#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nku s GLU 2 N 0.00 2.38 0.13 0.03 0.41 -1.26 -5.02 118.70 115.36 1nku s GLU 2 Ca 0.00 -0.91 0.08 0.00 -0.41 0.00 0.00 54.97 53.73 1nku s GLU 2 Cb 0.00 -2.44 -0.04 0.00 -1.78 0.00 0.00 34.13 29.87 1nku s GLU 2 CO 0.00 0.53 -0.20 1.03 -0.49 0.00 0.00 175.26 176.13 1nku s ARG 3 N -2.25 1.18 0.02 1.61 1.81 -1.26 -2.76 118.95 117.30 1nku s ARG 3 Ca 0.24 -1.26 -0.30 0.00 -1.72 0.00 0.00 55.73 52.69 1nku s ARG 3 Cb -0.11 -1.38 -0.05 0.00 -0.45 0.00 0.00 34.95 32.96 1nku s ARG 3 CO 0.16 0.31 1.20 0.00 -0.68 0.00 0.00 175.30 176.29 1nku h GLY 5 N 7.33 0.00 0.47 0.00 0.00 -1.92 -3.01 103.07 105.94 1nku h GLY 5 Ca -0.39 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.08 1nku h GLY 5 CO 0.83 0.00 0.60 1.49 0.00 0.00 0.00 176.54 179.46 1nku h TRP 6 N 0.00 0.93 -3.00 5.60 -0.00 -1.90 -3.42 115.95 114.17 1nku h TRP 6 Ca 0.00 0.03 -0.57 0.00 -0.00 0.00 0.00 58.89 58.35 1nku h TRP 6 Cb 0.37 -0.29 -0.17 0.00 -0.00 0.00 0.00 29.16 29.07 1nku h TRP 6 CO 0.00 0.34 -0.78 0.14 -0.00 0.00 0.00 178.44 178.14 1nku s VAL 7 N -5.77 2.08 0.27 1.49 -7.23 -1.14 -5.04 120.40 105.06 1nku s VAL 7 Ca -0.11 -2.08 0.00 0.00 -1.81 0.00 0.00 61.98 57.98 1nku s VAL 7 Cb 0.22 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 35.13 1nku s VAL 7 CO 0.80 -0.31 0.00 -1.54 -0.31 0.00 0.00 175.10 173.73 1nku n SER 8 N 0.02 -1.47 -4.87 4.85 3.41 -1.26 -4.78 113.62 109.52 1nku n SER 8 Ca -0.11 0.49 -0.31 0.00 -0.26 0.00 0.00 58.87 58.69 1nku n SER 8 Cb 0.58 1.52 -0.05 0.00 -0.26 0.00 0.00 64.21 66.00 1nku n SER 8 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1nku s GLN 9 N -2.00 3.25 0.00 4.33 2.00 -1.26 -4.85 119.66 121.13 1nku s GLN 9 Ca 0.00 -0.52 0.00 0.00 -2.00 0.00 0.00 55.36 52.84 1nku s GLN 9 Cb 0.00 -2.93 0.00 0.00 0.80 0.00 0.00 33.01 30.88 1nku s GLN 9 CO 0.00 0.60 0.00 -3.47 -0.50 0.00 0.00 175.29 171.92 1nku n ASP 10 N 0.36 -1.44 0.12 6.67 -0.08 -1.26 -4.81 116.55 116.11 1nku n ASP 10 Ca -0.06 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.27 1nku n ASP 10 Cb 0.51 -0.72 0.27 0.00 2.34 0.00 0.00 41.12 43.52 1nku n ASP 10 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1nku n PRO 11 N -0.03 0.07 -0.05 -0.67 -0.02 -1.26 -1.51 135.00 131.54 1nku n PRO 11 Ca 0.00 0.50 0.01 0.00 -2.02 0.00 0.00 63.50 61.99 1nku n PRO 11 Cb 0.00 -1.99 0.31 0.00 -0.02 0.00 0.00 33.50 31.81 1nku n PRO 11 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1nku h LEU 12 N 0.00 0.58 0.06 2.45 5.85 -1.99 -2.08 115.31 120.17 1nku h LEU 12 Ca 0.00 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1nku h LEU 12 Cb 0.54 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 1nku h LEU 12 CO 0.00 0.53 -0.05 1.88 -0.34 0.00 0.00 178.44 180.46 1nku h TYR 13 N 0.63 -0.14 -0.91 1.25 0.05 -1.58 -1.08 116.97 115.20 1nku h TYR 13 Ca 0.15 0.00 0.15 0.00 0.05 0.00 0.00 58.73 59.08 1nku h TYR 13 Cb 0.14 0.05 -0.09 0.00 1.01 0.00 0.00 36.73 37.84 1nku h TYR 13 CO 0.01 -0.07 0.51 0.82 -1.05 0.00 0.00 178.16 178.38 1nku h ILE 14 N -0.11 0.77 -0.33 -2.88 2.04 -1.75 0.98 117.51 116.23 1nku h ILE 14 Ca -0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1nku h ILE 14 Cb 0.09 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.13 1nku h ILE 14 CO -0.00 0.13 0.21 0.00 0.00 0.00 0.00 178.15 178.49 1nku h ALA 15 N 1.57 0.41 -0.02 1.87 0.00 -1.25 0.47 119.26 122.31 1nku h ALA 15 Ca 0.49 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.24 1nku h ALA 15 Cb 0.66 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1nku h ALA 15 CO -0.34 -0.12 -0.49 -0.92 0.00 0.00 0.00 179.25 177.38 1nku h TYR 16 N 0.44 0.53 0.00 0.00 5.03 0.01 -3.08 116.97 119.91 1nku h TYR 16 Ca 0.12 -0.28 0.00 0.00 2.58 0.00 0.00 58.73 61.15 1nku h TYR 16 Cb -0.04 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 38.17 1nku h TYR 16 CO -0.05 1.07 0.00 1.25 -1.32 0.00 0.00 178.16 179.11 1nku h HIS 17 N -0.16 0.00 0.01 -3.82 2.76 0.10 -1.79 115.15 112.25 1nku h HIS 17 Ca -0.05 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.11 1nku h HIS 17 Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.15 1nku h HIS 17 CO 0.15 0.00 -0.00 -0.44 -1.30 0.00 0.00 177.93 176.33 1nku h ASP 18 N 0.00 -0.01 0.09 3.26 3.32 -0.06 -3.41 116.42 119.61 1nku h ASP 18 Ca 0.00 -0.81 -0.00 0.00 0.02 0.00 0.00 57.03 56.24 1nku h ASP 18 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1nku h ASP 18 CO 0.00 0.83 -0.04 0.78 -1.72 0.00 0.00 179.24 179.09 1nku h ASN 19 N -0.89 -0.10 -5.12 6.45 2.35 -1.49 -3.48 115.58 113.30 1nku h ASN 19 Ca -0.00 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.51 1nku h ASN 19 Cb 0.82 0.03 0.01 0.00 0.05 0.00 0.00 38.32 39.22 1nku h ASN 19 CO 0.00 0.09 -0.05 -0.62 -1.65 0.00 0.00 177.43 175.20 1nku n GLU 20 N -3.22 0.86 -2.13 0.81 1.02 -0.68 -4.84 120.64 112.47 1nku n GLU 20 Ca -0.01 -1.51 0.00 0.00 -0.02 0.00 0.00 57.16 55.61 1nku n GLU 20 Cb 0.05 -0.06 0.00 0.00 -0.02 0.00 0.00 31.44 31.40 1nku n GLU 20 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1nku n TRP 21 N -1.51 -4.49 0.00 -0.32 -0.00 -1.26 -4.11 117.44 105.75 1nku n TRP 21 Ca 0.06 2.70 0.00 0.00 -0.00 0.00 0.00 57.50 60.26 1nku n TRP 21 Cb 0.29 -3.41 0.00 0.00 -0.00 0.00 0.00 31.31 28.19 1nku n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1nku n GLY 22 N 1.92 0.29 3.79 5.87 0.00 -0.67 -4.68 105.19 111.72 1nku n GLY 22 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1nku n GLY 22 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nku s VAL 23 N -2.00 4.64 0.10 1.61 -7.23 -1.24 -4.70 120.40 111.58 1nku s VAL 23 Ca 0.00 -0.70 -0.31 0.00 -1.81 0.00 0.00 61.98 59.16 1nku s VAL 23 Cb 0.00 -3.23 -0.10 0.00 0.56 0.00 0.00 36.38 33.61 1nku s VAL 23 CO 0.00 0.14 1.84 -2.16 -0.31 0.00 0.00 175.10 174.61 1nku s PRO 24 N -2.36 4.14 -0.11 4.82 0.04 -1.24 -3.57 135.00 136.72 1nku s PRO 24 Ca 0.30 2.57 0.00 0.00 0.04 0.00 0.00 61.00 63.91 1nku s PRO 24 Cb -0.12 -3.71 -0.02 0.00 0.04 0.00 0.00 34.50 30.69 1nku s PRO 24 CO 0.22 -0.86 -0.13 -1.21 0.04 0.00 0.00 177.00 175.07 1nku s GLU 25 N 3.08 3.19 0.00 4.56 2.02 0.59 -4.97 118.70 127.18 1nku s GLU 25 Ca 0.82 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 55.13 1nku s GLU 25 Cb -0.45 