.00 179.45 179.75 1kku h ILE 226 N 0.20 1.29 -0.44 1.86 1.08 -0.05 -0.18 117.51 121.26 1kku h ILE 226 Ca 0.03 -1.10 -0.01 0.00 -0.39 0.00 0.00 64.86 63.38 1kku h ILE 226 Cb 0.63 1.56 -0.02 0.00 -3.07 0.00 0.00 36.82 35.92 1kku h ILE 226 CO 0.05 0.34 0.24 0.03 -0.69 0.00 0.00 178.15 178.11 1kku h ARG 227 N 0.16 0.62 -0.60 2.37 3.08 -0.23 0.11 114.38 119.90 1kku h ARG 227 Ca 0.05 -0.08 0.09 0.00 0.07 0.00 0.00 59.98 60.11 1kku h ARG 227 Cb 0.55 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.41 1kku h ARG 227 CO 0.03 0.50 0.24 -0.09 -1.07 0.00 0.00 179.97 179.58 1kku h ARG 228 N 0.58 0.43 -0.72 0.04 2.43 -1.08 -0.64 114.38 115.42 1kku h ARG 228 Ca 0.16 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1kku h ARG 228 Cb 0.07 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 1kku h ARG 228 CO -0.02 0.28 0.26 0.00 -1.51 0.00 0.00 179.97 178.98 1kku h ALA 229 N 1.40 0.93 -0.03 2.80 0.00 0.11 -2.76 119.26 121.71 1kku h ALA 229 Ca 0.30 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1kku h ALA 229 Cb 0.34 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1kku h ALA 229 CO -0.28 0.58 0.00 -0.07 0.00 0.00 0.00 179.25 179.48 1kku h LEU 230 N 1.04 0.06 0.00 0.00 3.38 0.59 -1.19 115.31 119.19 1kku h LEU 230 Ca 0.24 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1kku h LEU 230 Cb 0.25 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1kku h LEU 230 CO -0.01 0.34 0.00 -2.11 0.09 0.00 0.00 178.44 176.74 1kku n ARG 231 N -4.91 0.07 -0.35 1.13 1.85 -0.42 -0.78 116.66 113.26 1kku n ARG 231 Ca -0.07 0.26 0.11 0.00 -1.00 0.00 0.00 57.85 57.15 1kku n ARG 231 Cb 0.17 -1.50 0.30 0.00 -1.05 0.00 0.00 32.46 30.39 1kku n ARG 231 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1kku n ARG 232 N -1.33 2.72 -1.23 2.89 1.74 -0.85 -4.91 116.66 115.69 1kku n ARG 232 Ca 0.03 -2.60 -0.08 0.00 -0.77 0.00 0.00 57.85 54.43 1kku n ARG 232 Cb 0.05 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 29.92 1kku n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1kku n GLY 233 N 1.56 0.98 3.90 -0.13 0.00 0.04 -5.01 105.19 106.54 1kku n GLY 233 Ca 0.23 -0.69 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 1kku n GLY 233 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1kku s GLN 234 N -2.67 3.61 0.46 1.61 -0.21 -0.51 -5.03 119.66 116.92 1kku s GLN 234 Ca 0.00 0.14 -0.24 0.00 0.02 0.00 0.00 55.36 55.29 1kku s GLN 234 Cb 0.00 -2.48 -0.07 0.00 1.00 0.00 0.00 33.01 31.45 1kku s GLN 234 CO 0.00 -0.01 1.27 0.45 -2.12 0.00 0.00 175.29 174.87 1kku s SER 235 N -3.64 6.00 0.00 5.90 0.15 -1.26 -4.59 113.70 116.27 1kku s SER 235 Ca 0.46 2.56 0.00 0.00 0.70 0.00 0.00 55.95 59.67 1kku s SER 235 Cb -0.10 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1kku s SER 235 CO 0.37 -1.05 0.60 2.30 1.20 0.00 0.00 173.24 176.66 1kku n ILE 236 N -0.38 0.35 -1.55 6.45 -5.35 -1.26 -4.98 119.36 112.64 1kku n ILE 236 Ca 0.07 -0.53 -0.56 0.00 -0.27 0.00 0.00 62.75 61.45 1kku