#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kl1 n LYS 2 N 0.00 0.00 -0.00 0.03 4.81 -1.26 -4.87 118.16 116.87 1kl1 n LYS 2 Ca 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.37 1kl1 n LYS 2 Cb 0.00 -0.48 -0.13 0.00 0.02 0.00 0.00 35.03 34.44 1kl1 n LYS 2 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1kl1 h TYR 3 N 0.00 0.00 -0.38 5.64 0.05 -2.05 -3.38 116.97 116.85 1kl1 h TYR 3 Ca 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 1kl1 h TYR 3 Cb 0.44 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 1kl1 h TYR 3 CO 0.00 0.96 0.11 1.25 -1.05 0.00 0.00 178.16 179.43 1kl1 h LEU 4 N 0.00 0.55 -0.97 3.88 5.85 -1.95 -1.21 115.31 121.47 1kl1 h LEU 4 Ca -0.23 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.37 1kl1 h LEU 4 Cb 1.93 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 42.74 1kl1 h LEU 4 CO 0.08 0.62 0.61 -0.65 -0.34 0.00 0.00 178.44 178.76 1kl1 h PRO 5 N 0.46 1.00 0.24 5.25 0.11 -1.84 0.15 132.00 137.38 1kl1 h PRO 5 Ca 0.12 -0.06 -0.33 0.00 0.11 0.00 0.00 66.00 65.84 1kl1 h PRO 5 Cb 0.27 -0.23 0.03 0.00 0.11 0.00 0.00 31.00 31.18 1kl1 h PRO 5 CO -0.00 0.66 -1.48 0.37 -0.21 0.00 0.00 178.00 177.35 1kl1 h GLN 6 N 1.03 0.51 -0.20 1.05 5.75 -1.71 -3.29 115.11 118.24 1kl1 h GLN 6 Ca 0.45 -0.87 -0.08 0.00 -0.15 0.00 0.00 58.65 58.01 1kl1 h GLN 6 Cb 0.34 0.32 -0.00 0.00 1.07 0.00 0.00 27.48 29.21 1kl1 h GLN 6 CO -0.22 1.41 -0.18 0.37 -2.65 0.00 0.00 178.83 177.56 1kl1 h GLN 7 N 0.14 0.47 -2.43 1.69 5.75 -0.97 -3.41 115.11 116.35 1kl1 h GLN 7 Ca -0.25 -0.24 -0.59 0.00 -0.15 0.00 0.00 58.65 57.42 1kl1 h GLN 7 Cb 2.15 0.01 -0.38 0.00 1.07 0.00 0.00 27.48 30.32 1kl1 h GLN 7 CO 0.26 0.81 -0.94 0.34 -2.65 0.00 0.00 178.83 176.65 1kl1 s ASP 8 N -6.25 1.74 0.27 -0.69 -1.08 0.49 -4.99 116.67 106.17 1kl1 s ASP 8 Ca -0.14 -3.04 -0.01 0.00 -0.52 0.00 0.00 52.55 48.84 1kl1 s ASP 8 Cb 0.06 -0.50 0.51 0.00 -1.46 0.00 0.00 42.92 41.53 1kl1 s ASP 8 CO 0.78 -0.18 1.81 -0.65 0.52 0.00 0.00 175.17 177.45 1kl1 h PRO 9 N 5.74 0.80 0.05 4.34 0.11 -1.73 0.07 132.00 141.38 1kl1 h PRO 9 Ca 0.24 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 1kl1 h PRO 9 Cb 0.91 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1kl1 h PRO 9 CO 0.38 0.53 -0.03 1.96 -0.21 0.00 0.00 178.00 180.64 1kl1 h GLN 10 N 0.82 -0.07 -0.56 1.05 4.20 -1.93 0.65 115.11 119.27 1kl1 h GLN 10 Ca 0.46 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.10 1kl1 h GLN 10 Cb 0.51 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 1kl1 h GLN 10 CO -0.29 0.08 0.05 0.28 -0.67 0.00 0.00 178.83 178.28 1kl1 h VAL 11 N -0.20 1.26 -0.79 -0.54 2.07 -1.85 -2.55 116.25 113.66 1kl1 h VAL 11 Ca -0.01 -1.04 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1kl1 h VAL 11 Cb 0.17 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1kl1 h VAL 11 CO 0.01 0.38 0.35 0.15 0.02 0.00 0.00 177.57 178.48 1kl1 h PHE 12 N 0.85 1.17 -0.76 1.57 3.57 -0.90 -1.24 116.94 121.19 1kl1 h PHE 12 Ca 0.17 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1kl1 h PHE 12 Cb 0.47 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 1kl1 h PHE 12 CO 0.03 0.87 0.35 0.00 -2.23 0.00 0.00 178.31 177.33 1kl1 h ALA 13 N 1.18 0.99 -0.52 2.41 0.00 -0.71 -0.71 119.26 121.90 1kl1 h ALA 13 Ca 0.27 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1kl1 h ALA 13 Cb 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1kl1 h ALA 13 CO -0.03 0.57 0.03 0.00 0.00 0.00 0.00 179.25 179.82 1kl1 h ALA 14 N 1.18 0.70 -0.58 0.00 0.00 -1.16 -0.76 119.26 118.64 1kl1 h ALA 14 Ca 0.26 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1kl1 h ALA 14 Cb 0.15 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1kl1 h ALA 14 CO -0.03 0.49 0.26 0.82 0.00 0.00 0.00 179.25 180.79 1kl1 h ILE 15 N 0.78 1.22 -0.43 0.00 2.04 -0.94 -1.58 117.51 118.60 1kl1 h ILE 15 Ca 0.15 -0.65 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1kl1 h ILE 15 Cb 0.49 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1kl1 h ILE 15 CO 0.02 0.26 -0.01 -0.33 0.00 0.00 0.00 178.15 178.08 1kl1 h GLU 16 N 0.80 0.71 -0.35 2.37 4.39 -0.92 0.90 114.58 122.49 1kl1 h GLU 16 Ca 0.20 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 1kl1 h GLU 16 Cb 0.16 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1kl1 h GLU 16 CO -0.02 0.74 0.22 1.96 -1.16 0.00 0.00 179.01 180.74 1kl1 h GLN 17 N 0.67 0.47 -0.63 2.33 4.20 -0.90 -1.25 115.11 119.99 1kl1 h GLN 17 Ca 0.13 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1kl1 h GLN 17 Cb 0.44 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.09 1kl1 h GLN 17 CO 0.02 0.34 0.31 1.49 -0.67 0.00 0.00 178.83 180.32 1kl1 h GLU 18 N 0.46 0.90 -0.42 1.46 4.57 -0.77 0.62 114.58 121.40 1kl1 h GLU 18 Ca 0.13 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1kl1 h GLU 18 Cb -0.01 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 1kl1 h GLU 18 CO -0.02 0.71 0.24 -0.09 -1.18 0.00 0.00 179.01 178.66 1kl1 h ARG 19 N 0.86 0.57 -0.25 1.92 2.43 -0.66 -0.60 114.38 118.65 1kl1 h ARG 19 Ca 0.22 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1kl1 h ARG 19 Cb 0.10 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1kl1 h ARG 19 CO -0.03 0.44 -0.18 0.87 -1.51 0.00 0.00 179.97 179.56 1kl1 h LYS 20 N 0.54 0.44 -0.36 0.20 1.57 -0.95 -2.80 116.57 115.22 1kl1 h LYS 20 Ca 0.15 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1kl1 h LYS 20 Cb 0.03 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1kl1 h LYS 20 CO -0.03 0.61 0.14 -0.09 -0.57 0.00 0.00 179.45 179.51 1kl1 h ARG 21 N 0.40 0.54 -0.57 3.15 2.43 -0.54 -0.77 114.38 119.02 1kl1 h ARG 21 Ca 0.07 -0.10 0.09 0.00 -0.81 0.00 0.00 59.98 59.23 1kl1 h ARG 21 Cb 0.55 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 1kl1 h ARG 21 CO 0.04 0.53 0.38 1.96 -1.51 0.00 0.00 179.97 181.37 1kl1 h GLN 22 N 0.43 0.37 0.21 0.20 4.20 -0.86 -1.95 115.11 117.70 1kl1 h GLN 22 Ca 0.12 -0.02 -0.32 0.00 0.06 0.00 0.00 58.65 58.49 1kl1 h GLN 22 Cb 0.19 -0.08 0.03 0.00 0.30 0.00 0.00 27.48 27.92 1kl1 h GLN 22 CO -0.01 0.25 -1.42 1.25 -0.67 0.00 0.00 178.83 178.23 1kl1 h HIS 23 N 0.38 0.80 0.00 2.96 2.76 -1.23 -3.37 115.15 117.45 1kl1 h HIS 23 Ca 0.26 -0.58 -0.09 0.00 -2.20 0.00 0.00 60.37 57.75 1kl1 h HIS 23 Cb 0.52 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 1kl1 h HIS 23 CO -0.00 1.47 -0.44 0.00 -1.30 0.00 0.00 177.93 177.66 1kl1 h ALA 24 N 0.30 0.75 -2.13 5.26 0.00 -0.61 -3.46 119.26 119.38 1kl1 h ALA 24 Ca -0.22 -0.40 -0.46 0.00 0.00 0.00 0.00 54.91 53.82 1kl1 h ALA 24 Cb 2.10 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.83 1kl1 h ALA 24 CO 0.25 0.55 -0.22 0.15 0.00 0.00 0.00 179.25 179.98 1kl1 s LYS 25 N -3.11 3.32 -0.50 0.00 -0.14 -0.79 -4.85 119.74 113.68 1kl1 s LYS 25 Ca 0.03 -0.53 -0.16 0.00 -1.36 0.00 0.00 55.97 53.95 1kl1 s LYS 25 Cb 0.08 -2.69 0.09 0.00 -1.68 0.00 0.00 37.83 33.63 1kl1 s LYS 25 CO 0.72 0.08 0.44 0.42 -0.76 0.00 0.00 175.35 176.25 1kl1 s ILE 26 N -2.30 5.20 -0.45 2.17 1.01 -0.04 -4.95 121.20 121.84 1kl1 s ILE 26 Ca 0.42 -1.16 -0.25 0.00 0.00 0.00 0.00 60.65 59.66 1kl1 s ILE 26 Cb -0.10 -4.21 0.03 0.00 0.01 0.00 0.00 42.46 38.19 1kl1 s ILE 26 CO 0.35 -0.69 0.90 -0.70 0.00 0.00 0.00 174.94 174.80 1kl1 s GLU 27 N 1.70 3.55 -0.16 2.79 2.56 -1.26 -1.29 118.70 126.60 1kl1 s GLU 27 Ca 0.04 0.17 0.17 0.00 0.00 0.00 0.00 54.97 55.35 1kl1 s GLU 27 Cb -0.26 -3.91 0.40 0.00 2.00 0.00 0.00 34.13 32.36 1kl1 s GLU 27 CO 0.06 -1.17 1.28 1.28 -0.56 0.00 0.00 175.26 176.15 1kl1 n LEU 28 N 7.03 3.06 -4.66 2.70 4.77 0.02 -4.16 117.00 125.77 1kl1 n LEU 28 Ca 0.06 -3.14 -0.43 0.00 -0.03 0.00 0.00 56.01 52.47 1kl1 n LEU 28 Cb 0.48 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1kl1 n LEU 28 CO 0.62 0.76 1.18 -0.63 -1.33 0.00 0.00 177.39 177.99 1kl1 s ILE 29 N -2.90 4.00 0.53 -0.08 1.01 -1.20 -1.05 121.20 121.52 1kl1 s ILE 29 Ca 0.37 1.23 0.21 0.00 0.00 0.00 0.00 60.65 62.45 1kl1 s ILE 29 Cb 0.32 -3.79 0.32 0.00 0.01 0.00 0.00 42.46 39.32 1kl1 s ILE 29 CO 0.05 -0.10 2.11 0.00 0.00 0.00 0.00 174.94 176.99 1kl1 h ALA 30 N 8.62 2.10 -0.15 9.38 0.00 -1.82 -2.29 119.26 135.09 1kl1 h ALA 30 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1kl1 h ALA 30 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1kl1 h ALA 30 CO 0.96 -0.22 0.00 -1.13 0.00 0.00 0.00 179.25 178.85 1kl1 n SER 31 N -4.38 1.53 -4.89 0.00 3.41 -1.26 -4.81 113.62 103.22 1kl1 n SER 31 Ca 0.01 -1.69 -0.20 0.00 -0.26 0.00 0.00 58.87 56.73 1kl1 n SER 31 Cb 0.27 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 1kl1 n SER 31 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1kl1 s GLU 32 N -1.81 2.62 0.29 4.33 2.02 -0.86 -4.37 118.70 120.92 1kl1 s GLU 32 Ca 0.32 -1.44 -0.19 0.00 0.02 0.00 0.00 54.97 53.69 1kl1 s GLU 32 Cb 0.17 -2.45 0.07 0.00 0.10 0.00 0.00 34.13 32.02 1kl1 s GLU 32 CO 0.26 -0.13 0.92 1.21 0.02 0.00 0.00 175.26 177.54 1kl1 s ASN 33 N -4.12 0.02 -0.16 -0.19 3.84 -1.26 -3.88 114.94 109.19 1kl1 s ASN 33 Ca 0.47 -0.94 0.02 0.00 0.21 0.00 0.00 52.86 52.62 1kl1 s ASN 33 Cb -0.05 0.68 0.01 0.00 -0.55 0.00 0.00 41.25 41.34 1kl1 s ASN 33 CO 0.28 -1.35 -0.20 -0.36 -2.79 0.00 0.00 177.10 172.68 1kl1 s PHE 34 N -2.12 2.73 0.62 0.43 0.08 -1.26 -4.97 117.98 113.48 1kl1 s PHE 34 Ca 0.19 -1.42 -0.10 0.00 0.12 0.00 0.00 56.93 55.72 1kl1 s PHE 34 Cb -0.04 -1.87 -0.02 0.00 -0.57 0.00 0.00 43.02 40.53 1kl1 s PHE 34 CO 0.09 -0.67 1.00 0.14 -0.10 0.00 0.00 175.22 175.67 1kl1 s VAL 35 N 1.00 4.25 0.87 -0.44 -7.23 -1.26 -4.99 120.40 112.61 1kl1 s VAL 35 Ca -0.02 0.55 -0.12 0.00 -1.81 0.00 0.00 61.98 60.58 1kl1 s VAL 35 Cb -0.15 -3.70 0.11 0.00 0.56 0.00 0.00 36.38 33.20 1kl1 s VAL 35 CO -0.06 -0.87 1.12 -0.94 -0.31 0.00 0.00 175.10 174.04 1kl1 s SER 36 N -4.24 3.90 0.29 4.85 1.04 -1.26 -4.92 113.70 113.36 1kl1 s SER 36 Ca 0.55 1.12 0.03 0.00 0.48 0.00 0.00 55.95 58.13 1kl1 s SER 36 Cb -0.11 -1.77 0.43 0.00 0.10 0.00 0.00 66.02 64.67 1kl1 s SER 36 CO 0.51 -2.33 1.72 0.03 0.98 0.00 0.00 173.24 174.15 1kl1 h ARG 37 N -1.34 0.43 -0.73 4.02 3.08 -1.99 -2.42 114.38 115.43 1kl1 h ARG 37 Ca -0.49 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.35 1kl1 h ARG 37 Cb 1.30 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.30 1kl1 h ARG 37 CO 0.61 0.67 0.28 0.00 -1.07 0.00 0.00 179.97 180.46 1kl1 h ALA 38 N 1.33 0.95 -0.38 0.04 0.00 -1.99 -0.94 119.26 118.27 1kl1 h ALA 38 Ca 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1kl1 h ALA 38 Cb 0.69 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1kl1 h ALA 38 CO 0.05 0.58 0.15 0.28 0.00 0.00 0.00 179.25 180.31 1kl1 h VAL 39 N 1.05 1.20 -0.80 0.00 2.07 -1.81 -1.86 116.25 116.11 1kl1 h VAL 39 Ca 0.24 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1kl1 h VAL 39 Cb 0.22 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1kl1 h VAL 39 CO -0.02 0.22 0.40 0.24 0.02 0.00 0.00 177.57 178.43 1kl1 h MET 40 N 0.47 1.14 -0.88 1.57 2.07 -1.31 -2.22 114.93 115.77 1kl1 h MET 40 Ca 0.13 -0.16 -0.01 0.00 -2.07 0.00 0.00 59.70 57.59 1kl1 h MET 40 Cb 0.20 -0.21 -0.04 0.00 -1.87 0.00 0.00 31.60 29.68 1kl1 h MET 40 CO -0.01 0.87 0.50 0.93 1.07 0.00 0.00 176.91 180.27 1kl1 h GLU 41 N 1.12 1.21 -0.70 1.72 5.08 -0.98 0.42 114.58 122.46 1kl1 h GLU 41 Ca 0.28 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1kl1 h GLU 41 Cb 0.09 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1kl1 h GLU 41 CO -0.04 0.87 0.30 0.00 -1.00 0.00 0.00 179.01 179.14 1kl1 h ALA 42 N 1.27 0.90 0.00 3.43 0.00 -0.96 -2.25 119.26 121.65 1kl1 h ALA 42 Ca 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1kl1 h ALA 42 Cb -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1kl1 h ALA 42 CO -0.05 0.50 -0.01 1.96 0.00 0.00 0.00 179.25 181.65 1kl1 h GLN 43 N 0.99 0.00 -0.76 0.00 4.20 -0.81 -2.74 115.11 115.98 1kl1 h GLN 43 Ca 0.23 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 1kl1 h GLN 43 Cb 0.