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1nku s GLU 25 CO 0.37 0.32 0.77 0.25 0.02 0.00 0.00 175.26 176.99 1nku n THR 26 N 3.21 0.58 -2.88 3.63 -2.24 -1.26 -4.97 114.28 110.35 1nku n THR 26 Ca -0.18 -0.75 -0.42 0.00 -2.27 0.00 0.00 64.05 60.43 1nku n THR 26 Cb 0.53 0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 69.46 1nku n THR 26 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1nku s ASP 27 N -0.58 6.70 0.31 3.42 1.01 -1.26 -4.91 116.67 121.36 1nku s ASP 27 Ca 0.00 0.70 -0.00 0.00 0.71 0.00 0.00 52.55 53.96 1nku s ASP 27 Cb 0.00 -2.43 0.50 0.00 1.01 0.00 0.00 42.92 41.99 1nku s ASP 27 CO 0.00 -0.69 1.93 0.28 0.21 0.00 0.00 175.17 176.90 1nku h SER 28 N 8.17 0.79 0.41 0.27 0.02 -1.98 0.23 113.55 121.46 1nku h SER 28 Ca -0.24 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.63 1nku h SER 28 Cb 1.09 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1nku h SER 28 CO 0.92 0.66 -0.20 0.11 -1.14 0.00 0.00 176.83 177.18 1nku h LYS 29 N 0.89 -0.53 -0.45 3.45 1.57 -2.00 -0.99 116.57 118.51 1nku h LYS 29 Ca 0.22 0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.91 1nku h LYS 29 Cb 0.06 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1nku h LYS 29 CO -0.03 -0.29 -0.23 -0.22 -0.57 0.00 0.00 179.45 178.11 1nku h LYS 30 N -0.67 0.93 -0.58 3.15 3.64 -1.94 -2.66 116.57 118.45 1nku h LYS 30 Ca -0.06 -0.40 0.03 0.00 -1.27 0.00 0.00 60.65 58.96 1nku h LYS 30 Cb 0.48 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.23 1nku h LYS 30 CO 0.09 1.06 0.34 1.25 -2.27 0.00 0.00 179.45 179.92 1nku h LEU 31 N 0.80 0.53 -0.57 5.20 5.85 -0.48 -1.33 115.31 125.32 1nku h LEU 31 Ca 0.10 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1nku h LEU 31 Cb 0.80 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 1nku h LEU 31 CO 0.07 0.37 0.24 0.15 -0.34 0.00 0.00 178.44 178.92 1nku h PHE 32 N 0.66 0.86 -0.49 1.25 3.57 -1.08 -2.38 116.94 119.32 1nku h PHE 32 Ca 0.24 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1nku h PHE 32 Cb 0.07 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 1nku h PHE 32 CO -0.07 0.69 0.31 1.49 -2.23 0.00 0.00 178.31 178.50 1nku h GLU 33 N 0.78 0.66 -0.53 1.11 4.81 -1.03 -1.57 114.58 118.81 1nku h GLU 33 Ca 0.19 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1nku h GLU 33 Cb 0.18 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1nku h GLU 33 CO -0.02 0.45 0.24 1.98 -0.73 0.00 0.00 179.01 180.93 1nku h MET 34 N 0.68 0.78 -0.10 1.92 4.05 -0.74 0.42 114.93 121.93 1nku h MET 34 Ca 0.18 -0.13 -0.04 0.00 -0.28 0.00 0.00 59.70 59.43 1nku h MET 34 Cb -0.04 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.62 1nku h MET 34 CO -0.04 0.66 -0.10 0.82 0.23 0.00 0.00 176.91 178.48 1nku h ILE 35 N 0.71 1.36 -0.07 1.77 1.08 -1.23 -0.28 117.51 120.86 1nku h ILE 35 Ca 0.18 -1.26 -0.02 0.00 -0.39 0.00 0.00 64.86 63.37 1nku h ILE 35 Cb 0.15 1.97 -0.00 0.00 -3.07 0.00 0.00 36.82 35.87 1nku h ILE 35 CO -0.02 0.36 -0.02 0.00 -0.69 0.00 0.00 178.15 177.78 1nku h LEU 37 N -0.20 1.04 -1.32 0.00 5.85 -0.23 -2.77 115.31 117.68 1nku h LEU 37 Ca 0.02 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 1nku h LEU 37 Cb 0.42 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1nku h LEU 37 CO 0.01 1.01 0.17 -0.08 -0.34 0.00 0.00 178.44 179.20 1nku h GLU 38 N 1.02 0.64 -0.72 1.25 4.57 -1.02 -1.88 114.58 118.43 1nku h GLU 38 Ca 0.21 -0.09 0.19 0.00 -1.18 0.00 0.00 59.36 58.50 1nku h GLU 38 Cb 0.38 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 1nku h GLU 38 CO 0.00 0.53 0.51 0.78 -1.18 0.00 0.00 179.01 179.66 1nku h GLY 39 N 0.79 0.19 1.67 1.92 0.00 -1.14 0.15 103.07 106.65 1nku h GLY 39 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 1nku h GLY 39 CO -0.01 0.01 0.18 1.46 0.00 0.00 0.00 176.54 178.17 1nku h GLN 40 N 0.10 0.44 -0.38 4.80 4.20 -1.43 -1.74 115.11 121.09 1nku h GLN 40 Ca 0.35 -0.04 0.11 0.00 0.06 0.00 0.00 58.65 59.14 1nku h GLN 40 Cb 1.25 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 1nku h GLN 40 CO -0.04 0.32 0.38 -0.56 -0.67 0.00 0.00 178.83 178.26 1nku h GLN 41 N 0.44 0.00 -6.01 1.46 3.07 -0.83 -3.41 115.11 109.84 1nku h GLN 41 Ca 0.12 0.00 -0.80 0.00 0.09 0.00 0.00 58.65 58.06 1nku h GLN 41 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 1nku h GLN 41 CO -0.02 0.00 1.04 0.00 0.09 0.00 0.00 178.83 179.94 1nku n ALA 42 N -2.39 -0.36 0.00 0.06 0.00 -0.66 0.33 120.51 117.49 1nku n ALA 42 Ca 0.06 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1nku n ALA 42 Cb 0.55 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1nku n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nku n GLY 43 N 5.73 2.97 3.46 0.00 0.00 -1.26 -5.00 105.19 111.09 1nku n GLY 43 Ca 0.42 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 1nku n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nku s LEU 44 N 0.00 2.61 0.61 0.99 1.43 1.01 -5.13 118.68 120.19 1nku s LEU 44 Ca 0.00 -1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 51.91 1nku s LEU 44 Cb 0.00 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 1nku s LEU 44 CO 0.00 -0.08 1.03 -0.44 0.23 0.00 0.00 176.35 177.09 1nku s SER 45 N -3.50 6.25 0.38 2.29 0.01 -1.26 -4.59 113.70 113.29 1nku s SER 45 Ca 0.29 1.43 0.05 0.00 1.31 0.00 0.00 55.95 59.04 1nku s SER 45 Cb -0.02 -2.47 0.74 0.00 0.21 0.00 0.00 66.02 64.48 1nku s SER 45 CO 0.14 -0.85 2.00 4.11 0.41 0.00 0.00 173.24 179.05 1nku h TRP 46 N -0.22 0.60 -0.97 2.43 0.09 -1.97 -2.40 115.95 113.51 1nku h TRP 46 Ca -0.44 -0.00 0.31 0.00 0.09 0.00 0.00 58.89 58.84 1nku h TRP 46 Cb 1.19 -0.20 -0.15 0.00 0.08 0.00 0.00 29.16 30.08 1nku h TRP 46 CO 0.66 0.42 0.44 0.97 0.09 0.00 0.00 178.44 181.02 1nku h ILE 47 N 0.63 0.25 -0.40 0.12 -0.00 -2.00 2.53 117.51 118.65 1nku h ILE 47 Ca 0.16 -0.08 -0.08 0.00 -0.00 0.00 0.00 64.86 64.86 1nku h ILE 47 Cb 0.