n ILE 236 Cb 0.45 0.97 -0.07 0.00 -1.74 0.00 0.00 39.64 39.25 1kku n ILE 236 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1kku n ARG 237 N -0.18 0.51 -0.78 6.28 3.00 -1.26 -2.01 116.66 122.23 1kku n ARG 237 Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 57.85 58.03 1kku n ARG 237 Cb 0.20 -1.75 0.00 0.00 0.00 0.00 0.00 32.46 30.91 1kku n ARG 237 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1kku n TYR 238 N 2.14 0.00 0.45 -0.14 4.02 -1.26 -4.83 117.16 117.54 1kku n TYR 238 Ca 0.20 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.17 1kku n TYR 238 Cb 0.12 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.34 1kku n TYR 238 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1kku n LEU 239 N 0.00 0.46 -4.06 7.72 4.77 -0.85 -5.00 117.00 120.04 1kku n LEU 239 Ca 0.00 -0.30 -0.07 0.00 -0.03 0.00 0.00 56.01 55.61 1kku n LEU 239 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 1kku n LEU 239 CO 0.00 0.11 -0.34 0.68 -1.33 0.00 0.00 177.39 176.52 1kku s VAL 240 N -2.77 0.20 0.41 4.08 -7.23 -1.24 -0.74 120.40 113.11 1kku s VAL 240 Ca 0.01 -1.66 -0.26 0.00 -1.81 0.00 0.00 61.98 58.27 1kku s VAL 240 Cb 0.12 -1.37 -0.10 0.00 0.56 0.00 0.00 36.38 35.59 1kku s VAL 240 CO 0.67 -0.92 1.31 -2.65 -0.31 0.00 0.00 175.10 173.20 1kku n PRO 241 N 0.26 2.03 -0.27 4.82 -0.02 -1.26 -4.70 135.00 135.86 1kku n PRO 241 Ca -0.15 0.72 0.08 0.00 -2.02 0.00 0.00 63.50 62.13 1kku n PRO 241 Cb 0.60 -2.43 0.21 0.00 -0.02 0.00 0.00 33.50 31.87 1kku n PRO 241 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1kku h ASP 242 N 2.20 -0.07 -0.01 2.55 5.19 -1.99 -0.15 116.42 124.15 1kku h ASP 242 Ca -0.48 0.17 -0.11 0.00 -0.62 0.00 0.00 57.03 55.99 1kku h ASP 242 Cb 1.29 0.25 -0.01 0.00 0.18 0.00 0.00 39.33 41.04 1kku h ASP 242 CO 0.60 -0.11 -0.33 -0.07 -3.12 0.00 0.00 179.24 176.22 1kku h LEU 243 N 0.21 0.49 -0.65 1.55 3.38 -1.92 -0.46 115.31 117.91 1kku h LEU 243 Ca 0.46 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 58.15 1kku h LEU 243 Cb 0.84 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1kku h LEU 243 CO -0.59 0.80 0.07 0.58 0.09 0.00 0.00 178.44 179.38 1kku h VAL 244 N 0.41 1.27 -0.81 1.22 2.07 -1.62 -1.55 116.25 117.23 1kku h VAL 244 Ca 0.05 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1kku h VAL 244 Cb 0.78 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1kku h VAL 244 CO 0.06 0.41 0.36 -0.61 0.02 0.00 0.00 177.57 177.80 1kku h GLN 245 N 1.02 1.19 -0.73 1.57 -0.00 -0.68 -1.41 115.11 116.08 1kku h GLN 245 Ca 0.19 -0.20 -0.06 0.00 -0.00 0.00 0.00 58.65 58.58 1kku h GLN 245 Cb 0.49 -0.20 -0.03 0.00 0.00 0.00 0.00 27.48 27.74 1kku h GLN 245 CO 0.02 0.94 0.20 0.93 0.00 0.00 0.00 178.83 180.93 1kku h GLU 246 N 1.17 1.15 -0.33 1.69 5.08 -0.82 -1.26 114.58 121.26 1kku h GLU 246 Ca 0.28 -0.26 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1kku h GLU 246 Cb 0.17 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1kku h GLU 