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1kl1 h GLN 43 CO -0.02 0.01 0.02 0.41 -0.67 0.00 0.00 178.83 178.58 1kl1 n GLY 44 N 0.53 2.46 3.98 3.46 0.00 0.08 -4.81 105.19 110.88 1kl1 n GLY 44 Ca 0.02 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 1kl1 n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kl1 s SER 45 N -0.47 4.54 0.00 1.61 1.04 -1.04 -4.99 113.70 114.40 1kl1 s SER 45 Ca 0.33 -0.14 0.19 0.00 0.48 0.00 0.00 55.95 56.81 1kl1 s SER 45 Cb 0.26 -0.37 1.02 0.00 0.10 0.00 0.00 66.02 67.02 1kl1 s SER 45 CO 0.10 -1.72 1.54 1.33 0.98 0.00 0.00 173.24 175.46 1kl1 n VAL 46 N -2.79 0.25 0.27 5.02 0.24 -1.26 -3.20 118.33 116.85 1kl1 n VAL 46 Ca 0.12 0.06 0.13 0.00 -2.04 0.00 0.00 64.34 62.62 1kl1 n VAL 46 Cb 0.60 -0.76 0.66 0.00 -1.47 0.00 0.00 33.84 32.87 1kl1 n VAL 46 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1kl1 h LEU 47 N 0.00 0.00 -1.95 1.34 4.07 -1.93 -1.82 115.31 115.01 1kl1 h LEU 47 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1kl1 h LEU 47 Cb 0.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.83 1kl1 h LEU 47 CO 0.00 0.00 -0.06 0.00 -1.08 0.00 0.00 178.44 177.30 1kl1 h THR 48 N 0.00 0.26 0.00 0.22 1.03 -1.91 -2.81 112.91 109.71 1kl1 h THR 48 Ca 0.00 -0.46 0.00 0.00 -0.01 0.00 0.00 66.41 65.94 1kl1 h THR 48 Cb 0.15 1.35 0.00 0.00 -1.07 0.00 0.00 68.15 68.59 1kl1 h THR 48 CO 0.00 0.06 0.00 0.59 -0.01 0.00 0.00 175.52 176.16 1kl1 n ASN 49 N -3.32 0.00 -4.66 0.00 5.03 -0.68 -4.81 115.26 106.81 1kl1 n ASN 49 Ca -0.01 0.46 -0.36 0.00 0.87 0.00 0.00 54.58 55.53 1kl1 n ASN 49 Cb 0.24 -0.48 -0.09 0.00 -1.02 0.00 0.00 39.78 38.42 1kl1 n ASN 49 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1kl1 s LYS 50 N -2.97 4.07 -0.07 3.52 2.47 -1.06 -5.07 119.74 120.64 1kl1 s LYS 50 Ca 0.11 -0.27 -0.29 0.00 -1.56 0.00 0.00 55.97 53.96 1kl1 s LYS 50 Cb 0.14 -3.51 -0.02 0.00 -1.46 0.00 0.00 37.83 32.98 1kl1 s LYS 50 CO 0.39 0.09 0.96 0.71 0.16 0.00 0.00 175.35 177.66 1kl1 s TYR 51 N 0.97 3.57 -0.34 4.03 2.02 -1.26 -4.77 117.35 121.57 1kl1 s TYR 51 Ca 0.07 1.58 0.16 0.00 -0.37 0.00 0.00 57.07 58.51 1kl1 s TYR 51 Cb -0.13 -3.12 0.44 0.00 -0.40 0.00 0.00 41.96 38.75 1kl1 s TYR 51 CO 0.04 -0.12 1.02 0.00 -1.57 0.00 0.00 175.55 174.92 1kl1 n ALA 52 N 4.51 2.86 -1.74 3.71 0.00 -1.26 -4.82 120.51 123.77 1kl1 n ALA 52 Ca 0.07 -2.75 -0.37 0.00 0.00 0.00 0.00 53.44 50.38 1kl1 n ALA 52 Cb 0.50 -0.95 0.06 0.00 0.00 0.00 0.00 19.45 19.06 1kl1 n ALA 52 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1kl1 s GLU 53 N -2.38 2.69 0.28 0.00 2.02 -1.26 -4.58 118.70 115.47 1kl1 s GLU 53 Ca 0.27 2.13 0.00 0.00 0.02 0.00 0.00 54.97 57.39 1kl1 s GLU 53 Cb 0.44 -1.96 0.00 0.00 0.10 0.00 0.00 34.13 32.72 1kl1 s GLU 53 CO 0.01 -1.51 0.00 0.41 0.02 0.00 0.00 175.26 174.19 1kl1 n GLY 54 N 0.87 -1.78 3.45 -1.39 0.00 -1.26 -1.68 105.19 103.40 1kl1 n GLY 54 Ca 0.14 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 44.04 1kl1 n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1kl1 s TYR 55 N 0.00 2.01 -0.01 1.61 1.51 -0.99 -4.91 117.35 116.57 1kl1 s TYR 55 Ca 0.00 -0.78 -0.37 0.00 -1.01 0.00 0.00 57.07 54.91 1kl1 s TYR 55 Cb 0.00 -1.23 -0.15 0.00 -0.11 0.00 0.00 41.96 40.47 1kl1 s TYR 55 CO 0.00 0.21 1.56 -2.30 -1.11 0.00 0.00 175.55 173.90 1kl1 n PRO 56 N -0.65 1.48 -0.84 -1.71 -0.02 -1.26 -0.14 135.00 131.86 1kl1 n PRO 56 Ca -0.04 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1kl1 n PRO 56 Cb 0.65 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1kl1 n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kl1 n GLY 57 N 3.35 1.03 2.66 -1.23 0.00 -1.26 -4.82 105.19 104.93 1kl1 n GLY 57 Ca 0.21 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.14 1kl1 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kl1 n ARG 58 N -2.00 1.15 -2.85 1.61 5.12 0.81 -5.13 116.66 115.37 1kl1 n ARG 58 Ca 0.00 -2.97 -0.24 0.00 -1.93 0.00 0.00 57.85 52.71 1kl1 n ARG 58 Cb 0.00 -1.02 0.02 0.00 -1.16 0.00 0.00 32.46 30.30 1kl1 n ARG 58 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1kl1 s ARG 59 N -2.45 3.01 -0.12 5.56 1.81 -1.12 -2.36 118.95 123.29 1kl1 s ARG 59 Ca 0.26 -0.41 0.16 0.00 -1.72 0.00 0.00 55.73 54.02 1kl1 s ARG 59 Cb 0.45 -2.50 0.60 0.00 -0.45 0.00 0.00 34.95 33.05 1kl1 s ARG 59 CO 0.01 -0.38 1.52 0.66 -0.68 0.00 0.00 175.30 176.43 1kl1 n TYR 60 N -2.19 1.19 -3.84 -0.53 4.01 -0.67 -4.91 117.16 110.22 1kl1 n TYR 60 Ca 0.02 -0.66 -0.13 0.00 -0.16 0.00 0.00 57.90 56.98 1kl1 n TYR 60 Cb 0.58 -0.24 -0.14 0.00 -0.31 0.00 0.00 39.34 39.23 1kl1 n TYR 60 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1kl1 s TYR 61 N -1.98 -0.07 0.94 -0.72 2.02 -1.26 -4.96 117.35 111.33 1kl1 s TYR 61 Ca 0.44 0.18 -0.14 0.00 -0.37 0.00 0.00 57.07 57.18 1kl1 s TYR 61 Cb 0.30 -0.01 0.16 0.00 -0.40 0.00 0.00 41.96 42.01 1kl1 s TYR 61 CO 0.18 -0.05 1.17 0.20 -1.57 0.00 0.00 175.55 175.49 1kl1 s GLY 62 N 0.20 1.62 -0.42 0.71 0.00 -1.26 -4.26 107.32 103.91 1kl1 s GLY 62 Ca -0.01 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 43.99 1kl1 s GLY 62 CO -0.01 -0.09 0.00 0.61 0.00 0.00 0.00 173.10 173.61 1kl1 n GLY 63 N -2.50 0.68 1.35 0.20 0.00 -1.26 -4.92 105.19 98.74 1kl1 n GLY 63 Ca 0.09 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.33 1kl1 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl1 h GLU 65 N 3.74 0.80 0.03 0.00 3.07 -1.94 0.18 114.58 120.46 1kl1 h GLU 65 Ca 0.00 -0.05 -0.30 0.00 -0.50 0.00 0.00 59.36 58.51 1kl1 h GLU 65 Cb 1.13 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 28.82 1kl1 h GLU 65 CO 0.12 0.53 -1.71 1.88 -1.40 0.00 0.00 179.01 178.43 1kl1 h TYR 66 N 0.83 0.12 0.00 4.33 0.99 -2.01 -3.21 116.97 118.02 1kl1 h TYR 66 Ca 0.52 -0.09 -0.03 0.00 2.00 0.00 0.00 58.73 61.12 1kl1 h TYR 66 Cb 0.68 -0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.40 1kl1 h TYR 66 CO -0.02 1.18 -0.17 -0.39 -0.00 0.00 0.00 178.16 178.76 1kl1 h VAL 67 N 0.02 0.39 -0.65 -2.88 -1.51 -1.79 -2.19 116.25 107.64 1kl1 h VAL 67 Ca -0.29 -1.00 -0.08 0.00 -1.23 0.00 0.00 66.70 64.09 1kl1 h VAL 67 Cb 2.01 1.74 -0.03 0.00 -2.13 0.00 0.00 31.29 32.88 1kl1 h VAL 67 CO 0.09 0.16 0.10 0.44 -1.23 0.00 0.00 177.57 177.14 1kl1 h ASP 68 N 0.00 1.03 -0.32 4.19 3.45 -0.72 -1.04 116.42 123.00 1kl1 h ASP 68 Ca -0.00 -0.26 -0.01 0.00 0.43 0.00 0.00 57.03 57.19 1kl1 h ASP 68 Cb 0.73 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 1kl1 h ASP 68 CO 0.02 1.03 0.17 0.40 -1.57 0.00 0.00 179.24 179.29 1kl1 h ILE 69 N 0.99 1.15 -0.47 0.35 2.04 -1.41 -1.66 117.51 118.49 1kl1 h ILE 69 Ca 0.20 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1kl1 h ILE 69 Cb 0.44 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1kl1 h ILE 69 CO 0.01 0.15 0.28 0.58 0.00 0.00 0.00 178.15 179.18 1kl1 h VAL 70 N 0.39 1.06 -0.52 1.67 2.07 -1.18 -0.35 116.25 119.39 1kl1 h VAL 70 Ca 0.11 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 1kl1 h VAL 70 Cb 0.09 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1kl1 h VAL 70 CO -0.02 0.10 0.06 -0.08 0.02 0.00 0.00 177.57 177.66 1kl1 h GLU 71 N 0.57 0.84 -0.26 1.57 4.81 -1.04 -1.84 114.58 119.23 1kl1 h GLU 71 Ca 0.19 -0.20 -0.15 0.00 -0.13 0.00 0.00 59.36 59.06 1kl1 h GLU 71 Cb 0.00 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1kl1 h GLU 71 CO -0.08 0.80 -0.45 0.93 -0.73 0.00 0.00 179.01 179.48 1kl1 h GLU 72 N 0.80 0.68 -0.33 1.92 4.39 -1.04 0.27 114.58 121.27 1kl1 h GLU 72 Ca 0.16 -0.38 0.01 0.00 0.34 0.00 0.00 59.36 59.49 1kl1 h GLU 72 Cb 0.39 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.04 1kl1 h GLU 72 CO 0.01 1.00 0.20 -0.07 -1.16 0.00 0.00 179.01 178.98 1kl1 h LEU 73 N 0.55 0.32 -0.13 1.33 3.38 -0.87 0.30 115.31 120.18 1kl1 h LEU 73 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1kl1 h LEU 73 Cb 1.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1kl1 h LEU 73 CO 0.09 0.24 0.09 0.00 0.09 0.00 0.00 178.44 178.95 1kl1 h ALA 74 N 1.14 0.17 -0.46 1.53 0.00 -0.97 -0.50 119.26 120.16 1kl1 h ALA 74 Ca 0.13 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1kl1 h ALA 74 Cb -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1kl1 h ALA 74 CO -0.05 -0.34 0.18 0.00 0.00 0.00 0.00 179.25 179.04 1kl1 h ARG 75 N 0.17 0.69 -0.26 0.00 3.08 -0.72 -1.03 114.38 116.32 1kl1 h ARG 75 Ca 0.05 -0.13 -0.15 0.00 0.07 0.00 0.00 59.98 59.82 1kl1 h ARG 75 Cb -0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1kl1 h ARG 75 CO -0.01 0.63 -0.45 0.93 -1.07 0.00 0.00 179.97 180.00 1kl1 h GLU 76 N 0.60 0.67 -0.33 0.04 4.39 -0.29 -1.67 114.58 117.99 1kl1 h GLU 76 Ca 0.15 -0.37 -0.10 0.00 0.34 0.00 0.00 59.36 59.38 1kl1 h GLU 76 Cb 0.20 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1kl1 h GLU 76 CO -0.01 0.98 -0.23 0.00 -1.16 0.00 0.00 179.01 178.60 1kl1 h ARG 77 N 0.54 0.64 -0.49 2.33 3.08 -1.01 -1.63 114.38 117.84 1kl1 h ARG 77 Ca 0.03 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1kl1 h ARG 77 Cb 1.