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 36.82 36.81 1nku h ILE 47 CO -0.03 0.04 -0.10 0.74 -0.00 0.00 0.00 178.15 178.81 1nku h THR 48 N 0.24 1.25 -0.02 2.19 2.02 -1.81 -2.62 112.91 114.16 1nku h THR 48 Ca 0.69 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 1nku h THR 48 Cb 1.56 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 1nku h THR 48 CO -0.66 0.37 -0.00 0.58 0.37 0.00 0.00 175.52 176.18 1nku h VAL 49 N 0.64 1.29 0.13 3.16 2.07 0.42 0.17 116.25 124.12 1nku h VAL 49 Ca 0.11 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.79 1nku h VAL 49 Cb 0.54 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 1nku h VAL 49 CO 0.03 0.23 -0.32 -0.07 0.02 0.00 0.00 177.57 177.46 1nku h LEU 50 N -0.31 -0.92 -0.67 2.57 4.07 -0.66 2.09 115.31 121.48 1nku h LEU 50 Ca 0.01 0.10 0.06 0.00 0.08 0.00 0.00 57.88 58.13 1nku h LEU 50 Cb 0.37 0.35 -0.05 0.00 1.08 0.00 0.00 40.66 42.41 1nku h LEU 50 CO 0.00 -0.41 0.38 0.50 -1.08 0.00 0.00 178.44 177.83 1nku h LYS 51 N -0.55 0.67 -0.19 1.13 3.64 -1.50 0.22 116.57 119.99 1nku h LYS 51 Ca 0.03 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1nku h LYS 51 Cb 0.58 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1nku h LYS 51 CO -0.18 0.45 -0.09 -0.22 -2.27 0.00 0.00 179.45 177.14 1nku h LYS 52 N 0.70 0.30 -0.95 1.90 3.64 0.28 -2.19 116.57 120.25 1nku h LYS 52 Ca 0.30 -0.06 0.24 0.00 -1.27 0.00 0.00 60.65 59.85 1nku h LYS 52 Cb 0.18 -0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 31.83 1nku h LYS 52 CO -0.18 0.40 0.49 -0.09 -2.27 0.00 0.00 179.45 177.80 1nku h ARG 53 N 0.29 0.46 -0.19 1.90 1.12 0.67 1.92 114.38 120.55 1nku h ARG 53 Ca 0.06 -0.03 -0.11 0.00 -1.11 0.00 0.00 59.98 58.79 1nku h ARG 53 Cb 0.34 -0.10 -0.00 0.00 -0.01 0.00 0.00 29.97 30.19 1nku h ARG 53 CO 0.02 0.30 -0.31 0.93 -3.11 0.00 0.00 179.97 177.80 1nku h GLU 54 N 0.47 0.54 -0.67 0.20 5.08 -1.32 -2.61 114.58 116.26 1nku h GLU 54 Ca 0.60 -0.33 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 1nku h GLU 54 Cb 1.16 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1nku h GLU 54 CO -0.51 0.93 0.12 -0.91 -1.00 0.00 0.00 179.01 177.65 1nku h ASN 55 N 0.19 1.06 -0.73 1.42 -0.26 -0.07 -2.66 115.58 114.53 1nku h ASN 55 Ca 0.01 -0.25 0.06 0.00 -0.56 0.00 0.00 56.30 55.56 1nku h ASN 55 Cb 0.89 -0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 37.82 1nku h ASN 55 CO 0.07 1.04 0.43 0.22 -1.06 0.00 0.00 177.43 178.13 1nku h TYR 56 N 1.03 0.79 -0.73 1.19 3.20 0.28 -0.48 116.97 122.25 1nku h TYR 56 Ca 0.21 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.15 1nku h TYR 56 Cb 0.42 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 1nku h TYR 56 CO 0.03 0.39 0.48 -0.09 -1.64 0.00 0.00 178.16 177.34 1nku h ARG 57 N 0.79 0.82 -0.31 1.82 2.43 -1.12 0.99 114.38 119.81 1nku h ARG 57 Ca 0.32 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.37 1nku h ARG 57 Cb 0.17 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1nku h ARG 57 CO -0.17 0.54 -0.13 0.00 -1.51 0.00 0.00 179.97 178.71 1nku h ALA 58 N 1.58 1.21 0.07 2.80 0.00 -0.92 -2.58 119.26 121.42 1nku h ALA 58 Ca 0.30 -0.28 -0.36 0.00 0.00 0.00 0.00 54.91 54.57 1nku h ALA 58 Cb 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1nku h ALA 58 CO -0.09 0.51 -2.04 0.00 0.00 0.00 0.00 179.25 177.62 1nku n PHE 60 N -3.64 0.71 -0.11 0.00 3.72 0.26 -4.31 117.46 114.09 1nku n PHE 60 Ca -0.37 0.31 0.16 0.00 -0.05 0.00 0.00 57.45 57.50 1nku n PHE 60 Cb 0.96 -0.99 0.56 0.00 -0.94 0.00 0.00 39.48 39.07 1nku n PHE 60 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1nku h HIS 61 N -1.00 0.34 -0.87 1.38 2.76 -1.55 0.71 115.15 116.92 1nku h HIS 61 Ca -0.35 0.01 0.15 0.00 -2.20 0.00 0.00 60.37 57.97 1nku h HIS 61 Cb 1.23 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 30.01 1nku h HIS 61 CO -0.03 0.13 0.57 0.37 -1.30 0.00 0.00 177.93 177.67 1nku h GLN 62 N 0.30 0.62 -0.26 5.26 5.75 -1.71 0.34 115.11 125.40 1nku h GLN 62 Ca 0.33 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.79 1nku h GLN 62 Cb 0.86 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.27 1nku h GLN 62 CO -0.08 0.41 0.00 1.19 -2.65 0.00 0.00 178.83 177.70 1nku n PHE 63 N -4.55 0.32 -1.53 3.99 3.72 0.19 -5.06 117.46 114.54 1nku n PHE 63 Ca 0.17 -0.16 0.06 0.00 -0.05 0.00 0.00 57.45 57.47 1nku n PHE 63 Cb 0.49 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.00 1nku n PHE 63 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1nku n ASP 64 N 1.10 -8.26 0.22 4.37 9.92 0.12 -3.72 116.55 120.30 1nku n ASP 64 Ca 0.18 1.75 0.06 0.00 -0.53 0.00 0.00 54.79 56.24 1nku n ASP 64 Cb 0.52 -5.05 0.49 0.00 -0.64 0.00 0.00 41.12 36.44 1nku n ASP 64 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1nku h PRO 65 N -0.35 0.00 -0.18 -0.24 0.13 -1.86 -3.06 132.00 126.44 1nku h PRO 65 Ca -0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1nku h PRO 65 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1nku h PRO 65 CO 0.03 0.23 0.08 0.28 -0.23 0.00 0.00 178.00 178.39 1nku h VAL 66 N 0.00 1.14 -0.15 1.56 2.07 -1.98 -2.44 116.25 116.45 1nku h VAL 66 Ca -0.00 -0.42 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1nku h VAL 66 Cb 0.43 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1nku h VAL 66 CO 0.03 0.14 -0.20 0.11 0.02 0.00 0.00 177.57 177.67 1nku h LYS 67 N 0.15 0.26 -0.73 1.57 1.57 -1.63 -2.38 116.57 115.39 1nku h LYS 67 Ca 0.06 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 1nku h LYS 67 Cb 0.14 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 1nku h LYS 67 CO -0.01 0.46 0.43 0.28 -0.57 0.00 0.00 179.45 180.05 1nku h VAL 68 N 0.24 1.02 0.00 0.50 2.07 -1.35 2.60 116.25 121.34 1nku h VAL 68 Ca 0.04 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 1nku h VAL 68 Cb 0.50 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1nku h VAL 68 CO 0.03 0.15 -0.54 0.00 0.02 0.00 0.00 177.57 177.23 1nku h ALA 69 N 1.35 1.00 -0.45 1.67 0.00 -1.19 -2.87 119.26 118.77 1nku h ALA 69 Ca 0.31 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1nku h ALA 69 Cb 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1nku h ALA 69 CO -0.16 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1nku n ALA 70 N -2.39 3.47 -1.81 0.00 0.00 0.08 -4.76 120.51 115.10 1nku n ALA 70 Ca -0.01 -2.05 -0.33 0.00 0.00 0.00 0.00 53.44 51.05 1nku n ALA 70 Cb 0.58 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 1nku n ALA 70 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1nku s MET 71 N -2.71 4.00 0.24 0.00 -1.94 0.85 -4.95 119.30 114.80 1nku s MET 71 Ca 0.49 1.21 0.04 0.00 -1.71 0.00 0.00 55.69 55.72 1nku s MET 71 Cb 0.38 -2.14 -0.03 0.00 2.01 0.00 0.00 34.83 35.05 1nku s MET 71 CO 0.14 -0.24 0.37 -0.65 -0.01 0.00 0.00 175.02 174.63 1nku s GLN 72 N -3.30 3.44 0.41 2.03 -0.21 -1.26 -4.98 119.66 115.79 1nku s GLN 72 Ca 0.64 -0.71 0.10 0.00 0.02 0.00 0.00 55.36 55.41 1nku s GLN 72 Cb -0.12 -2.88 0.91 0.00 1.00 0.00 0.00 33.01 31.92 1nku s GLN 72 CO 0.18 0.41 2.01 0.93 -2.12 0.00 0.00 175.29 176.70 1nku h GLU 73 N 1.21 0.52 -0.89 2.91 5.08 -2.00 -0.29 114.58 121.11 1nku h GLU 73 Ca -0.52 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 57.82 1nku h GLU 73 Cb 1.23 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 1nku h GLU 73 CO 0.62 0.34 0.58 1.49 -1.00 0.00 0.00 179.01 181.04 1nku h GLU 74 N 0.53 1.18 -0.74 2.33 4.81 -2.01 -1.49 114.58 119.19 1nku h GLU 74 Ca 0.23 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1nku h GLU 74 Cb 0.25 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1nku h GLU 74 CO -0.06 0.79 0.34 -0.44 -0.73 0.00 0.00 179.01 178.90 1nku h ASP 75 N 1.21 0.97 -0.89 1.04 3.32 -1.44 -2.31 116.42 118.33 1nku h ASP 75 Ca 0.33 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1nku h ASP 75 Cb -0.13 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.13 1nku h ASP 75 CO -0.07 0.83 0.53 0.58 -1.72 0.00 0.00 179.24 179.39 1nku h VAL 76 N 1.05 1.25 -0.63 -1.35 2.07 -1.06 -2.12 116.25 115.46 1nku h VAL 76 Ca 0.25 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1nku h VAL 76 Cb 0.13 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 1nku h VAL 76 CO -0.03 0.26 0.24 -0.33 0.02 0.00 0.00 177.57 177.73 1nku h GLU 77 N 1.22 0.92 -0.71 1.57 5.08 -1.05 -2.11 114.58 119.50 1nku h GLU 77 Ca 0.32 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1nku h GLU 77 Cb -0.04 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 1nku h GLU 77 CO -0.06 0.76 0.44 -0.09 -1.00 0.00 0.00 179.01 179.06 1nku h ARG 78 N 0.90 0.95 -0.18 2.33 2.43 -1.09 -2.05 114.38 117.68 1nku h ARG 78 Ca 0.21 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.22 1nku h ARG 78 Cb 0.20 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1nku h ARG 78 CO -0.02 0.67 -0.26 -0.07 -1.51 0.00 0.00 179.97 178.78 1nku h LEU 79 N 0.96 0.33 -1.24 3.80 3.38 -1.18 -2.66 115.31 118.70 1nku h LEU 79 Ca 0.25 -0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.29 1nku h LEU 79 Cb -0.05 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.53 1nku h LEU 79 CO -0.05 0.60 0.60 0.58 0.09 0.00 0.00 178.44 180.25 1nku h VAL 80 N 0.30 0.77 0.19 1.22 2.07 -0.71 -0.45 116.25 119.64 1nku h VAL 80 Ca 0.05 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1nku h VAL 80 Cb 0.62 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1nku h VAL 80 CO 0.04 0.12 -0.09 -0.61 0.02 0.00 0.00 177.57 177.06 1nku h GLN 81 N 0.67 -0.24 -4.57 1.57 4.15 -1.44 -3.37 115.11 111.89 1nku h GLN 81 Ca 0.49 0.02 -0.71 0.00 0.77 0.00 0.00 58.65 59.22 1nku h GLN 81 Cb 0.85 0.05 -0.20 0.00 0.21 0.00 0.00 27.48 28.39 1nku h GLN 81 CO -0.25 -0.11 -0.42 0.34 -1.93 0.00 0.00 178.83 176.45 1nku s ASP 82 N -5.02 6.11 0.00 -0.69 2.15 -0.18 -4.94 116.67 114.10 1nku s ASP 82 Ca -0.14 -0.79 0.00 0.00 0.43 0.00 0.00 52.55 52.05 1nku s ASP 82 Cb 0.05 -2.16 0.00 0.00 -0.30 0.00 0.00 42.92 40.51 1nku s ASP 82 CO 0.64 -0.42 0.00 0.00 -0.17 0.00 0.00 175.17 175.23 1nku n ALA 83 N 5.18 1.24 -1.01 3.66 0.00 -1.24 -4.72 120.51 123.62 1nku n ALA 83 Ca -0.11 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.33 1nku n ALA 83 Cb 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.92 1nku n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nku n GLY 84 N 4.09 0.12 3.61 0.00 0.00 -1.26 -4.91 105.19 106.83 1nku n GLY 84 Ca 0.00 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1nku n GLY 84 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nku s ILE 85 N -1.20 0.76 0.00 -0.61 -4.36 -1.26 -5.00 121.20 109.52 1nku s ILE 85 Ca 0.00 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1nku s ILE 85 Cb 0.00 -2.24 0.00 0.00 1.25 0.00 0.00 42.46 41.47 1nku s ILE 85 CO 0.00 0.00 0.00 0.00 0.24 0.00 0.00 174.94 175.18 1nku n ILE 86 N -1.06 0.00 -1.37 8.37 3.06 -1.26 -4.81 119.36 122.28 1nku n ILE 86 Ca -0.11 0.00 -0.37 0.00 -2.50 0.00 0.00 62.75 59.77 1nku n ILE 86 Cb 0.66 0.00 0.06 0.00 0.54 0.00 0.00 39.64 40.90 1nku n ILE 86 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1nku n ARG 87 N 0.00 0.46 -4.72 9.51 3.00 -1.26 -5.01 116.66 118.64 1nku n ARG 87 Ca 0.00 0.19 -0.32 0.00 -0.00 0.00 0.00 57.85 57.73 1nku n ARG 87 Cb 0.00 -1.89 -0.08 0.00 0.00 0.00 0.00 32.46 30.49 1nku n ARG 87 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1nku s HIS 88 N -1.80 1.90 0.00 -0.14 -3.43 -1.26 -4.43 115.29 106.14 1nku s HIS 88 Ca 0.69 -0.97 0.00 0.00 -0.80 0.00 0.00 55.06 53.97 1nku s HIS 88 Cb -0.38 -1.57 0.00 0.00 -1.43 0.00 0.00 32.58 29.20 1nku s HIS 88 CO 0.54 0.18 0.00 -2.13 -2.00 0.00 0.00 174.74 171.34 1nku n ARG 89 N -1.20 0.00 -0.01 -0.38 0.00 -1.26 -3.46 116.66 110.36 1nku n ARG 89 Ca -0.17 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.57 1nku n ARG 89 Cb 0.67 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 33.07 1nku n ARG 89 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1nku h GLY 90 N 0.00 0.14 0.76 5.14 0.00 -1.99 0.71 103.07 107.82 1nku h GLY 90 Ca 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 1nku h GLY 90 CO 0.00 0.06 -0.26 1.70 0.00 0.00 0.00 176.54 178.04 1nku h LYS 91 N 0.06 0.40 -0.80 4.80 1.63 -1.78 -2.87 116.57 118.02 1nku h LYS 91 Ca 0.03 -0.26 0.09 0.00 -0.85 0.00 0.00 60.65 59.66 1nku h LYS 91 Cb 0.06 0.03 -0.07 0.00 -0.60 0.00 0.00 32.23 31.66 1nku h LYS 91 CO -0.01 0.86 0.45 0.82 -3.45 0.00 0.00 179.45 178.12 1nku h ILE 92 N -0.01 0.91 -0.97 2.00 2.04 -1.75 0.24 117.51 119.97 1nku h ILE 92 Ca 0.00 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.65 1nku h ILE 92 Cb 0.85 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 1nku h ILE 92 CO 0.06 0.14 0.63 -0.61 0.00 0.00 0.00 178.15 178.37 1nku h GLN 93 N 0.76 1.14 -0.57 2.37 5.75 -0.80 -1.09 115.11 122.66 1nku h GLN 93 Ca 0.38 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.77 1nku h GLN 93 Cb 0.34 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 1nku h GLN 93 CO -0.24 