246 CO -0.03 0.99 0.05 -0.92 -1.00 0.00 0.00 179.01 178.11 1kku h TYR 247 N 1.09 0.57 -0.83 4.33 3.20 -1.06 0.24 116.97 124.51 1kku h TYR 247 Ca 0.23 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1kku h TYR 247 Cb 0.34 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 1kku h TYR 247 CO 0.03 0.61 0.37 0.82 -1.64 0.00 0.00 178.16 178.35 1kku h ILE 248 N 0.37 1.26 -0.32 1.81 2.04 -1.19 -2.27 117.51 119.21 1kku h ILE 248 Ca 0.10 -0.78 -0.17 0.00 1.00 0.00 0.00 64.86 65.01 1kku h ILE 248 Cb 0.35 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1kku h ILE 248 CO 0.01 0.33 -0.45 -0.08 0.00 0.00 0.00 178.15 177.95 1kku h GLU 249 N 1.20 0.87 -0.06 2.37 4.81 -0.57 -1.37 114.58 121.83 1kku h GLU 249 Ca 0.28 -0.51 -0.13 0.00 -0.13 0.00 0.00 59.36 58.88 1kku h GLU 249 Cb 0.17 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1kku h GLU 249 CO -0.03 1.15 -0.54 0.87 -0.73 0.00 0.00 179.01 179.74 1kku h LYS 250 N 0.67 0.16 -0.19 1.92 1.79 -0.80 -2.84 116.57 117.27 1kku h LYS 250 Ca 0.04 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1kku h LYS 250 Cb 1.05 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 1kku h LYS 250 CO 0.11 0.66 0.00 0.72 -1.08 0.00 0.00 179.45 179.85 1kku n HIS 251 N -3.92 0.25 -4.12 -1.35 8.25 -0.87 -4.96 115.22 108.50 1kku n HIS 251 Ca -0.02 -0.12 -0.34 0.00 -0.26 0.00 0.00 57.72 56.98 1kku n HIS 251 Cb 0.56 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.66 1kku n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1kku n ASN 252 N 0.37 -3.20 -4.80 0.41 5.15 -0.56 -4.93 115.26 107.70 1kku n ASN 252 Ca 0.16 -0.96 -0.35 0.00 -0.60 0.00 0.00 54.58 52.83 1kku n ASN 252 Cb 0.33 -3.03 -0.05 0.00 -0.53 0.00 0.00 39.78 36.50 1kku n ASN 252 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1kku s LEU 253 N -7.23 3.96 0.00 1.20 1.43 -0.93 -3.56 118.68 113.56 1kku s LEU 253 Ca 0.62 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.62 1kku s LEU 253 Cb -0.33 -4.44 0.00 0.00 0.03 0.00 0.00 46.19 41.45 1kku s LEU 253 CO 0.90 -0.58 0.00 -1.22 0.23 0.00 0.00 176.35 175.69 1kku n TYR 254 N -0.60 0.00 0.08 0.29 4.02 -1.26 -4.80 117.16 114.89 1kku n TYR 254 Ca 0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.88 1kku n TYR 254 Cb 0.52 -1.52 0.02 0.00 -0.02 0.00 0.00 39.34 38.34 1kku n TYR 254 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1kku h SER 255 N 0.00 0.33 0.00 7.72 4.64 -1.82 -2.58 113.55 121.84 1kku h SER 255 Ca 0.00 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1kku h SER 255 Cb 0.54 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1kku h SER 255 CO 0.00 1.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.42 1kku n SER 256 N -3.74 0.00 0.00 4.97 3.41 -1.26 -4.40 113.62 112.60 1kku n SER 256 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 1kku n SER 256 Cb 0.75 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 1kku n SER 256 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26