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1kl1 h ARG 77 CO 0.09 0.81 0.28 0.00 -1.07 0.00 0.00 179.97 180.08 1kl1 h ALA 78 N 1.19 0.62 -0.60 0.04 0.00 -1.00 -0.43 119.26 119.09 1kl1 h ALA 78 Ca 0.08 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1kl1 h ALA 78 Cb 0.69 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1kl1 h ALA 78 CO 0.05 0.13 0.15 0.87 0.00 0.00 0.00 179.25 180.45 1kl1 h LYS 79 N 0.64 0.93 -0.43 0.00 1.57 -1.05 -0.93 116.57 117.31 1kl1 h LYS 79 Ca 0.17 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 1kl1 h LYS 79 Cb 0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1kl1 h LYS 79 CO -0.03 0.83 -0.19 0.37 -0.57 0.00 0.00 179.45 179.86 1kl1 h GLN 80 N 0.89 0.84 -0.21 3.15 4.15 -1.09 0.62 115.11 123.46 1kl1 h GLN 80 Ca 0.19 -0.33 -0.03 0.00 0.77 0.00 0.00 58.65 59.25 1kl1 h GLN 80 Cb 0.32 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 1kl1 h GLN 80 CO -0.00 0.96 0.00 1.25 -1.93 0.00 0.00 178.83 179.11 1kl1 h LEU 81 N 0.73 0.36 0.00 -2.39 5.85 -0.56 -3.36 115.31 115.93 1kl1 h LEU 81 Ca 0.11 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1kl1 h LEU 81 Cb 0.71 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1kl1 h LEU 81 CO 0.05 0.58 -0.69 0.49 -0.34 0.00 0.00 178.44 178.54 1kl1 n PHE 82 N -4.68 0.00 -1.89 1.25 3.72 -0.40 -4.75 117.46 110.70 1kl1 n PHE 82 Ca -0.04 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.27 1kl1 n PHE 82 Cb 0.23 -0.05 -0.01 0.00 -0.94 0.00 0.00 39.48 38.71 1kl1 n PHE 82 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1kl1 n GLY 83 N 1.37 0.33 3.87 1.37 0.00 0.22 -4.82 105.19 107.52 1kl1 n GLY 83 Ca 0.01 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 1kl1 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl1 s ALA 84 N -2.41 3.20 0.19 4.61 0.00 -1.24 -4.96 121.76 121.15 1kl1 s ALA 84 Ca 0.00 -0.10 0.11 0.00 0.00 0.00 0.00 51.96 51.97 1kl1 s ALA 84 Cb 0.00 -2.92 0.22 0.00 0.00 0.00 0.00 23.12 20.42 1kl1 s ALA 84 CO 0.00 -0.32 1.52 0.93 0.00 0.00 0.00 175.76 177.90 1kl1 h GLU 85 N 0.56 0.00 -3.46 0.00 5.08 -1.93 -3.45 114.58 111.38 1kl1 h GLU 85 Ca -0.46 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 57.75 1kl1 h GLU 85 Cb 1.19 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.23 1kl1 h GLU 85 CO 0.62 0.69 -0.48 -1.58 -1.00 0.00 0.00 179.01 177.26 1kl1 s HIS 86 N -3.32 0.00 0.05 4.33 5.04 -0.61 -4.74 115.29 116.04 1kl1 s HIS 86 Ca -0.00 -0.04 0.04 0.00 -1.54 0.00 0.00 55.06 53.52 1kl1 s HIS 86 Cb 0.11 -0.03 -0.02 0.00 0.04 0.00 0.00 32.58 32.68 1kl1 s HIS 86 CO 0.77 -0.27 -0.12 0.00 -2.34 0.00 0.00 174.74 172.77 1kl1 s ALA 87 N -1.21 1.01 -0.21 1.58 0.00 -1.26 -1.71 121.76 119.95 1kl1 s ALA 87 Ca -0.13 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1kl1 s ALA 87 Cb -0.07 -0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.00 1kl1 s ALA 87 CO 0.02 0.15 -0.06 1.21 0.00 0.00 0.00 175.76 177.07 1kl1 s ASN 88 N -1.35 3.55 -0.04 0.00 3.04 0.26 -4.95 114.94 115.45 1kl1 s ASN 88 Ca -0.02 -1.01 0.19 0.00 0.04 0.00 0.00 52.86 52.07 1kl1 s ASN 88 Cb -0.09 -1.14 0.61 0.00 -1.54 0.00 0.00 41.25 39.10 1kl1 s ASN 88 CO 0.01 -0.20 1.52 1.33 -3.04 0.00 0.00 177.10 176.72 1kl1 n VAL 89 N 4.72 1.27 0.29 -5.21 0.24 -1.26 -1.34 118.33 117.03 1kl1 n VAL 89 Ca -0.13 -1.08 0.12 0.00 -2.04 0.00 0.00 64.34 61.21 1kl1 n VAL 89 Cb 0.45 0.38 0.13 0.00 -1.47 0.00 0.00 33.84 33.33 1kl1 n VAL 89 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1kl1 h GLN 90 N 3.82 0.00 -6.39 7.34 4.20 -1.95 -3.46 115.11 118.67 1kl1 h GLN 90 Ca 0.00 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 58.08 1kl1 h GLN 90 Cb 1.09 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.93 1kl1 h GLN 90 CO 0.07 0.00 0.56 -2.30 -0.67 0.00 0.00 178.83 176.49 1kl1 n PRO 91 N -2.65 1.57 0.26 1.46 -0.02 -1.26 -4.74 135.00 129.63 1kl1 n PRO 91 Ca 0.02 0.56 0.14 0.00 -2.02 0.00 0.00 63.50 62.21 1kl1 n PRO 91 Cb 0.51 -2.23 0.61 0.00 -0.02 0.00 0.00 33.50 32.37 1kl1 n PRO 91 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1kl1 h HIS 92 N 4.82 0.00 -2.76 6.00 3.86 -1.92 -0.71 115.15 124.45 1kl1 h HIS 92 Ca -0.46 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 58.83 1kl1 h HIS 92 Cb 1.30 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.75 1kl1 h HIS 92 CO 0.60 0.10 0.39 -1.54 0.86 0.00 0.00 177.93 178.34 1kl1 s SER 93 N -5.92 -0.06 0.23 2.45 1.04 -1.26 -4.16 113.70 106.02 1kl1 s SER 93 Ca 0.00 -0.83 -0.05 0.00 0.48 0.00 0.00 55.95 55.55 1kl1 s SER 93 Cb 0.10 0.68 0.22 0.00 0.10 0.00 0.00 66.02 67.12 1kl1 s SER 93 CO 0.58 -1.32 1.73 1.23 0.98 0.00 0.00 173.24 176.44 1kl1 h GLY 94 N 2.00 1.05 0.98 7.32 0.00 -1.82 -1.06 103.07 111.54 1kl1 h GLY 94 Ca -0.28 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.36 1kl1 h GLY 94 CO 0.35 0.63 0.29 0.00 0.00 0.00 0.00 176.54 177.81 1kl1 h ALA 95 N 1.17 0.66 -0.03 3.60 0.00 -1.95 -1.28 119.26 121.43 1kl1 h ALA 95 Ca 0.18 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1kl1 h ALA 95 Cb 0.42 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1kl1 h ALA 95 CO 0.01 0.17 -0.52 1.96 0.00 0.00 0.00 179.25 180.87 1kl1 h GLN 96 N 0.68 0.08 -0.02 0.00 7.50 -1.89 0.01 115.11 121.48 1kl1 h GLN 96 Ca 0.18 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.28 1kl1 h GLN 96 Cb 0.04 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.57 1kl1 h GLN 96 CO -0.03 0.58 0.01 0.00 -1.50 0.00 0.00 178.83 177.89 1kl1 h ALA 97 N 1.41 0.03 -0.51 3.87 0.00 -0.85 -1.47 119.26 121.74 1kl1 h ALA 97 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1kl1 h ALA 97 Cb 0.94 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1kl1 h ALA 97 CO 0.07 -0.38 0.33 -0.91 0.00 0.00 0.00 179.25 178.36 1kl1 h ASN 98 N -0.14 0.59 -0.77 0.00 2.35 -1.09 -2.70 115.58 113.83 1kl1 h ASN 98 Ca 0.01 -0.03 0.07 0.00 -0.55 0.00 0.00 56.30 55.80 1kl1 h ASN 98 Cb 0.18 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 1kl1 h ASN 98 CO -0.00 0.45 0.45 -0.03 -1.65 0.00 0.00 177.43 176.65 1kl1 h MET 99 N 0.69 0.79 -0.49 0.81 4.05 -0.85 -1.58 114.93 118.35 1kl1 h MET 99 Ca 0.19 -0.05 -0.11 0.00 -0.28 0.00 0.00 59.70 59.45 1kl1 h MET 99 Cb -0.05 -0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 30.55 1kl1 h MET 99 CO -0.04 0.52 -0.12 0.00 0.23 0.00 0.00 176.91 177.50 1kl1 h ALA 100 N 1.39 0.85 -0.22 0.39 0.00 -1.09 0.37 119.26 120.96 1kl1 h ALA 100 Ca 0.35 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1kl1 h ALA 100 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1kl1 h ALA 100 CO -0.19 0.65 0.05 0.28 0.00 0.00 0.00 179.25 180.04 1kl1 h VAL 101 N 0.82 1.21 -0.75 0.00 2.07 -1.13 -1.02 116.25 117.44 1kl1 h VAL 101 Ca 0.13 -0.66 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1kl1 h VAL 101 Cb 0.66 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 1kl1 h VAL 101 CO 0.05 0.21 0.48 1.88 0.02 0.00 0.00 177.57 180.21 1kl1 h TYR 102 N 0.17 0.91 -0.29 1.57 0.05 -1.12 -1.68 116.97 116.58 1kl1 h TYR 102 Ca 0.07 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 1kl1 h TYR 102 Cb 0.27 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.69 1kl1 h TYR 102 CO 0.01 0.53 0.11 0.35 -1.05 0.00 0.00 178.16 178.12 1kl1 h PHE 103 N 0.95 0.39 -0.05 4.88 3.57 -0.71 -0.59 116.94 125.38 1kl1 h PHE 103 Ca 0.30 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.77 1kl1 h PHE 103 Cb -0.02 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 1kl1 h PHE 103 CO -0.03 0.32 -0.04 1.15 -2.23 0.00 0.00 178.31 177.47 1kl1 h THR 104 N 0.40 1.37 -0.00 4.41 2.02 -0.31 -3.39 112.91 117.40 1kl1 h THR 104 Ca 0.10 -1.17 0.00 0.00 0.77 0.00 0.00 66.41 66.12 1kl1 h THR 104 Cb 0.09 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1kl1 h THR 104 CO -0.01 0.32 -0.65 1.33 0.37 0.00 0.00 175.52 176.88 1kl1 n VAL 105 N -4.76 0.00 -4.25 3.16 0.24 -0.77 -5.01 118.33 106.93 1kl1 n VAL 105 Ca -0.08 -0.18 -0.29 0.00 -2.04 0.00 0.00 64.34 61.76 1kl1 n VAL 105 Cb 0.28 1.01 -0.10 0.00 -1.47 0.00 0.00 33.84 33.56 1kl1 n VAL 105 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1kl1 s LEU 106 N -2.62 2.94 0.16 1.34 1.43 -0.24 -5.01 118.68 116.67 1kl1 s LEU 106 Ca 0.06 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 1kl1 s LEU 106 Cb 0.11 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 1kl1 s LEU 106 CO 0.57 0.16 0.26 -1.61 0.23 0.00 0.00 176.35 175.97 1kl1 s GLU 107 N -2.30 3.34 0.14 1.70 2.02 -1.26 -4.70 118.70 117.64 1kl1 s GLU 107 Ca 0.21 -0.66 -0.35 0.00 0.02 0.00 0.00 54.97 54.20 1kl1 s GLU 107 Cb -0.11 -2.90 -0.15 0.00 0.10 0.00 0.00 34.13 31.07 1kl1 s GLU 107 CO 0.13 0.51 1.42 1.58 0.02 0.00 0.00 175.26 178.92 1kl1 n HIS 108 N -0.58 1.85 -0.45 1.61 -0.00 -1.26 -1.56 115.22 114.83 1kl1 n HIS 108 Ca -0.07 0.48 0.00 0.00 -0.00 0.00 0.00 57.72 58.13 1kl1 n HIS 108 Cb 0.54 -2.42 0.00 0.00 -0.00 0.00 0.00 29.99 28.11 1kl1 n HIS 108 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1kl1 n GLY 109 N 2.77 1.17 3.75 1.57 0.00 0.75 -5.00 105.19 110.20 1kl1 n GLY 109 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1kl1 n GLY 109 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1kl1 s ASP 110 N -3.09 4.65 0.00 1.61 1.01 -0.60 -4.05 116.67 116.20 1kl1 s ASP 110 Ca 0.00 2.18 -0.23 0.00 0.71 0.00 0.00 52.55 55.21 1kl1 s ASP 110 Cb 0.00 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1kl1 s ASP 110 CO 0.00 -1.95 0.69 -0.89 0.21 0.00 0.00 175.17 173.23 1kl1 s THR 111 N -2.15 4.86 -0.02 -1.27 2.01 -1.26 -0.28 115.64 117.54 1kl1 s THR 111 Ca 0.71 1.44 0.04 0.00 0.31 0.00 0.00 61.69 64.19 1kl1 s THR 111 Cb -0.25 -4.03 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 1kl1 s THR 111 CO 0.43 0.37 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.89 1kl1 s VAL 112 N 0.05 1.16 -0.21 3.82 1.01 -0.24 -1.22 120.40 124.76 1kl1 s VAL 112 Ca 0.35 -0.62 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1kl1 s VAL 112 Cb -0.19 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 1kl1 s VAL 112 CO 0.20 0.33 -0.03 -0.22 0.00 0.00 0.00 175.10 175.38 1kl1 s LEU 113 N -0.24 3.01 0.28 3.92 2.96 -0.61 -0.82 118.68 127.18 1kl1 s LEU 113 Ca 0.04 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.65 1kl1 s LEU 113 Cb -0.07 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 1kl1 s LEU 113 CO -0.00 0.01 0.18 -0.83 -1.32 0.00 0.00 176.35 174.39 1kl1 s GLY 114 N 1.32 1.93 0.22 7.98 0.00 -0.52 0.20 107.32 118.45 1kl1 s GLY 114 Ca 0.04 -1.82 -0.30 0.00 0.00 0.00 0.00 44.72 42.64 1kl1 s GLY 114 CO -0.01 -1.50 1.27 -0.29 0.00 0.00 0.00 173.10 172.57 1kl1 s MET 115 N -3.83 4.42 -0.07 2.90 1.75 -1.26 -1.43 119.30 121.78 1kl1 s MET 115 Ca 0.38 2.03 -0.38 0.00 -1.25 0.00 0.00 55.69 56.47 1kl1 s MET 115 Cb 0.05 -3.18 -0.16 0.00 2.84 0.00 0.00 34.83 34.38 1kl1 s MET 115 CO 0.18 -0.17 1.54 -1.71 -0.65 0.00 0.00 175.02 174.21 1kl1 n ASN 116 N 2.20 2.07 0.17 1.11 2.85 0.18 -3.99 115.26 119.84 1kl1 n ASN 116 Ca 0.04 1.09 0.11 0.00 -0.11 0.00 0.00 54.58 55.71 1kl1 n ASN 116 Cb 0.43 -1.18 0.63 0.00 1.24 0.00 0.00 39.78 40.89 1kl1 n ASN 116 