0.75 0.18 0.00 -2.65 0.00 0.00 178.83 176.87 1nku h ALA 94 N 1.46 1.24 -0.62 3.38 0.00 -0.74 -2.52 119.26 121.46 1nku h ALA 94 Ca 0.40 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.16 1nku h ALA 94 Cb 0.10 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1nku h ALA 94 CO -0.14 0.54 0.38 0.82 0.00 0.00 0.00 179.25 180.84 1nku h ILE 95 N 0.84 1.06 -0.85 0.00 1.08 -0.52 -1.80 117.51 117.33 1nku h ILE 95 Ca 0.19 -0.25 0.02 0.00 -0.39 0.00 0.00 64.86 64.43 1nku h ILE 95 Cb 0.24 0.26 -0.05 0.00 -3.07 0.00 0.00 36.82 34.20 1nku h ILE 95 CO -0.01 0.13 0.55 0.40 -0.69 0.00 0.00 178.15 178.54 1nku h ILE 96 N 0.74 1.17 -0.67 -0.67 2.04 -1.23 -2.41 117.51 116.47 1nku h ILE 96 Ca 0.25 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1nku h ILE 96 Cb 0.04 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.06 1nku h ILE 96 CO -0.11 0.20 0.41 1.23 0.00 0.00 0.00 178.15 179.88 1nku h GLY 97 N 1.10 0.98 1.01 5.37 0.00 -1.14 -2.31 103.07 108.07 1nku h GLY 97 Ca 0.33 -0.40 0.01 0.00 0.00 0.00 0.00 47.33 47.26 1nku h GLY 97 CO -0.10 0.39 0.55 -0.57 0.00 0.00 0.00 176.54 176.81 1nku h ASN 98 N 0.92 0.96 -0.66 0.19 -1.24 -0.93 -1.44 115.58 113.38 1nku h ASN 98 Ca 0.24 -0.03 -0.08 0.00 0.71 0.00 0.00 56.30 57.15 1nku h ASN 98 Cb -0.03 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 38.75 1nku h ASN 98 CO -0.05 0.70 0.11 0.00 -1.29 0.00 0.00 177.43 176.90 1nku h ALA 99 N 1.30 0.88 -0.56 1.57 0.00 -1.19 0.13 119.26 121.39 1nku h ALA 99 Ca 0.30 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1nku h ALA 99 Cb -0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1nku h ALA 99 CO -0.07 0.64 0.14 0.00 0.00 0.00 0.00 179.25 179.97 1nku h ARG 100 N 1.01 0.89 -0.27 0.00 3.08 -0.93 -0.71 114.38 117.47 1nku h ARG 100 Ca 0.20 -0.21 -0.19 0.00 0.07 0.00 0.00 59.98 59.85 1nku h ARG 100 Cb 0.43 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1nku h ARG 100 CO 0.01 0.83 -0.59 0.00 -1.07 0.00 0.00 179.97 179.15 1nku h ALA 101 N 1.02 0.45 -0.27 0.04 0.00 -1.08 -2.53 119.26 116.90 1nku h ALA 101 Ca 0.18 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1nku h ALA 101 Cb 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1nku h ALA 101 CO 0.00 0.68 0.12 -0.92 0.00 0.00 0.00 179.25 179.13 1nku h TYR 102 N 0.65 0.40 -0.60 0.00 5.03 -0.57 -2.71 116.97 119.18 1nku h TYR 102 Ca 0.00 -0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.21 1nku h TYR 102 Cb 1.20 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 39.33 1nku h TYR 102 CO 0.07 0.40 0.06 -0.07 -1.32 0.00 0.00 178.16 177.30 1nku h LEU 103 N 0.30 0.97 -0.86 2.82 3.38 -1.15 -2.81 115.31 117.95 1nku h LEU 103 Ca 0.09 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1nku h LEU 103 Cb 0.15 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1nku h LEU 103 CO -0.01 0.99 0.56 -0.61 0.09 0.00 0.00 178.44 179.46 1nku h GLN 104 N 0.94 1.07 -0.70 1.13 4.15 -1.29 -1.96 115.11 118.45 1nku h GLN 104 Ca 0.18 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 1nku h GLN 104 Cb 0.46 -0.24 -0.03 0.00 0.21 0.00 0.00 27.48 27.88 1nku h GLN 104 CO 0.02 0.71 0.18 1.98 -1.93 0.00 0.00 178.83 179.79 1nku h MET 105 N 1.10 1.10 -0.35 1.69 4.05 -1.26 -2.68 114.93 118.58 1nku h MET 105 Ca 0.33 -0.25 -0.06 0.00 -0.28 0.00 0.00 59.70 59.44 1nku h MET 105 Cb -0.04 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.59 1nku h MET 105 CO -0.10 0.96 -0.04 1.49 0.23 0.00 0.00 176.91 179.44 1nku h GLU 106 N 1.04 0.57 -0.19 0.39 4.81 -1.14 -1.79 114.58 118.27 1nku h GLU 106 Ca 0.22 -0.14 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1nku h GLU 106 Cb 0.34 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1nku h GLU 106 CO -0.00 0.62 0.35 1.96 -0.73 0.00 0.00 179.01 181.21 1nku h GLN 107 N 0.53 0.00 0.00 1.92 4.20 -1.02 1.23 115.11 121.97 1nku h GLN 107 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1nku h GLN 107 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1nku h GLN 107 CO 0.02 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 1nku n ASN 108 N -3.35 0.00 0.00 1.46 5.03 -0.67 -4.87 115.26 112.86 1nku n ASN 108 Ca 0.02 0.36 0.00 0.00 0.87 0.00 0.00 54.58 55.83 1nku n ASN 108 Cb 0.45 -0.45 0.00 0.00 -1.02 0.00 0.00 39.78 38.77 1nku n ASN 108 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nku n GLY 109 N 1.03 0.47 3.18 7.41 0.00 0.42 -5.02 105.19 112.69 1nku n GLY 109 Ca 0.07 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 45.00 1nku n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nku s GLU 110 N -1.36 2.33 0.19 1.61 2.56 -1.25 -5.08 118.70 117.71 1nku s GLU 110 Ca 0.00 -1.45 -0.32 0.00 0.00 0.00 0.00 54.97 53.20 1nku s GLU 110 Cb 0.00 -3.41 -0.15 0.00 2.00 0.00 0.00 34.13 32.57 1nku s GLU 110 CO 0.00 -0.80 1.22 -2.30 -0.56 0.00 0.00 175.26 172.82 1nku n PRO 111 N 4.67 1.39 -0.16 4.30 -0.02 -1.26 -4.48 135.00 139.44 1nku n PRO 111 Ca -0.09 0.50 -0.09 0.00 -2.02 0.00 0.00 63.50 61.80 1nku n PRO 111 Cb 0.43 -2.03 0.01 0.00 -0.02 0.00 0.00 33.50 31.88 1nku n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1nku h PHE 112 N 3.57 0.74 -0.64 6.00 3.04 -1.95 -2.66 116.94 125.04 1nku h PHE 112 Ca -0.44 -0.07 -0.01 0.00 3.98 0.00 0.00 57.97 61.44 1nku h PHE 112 Cb 1.33 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 39.59 1nku h PHE 112 CO 0.55 0.64 0.35 0.00 -2.02 0.00 0.00 178.31 177.83 1nku h ALA 113 N 1.02 0.82 -0.68 2.41 0.00 -1.89 -2.06 119.26 118.88 1nku h ALA 113 Ca 0.16 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1nku h ALA 113 Cb 0.23 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1nku h ALA 113 CO -0.01 0.35 0.45 -0.44 0.00 0.00 0.00 179.25 179.59 1nku h ASP 114 N 0.88 0.74 -0.43 0.00 3.32 -1.89 -1.63 116.42 117.41 1nku h ASP 114 Ca 0.23 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.30 1nku h ASP 114 Cb 0.05 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 1nku h ASP 114 CO -0.04 0.53 0.19 0.15 -1.72 0.00 0.00 179.24 178.36 1nku h PHE 115 N 0.87 0.35 -0.31 4.55 3.57 -1.03 0.29 116.94 125.23 1nku h PHE 115 Ca 0.26 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 1nku h PHE 115 Cb -0.04 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1nku h PHE 115 CO -0.00 0.17 0.16 0.28 -2.23 