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1kl1 h LEU 117 N 5.89 0.05 -0.57 1.20 4.07 -1.91 0.21 115.31 124.25 1kl1 h LEU 117 Ca -0.47 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1kl1 h LEU 117 Cb 1.32 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 43.05 1kl1 h LEU 117 CO 0.86 0.04 -0.11 -1.54 -1.08 0.00 0.00 178.44 176.61 1kl1 n SER 118 N -4.50 1.00 -0.69 -0.43 3.41 -1.26 -3.39 113.62 107.76 1kl1 n SER 118 Ca 0.01 -1.06 0.08 0.00 -0.26 0.00 0.00 58.87 57.63 1kl1 n SER 118 Cb 0.22 0.03 0.10 0.00 -0.26 0.00 0.00 64.21 64.29 1kl1 n SER 118 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1kl1 n HIS 119 N -0.43 0.14 0.00 7.33 8.25 -0.02 -3.69 115.22 126.80 1kl1 n HIS 119 Ca 0.16 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1kl1 n HIS 119 Cb 0.31 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1kl1 n HIS 119 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1kl1 n GLY 120 N 0.91 1.03 3.73 -1.41 0.00 -1.00 -4.76 105.19 103.69 1kl1 n GLY 120 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1kl1 n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kl1 s GLY 121 N -0.46 2.31 0.44 -0.02 0.00 -0.70 -0.34 107.32 108.56 1kl1 s GLY 121 Ca 0.00 0.81 -0.03 0.00 0.00 0.00 0.00 44.72 45.50 1kl1 s GLY 121 CO 0.00 1.20 0.71 -1.58 0.00 0.00 0.00 173.10 173.43 1kl1 s HIS 122 N -2.05 3.52 0.33 1.90 5.65 -1.26 -4.55 115.29 118.81 1kl1 s HIS 122 Ca 0.73 0.63 0.08 0.00 0.25 0.00 0.00 55.06 56.75 1kl1 s HIS 122 Cb -0.27 -2.19 0.81 0.00 -1.18 0.00 0.00 32.58 29.75 1kl1 s HIS 122 CO 0.44 -0.18 1.79 1.25 -0.65 0.00 0.00 174.74 177.39 1kl1 h LEU 123 N 0.38 0.71 -0.04 8.88 5.85 -1.95 0.19 115.31 129.34 1kl1 h LEU 123 Ca -0.48 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1kl1 h LEU 123 Cb 1.21 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1kl1 h LEU 123 CO 0.61 0.25 0.00 0.35 -0.34 0.00 0.00 178.44 179.31 1kl1 n THR 124 N -4.72 0.01 -1.49 1.05 -2.24 -1.26 -1.76 114.28 103.88 1kl1 n THR 124 Ca 0.23 -0.01 -0.29 0.00 -2.27 0.00 0.00 64.05 61.70 1kl1 n THR 124 Cb 0.61 -0.10 0.09 0.00 -2.10 0.00 0.00 70.33 68.82 1kl1 n THR 124 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1kl1 n HIS 125 N -0.58 2.95 0.00 4.78 8.25 0.67 -4.77 115.22 126.52 1kl1 n HIS 125 Ca 0.06 -2.63 0.00 0.00 -0.26 0.00 0.00 57.72 54.89 1kl1 n HIS 125 Cb 0.04 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.06 1kl1 n HIS 125 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1kl1 n GLY 126 N -0.91 1.14 3.72 -1.41 0.00 -1.22 -4.76 105.19 101.75 1kl1 n GLY 126 Ca 0.56 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.16 1kl1 n GLY 126 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1kl1 n SER 127 N 0.00 3.09 0.06 1.61 2.88 -0.72 -3.97 113.62 116.57 1kl1 n SER 127 Ca 0.00 1.21 0.09 0.00 -1.33 0.00 0.00 58.87 58.84 1kl1 n SER 127 Cb 0.00 -1.53 0.38 0.00 -0.75 0.00 0.00 64.21 62.32 1kl1 n SER 127 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1kl1 n PRO 128 N 0.51 0.09 -0.26 -1.46 -0.04 -1.26 -1.58 135.00 130.99 1kl1 n PRO 128 Ca 0.04 0.35 0.08 0.00 -0.04 0.00 0.00 63.50 63.92 1kl1 n PRO 128 Cb 0.37 -1.68 0.22 0.00 -0.04 0.00 0.00 33.50 32.37 1kl1 n PRO 128 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1kl1 n VAL 129 N -1.85 1.06 -4.24 0.52 0.24 -1.26 -4.49 118.33 108.32 1kl1 n VAL 129 Ca 0.03 -1.03 -0.23 0.00 -2.04 0.00 0.00 64.34 61.07 1kl1 n VAL 129 Cb 0.18 0.47 -0.07 0.00 -1.47 0.00 0.00 33.84 32.96 1kl1 n VAL 129 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1kl1 s ASN 130 N -1.02 4.80 0.36 -1.34 3.84 -0.62 -5.03 114.94 115.94 1kl1 s ASN 130 Ca 0.33 -0.52 0.07 0.00 0.21 0.00 0.00 52.86 52.95 1kl1 s ASN 130 Cb 0.18 -1.00 0.78 0.00 -0.55 0.00 0.00 41.25 40.66 1kl1 s ASN 130 CO 0.22 0.00 1.92 2.19 -2.79 0.00 0.00 177.10 178.64 1kl1 h PHE 131 N 1.88 0.78 -0.24 0.43 -0.00 -1.92 -2.13 116.94 115.73 1kl1 h PHE 131 Ca -0.46 0.02 0.05 0.00 -0.00 0.00 0.00 57.97 57.58 1kl1 h PHE 131 Cb 1.24 -0.25 -0.04 0.00 -0.00 0.00 0.00 35.95 36.90 1kl1 h PHE 131 CO 0.65 0.36 -0.05 0.66 -0.00 0.00 0.00 178.31 179.93 1kl1 h SER 132 N 0.73 -0.20 0.79 -0.68 4.64 -1.86 0.18 113.55 117.15 1kl1 h SER 132 Ca 0.37 0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.64 1kl1 h SER 132 Cb 0.45 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 1kl1 h SER 132 CO -0.14 -0.07 -0.53 1.23 -0.87 0.00 0.00 176.83 176.45 1kl1 h GLY 133 N 0.01 0.00 1.25 -0.77 0.00 -1.07 -2.22 103.07 100.27 1kl1 h GLY 133 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.12 1kl1 h GLY 133 CO -0.24 0.00 -1.43 -2.08 0.00 0.00 0.00 176.54 172.79 1kl1 h VAL 134 N 0.00 1.28 0.13 4.60 2.07 -1.09 -3.37 116.25 119.87 1kl1 h VAL 134 Ca -0.01 -2.65 -0.28 0.00 0.82 0.00 0.00 66.70 64.59 1kl1 h VAL 134 Cb 1.07 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.82 1kl1 h VAL 134 CO 0.07 0.80 -1.25 -0.61 0.02 0.00 0.00 177.57 176.59 1kl1 h GLN 135 N 0.17 0.27 -5.60 1.57 5.75 -0.70 -3.47 115.11 113.11 1kl1 h GLN 135 Ca -0.24 -0.47 -0.53 0.00 -0.15 0.00 0.00 58.65 57.26 1kl1 h GLN 135 Cb 2.12 0.17 -0.14 0.00 1.07 0.00 0.00 27.48 30.71 1kl1 h GLN 135 CO 0.27 1.22 -0.66 0.71 -2.65 0.00 0.00 178.83 177.72 1kl1 s TYR 136 N -2.65 2.11 -0.76 3.99 2.02 -0.84 -0.18 117.35 121.05 1kl1 s TYR 136 Ca -0.04 -0.67 -0.18 0.00 -0.37 0.00 0.00 57.07 55.80 1kl1 s TYR 136 Cb 0.07 -1.25 0.13 0.00 -0.40 0.00 0.00 41.96 40.51 1kl1 s TYR 136 CO 0.88 0.34 0.89 1.21 -1.57 0.00 0.00 175.55 177.30 1kl1 s ASN 137 N -3.51 6.44 0.04 2.29 2.47 0.62 -4.55 114.94 118.74 1kl1 s ASN 137 Ca 0.31 -1.82 -0.21 0.00 0.42 0.00 0.00 52.86 51.56 1kl1 s ASN 137 Cb 0.04 -2.33 -0.06 0.00 -1.45 0.00 0.00 41.25 37.45 1kl1 s ASN 137 CO 0.14 -1.04 0.62 -0.36 -3.72 0.00 0.00 177.10 172.74 1kl1 s PHE 138 N 2.38 3.75 0.17 0.43 0.40 -1.26 -1.08 117.98 122.77 1kl1 s PHE 138 Ca 0.21 1.28 0.10 0.00 -0.60 0.00 0.00 56.93 57.93 1kl1 s PHE 138 Cb -0.14 -2.60 -0.04 0.00 0.51 0.00 0.00 43.02 40.74 1kl1 s PHE 138 CO -0.01 0.44 -0.22 0.14 0.70 0.00 0.00 175.22 176.27 1kl1 s VAL 139 N -0.57 2.12 0.10 -0.44 -7.23 0.00 -4.94 120.40 109.44 1kl1 s VAL 139 Ca 0.31 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.61 1kl1 s VAL 139 Cb -0.19 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 1kl1 s VAL 139 CO 0.19 -0.17 -0.19 0.00 -0.31 0.00 0.00 175.10 174.62 1kl1 s ALA 140 N -1.74 1.68 0.18 1.32 0.00 -1.26 -1.44 121.76 120.51 1kl1 s ALA 140 Ca 0.18 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 50.98 1kl1 s ALA 140 Cb -0.07 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 1kl1 s ALA 140 CO 0.08 0.30 0.07 1.52 0.00 0.00 0.00 175.76 177.73 1kl1 s TYR 141 N -1.30 2.97 0.47 0.00 -0.85 -0.51 -4.84 117.35 113.29 1kl1 s TYR 141 Ca 0.06 -0.10 0.02 0.00 -0.52 0.00 0.00 57.07 56.53 1kl1 s TYR 141 Cb -0.09 -1.42 -0.02 0.00 0.38 0.00 0.00 41.96 40.81 1kl1 s TYR 141 CO 0.04 0.53 0.05 0.20 -1.52 0.00 0.00 175.55 174.85 1kl1 s GLY 142 N -3.12 2.88 0.23 5.49 0.00 -1.26 -0.65 107.32 110.88 1kl1 s GLY 142 Ca 0.29 -0.71 0.04 0.00 0.00 0.00 0.00 44.72 44.35 1kl1 s GLY 142 CO 0.21 -2.06 0.35 -1.34 0.00 0.00 0.00 173.10 170.27 1kl1 s VAL 143 N -3.00 5.26 0.37 1.40 -7.23 -1.26 -1.46 120.40 114.47 1kl1 s VAL 143 Ca 0.13 -0.91 -0.28 0.00 -1.81 0.00 0.00 61.98 59.10 1kl1 s VAL 143 Cb 0.02 -3.84 -0.11 0.00 0.56 0.00 0.00 36.38 33.01 1kl1 s VAL 143 CO 0.08 -0.30 1.42 -0.62 -0.31 0.00 0.00 175.10 175.37 1kl1 s ASP 144 N -3.85 6.46 0.56 4.85 -1.08 0.02 -4.76 116.67 118.87 1kl1 s ASP 144 Ca 0.34 2.93 0.24 0.00 -0.52 0.00 0.00 52.55 55.54 1kl1 s ASP 144 Cb -0.09 -2.66 1.59 0.00 -1.46 0.00 0.00 42.92 40.30 1kl1 s ASP 144 CO 0.29 -0.78 2.20 -0.65 0.52 0.00 0.00 175.17 176.76 1kl1 h PRO 145 N 3.09 0.00 0.00 4.34 0.11 -1.97 -0.72 132.00 136.85 1kl1 h PRO 145 Ca -0.50 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 65.24 1kl1 h PRO 145 Cb 1.24 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 1kl1 h PRO 145 CO 0.64 0.01 -2.29 0.39 -0.21 0.00 0.00 178.00 176.55 1kl1 n GLU 146 N -4.08 0.52 0.16 1.05 4.71 -1.26 -4.64 120.64 117.10 1kl1 n GLU 146 Ca -0.03 0.18 0.09 0.00 -0.01 0.00 0.00 57.16 57.39 1kl1 n GLU 146 Cb 0.10 -1.38 0.08 0.00 -1.01 0.00 0.00 31.44 29.22 1kl1 n GLU 146 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 1kl1 h THR 147 N -0.49 0.24 -0.88 2.62 1.35 -1.97 -3.45 112.91 110.34 1kl1 h THR 147 Ca -0.55 -1.37 -0.38 0.00 -0.55 0.00 0.00 66.41 63.56 1kl1 h THR 147 Cb 1.63 1.99 -0.15 0.00 -1.73 0.00 0.00 68.15 69.89 1kl1 h THR 147 CO -0.24 0.14 -0.34 1.41 -0.25 0.00 0.00 175.52 176.23 1kl1 n HIS 148 N -3.02 0.00 -3.70 4.73 8.25 -0.27 -4.07 115.22 117.13 1kl1 n HIS 148 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 1kl1 n HIS 148 Cb 0.61 -3.14 -0.06 0.00 1.12 0.00 0.00 29.99 28.52 1kl1 n HIS 148 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1kl1 s VAL 149 N -2.67 5.28 0.09 1.59 1.01 -1.26 -4.70 120.40 119.73 1kl1 s VAL 149 Ca 0.00 0.47 -0.36 0.00 0.00 0.00 0.00 61.98 62.09 1kl1 s VAL 149 Cb 0.00 -3.55 -0.17 0.00 0.00 0.00 0.00 36.38 32.65 1kl1 s VAL 149 CO 0.00 0.57 1.21 -0.38 0.00 0.00 0.00 175.10 176.50 1kl1 n ILE 150 N 1.79 0.28 -2.89 2.22 5.41 -1.26 -0.80 119.36 124.12 1kl1 n ILE 150 Ca -0.16 -0.07 -0.43 0.00 1.00 0.00 0.00 62.75 63.09 1kl1 n ILE 150 Cb 0.54 -0.62 -0.04 0.00 -0.71 0.00 0.00 39.64 38.80 1kl1 n ILE 150 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1kl1 s ASP 151 N 0.22 6.19 0.51 4.38 3.68 -0.54 -4.75 116.67 126.36 1kl1 s ASP 151 Ca 0.82 -1.08 0.24 0.00 2.13 0.00 0.00 52.55 54.66 1kl1 s ASP 151 Cb -1.00 -2.41 1.38 0.00 -1.45 0.00 0.00 42.92 39.45 1kl1 s ASP 151 CO 0.50 -1.39 2.08 1.88 0.13 0.00 0.00 175.17 178.37 1kl1 h TYR 152 N 9.50 0.00 -0.21 -5.34 -1.99 -1.89 0.33 116.97 117.38 1kl1 h TYR 152 Ca -0.27 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.35 1kl1 h TYR 152 Cb 1.07 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.79 1kl1 h TYR 152 CO 0.96 0.12 -0.36 -0.44 -0.00 0.00 0.00 178.16 178.44 1kl1 h ASP 153 N 0.00 0.46 -0.15 3.88 3.32 -1.97 -1.40 116.42 120.56 1kl1 h ASP 153 Ca -0.00 -0.19 -0.17 0.00 0.02 0.00 0.00 57.03 56.69 1kl1 h ASP 153 Cb 0.27 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1kl1 h ASP 153 CO 0.02 0.79 -0.53 -0.78 -1.72 0.00 0.00 179.24 177.02 1kl1 h ASP 154 N 0.38 0.82 -0.31 6.45 3.58 -1.35 -0.90 116.42 125.09 1kl1 h ASP 154 Ca 0.04 -0.43 0.04 0.00 0.42 0.00 0.00 57.03 57.10 1kl1 h ASP 154 Cb 0.81 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 41.59 1kl1 h ASP 154 CO 0.07 1.19 0.09 0.58 -2.88 0.00 0.00 179.24 178.29 1kl1 h VAL 155 N 0.57 0.89 -0.51 2.25 2.07 -0.95 -1.16 116.25 119.41 1kl1 h VAL 155 Ca 0.02 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 1kl1 h VAL 155 Cb 1.10 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1kl1 h VAL 155 CO 0.11 0.04 0.04 -0.09 0.02 0.00 0.00 177.57 177.69 1kl1 h ARG 156 N 0.22 0.87 -0.31 1.57 2.43 -1.16 -0.90 114.38 117.09 1kl1 h ARG 156 Ca 0.14 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 1kl1 h ARG 156 Cb 0.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1kl1 h ARG 156 CO -0.16 0.88 0.04 1.49 -1.51 0.00 0.00 179.97 180.71 1kl1 h GLU 157 N 0.75 0.52 -0.59 0.20 4.81 -0.98 -0.57 114.58 118.72 1kl1 h GLU 157 Ca 0.15 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1kl1 h GLU 157 Cb 0.46 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1kl1 h GLU 157 CO 0.02 0.63 0.23 0.87 -0.73 0.00 0.00 179.01 180.03 1kl1 h LYS 158 N 0.34 0.89 -0.41 1.92 1.79 -1.19 -0.47 116.57 119.44 1kl1 h LYS 158 Ca 0.09 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1kl1 h LYS 158 Cb 0.37 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 1kl1 h LYS 158 CO 0.01 0.77 0.24 0.00 -1.08 0.00 0.00 179.45 179.39 1kl1 h ALA 159 N 1.08 0.53 -0.22 3.86 0.00 -0.99 -0.14 119.26 123.38 1kl1 h ALA 159 Ca 0.20 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1kl1 h ALA 159 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1kl1 h ALA 159 CO -0.01 0.03 -0.28 0.00 0.00 0.00 0.00 179.25 178.99 1kl1 h ARG 160 N 0.54 0.42 0.04 0.00 3.08 -0.86 0.10 114.38 117.71 1kl1 h ARG 160 Ca 0.15 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1kl1 h ARG 160 Cb 0.02 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1kl1 h ARG 160 CO -0.03 0.67 -0.02 1.25 -1.07 0.00 0.00 179.97 180.77 1kl1 h LEU 161 N 0.37 -0.05 0.00 3.04 5.85 -0.94 -3.37 115.31 120.22 1kl1 h LEU 161 Ca 0.05 -0.62 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1kl1 h LEU 161 Cb 0.69 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1kl1 h LEU 161 CO 0.05 0.65 -0.57 1.41 -0.34 0.00 0.00 178.44 179.63 1kl1 n HIS 162 N -4.78 0.50 -3.71 1.25 8.25 -0.08 -5.00 115.22 111.65 1kl1 n HIS 162 Ca -0.08 0.15 -0.28 0.00 -0.26 0.00 0.00 57.72 57.24 1kl1 n HIS 162 Cb 0.33 -0.62 0.02 0.00 1.12 0.00 0.00 29.99 30.83 1kl1 n HIS 162 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1kl1 n ARG 163 N -2.04 -1.12 -2.06 -0.41 5.12 0.36 -4.91 116.66 111.59 1kl1 n ARG 163 Ca 0.04 0.61 -0.35 0.00 -1.93 0.00 0.00 57.85 56.22 1kl1 n ARG 163 Cb 0.43 -3.44 0.02 0.00 -1.16 0.00 0.00 32.46 28.31 1kl1 n ARG 163 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1kl1 s PRO 164 N -5.56 3.11 0.18 5.56 0.04 -1.26 -4.85 135.00 132.22 1kl1 s PRO 164 Ca 0.27 1.58 0.09 0.00 0.04 0.00 0.00 61.00 62.98 1kl1 s PRO 164 Cb -0.12 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.38 1kl1 s PRO 164 CO 0.88 -1.03 1.36 -0.22 0.04 0.00 0.00 177.00 178.03 1kl1 h LYS 165 N 0.78 0.00 -4.04 4.56 3.64 -1.51 -3.40 116.57 116.60 1kl1 h LYS 165 Ca -0.49 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 58.62 1kl1 h LYS 165 Cb 1.26 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 32.81 1kl1 h LYS 165 CO 0.56 0.84 -0.73 -1.17 -2.27 0.00 0.00 179.45 176.67 1kl1 s LEU 166 N -6.74 2.04 -0.10 5.20 2.96 -1.24 -1.19 118.68 119.62 1kl1 s LEU 166 Ca 0.01 -0.12 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1kl1 s LEU 166 Cb 0.10 -0.11 -0.02 0.00 0.50 0.00 0.00 46.19 46.66 1kl1 s LEU 166 CO 0.79 -0.01 -0.16 -0.63 -1.32 0.00 0.00 176.35 175.02 1kl1 s ILE 167 N -0.26 2.81 -0.14 6.68 1.01 -0.18 -1.57 121.20 129.55 1kl1 s ILE 167 Ca -0.01 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1kl1 s ILE 167 Cb -0.02 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 1kl1 s ILE 167 CO -0.00 0.55 -0.06 -0.69 0.00 0.00 0.00 174.94 174.74 1kl1 s VAL 168 N -0.00 3.67 0.11 2.92 1.01 0.13 -0.98 120.40 127.26 1kl1 s VAL 168 Ca -0.05 -0.45 0.11 0.00 0.00 0.00 0.00 61.98 61.59 1kl1 s VAL 168 Cb -0.14 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1kl1 s VAL 168 CO 0.04 0.52 -0.27 0.00 0.00 0.00 0.00 175.10 175.39 1kl1 s ALA 169 N 0.17 2.33 0.00 5.51 0.00 -0.22 -4.07 121.76 125.48 1kl1 s ALA 169 Ca -0.03 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.51 1kl1 s ALA 169 Cb -0.14 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.58 1kl1 s ALA 169 CO 0.03 0.53 0.00 0.00 0.00 0.00 0.00 175.76 176.33 1kl1 n ALA 170 N 1.11 0.00 -3.48 0.00 0.00 -1.26 -0.78 120.51 116.10 1kl1 n ALA 170 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 1kl1 n ALA 170 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.94 1kl1 n ALA 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kl1 s ALA 171 N -2.12 -0.66 -0.81 0.00 0.00 -1.26 -4.66 121.76 112.26 1kl1 s ALA 171 Ca 0.00 -0.64 0.21 0.00 0.00 0.00 0.00 51.96 51.53 1kl1 s ALA 171 Cb 0.00 0.97 -0.20 0.00 0.00 0.00 0.00 23.12 23.89 1kl1 s ALA 171 CO 0.00 -0.94 0.86 0.43 0.00 0.00 0.00 175.76 176.11 1kl1 n SER 172 N -0.45 0.78 -2.69 0.00 7.64 0.54 -4.51 113.62 114.93 1kl1 n SER 172 Ca -0.03 -0.75 -0.08 0.00 1.01 0.00 0.00 58.87 59.02 1kl1 n SER 172 Cb 0.61 1.13 0.08 0.00 -1.01 0.00 0.00 64.21 65.02 1kl1 n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kl1 n ALA 173 N -1.65 2.03 -3.80 -0.43 0.00 -1.06 -4.99 120.51 110.60 1kl1 n ALA 173 Ca 0.03 -2.00 -0.34 0.00 0.00 0.00 0.00 53.44 51.12 1kl1 n ALA 173 Cb 0.38 -0.98 -0.14 0.00 0.00 0.00 0.00 19.45 18.70 1kl1 n ALA 173 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1kl1 s TYR 174 N -1.07 3.11 -2.07 0.00 5.04 -1.26 -4.56 117.35 116.54 1kl1 s TYR 174 Ca 0.24 -1.75 0.17 0.00 -2.44 0.00 0.00 57.07 53.29 1kl1 s TYR 174 Cb 0.42 -2.03 0.89 0.00 0.35 0.00 0.00 41.96 41.59 1kl1 s TYR 174 CO -0.04 -0.78 1.59 -0.35 -1.34 0.00 0.00 175.55 174.64 1kl1 n PRO 175 N 4.61 1.20 -4.46 4.97 -0.04 -1.26 -4.90 135.00 135.12 1kl1 n PRO 175 Ca -0.16 -0.30 -0.25 0.00 -0.04 0.00 0.00 63.50 62.75 1kl1 n PRO 175 Cb 0.46 -1.29 -0.10 0.00 -0.04 0.00 0.00 33.50 32.53 1kl1 n PRO 175 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1kl1 s ARG 176 N -1.93 1.89 0.36 0.54 1.81 -1.26 0.16 118.95 120.51 1kl1 s ARG 176 Ca 0.26 -1.83 -0.28 0.00 -1.72 0.00 0.00 55.73 52.16 1kl1 s ARG 176 Cb 0.13 -1.80 -0.10 0.00 -0.45 0.00 0.00 34.95 32.72 1kl1 s ARG 176 CO 0.20 0.19 1.36 0.42 -0.68 0.00 0.00 175.30 176.79 1kl1 s ILE 177 N -2.55 2.48 -0.12 1.52 1.01 -1.26 -4.90 121.20 117.38 1kl1 s ILE 177 Ca 0.33 0.48 -0.10 0.00 0.00 0.00 0.00 60.65 61.36 1kl1 s ILE 177 Cb -0.00 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.12 1kl1 s ILE 177 CO 0.17 0.11 0.20 -0.63 0.00 0.00 0.00 174.94 174.78 1kl1 s ILE 178 N -1.16 5.39 -0.79 2.92 1.01 -1.26 -5.01 121.20 122.30 1kl1 s ILE 178 Ca 0.52 0.34 -0.18 0.00 0.00 0.00 0.00 60.65 61.33 1kl1 s ILE 178 Cb -0.42 -3.49 0.13 0.00 0.01 0.00 0.00 42.46 38.69 1kl1 s ILE 178 CO 0.55 0.55 0.94 -0.62 0.00 0.00 0.00 174.94 176.36 1kl1 s ASP 179 N -0.56 6.48 0.36 3.58 -1.08 -1.26 -4.88 116.67 119.31 1kl1 s ASP 179 Ca 0.15 -1.86 0.12 0.00 -0.52 0.00 0.00 52.55 50.44 1kl1 s ASP 179 Cb -0.13 -2.35 0.69 0.00 -1.46 0.00 0.00 42.92 39.68 1kl1 s ASP 179 CO 0.04 -1.05 1.81 -0.26 0.52 0.00 0.00 175.17 176.24 1kl1 h PHE 180 N 8.84 0.01 -0.76 -5.34 0.05 -1.96 -2.64 116.94 115.16 1kl1 h PHE 180 Ca -0.02 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.76 1kl1 h PHE 180 Cb 1.05 -0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.96 1kl1 h PHE 180 CO 1.04 0.39 0.46 0.00 -0.18 0.00 0.00 178.31 180.02 1kl1 h ALA 181 N 1.61 0.97 -0.45 2.45 0.00 -1.95 -0.42 119.26 121.46 1kl1 h ALA 181 Ca -0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1kl1 h ALA 181 Cb 0.68 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1kl1 h ALA 181 CO 0.05 0.43 -0.26 0.87 0.00 0.00 0.00 179.25 180.34 1kl1 h LYS 182 N 1.04 0.98 -0.74 0.00 1.57 -1.91 -0.72 116.57 116.78 1kl1 h LYS 182 Ca 0.27 -0.45 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1kl1 h LYS 182 Cb -0.04 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 1kl1 h LYS 182 CO -0.05 1.12 0.48 0.74 -0.57 0.00 0.00 179.45 181.16 1kl1 h PHE 183 N 0.82 0.90 -0.31 -1.35 0.04 -1.13 -1.09 116.94 114.82 1kl1 h PHE 183 Ca 0.10 0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.76 1kl1 h PHE 183 Cb 0.85 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.69 1kl1 h PHE 183 CO 0.06 0.53 -0.34 -0.09 -0.60 0.00 0.00 178.31 177.87 1kl1 h ARG 184 N 0.95 0.68 -0.80 1.51 9.65 -0.91 -0.86 114.38 124.59 1kl1 h ARG 184 Ca 0.29 -0.32 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1kl1 h ARG 184 Cb -0.03 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.51 1kl1 h ARG 184 CO -0.09 0.92 0.50 1.49 2.80 0.00 0.00 179.97 185.59 1kl1 h GLU 185 N 0.57 1.07 -0.32 0.20 4.81 -0.63 0.04 114.58 120.32 1kl1 h GLU 185 Ca 0.06 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.11 1kl1 h GLU 185 Cb 0.85 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1kl1 h GLU 185 CO 0.07 0.74 -0.16 0.82 -0.73 0.00 0.00 179.01 179.75 1kl1 h ILE 186 N 1.09 1.29 -0.69 2.32 2.04 -0.92 -1.71 117.51 120.92 1kl1 h ILE 186 Ca 0.29 -1.27 0.02 0.00 1.00 0.00 0.00 64.86 64.90 1kl1 h ILE 186 Cb -0.08 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 1kl1 h ILE 186 CO -0.06 0.41 0.45 0.00 0.00 0.00 0.00 178.15 178.95 1kl1 h ALA 187 N 0.77 0.89 -0.63 1.87 0.00 -0.91 -1.57 119.26 119.69 1kl1 h ALA 187 Ca 0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1kl1 h ALA 187 Cb 0.70 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1kl1 h ALA 187 CO 0.05 0.25 0.16 -0.44 0.00 0.00 0.00 179.25 179.26 1kl1 h ASP 188 N 0.89 0.93 -0.98 0.00 3.45 -0.91 0.20 116.42 120.00 1kl1 h ASP 188 Ca 0.27 -0.18 0.05 0.00 0.43 0.00 0.00 57.03 57.60 1kl1 h ASP 188 Cb -0.04 -0.24 -0.06 0.00 -0.56 0.00 0.00 39.33 38.43 1kl1 h ASP 188 CO -0.08 0.90 0.64 -0.08 -1.57 0.00 0.00 179.24 179.04 1kl1 h GLU 189 N 0.94 1.16 -0.23 3.56 4.81 -0.34 -3.03 114.58 121.45 1kl1 h GLU 189 Ca 0.20 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1kl1 h GLU 189 Cb 0.33 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1kl1 h GLU 189 CO -0.00 0.77 0.00 1.33 -0.73 0.00 0.00 179.01 180.38 1kl1 n VAL 190 N -4.47 0.39 -2.94 0.32 0.24 -0.90 -4.98 118.33 105.99 1kl1 n VAL 190 Ca 0.14 -0.70 -0.11 0.00 -2.04 0.00 0.00 64.34 61.63 1kl1 n VAL 190 Cb 0.14 1.03 0.03 0.00 -1.47 0.00 0.00 33.84 33.57 1kl1 n VAL 190 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1kl1 n GLY 191 N 1.05 0.21 3.74 7.63 0.00 0.18 -4.91 105.19 113.10 1kl1 n GLY 191 Ca 0.14 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 1kl1 n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kl1 