0.00 0.00 178.31 176.69 1nku h VAL 116 N 0.39 1.14 -0.45 1.41 2.07 -1.13 -2.28 116.25 117.41 1nku h VAL 116 Ca 0.19 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1nku h VAL 116 Cb 0.12 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1nku h VAL 116 CO -0.15 0.14 0.18 -0.50 0.02 0.00 0.00 177.57 177.26 1nku h TRP 117 N 0.38 0.64 -0.68 1.57 4.06 -0.71 -2.26 115.95 118.95 1nku h TRP 117 Ca 0.11 -0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.06 1nku h TRP 117 Cb 0.08 -0.20 -0.04 0.00 -1.00 0.00 0.00 29.16 28.01 1nku h TRP 117 CO -0.03 0.50 0.45 0.77 -3.56 0.00 0.00 178.44 176.57 1nku h SER 118 N 0.64 0.72 0.19 -3.49 0.02 0.14 0.53 113.55 112.30 1nku h SER 118 Ca 0.16 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 1nku h SER 118 Cb 0.13 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1nku h SER 118 CO -0.02 0.51 -0.15 -0.26 -1.14 0.00 0.00 176.83 175.77 1nku h PHE 119 N 0.84 0.00 -0.49 3.45 -1.00 -1.19 -1.49 116.94 117.07 1nku h PHE 119 Ca 0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.04 1nku h PHE 119 Cb 0.01 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1nku h PHE 119 CO -0.00 0.15 0.00 1.33 -1.61 0.00 0.00 178.31 178.18 1nku n VAL 120 N -4.19 2.37 -2.88 -0.55 0.24 -0.48 -4.91 118.33 107.93 1nku n VAL 120 Ca -0.02 -1.49 -0.22 0.00 -2.04 0.00 0.00 64.34 60.57 1nku n VAL 120 Cb 0.22 -0.15 0.03 0.00 -1.47 0.00 0.00 33.84 32.47 1nku n VAL 120 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1nku n ASN 121 N 0.39 -6.00 -2.41 -1.34 5.15 -0.56 -1.68 115.26 108.80 1nku n ASN 121 Ca 0.25 -0.23 -0.07 0.00 -0.60 0.00 0.00 54.58 53.93 1nku n ASN 121 Cb 1.02 -4.86 -0.00 0.00 -0.53 0.00 0.00 39.78 35.40 1nku n ASN 121 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 1nku n HIS 122 N -4.40 -1.64 -3.87 1.20 -0.00 0.18 -4.87 115.22 101.81 1nku n HIS 122 Ca -0.14 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.24 1nku n HIS 122 Cb 0.63 -1.93 -0.13 0.00 -0.00 0.00 0.00 29.99 28.56 1nku n HIS 122 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 1nku s GLN 123 N -4.91 1.83 0.44 1.57 -0.44 -0.67 -5.08 119.66 112.40 1nku s GLN 123 Ca 0.00 -1.82 -0.23 0.00 -2.50 0.00 0.00 55.36 50.81 1nku s GLN 123 Cb 0.00 -3.43 -0.10 0.00 -1.64 0.00 0.00 33.01 27.83 1nku s GLN 123 CO 0.00 -1.01 0.91 -2.30 0.50 0.00 0.00 175.29 173.39 1nku n PRO 124 N 4.47 1.14 -4.37 1.67 -0.02 -1.26 -4.97 135.00 131.66 1nku n PRO 124 Ca -0.00 0.41 -0.26 0.00 -2.02 0.00 0.00 63.50 61.63 1nku n PRO 124 Cb 0.42 -1.95 -0.10 0.00 -0.02 0.00 0.00 33.50 31.84 1nku n PRO 124 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1nku s GLN 125 N -2.02 1.84 0.07 -0.52 -0.21 0.12 -5.03 119.66 113.92 1nku s GLN 125 Ca 0.65 -1.46 0.02 0.00 0.02 0.00 0.00 55.36 54.59 1nku s GLN 125 Cb -0.55 -1.99 -0.03 0.00 1.00 0.00 0.00 33.01 31.44 1nku s GLN 125 CO 0.56 0.40 -0.07 -1.64 -2.12 0.00 0.00 175.29 172.42 1nku s MET 126 N -2.99 0.68 0.20 2.91 -1.94 -1.26 -0.93 119.30 115.96 1nku s MET 126 Ca 0.25 -1.07 0.11 0.00 -1.71 0.00 0.00 55.69 53.27 1nku s MET 126 Cb -0.08 -0.20 -0.04 0.00 2.01 0.00 0.00 34.83 36.52 1nku s MET 126 CO 0.14 0.00 -0.21 -0.08 -0.01 0.00 0.00 175.02 174.86 1nku s THR 127 N -2.67 2.54 -0.41 2.05 -1.32 -0.97 -4.77 115.64 110.09 1nku s THR 127 Ca 0.02 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.59 1nku s THR 127 Cb -0.01 -2.24 0.32 0.00 -1.51 0.00 0.00 72.50 69.06 1nku s THR 127 CO -0.03 -0.15 0.85 0.00 -2.21 0.00 0.00 174.62 173.09 1nku n GLN 128 N 0.12 0.95 0.00 7.08 6.02 -1.26 -4.90 117.38 125.39 1nku n GLN 128 Ca -0.11 -2.76 0.00 0.00 -0.01 0.00 0.00 57.00 54.11 1nku n GLN 128 Cb 0.56 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.41 1nku n GLN 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nku n ALA 129 N 0.50 0.00 0.00 -1.58 0.00 -1.26 -5.01 120.51 113.16 1nku n ALA 129 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1nku n ALA 129 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1nku n ALA 129 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1nku n THR 130 N 0.00 0.00 -4.41 0.00 -1.04 -1.26 -4.45 114.28 103.12 1nku n THR 130 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 1nku n THR 130 Cb 0.00 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.39 1nku n THR 130 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1nku s THR 131 N -0.98 2.35 0.40 12.58 2.01 -1.26 -4.89 115.64 125.86 1nku s THR 131 Ca 0.00 -1.94 0.07 0.00 0.31 0.00 0.00 61.69 60.13 1nku s THR 131 Cb 0.00 -2.10 0.26 0.00 0.01 0.00 0.00 72.50 70.67 1nku s THR 131 CO 0.00 -0.05 2.04 -0.07 -0.69 0.00 0.00 174.62 175.85 1nku h LEU 132 N 3.40 0.48 -1.29 4.42 3.38 -1.95 -1.75 115.31 122.01 1nku h LEU 132 Ca -0.48 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.53 1nku h LEU 132 Cb 1.20 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.78 1nku h LEU 132 CO 0.45 0.36 0.52 -1.28 0.09 0.00 0.00 178.44 178.58 1nku h SER 133 N 0.56 0.76 -0.10 -0.43 0.87 -2.03 -0.48 113.55 112.70 1nku h SER 133 Ca 0.15 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 1nku h SER 133 Cb -0.04 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1nku h SER 133 CO -0.03 0.50 -0.00 -0.33 -0.53 0.00 0.00 176.83 176.44 1nku h GLU 134 N 0.87 0.28 -5.88 2.24 4.39 -1.73 -3.39 114.58 111.37 1nku h GLU 134 Ca 0.34 -0.04 -0.60 0.00 0.34 0.00 0.00 59.36 59.39 1nku h GLU 134 Cb 0.20 -0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 28.70 1nku h GLU 134 CO -0.11 0.31 0.47 0.42 -1.16 0.00 0.00 179.01 178.94 1nku s ILE 135 N -4.99 4.71 -0.01 3.13 1.01 -0.19 -5.02 121.20 119.84 1nku s ILE 135 Ca -0.06 1.14 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 1nku s ILE 135 Cb 0.16 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 1nku s ILE 135 CO 0.72 -0.38 1.10 -2.16 0.00 0.00 0.00 174.94 174.22 1nku s PRO 136 N 3.16 4.45 0.37 2.79 0.04 -1.26 -4.92 135.00 139.63 1nku s PRO 136 Ca 0.34 1.57 0.25 0.00 0.04 0.00 0.00 61.00 63.21 1nku s PRO 136 Cb -0.13 -3.46 0.68 0.00 0.04 0.00 0.00 34.50 31.62 1nku s PRO 136 CO 0.15 -0.24 1.72 1.15 0.04 0.00 0.00 177.00 179.82 1nku h THR 137 N 4.82 0.00 -3.17 1.26 2.02 -1.94 -3.40 112.91 112.50 1nku h THR 137 Ca -0.38 -0.70 -0.73 0.00 0.77 0.00 0.00 66.41 65.37 1nku