s ALA 192 N -3.09 3.43 0.65 4.61 0.00 0.47 -4.92 121.76 122.92 1kl1 s ALA 192 Ca 0.25 -1.23 -0.13 0.00 0.00 0.00 0.00 51.96 50.86 1kl1 s ALA 192 Cb -0.11 -1.24 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 1kl1 s ALA 192 CO 0.31 0.55 1.05 0.71 0.00 0.00 0.00 175.76 178.39 1kl1 s TYR 193 N -1.65 3.10 -0.14 0.00 2.02 -0.34 -4.44 117.35 115.90 1kl1 s TYR 193 Ca 0.29 1.45 0.01 0.00 -0.37 0.00 0.00 57.07 58.45 1kl1 s TYR 193 Cb -0.10 -2.91 -0.00 0.00 -0.40 0.00 0.00 41.96 38.54 1kl1 s TYR 193 CO 0.21 -1.14 -0.17 -1.17 -1.57 0.00 0.00 175.55 171.70 1kl1 s LEU 194 N -5.13 2.38 -0.14 -1.29 2.96 -1.26 -1.01 118.68 115.18 1kl1 s LEU 194 Ca 0.60 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1kl1 s LEU 194 Cb -0.14 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1kl1 s LEU 194 CO 0.48 0.10 -0.11 -0.32 -1.32 0.00 0.00 176.35 175.18 1kl1 s MET 195 N 0.72 3.42 -0.21 1.98 -2.45 -0.15 -1.10 119.30 121.50 1kl1 s MET 195 Ca -0.08 -0.66 -0.04 0.00 -1.25 0.00 0.00 55.69 53.66 1kl1 s MET 195 Cb -0.16 -2.69 -0.01 0.00 1.25 0.00 0.00 34.83 33.23 1kl1 s MET 195 CO 0.01 0.20 -0.05 0.08 1.05 0.00 0.00 175.02 176.31 1kl1 s VAL 196 N 0.41 3.39 -0.71 10.11 1.01 -0.21 -1.05 120.40 133.34 1kl1 s VAL 196 Ca -0.09 -0.49 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 1kl1 s VAL 196 Cb -0.16 -2.53 0.14 0.00 0.00 0.00 0.00 36.38 33.83 1kl1 s VAL 196 CO 0.05 0.43 0.79 -0.62 0.00 0.00 0.00 175.10 175.75 1kl1 s ASP 197 N 1.36 6.41 -0.15 3.32 -1.08 0.04 -0.68 116.67 125.89 1kl1 s ASP 197 Ca 0.04 -1.87 0.09 0.00 -0.52 0.00 0.00 52.55 50.29 1kl1 s ASP 197 Cb -0.14 -2.29 0.52 0.00 -1.46 0.00 0.00 42.92 39.54 1kl1 s ASP 197 CO -0.02 -0.96 1.29 1.15 0.52 0.00 0.00 175.17 177.14 1kl1 n MET 198 N 5.76 3.46 -0.28 4.34 0.00 0.35 -4.04 117.12 126.71 1kl1 n MET 198 Ca 0.02 -1.99 -0.01 0.00 0.00 0.00 0.00 57.70 55.73 1kl1 n MET 198 Cb 0.45 -1.98 0.06 0.00 0.00 0.00 0.00 33.22 31.74 1kl1 n MET 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1kl1 h ALA 199 N 3.28 0.25 -0.67 3.17 0.00 -1.88 -0.32 119.26 123.09 1kl1 h ALA 199 Ca 0.00 0.26 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1kl1 h ALA 199 Cb 1.43 0.77 -0.03 0.00 0.00 0.00 0.00 17.79 19.96 1kl1 h ALA 199 CO 0.31 -0.55 0.12 0.45 0.00 0.00 0.00 179.25 179.58 1kl1 h HIS 200 N -0.06 1.16 -0.68 0.00 3.86 -1.83 -3.30 115.15 114.30 1kl1 h HIS 200 Ca 0.33 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1kl1 h HIS 200 Cb 0.58 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1kl1 h HIS 200 CO -0.70 0.96 0.00 0.44 0.86 0.00 0.00 177.93 179.50 1kl1 n ILE 201 N -4.22 0.99 -0.27 2.45 -5.35 -0.41 -3.72 119.36 108.83 1kl1 n ILE 201 Ca 0.05 -0.99 0.04 0.00 -0.27 0.00 0.00 62.75 61.58 1kl1 n ILE 201 Cb 0.28 0.51 0.18 0.00 -1.74 0.00 0.00 39.64 38.88 1kl1 n ILE 201 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1kl1 h ALA 202 N 4.00 1.13 -0.63 -1.28 0.00 -1.20 -0.08 119.26 121.20 1kl1 h ALA 202 Ca 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1kl1 h ALA 202 Cb 0.96 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1kl1 h ALA 202 CO 0.00 -0.08 0.22 0.78 0.00 0.00 0.00 179.25 180.17 1kl1 h GLY 203 N 0.60 1.02 1.07 0.00 0.00 -1.83 -0.04 103.07 103.89 1kl1 h GLY 203 Ca 0.41 -0.56 -0.13 0.00 0.00 0.00 0.00 47.33 47.06 1kl1 h GLY 203 CO -0.33 0.52 -0.21 1.41 0.00 0.00 0.00 176.54 177.94 1kl1 h LEU 204 N 0.92 0.96 -0.35 3.11 3.38 -1.44 -1.58 115.31 120.31 1kl1 h LEU 204 Ca 0.21 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1kl1 h LEU 204 Cb 0.24 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1kl1 h LEU 204 CO -0.01 1.15 0.21 0.58 0.09 0.00 0.00 178.44 180.46 1kl1 h VAL 205 N 0.77 1.11 0.00 1.22 2.07 -0.83 0.14 116.25 120.73 1kl1 h VAL 205 Ca 0.10 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1kl1 h VAL 205 Cb 0.78 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1kl1 h VAL 205 CO 0.06 0.11 -0.14 0.00 0.02 0.00 0.00 177.57 177.63 1kl1 h ALA 206 N 1.10 1.65 -0.24 1.67 0.00 -0.80 -2.31 119.26 120.32 1kl1 h ALA 206 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1kl1 h ALA 206 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1kl1 h ALA 206 CO -0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1kl1 n ALA 207 N -2.46 2.48 -1.04 0.00 0.00 -0.61 -4.94 120.51 113.94 1kl1 n ALA 207 Ca -0.02 -0.71 -0.01 0.00 0.00 0.00 0.00 53.44 52.69 1kl1 n ALA 207 Cb 0.21 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 1kl1 n ALA 207 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kl1 n GLY 208 N 1.29 0.48 0.58 0.00 0.00 -0.80 -4.93 105.19 101.81 1kl1 n GLY 208 Ca 0.17 -0.97 0.10 0.00 0.00 0.00 0.00 46.02 45.32 1kl1 n GLY 208 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1kl1 n LEU 209 N -0.14 2.19 -3.85 0.99 4.77 0.43 -4.86 117.00 116.52 1kl1 n LEU 209 Ca -0.01 -0.83 -0.13 0.00 -0.03 0.00 0.00 56.01 55.00 1kl1 n LEU 209 Cb 0.04 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.99 1kl1 n LEU 209 CO 0.02 0.39 -0.36 -2.28 -1.33 0.00 0.00 177.39 173.83 1kl1 s HIS 210 N -2.17 0.07 0.28 -1.77 2.46 -1.16 -4.92 115.29 108.08 1kl1 s HIS 210 Ca 0.19 0.02 -0.29 0.00 0.47 0.00 0.00 55.06 55.46 1kl1 s HIS 210 Cb 0.17 -0.11 -0.14 0.00 -0.13 0.00 0.00 32.58 32.37 1kl1 s HIS 210 CO 0.45 -0.03 1.10 -2.30 -2.47 0.00 0.00 174.74 171.49 1kl1 n PRO 211 N 3.40 1.50 -2.87 2.88 -0.02 -1.26 -4.34 135.00 134.30 1kl1 n PRO 211 Ca -0.17 0.53 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 1kl1 n PRO 211 Cb 0.57 -1.96 -0.04 0.00 -0.02 0.00 0.00 33.50 32.05 1kl1 n PRO 211 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1kl1 s ASN 212 N -0.40 7.10 0.51 2.55 3.84 -1.26 -4.90 114.94 122.38 1kl1 s ASN 212 Ca 0.60 1.34 0.31 0.00 0.21 0.00 0.00 52.86 55.32 1kl1 s ASN 212 Cb -0.69 -2.48 1.07 0.00 -0.55 0.00 0.00 41.25 38.60 1kl1 s ASN 212 CO 0.59 -0.29 1.87 1.55 -2.79 0.00 0.00 177.10 178.03 1kl1 h PRO 213 N 7.00 0.00 -0.62 0.43 0.13 -1.96 -3.38 132.00 133.60 1kl1 h PRO 213 Ca -0.36 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.89 1kl1 h PRO 213 Cb 1.17 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.18 1kl1 h PRO 213 CO 0.79 0.00 -0.27 0.28 -0.23 0.00 0.00 178.00 178.58 1kl1 h VAL 214 N 0.00 0.23 0.00 1.56 2.07 -1.89 0.02 116.25 118.24 1kl1 h VAL 214 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1kl1 h VAL 214 Cb 0.65 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1kl1 h VAL 214 CO 0.00 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.14 1kl1 h PRO 215 N -0.10 0.00 0.00 1.57 0.13 -1.92 -3.19 132.00 128.49 1kl1 h PRO 215 Ca 0.27 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.28 1kl1 h PRO 215 Cb 0.53 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1kl1 h PRO 215 CO -0.68 0.00 -1.95 0.66 -0.23 0.00 0.00 178.00 175.79 1kl1 n TYR 216 N -2.82 0.00 -4.07 1.56 4.01 -0.14 -5.01 117.16 110.68 1kl1 n TYR 216 Ca -0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.42 1kl1 n TYR 216 Cb 0.19 -0.57 -0.07 0.00 -0.31 0.00 0.00 39.34 38.59 1kl1 n TYR 216 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1kl1 s ALA 217 N -2.94 3.61 0.16 -0.72 0.00 -0.40 -4.71 121.76 116.76 1kl1 s ALA 217 Ca -0.07 -0.91 -0.08 0.00 0.00 0.00 0.00 51.96 50.90 1kl1 s ALA 217 Cb 0.09 -1.56 0.01 0.00 0.00 0.00 0.00 23.12 21.66 1kl1 s ALA 217 CO 0.73 0.72 1.46 0.45 0.00 0.00 0.00 175.76 179.13 1kl1 h HIS 218 N 3.78 0.94 -4.04 0.00 3.86 -1.43 -3.45 115.15 114.82 1kl1 h HIS 218 Ca -0.48 -0.32 -0.41 0.00 -1.16 0.00 0.00 60.37 58.00 1kl1 h HIS 218 Cb 1.17 -0.18 -0.29 0.00 1.06 0.00 0.00 27.41 29.17 1kl1 h HIS 218 CO 0.63 1.11 -0.78 -0.06 0.86 0.00 0.00 177.93 179.68 1kl1 s PHE 219 N -4.14 0.88 -0.12 2.45 0.40 -1.07 -3.25 117.98 113.13 1kl1 s PHE 219 Ca -0.09 -0.17 0.01 0.00 -0.60 0.00 0.00 56.93 56.07 1kl1 s PHE 219 Cb 0.11 -0.58 0.02 0.00 0.51 0.00 0.00 43.02 43.08 1kl1 s PHE 219 CO 0.87 -0.02 -0.13 0.08 0.70 0.00 0.00 175.22 176.71 1kl1 s VAL 220 N -0.19 1.44 0.27 -0.44 1.01 0.76 -1.04 120.40 122.21 1kl1 s VAL 220 Ca 0.03 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.51 1kl1 s VAL 220 Cb -0.04 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1kl1 s VAL 220 CO -0.00 0.43 0.14 0.42 0.00 0.00 0.00 175.10 176.09 1kl1 s THR 221 N 1.30 4.02 0.06 3.92 -4.23 0.15 -0.06 115.64 120.80 1kl1 s THR 221 Ca -0.00 -1.56 -0.27 0.00 -1.18 0.00 0.00 61.69 58.68 1kl1 s THR 221 Cb -0.14 -3.20 0.09 0.00 1.34 0.00 0.00 72.50 70.58 1kl1 s THR 221 CO -0.06 -0.34 0.91 0.28 -0.54 0.00 0.00 174.62 174.87 1kl1 s THR 222 N -2.22 0.00 0.30 3.99 -1.32 -0.68 -0.49 115.64 115.22 1kl1 s THR 222 Ca 0.33 -0.26 0.03 0.00 -1.21 0.00 0.00 61.69 60.58 1kl1 s THR 222 Cb -0.07 -1.40 -0.03 0.00 -1.51 0.00 0.00 72.50 69.49 1kl1 s THR 222 CO 0.23 0.00 0.46 0.42 -2.21 0.00 0.00 174.62 173.53 1kl1 s THR 223 N -3.20 5.16 -2.23 5.08 -4.23 -1.26 -1.20 115.64 113.76 1kl1 s THR 223 Ca 0.08 -0.70 0.23 0.00 -1.18 0.00 0.00 61.69 60.12 1kl1 s THR 223 Cb -0.01 -3.86 0.07 0.00 1.34 0.00 0.00 72.50 70.05 1kl1 s THR 223 CO -0.05 -0.45 1.19 0.35 -0.54 0.00 0.00 174.62 175.12 1kl1 n THR 224 N -1.62 0.00 0.36 3.99 -2.24 -0.29 -4.63 114.28 109.85 1kl1 n THR 224 Ca -0.07 -0.30 0.09 0.00 -2.27 0.00 0.00 64.05 61.51 1kl1 n THR 224 Cb 0.57 1.21 0.14 0.00 -2.10 0.00 0.00 70.33 70.15 1kl1 n THR 224 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kl1 n HIS 225 N 0.22 0.29 0.00 4.78 1.44 -1.19 -0.19 115.22 120.57 1kl1 n HIS 225 Ca 0.11 -0.19 0.00 0.00 -2.01 0.00 0.00 57.72 55.63 1kl1 n HIS 225 Cb 0.48 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.59 1kl1 n HIS 225 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1kl1 n LYS 226 N 1.07 0.00 0.29 -1.40 5.02 -1.26 -4.33 118.16 117.55 1kl1 n LYS 226 Ca 0.14 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.61 1kl1 n LYS 226 Cb 0.48 0.00 0.78 0.00 -0.02 0.00 0.00 35.03 36.27 1kl1 n LYS 226 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1kl1 h THR 227 N 0.00 0.03 0.00 -0.18 1.35 -1.77 -1.23 112.91 111.11 1kl1 h THR 227 Ca 0.00 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1kl1 h THR 227 Cb 0.00 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 1kl1 h THR 227 CO 0.00 0.01 0.00 0.25 -0.25 0.00 0.00 175.52 175.53 1kl1 h LEU 228 N 0.00 0.00 -0.88 3.87 5.85 -1.87 -3.36 115.31 118.92 1kl1 h LEU 228 Ca -0.00 0.00 -0.41 0.00 0.84 0.00 0.00 57.88 58.31 1kl1 h LEU 228 Cb 0.42 0.00 0.11 0.00 0.37 0.00 0.00 40.66 41.56 1kl1 h LEU 228 CO 0.00 0.00 -0.69 -1.14 -0.34 0.00 0.00 178.44 176.27 1kl1 n ARG 229 N -2.37 -7.60 -2.10 1.25 0.63 -0.46 -4.90 116.66 101.11 1kl1 n ARG 229 Ca 0.03 0.79 -0.07 0.00 -0.92 0.00 0.00 57.85 57.68 1kl1 n ARG 229 Cb 0.30 -5.83 0.00 0.00 0.45 0.00 0.00 32.46 27.38 1kl1 n ARG 229 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1kl1 n GLY 230 N -1.96 2.98 3.70 5.14 0.00 0.74 -4.68 105.19 111.10 1kl1 n GLY 230 Ca 0.01 -2.20 -0.30 0.00 0.00 0.00 0.00 46.02 43.53 1kl1 n GLY 230 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1kl1 s PRO 231 N -2.58 1.22 -0.11 1.61 0.04 -1.26 -4.08 135.00 129.84 1kl1 s PRO 231 Ca 0.08 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 61.83 1kl1 s PRO 231 Cb -0.01 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.72 1kl1 s PRO 231 CO 0.05 -2.32 1.29 0.50 0.04 0.00 0.00 177.00 176.56 1kl1 s ARG 232 N -4.84 4.27 0.00 4.56 3.52 -1.26 -3.18 118.95 122.01 1kl1 s ARG 232 Ca 0.64 1.73 0.00 0.00 -0.13 0.00 0.00 55.73 57.97 1kl1 s ARG 232 Cb -0.19 -3.70 0.00 0.00 -1.56 0.00 0.00 34.95 29.49 1kl1 s ARG 232 CO 0.58 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.84 1kl1 n GLY 233 N 3.58 -1.56 3.60 8.12 0.00 -1.26 -4.89 105.19 112.79 1kl1 n GLY 233 Ca 0.13 -1.06 -0.29 0.00 0.00 0.00 0.00 46.02 44.80 1kl1 n GLY 233 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kl1 s GLY 234 N 0.00 2.82 -0.10 -0.02 0.00 -0.27 -1.13 107.32 108.61 1kl1 s GLY 234 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 44.72 43.58 1kl1 s GLY 234 CO 0.00 -1.95 0.73 -0.29 0.00 0.00 0.00 173.10 171.58 1kl1 s MET 235 N -3.74 0.96 -0.06 2.90 0.00 -0.34 -3.98 119.30 115.05 1kl1 s MET 235 Ca 0.16 0.38 0.05 0.00 0.00 0.00 0.00 55.69 56.28 1kl1 s MET 235 Cb 0.01 0.46 -0.01 0.00 0.00 0.00 0.00 34.83 35.29 1kl1 s MET 235 CO 0.11 -0.27 -0.21 0.42 0.00 0.00 0.00 175.02 175.06 1kl1 s ILE 236 N -0.89 1.78 0.01 10.11 1.01 -0.45 -1.69 121.20 131.07 1kl1 s ILE 236 Ca -0.08 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 59.73 1kl1 s ILE 236 Cb -0.01 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 1kl1 s ILE 236 CO 0.07 0.50 -0.18 -0.76 0.00 0.00 0.00 174.94 174.57 1kl1 s LEU 237 N 0.01 2.56 0.20 2.97 1.43 0.91 -0.57 118.68 126.19 1kl1 s LEU 237 Ca -0.06 -0.37 -0.23 0.00 -1.03 0.00 0.00 54.13 52.44 1kl1 s LEU 237 Cb -0.13 -1.50 0.05 0.00 0.03 0.00 0.00 46.19 44.63 1kl1 s LEU 237 CO 0.04 0.29 0.84 0.00 0.23 0.00 0.00 176.35 177.75 1kl1 s GLN 239 N -3.57 2.69 0.37 0.00 0.00 -1.20 -1.57 119.66 116.37 1kl1 s GLN 239 Ca 0.11 1.00 0.10 0.00 -0.00 0.00 0.00 55.36 56.57 1kl1 s GLN 239 Cb -0.03 -1.96 0.86 0.00 0.00 0.00 0.00 33.01 31.88 1kl1 s GLN 239 CO 0.03 -1.29 1.87 1.49 0.00 0.00 0.00 175.29 177.39 1kl1 h GLU 240 N -0.86 0.62 0.00 9.60 4.57 -1.95 -0.86 114.58 125.70 1kl1 h GLU 240 Ca -0.44 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 57.70 1kl1 h GLU 240 Cb 1.22 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1kl1 h GLU 240 CO 0.55 0.41 -0.03 -0.56 -1.18 0.00 0.00 179.01 178.20 1kl1 h GLN 241 N 0.64 0.00 -0.02 1.92 3.07 -1.99 -2.07 115.11 116.65 1kl1 h GLN 241 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.19 1kl1 h GLN 241 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.34 1kl1 h GLN 241 CO -0.20 0.03 -0.09 1.19 0.09 0.00 0.00 178.83 179.85 1kl1 n PHE 242 N -3.55 0.00 -0.08 0.06 3.72 -0.35 -4.73 117.46 112.53 1kl1 n PHE 242 Ca -0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 1kl1 n PHE 242 Cb 0.13 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.66 1kl1 n PHE 242 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1kl1 h ALA 243 N 3.40 0.01 -0.51 4.37 0.00 -1.15 0.75 119.26 126.12 1kl1 h ALA 243 Ca 0.00 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1kl1 h ALA 243 Cb 0.71 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1kl1 h ALA 243 CO 0.00 -0.60 0.14 -0.22 0.00 0.00 0.00 179.25 178.57 1kl1 h LYS 244 N -0.17 0.80 -0.65 0.00 3.64 -1.85 -1.19 116.57 117.16 1kl1 h LYS 244 Ca 0.16 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1kl1 h LYS 244 Cb 0.41 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1kl1 h LYS 244 CO -0.40 0.76 0.19 1.96 -2.27 0.00 0.00 179.45 179.69 1kl1 h GLN 245 N 0.70 1.01 -0.53 1.90 4.20 -1.77 -0.87 115.11 119.76 1kl1 h GLN 245 Ca 0.16 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 1kl1 h GLN 245 Cb 0.31 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 1kl1 h GLN 245 CO -0.00 0.89 -0.00 0.82 -0.67 0.00 0.00 178.83 179.87 1kl1 h ILE 246 N 0.94 1.26 -0.77 2.54 1.08 -0.73 0.41 117.51 122.24 1kl1 h ILE 246 Ca 0.21 -1.11 -0.05 0.00 -0.39 0.00 0.00 64.86 63.51 1kl1 h ILE 246 Cb 0.31 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 1kl1 h ILE 246 CO -0.00 0.39 0.28 0.44 -0.69 0.00 0.00 178.15 178.57 1kl1 h ASP 247 N 0.81 1.09 0.85 1.72 3.32 -1.05 -1.89 116.42 121.27 1kl1 h ASP 247 Ca 0.15 -0.19 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1kl1 h ASP 247 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1kl1 h ASP 247 CO 0.03 0.99 -0.50 0.11 -1.72 0.00 0.00 179.24 178.15 1kl1 h LYS 248 N 1.13 0.00 -0.59 3.56 1.57 -0.91 -0.95 116.57 120.38 1kl1 h LYS 248 Ca 0.25 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.95 1kl1 h LYS 248 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1kl1 h LYS 248 CO -0.01 0.50 0.04 0.00 -0.57 0.00 0.00 179.45 179.40 1kl1 h ALA 249 N 1.50 0.79 -0.12 3.86 0.00 -0.28 -1.27 119.26 123.74 1kl1 h ALA 249 Ca -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1kl1 h ALA 249 Cb 1.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1kl1 h ALA 249 CO 0.06 0.59 -0.09 0.82 0.00 0.00 0.00 179.25 180.63 1kl1 h ILE 250 N 0.91 1.34 -1.88 0.00 1.08 -1.18 0.19 117.51 117.96 1kl1 h ILE 250 Ca 0.17 -1.20 -0.22 0.00 -0.39 0.00 0.00 64.86 63.22 1kl1 h ILE 250 Cb 0.50 1.86 -0.30 0.00 -3.07 0.00 0.00 36.82 35.81 1kl1 h ILE 250 CO 0.02 0.34 -0.55 0.12 -0.69 0.00 0.00 178.15 177.39 1kl1 s PHE 251 N -4.41 -0.81 -1.07 1.37 5.36 -0.38 -0.90 117.98 117.14 1kl1 s PHE 251 Ca -0.14 0.30 0.12 0.00 -0.96 0.00 0.00 56.93 56.24 1kl1 s PHE 251 Cb 0.05 -0.21 0.33 0.00 -0.34 0.00 0.00 43.02 42.85 1kl1 s PHE 251 CO 0.73 -0.90 1.27 -0.35 -1.46 0.00 0.00 175.22 174.51 1kl1 n PRO 252 N 5.34 2.74 0.00 10.12 -0.04 -1.02 -4.02 135.00 148.13 1kl1 n PRO 252 Ca -0.01 -2.07 0.00 0.00 -0.04 0.00 0.00 63.50 61.37 1kl1 n PRO 252 Cb 0.49 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 1kl1 n PRO 252 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1kl1 n GLY 253 N 0.65 -2.13 0.00 0.55 0.00 -0.51 -4.67 105.19 99.08 1kl1 n GLY 253 Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.17 1kl1 n GLY 253 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1kl1 n ILE 254 N -1.79 0.00 -4.49 -0.61 -5.35 0.68 -4.98 119.36 102.82 1kl1 n ILE 254 Ca 0.00 -0.26 -0.22 0.00 -0.27 0.00 0.00 62.75 62.01 1kl1 n ILE 254 Cb 0.00 0.71 -0.05 0.00 -1.74 0.00 0.00 39.64 38.57 1kl1 n ILE 254 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1kl1 n GLN 255 N -1.37 1.05 0.00 6.28 6.02 -0.08 -5.05 117.38 124.23 1kl1 n GLN 255 Ca 0.00 -2.54 0.00 0.00 -0.01 0.00 0.00 57.00 54.45 1kl1 n GLN 255 Cb 0.10 0.81 0.00 0.00 1.02 0.00 0.00 30.24 32.17 1kl1 n GLN 255 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1kl1 n GLY 256 N 0.66 2.43 3.75 1.08 0.00 -1.26 -4.70 105.19 107.15 1kl1 n GLY 256 Ca -0.12 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1kl1 n GLY 256 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kl1 s GLY 257 N 0.00 2.86 0.69 -0.02 0.00 -1.26 -4.77 107.32 104.82 1kl1 s GLY 257 Ca 0.00 1.01 -0.11 0.00 0.00 0.00 0.00 44.72 45.62 1kl1 s GLY 257 CO 0.00 1.76 1.07 2.56 0.00 0.00 0.00 173.10 178.49 1kl1 s PRO 258 N -0.97 2.97 -0.98 2.90 0.04 -1.26 -4.99 135.00 132.72 1kl1 s PRO 258 Ca 0.49 0.67 -0.19 0.00 0.04 0.00 0.00 61.00 62.02 1kl1 s PRO 258 Cb -0.34 -2.02 0.13 0.00 0.04 0.00 0.00 34.50 32.31 1kl1 s PRO 258 CO 0.42 -1.00 1.20 -0.51 0.04 0.00 0.00 177.00 177.15 1kl1 s LEU 259 N -5.41 4.87 0.44 -3.56 1.43 -1.26 -4.77 118.68 110.41 1kl1 s LEU 259 Ca 0.58 -2.09 0.10 0.00 -1.03 0.00 0.00 54.13 51.68 1kl1 s LEU 259 Cb -0.12 -2.42 0.97 0.00 0.03 0.00 0.00 46.19 44.64 1kl1 s LEU 259 CO 0.53 -1.08 2.07 0.24 0.23 0.00 0.00 176.35 178.35 1kl1 h MET 260 N 8.74 0.37 -0.64 1.70 2.86 -1.86 -0.09 114.93 126.00 1kl1 h MET 260 Ca 0.18 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.71 1kl1 h MET 260 Cb 1.00 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1kl1 h MET 260 CO 1.16 0.26 0.06 1.12 1.06 0.00 0.00 176.91 180.57 1kl1 h HIS 261 N 0.37 1.17 -0.32 -0.22 -0.00 -1.86 -0.45 115.15 113.85 1kl1 h HIS 261 Ca 0.10 -0.18 -0.15 0.00 -0.00 0.00 0.00 60.37 60.13 1kl1 h HIS 261 Cb -0.01 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.08 1kl1 h HIS 261 CO 0.00 1.01 -0.41 0.28 -0.00 0.00 0.00 177.93 178.80 1kl1 h VAL 262 N 1.00 1.28 -0.57 6.12 2.07 -1.59 -1.79 116.25 122.78 1kl1 h VAL 262 Ca 0.19 -1.59 -0.05 0.00 0.82 0.00 0.00 66.70 66.07 1kl1 h VAL 262 Cb 0.50 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1kl1 h VAL 262 CO 0.02 0.52 0.16 0.40 0.02 0.00 0.00 177.57 178.69 1kl1 h ILE 263 N 0.64 1.23 -0.63 4.57 2.04 -0.81 0.21 117.51 124.76 1kl1 h ILE 263 Ca 0.05 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1kl1 h ILE 263 Cb 0.97 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1kl1 h ILE 263 CO 0.09 0.30 0.40 0.00 0.00 0.00 0.00 178.15 178.94 1kl1 h ALA 264 N 1.33 0.80 -0.23 1.87 0.00 -0.89 -1.14 119.26 121.00 1kl1 h ALA 264 Ca 0.19 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1kl1 h ALA 264 Cb 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1kl1 h ALA 264 CO -0.00 0.26 -0.13 0.00 0.00 0.00 0.00 179.25 179.38 1kl1 h ALA 265 N 1.21 1.35 -0.24 0.00 0.00 -0.29 -1.76 119.26 119.52 1kl1 h ALA 265 Ca 0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1kl1 h ALA 265 Cb -0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1kl1 h ALA 265 CO -0.05 0.44 0.10 0.87 0.00 0.00 0.00 179.25 180.62 1kl1 h LYS 266 N 0.35 0.36 -0.67 0.00 1.57 -0.05 -0.32 116.57 117.82 1kl1 h LYS 266 Ca 0.07 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1kl1 h LYS 266 Cb 0.45 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1kl1 h LYS 266 CO 0.03 0.39 0.37 0.00 -0.57 0.00 0.00 179.45 179.67 1kl1 h ALA 267 N 0.95 0.90 -0.19 3.86 0.00 -0.88 0.13 119.26 124.03 1kl1 h ALA 267 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1kl1 h ALA 267 Cb 0.16 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1kl1 h ALA 267 CO -0.01 0.04 0.12 0.28 0.00 0.00 0.00 179.25 179.68 1kl1 h VAL 268 N 0.67 1.06 -0.48 0.00 2.07 -1.02 -0.32 116.25 118.24 1kl1 h VAL 268 Ca 0.30 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.67 1kl1 h VAL 268 