h THR 137 Cb 1.19 1.68 -0.21 0.00 -1.74 0.00 0.00 68.15 69.07 1nku h THR 137 CO 0.81 0.00 -0.15 -0.55 0.37 0.00 0.00 175.52 176.01 1nku s SER 138 N -5.44 6.18 0.13 4.18 0.15 -1.26 -4.79 113.70 112.85 1nku s SER 138 Ca 0.07 -1.37 0.09 0.00 0.70 0.00 0.00 55.95 55.45 1nku s SER 138 Cb 0.08 -2.23 -0.04 0.00 -1.71 0.00 0.00 66.02 62.12 1nku s SER 138 CO 0.61 -0.83 -0.19 0.42 1.20 0.00 0.00 173.24 174.45 1nku s THR 139 N 2.02 2.77 0.46 6.45 -4.23 -1.26 -5.02 115.64 116.82 1nku s THR 139 Ca 0.07 -1.57 0.13 0.00 -1.18 0.00 0.00 61.69 59.14 1nku s THR 139 Cb -0.25 -2.28 0.29 0.00 1.34 0.00 0.00 72.50 71.61 1nku s THR 139 CO 0.07 0.07 2.07 1.55 -0.54 0.00 0.00 174.62 177.84 1nku h PRO 140 N 3.66 0.30 -0.12 3.99 0.13 -1.99 -1.86 132.00 136.11 1nku h PRO 140 Ca -0.50 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.46 1nku h PRO 140 Cb 1.17 -0.07 0.01 0.00 0.13 0.00 0.00 31.00 32.24 1nku h PRO 140 CO 0.46 0.20 -0.53 0.00 -0.23 0.00 0.00 178.00 177.89 1nku h ALA 141 N 1.82 0.22 -0.25 -0.56 0.00 -1.95 -1.96 119.26 116.58 1nku h ALA 141 Ca 0.13 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1nku h ALA 141 Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1nku h ALA 141 CO -0.03 0.43 0.15 1.03 0.00 0.00 0.00 179.25 180.83 1nku h SER 142 N 0.19 0.30 -0.66 0.00 0.87 -1.81 0.57 113.55 113.01 1nku h SER 142 Ca -0.03 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.45 1nku h SER 142 Cb 1.17 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 63.03 1nku h SER 142 CO 0.11 0.26 0.32 0.44 -0.53 0.00 0.00 176.83 177.43 1nku h ASP 143 N 0.32 0.87 -0.39 6.23 3.32 -1.39 0.05 116.42 125.43 1nku h ASP 143 Ca 0.09 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 1nku h ASP 143 Cb 0.01 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1nku h ASP 143 CO -0.02 0.76 -0.28 0.00 -1.72 0.00 0.00 179.24 177.98 1nku h ALA 144 N 1.15 0.55 -0.66 3.45 0.00 -0.97 -2.74 119.26 120.04 1nku h ALA 144 Ca 0.23 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1nku h ALA 144 Cb 0.12 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1nku h ALA 144 CO -0.03 0.57 0.33 1.25 0.00 0.00 0.00 179.25 181.38 1nku h LEU 145 N 0.68 0.85 -0.47 0.00 6.46 0.49 -2.11 115.31 121.21 1nku h LEU 145 Ca 0.07 -0.12 0.01 0.00 -0.12 0.00 0.00 57.88 57.72 1nku h LEU 145 Cb 0.85 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.54 1nku h LEU 145 CO 0.07 0.73 0.31 0.28 -0.62 0.00 0.00 178.44 179.21 1nku h SER 146 N 0.91 0.52 -0.45 1.25 0.02 -0.89 -1.59 113.55 113.32 1nku h SER 146 Ca 0.23 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1nku h SER 146 Cb 0.09 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1nku h SER 146 CO -0.03 0.38 0.27 0.11 -1.14 0.00 0.00 176.83 176.41 1nku h LYS 147 N 0.62 0.65 -0.27 3.45 1.57 -1.17 -1.76 116.57 119.65 1nku h LYS 147 Ca 0.18 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 1nku h LYS 147 Cb -0.05 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1nku h LYS 147 CO -0.05 0.47 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 1nku h ALA 148 N 1.64 0.37 -0.42 3.86 0.00 -0.64 -2.83 119.26 121.24 1nku h ALA 148 Ca 0.17 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1nku h ALA 148 Cb 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1nku h ALA 148 CO -0.03 0.11 0.08 -0.07 0.00 0.00 0.00 179.25 179.33 1nku h LEU 149 N 0.27 0.59 -1.70 0.00 3.38 -0.92 -1.97 115.31 114.97 1nku h LEU 149 Ca 0.08 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.01 1nku h LEU 149 Cb 0.42 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1nku h LEU 149 CO 0.01 0.61 0.30 0.11 0.09 0.00 0.00 178.44 179.57 1nku h LYS 150 N 0.62 0.36 -0.93 1.13 1.79 -1.08 -1.07 116.57 117.39 1nku h LYS 150 Ca 0.14 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1nku h LYS 150 Cb 0.27 -0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.80 1nku h LYS 150 CO 0.00 0.24 0.61 -0.22 -1.08 0.00 0.00 179.45 179.00 1nku h LYS 151 N 0.37 1.23 0.00 3.15 3.64 -1.23 -0.14 116.57 123.59 1nku h LYS 151 Ca 0.20 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1nku h LYS 151 Cb 0.31 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1nku h LYS 151 CO -0.05 0.82 -0.02 0.00 -2.27 0.00 0.00 179.45 177.94 1nku h ARG 152 N 1.26 0.00 -0.14 1.90 3.08 -1.27 -3.46 114.38 115.75 1nku h ARG 152 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1nku h ARG 152 Cb -0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1nku h ARG 152 CO -0.07 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.25 1nku n GLY 153 N -0.23 1.22 3.75 0.04 0.00 -0.06 -4.92 105.19 104.98 1nku n GLY 153 Ca -0.00 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 1nku n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nku s PHE 154 N -2.14 3.96 0.35 1.61 0.40 -1.19 -4.98 117.98 115.99 1nku s PHE 154 Ca 0.00 1.91 0.07 0.00 -0.60 0.00 0.00 56.93 58.31 1nku s PHE 154 Cb 0.00 -3.00 -0.02 0.00 0.51 0.00 0.00 43.02 40.51 1nku s PHE 154 CO 0.00 0.40 0.32 0.15 0.70 0.00 0.00 175.22 176.79 1nku s LYS 155 N -1.19 2.72 -1.29 0.44 1.02 -1.26 -4.59 119.74 115.58 1nku s LYS 155 Ca 0.41 -1.32 -0.02 0.00 0.02 0.00 0.00 55.97 55.07 1nku s LYS 155 Cb -0.26 -2.49 0.01 0.00 -0.52 0.00 0.00 37.83 34.57 1nku s LYS 155 CO 0.33 0.04 0.84 1.19 -0.92 0.00 0.00 175.35 176.83 1nku n PHE 156 N -1.42 -2.08 -1.49 3.18 3.72 -1.26 -4.89 117.46 113.21 1nku n PHE 156 Ca -0.01 0.89 0.07 0.00 -0.05 0.00 0.00 57.45 58.35 1nku n PHE 156 Cb 0.60 -4.62 0.16 0.00 -0.94 0.00 0.00 39.48 34.69 1nku n PHE 156 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 1nku n VAL 157 N -4.30 1.86 -1.03 -4.37 3.14 -1.26 -4.08 118.33 108.29 1nku n VAL 157 Ca -0.25 -2.63 -0.33 0.00 -2.96 0.00 0.00 64.34 58.17 1nku n VAL 157 Cb 0.66 -0.13 0.01 0.00 -1.06 0.00 0.00 33.84 33.32 1nku n VAL 157 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1nku n GLY 158 N -1.08 -2.91 0.35 7.55 0.00 -1.26 -4.52 105.19 103.32 1nku n GLY 158 Ca 0.16 -0.23 0.18 0.00 0.00 0.00 0.00 46.02 46.13 1nku n GLY 158 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1nku h THR 159 N -0.13 0.67 -0.68 2.61 2.02 -1.98 0.28 112.91 115.71 1nku h THR 159 Ca -0.35 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 1nku h THR 159 Cb 1.21 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 1nku h THR 159 CO 0.33 0.00 0.15 0.71 0.37 0.00 0.00 175.52 177.09 1nku h THR 160 N 0.00 1.26 -0.42 3.16 1.35 -1.95 -2.30 112.91 114.01 1nku h THR 160 Ca 0.16 -0.97 -0.06 0.00 -0.55 0.00 0.00 66.41 64.99 1nku h THR 160 Cb 0.73 0.59 -0.02 0.00 -1.73 0.00 0.00 68.15 67.72 1nku h THR 160 CO -0.00 0.37 0.01 0.40 -0.25 0.00 0.00 175.52 176.05 1nku h ILE 161 N 1.02 1.22 -0.15 6.82 2.04 -1.21 -1.46 117.51 125.78 1nku h ILE 161 Ca 0.21 -0.89 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 1nku h ILE 161 Cb 0.38 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1nku h ILE 161 CO 0.00 0.31 0.06 0.00 0.00 0.00 0.00 178.15 178.52 1nku h TYR 163 N 0.09 0.51 -0.76 0.00 3.20 -1.20 -2.12 116.97 116.69 1nku h TYR 163 Ca 0.05 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1nku h TYR 163 Cb 0.18 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 1nku h TYR 163 CO -0.01 0.50 0.50 0.77 -1.64 0.00 0.00 178.16 178.28 1nku h SER 164 N 0.38 0.83 -0.93 -2.11 0.02 -1.12 -1.09 113.55 109.53 1nku h SER 164 Ca 0.11 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1nku h SER 164 Cb 0.21 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 1nku h SER 164 CO -0.01 0.59 0.57 0.15 -1.14 0.00 0.00 176.83 176.99 1nku h PHE 165 N 0.98 1.20 -0.48 3.45 3.57 -0.28 -1.58 116.94 123.79 1nku h PHE 165 Ca 0.29 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.75 1nku h PHE 165 Cb -0.02 -0.40 -0.02 0.00 2.79 0.00 0.00 35.95 38.29 1nku h PHE 165 CO -0.00 0.79 0.10 0.52 -2.23 0.00 0.00 178.31 177.49 1nku h MET 166 N 1.27 0.74 -0.71 1.11 2.86 -0.58 0.38 114.93 119.99 1nku h MET 166 Ca 0.33 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.85 1nku h MET 166 Cb -0.08 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.43 1nku h MET 166 CO -0.07 0.68 0.46 1.96 1.06 0.00 0.00 176.91 181.00 1nku h GLN 167 N 0.71 0.88 0.00 1.72 4.20 -0.79 -1.33 115.11 120.50 1nku h GLN 167 Ca 0.16 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1nku h GLN 167 Cb 0.29 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1nku h GLN 167 CO 0.00 0.58 -0.24 0.00 -0.67 0.00 0.00 178.83 178.51 1nku h ALA 168 N 1.29 0.05 -1.01 3.87 0.00 -1.10 -1.78 119.26 120.58 1nku h ALA 168 Ca 0.28 -0.57 0.23 0.00 0.00 0.00 0.00 54.91 54.85 1nku h ALA 168 Cb -0.03 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 17.79 1nku h ALA 168 CO -0.09 0.14 0.61 0.00 0.00 0.00 0.00 179.25 179.91 1nku n GLY 170 N -1.33 0.73 0.38 0.00 0.00 -0.51 -0.30 105.19 104.16 1nku n GLY 170 Ca 0.26 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.41 1nku n GLY 170 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nku h LEU 171 N 0.00 0.56 -8.20 0.99 3.38 -1.87 -3.39 115.31 106.77 1nku h LEU 171 Ca 0.00 0.04 -0.52 0.00 0.09 0.00 0.00 57.88 57.49 1nku h LEU 171 Cb 0.00 -0.07 -0.30 0.00 0.09 0.00 0.00 40.66 40.38 1nku h LEU 171 CO 0.00 0.28 -0.82 0.54 0.09 0.00 0.00 178.44 178.52 1nku s VAL 172 N -5.58 1.23 -0.69 1.22 0.11 -1.26 -0.70 120.40 114.73 1nku s VAL 172 Ca -0.09 -0.63 -0.26 0.00 -2.93 0.00 0.00 61.98 58.06 1nku s VAL 172 Cb 0.22 -1.04 0.04 0.00 -1.53 0.00 0.00 36.38 34.06 1nku s VAL 172 CO 0.78 0.35 1.20 0.21 -3.33 0.00 0.00 175.10 174.32 1nku s ASN 173 N -0.14 6.23 -0.50 3.54 2.47 -0.11 -4.66 114.94 121.77 1nku s ASN 173 Ca 0.01 -0.41 0.04 0.00 0.42 0.00 0.00 52.86 52.92 1nku s ASN 173 Cb -0.08 -2.53 0.13 0.00 -1.45 0.00 0.00 41.25 37.31 1nku s ASN 173 CO 0.00 -1.68 0.24 -1.81 -3.72 0.00 0.00 177.10 170.13 1nku s ASP 174 N 3.53 4.43 0.00 -4.21 1.01 -1.26 -2.30 116.67 117.87 1nku s ASP 174 Ca 0.34 -2.88 0.00 0.00 0.71 0.00 0.00 52.55 50.73 1nku s ASP 174 Cb -0.09 -1.65 0.00 0.00 1.01 0.00 0.00 42.92 42.19 1nku s ASP 174 CO 0.17 -0.26 0.00 1.41 0.21 0.00 0.00 175.17 176.70 1nku n HIS 175 N 3.30 -0.07 0.00 4.23 8.25 -1.26 -4.96 115.22 124.70 1nku n HIS 175 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1nku n HIS 175 Cb 0.34 0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.69 1nku n HIS 175 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1nku n VAL 176 N -1.72 0.00 -0.08 1.59 3.14 -1.26 -4.51 118.33 115.49 1nku n VAL 176 Ca 0.00 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 1nku n VAL 176 Cb 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 32.74 1nku n VAL 176 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1nku h VAL 177 N 0.48 1.22 0.00 1.55 2.07 -1.85 -3.39 116.25 116.33 1nku h VAL 177 Ca 0.00 -0.73 -0.16 0.00 0.82 0.00 0.00 66.70 66.63 1nku h VAL 177 Cb 0.00 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1nku h VAL 177 CO 0.00 0.23 -1.59 0.61 0.02 0.00 0.00 177.57 176.84 1nku n GLY 178 N -0.49 -0.15 1.22 2.17 0.00 -1.20 -4.00 105.19 102.75 1nku n GLY 178 Ca -0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 1nku n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nku s TYR 182 N -2.01 3.21 0.00 0.00 5.04 -0.61 -5.00 117.35 117.98 1nku s TYR 182 Ca -0.01 -0.61 0.00 0.00 -2.44 0.00 0.00 57.07 54.01 1nku s TYR 182 Cb 0.00 -2.43 0.00 0.00 0.35 0.00 0.00 41.96 39.88 1nku s TYR 182 CO 0.01 -0.50 0.04 -0.35 -1.34 0.00 0.00 175.55 173.41 1nku n PRO 183 N 5.03 0.00 -0.23 4.97 -0.04 -1.26 -3.24 135.00 140.23 1nku n PRO 183 Ca -0.13 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 1nku n PRO 183 Cb 0.48 -0.94 0.00 0.00 -0.04 0.00 0.00 33.50 33.00 1nku n PRO 183 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nku n GLY 184 N 1.94 0.65 0.49 0.55 0.00 -1.26 -4.35 105.19 103.21 1nku n GLY 184 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1nku n GLY 184 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nku n ASN 185 N 0.00 -0.10 -3.56 1.61 3.02 -1.26 -5.07 115.26 109.90 1nku n ASN 185 Ca 0.00 -0.21 -0.27 0.00 -0.03 0.00 0.00 54.58 54.07 1nku n ASN 185 Cb 0.00 0.03 -0.11 0.00 -0.61 0.00 0.00 39.78 39.09 1nku n ASN 185 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1nku s LYS 186 N 0.00 1.41 0.00 3.52 -0.14 -1.26 -5.25 119.74 118.02 1nku s LYS 186 Ca 0.00 -2.50 0.31 0.00 -1.36 0.00 0.00 55.97 52.42 1nku s LYS 186 Cb 0.00 -2.08 1.64 0.00 -1.68 0.00 0.00 37.83 35.72 1nku s LYS 186 CO 0.00 -1.35 2.08 -0.35 -0.76 0.00 0.00 175.35 174.97