Cb 0.21 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1kl1 h VAL 268 CO -0.19 0.05 0.14 0.00 0.02 0.00 0.00 177.57 177.59 1kl1 h ALA 269 N 1.06 1.34 -0.32 1.67 0.00 -0.46 -1.15 119.26 121.41 1kl1 h ALA 269 Ca 0.07 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1kl1 h ALA 269 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1kl1 h ALA 269 CO -0.01 0.47 -0.31 0.74 0.00 0.00 0.00 179.25 180.14 1kl1 h PHE 270 N 0.69 0.80 -0.71 0.00 0.05 -0.30 -0.92 116.94 116.56 1kl1 h PHE 270 Ca 0.16 -0.21 -0.03 0.00 3.82 0.00 0.00 57.97 61.71 1kl1 h PHE 270 Cb 0.23 -0.18 -0.03 0.00 2.00 0.00 0.00 35.95 37.96 1kl1 h PHE 270 CO 0.01 0.92 0.31 0.78 -0.18 0.00 0.00 178.31 180.15 1kl1 h GLY 271 N 0.98 1.12 1.02 -1.45 0.00 -0.52 -1.35 103.07 102.86 1kl1 h GLY 271 Ca 0.07 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 1kl1 h GLY 271 CO 0.07 0.55 0.38 0.83 0.00 0.00 0.00 176.54 178.37 1kl1 h GLU 272 N 1.00 1.11 0.00 4.80 5.08 -0.90 -2.76 114.58 122.91 1kl1 h GLU 272 Ca 0.24 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1kl1 h GLU 272 Cb 0.17 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1kl1 h GLU 272 CO -0.02 0.86 -0.23 0.00 -1.00 0.00 0.00 179.01 178.61 1kl1 h ALA 273 N 1.20 1.15 0.00 3.43 0.00 -0.58 -2.35 119.26 122.11 1kl1 h ALA 273 Ca 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1kl1 h ALA 273 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1kl1 h ALA 273 CO -0.04 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.78 1kl1 n LEU 274 N -3.58 0.47 -4.85 0.00 4.77 -0.56 -4.66 117.00 108.59 1kl1 n LEU 274 Ca -0.01 0.57 -0.32 0.00 -0.03 0.00 0.00 56.01 56.22 1kl1 n LEU 274 Cb 0.37 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1kl1 n LEU 274 CO 0.33 -0.26 0.65 -1.10 -1.33 0.00 0.00 177.39 175.68 1kl1 s GLN 275 N -3.12 3.93 0.31 3.23 -1.52 -0.88 -4.98 119.66 116.63 1kl1 s GLN 275 Ca 0.09 0.89 -0.01 0.00 -1.95 0.00 0.00 55.36 54.39 1kl1 s GLN 275 Cb 0.13 -2.17 0.49 0.00 -0.22 0.00 0.00 33.01 31.23 1kl1 s GLN 275 CO 0.48 -0.23 1.95 -0.44 -0.25 0.00 0.00 175.29 176.80 1kl1 h ASP 276 N 1.00 0.85 0.33 5.90 3.32 -1.88 -2.21 116.42 123.72 1kl1 h ASP 276 Ca -0.47 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 1kl1 h ASP 276 Cb 1.18 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 1kl1 h ASP 276 CO 0.62 0.66 -0.22 -2.24 -1.72 0.00 0.00 179.24 176.34 1kl1 h ASP 277 N 0.97 0.00 -0.21 6.45 2.03 -1.93 -1.55 116.42 122.17 1kl1 h ASP 277 Ca 0.25 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.44 1kl1 h ASP 277 Cb -0.03 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.46 1kl1 h ASP 277 CO -0.05 0.22 -0.25 0.15 -1.03 0.00 0.00 179.24 178.28 1kl1 h PHE 278 N 0.00 0.78 -0.74 4.15 3.57 -1.60 -0.38 116.94 122.71 1kl1 h PHE 278 Ca -0.00 -0.18 -0.05 0.00 3.53 0.00 0.00 57.97 61.26 1kl1 h PHE 278 Cb 0.44 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 1kl1 h PHE 278 CO 0.00 0.87 0.25 0.87 -2.23 0.00 0.00 178.31 178.07 1kl1 h LYS 279 N 0.60 1.14 -0.51 1.11 6.56 -1.28 -0.09 116.57 124.11 1kl1 h LYS 279 Ca 0.08 -0.23 -0.08 0.00 -1.06 0.00 0.00 60.65 59.36 1kl1 h LYS 279 Cb 0.74 -0.17 -0.02 0.00 -0.57 0.00 0.00 32.23 32.21 1kl1 h LYS 279 CO 0.06 0.96 0.02 0.00 -2.06 0.00 0.00 179.45 178.43 1kl1 h ALA 280 N 1.17 0.68 0.08 3.86 0.00 -1.19 -2.30 119.26 121.56 1kl1 h ALA 280 Ca 0.24 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1kl1 h ALA 280 Cb 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1kl1 h ALA 280 CO -0.01 0.48 -0.21 -0.92 0.00 0.00 0.00 179.25 178.59 1kl1 h TYR 281 N 0.75 -0.55 -0.92 0.00 3.20 -0.78 -2.07 116.97 116.60 1kl1 h TYR 281 Ca 0.15 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.08 1kl1 h TYR 281 Cb 0.49 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.94 1kl1 h TYR 281 CO 0.04 -0.30 0.59 0.00 -1.64 0.00 0.00 178.16 176.84 1kl1 h ALA 282 N 0.44 1.26 -0.84 1.82 0.00 -0.87 -0.39 119.26 120.68 1kl1 h ALA 282 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1kl1 h ALA 282 Cb 0.42 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1kl1 h ALA 282 CO -0.14 0.38 0.50 -0.22 0.00 0.00 0.00 179.25 179.78 1kl1 h LYS 283 N 1.09 1.15 -0.26 0.00 3.64 -1.25 -2.20 116.57 118.73 1kl1 h LYS 283 Ca 0.39 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 59.61 1kl1 h LYS 283 Cb 0.12 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1kl1 h LYS 283 CO -0.16 0.81 -0.09 0.00 -2.27 0.00 0.00 179.45 177.74 1kl1 h ARG 284 N 1.16 0.42 0.25 1.90 3.08 -0.56 0.16 114.38 120.80 1kl1 h ARG 284 Ca 0.30 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1kl1 h ARG 284 Cb -0.04 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1kl1 h ARG 284 CO -0.06 0.53 -0.12 0.28 -1.07 0.00 0.00 179.97 179.53 1kl1 h VAL 285 N 0.40 0.76 -0.42 2.04 2.07 -0.53 0.46 116.25 121.03 1kl1 h VAL 285 Ca 0.08 -0.04 -0.12 0.00 0.82 0.00 0.00 66.70 67.44 1kl1 h VAL 285 Cb 0.41 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1kl1 h VAL 285 CO 0.02 0.01 -0.21 0.58 0.02 0.00 0.00 177.57 177.99 1kl1 h VAL 286 N -0.35 1.28 -0.73 2.57 2.07 -1.21 -1.18 116.25 118.69 1kl1 h VAL 286 Ca -0.03 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.13 1kl1 h VAL 286 Cb 0.27 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1kl1 h VAL 286 CO 0.06 0.46 0.46 0.44 0.02 0.00 0.00 177.57 179.00 1kl1 h ASP 287 N 0.72 0.86 -0.65 0.57 3.45 -0.62 -1.09 116.42 119.66 1kl1 h ASP 287 Ca 0.09 -0.05 -0.07 0.00 0.43 0.00 0.00 57.03 57.44 1kl1 h ASP 287 Cb 0.78 -0.22 -0.03 0.00 -0.56 0.00 0.00 39.33 39.31 1kl1 h ASP 287 CO 0.06 0.65 0.14 0.78 -1.57 0.00 0.00 179.24 179.30 1kl1 h ASN 288 N 0.99 1.01 -0.45 6.45 2.35 -0.77 -0.83 115.58 124.34 1kl1 h ASN 288 Ca 0.26 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 1kl1 h ASN 288 Cb -0.07 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.02 1kl1 h ASN 288 CO -0.05 0.99 -0.01 0.00 -1.65 0.00 0.00 177.43 176.71 1kl1 h ALA 289 N 1.13 0.61 -0.52 -0.83 0.00 -0.86 0.16 119.26 118.96 1kl1 h ALA 289 Ca 0.21 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1kl1 h ALA 289 Cb 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1kl1 h ALA 289 CO 0.01 0.42 0.16 0.87 0.00 0.00 0.00 179.25 180.71 1kl1 h LYS 290 N 0.65 0.80 -0.15 0.00 6.56 -1.01 -0.34 116.57 123.09 1kl1 h LYS 290 Ca 0.13 -0.17 -0.01 0.00 -1.06 0.00 0.00 60.65 59.54 1kl1 h LYS 290 Cb 0.51 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 1kl1 h LYS 290 CO 0.02 0.74 0.05 -0.09 -2.06 0.00 0.00 179.45 178.12 1kl1 h ARG 291 N 0.70 0.23 -0.74 3.15 9.65 -1.00 -0.95 114.38 125.41 1kl1 h ARG 291 Ca 0.17 -0.04 0.04 0.00 -1.10 0.00 0.00 59.98 59.04 1kl1 h ARG 291 Cb 0.27 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.77 1kl1 h ARG 291 CO -0.01 0.33 0.46 1.25 2.80 0.00 0.00 179.97 184.81 1kl1 h LEU 292 N 0.07 0.74 0.09 3.80 5.85 -0.61 0.87 115.31 126.12 1kl1 h LEU 292 Ca 0.05 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1kl1 h LEU 292 Cb 0.19 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 1kl1 h LEU 292 CO -0.00 0.50 -0.05 0.00 -0.34 0.00 0.00 178.44 178.54 1kl1 h ALA 293 N 1.34 -0.13 -0.69 1.25 0.00 -0.88 -0.05 119.26 120.09 1kl1 h ALA 293 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1kl1 h ALA 293 Cb 0.08 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1kl1 h ALA 293 CO -0.14 -0.58 0.44 1.03 0.00 0.00 0.00 179.25 180.00 1kl1 h SER 294 N -0.14 0.81 -0.36 0.00 0.87 -0.83 -0.69 113.55 113.21 1kl1 h SER 294 Ca -0.01 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 1kl1 h SER 294 Cb 0.11 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1kl1 h SER 294 CO 0.01 0.61 -0.03 0.00 -0.53 0.00 0.00 176.83 176.90 1kl1 h ALA 295 N 1.23 1.11 -0.36 6.23 0.00 -0.67 -0.04 119.26 126.76 1kl1 h ALA 295 Ca 0.25 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1kl1 h ALA 295 Cb -0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1kl1 h ALA 295 CO -0.05 0.56 -0.34 -0.07 0.00 0.00 0.00 179.25 179.36 1kl1 h LEU 296 N 0.70 0.85 -1.12 0.00 3.38 -0.58 -2.27 115.31 116.27 1kl1 h LEU 296 Ca 0.13 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 1kl1 h LEU 296 Cb 0.47 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1kl1 h LEU 296 CO 0.02 1.11 0.06 1.56 0.09 0.00 0.00 178.44 181.29 1kl1 h GLN 297 N 0.68 0.68 -0.26 1.13 4.20 -0.77 -1.21 115.11 119.56 1kl1 h GLN 297 Ca 0.07 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1kl1 h GLN 297 Cb 0.89 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 1kl1 h GLN 297 CO 0.08 0.65 0.07 -0.97 -0.67 0.00 0.00 178.83 178.00 1kl1 h ASN 298 N 0.65 0.33 0.91 1.46 -0.73 -0.66 -1.43 115.58 116.11 1kl1 h ASN 298 Ca 0.14 -0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.28 1kl1 h ASN 298 Cb 0.32 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 38.82 1kl1 h ASN 298 CO 0.00 0.33 0.00 -0.62 -0.37 0.00 0.00 177.43 176.77 1kl1 n GLU 299 N -4.40 0.05 0.00 6.67 -0.58 -0.76 -4.90 120.64 116.72 1kl1 n GLU 299 Ca 0.01 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1kl1 n GLU 299 Cb 0.15 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 1kl1 n GLU 299 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kl1 n GLY 300 N 0.94 1.13 3.82 0.62 0.00 -0.54 -5.01 105.19 106.16 1kl1 n GLY 300 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1kl1 n GLY 300 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1kl1 s PHE 301 N -2.00 3.53 -0.12 1.61 0.08 -0.53 -4.99 117.98 115.56 1kl1 s PHE 301 Ca 0.00 1.40 -0.16 0.00 0.12 0.00 0.00 56.93 58.29 1kl1 s PHE 301 Cb 0.00 -2.65 -0.05 0.00 -0.57 0.00 0.00 43.02 39.76 1kl1 s PHE 301 CO 0.00 0.20 0.39 0.99 -0.10 0.00 0.00 175.22 176.70 1kl1 s THR 302 N -1.75 5.21 -0.09 0.64 2.01 -1.26 -4.17 115.64 116.24 1kl1 s THR 302 Ca 0.49 0.77 -0.02 0.00 0.31 0.00 0.00 61.69 63.25 1kl1 s THR 302 Cb -0.14 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.61 1kl1 s THR 302 CO 0.19 0.39 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.75 1kl1 s LEU 303 N 0.27 3.52 0.23 4.42 1.43 -1.26 -0.64 118.68 126.65 1kl1 s LEU 303 Ca 0.22 0.11 -0.31 0.00 -1.03 0.00 0.00 54.13 53.12 1kl1 s LEU 303 Cb -0.14 -1.80 -0.11 0.00 0.03 0.00 0.00 46.19 44.16 1kl1 s LEU 303 CO 0.08 0.36 1.55 -0.69 0.23 0.00 0.00 176.35 177.88 1kl1 s VAL 304 N -0.77 2.41 0.00 -1.59 1.01 0.12 -1.33 120.40 120.25 1kl1 s VAL 304 Ca 0.12 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1kl1 s VAL 304 Cb -0.11 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.06 1kl1 s VAL 304 CO 0.02 0.04 0.00 -1.54 0.00 0.00 0.00 175.10 173.62 1kl1 n SER 305 N 2.90 -0.12 0.00 3.32 3.41 -1.26 -3.62 113.62 118.25 1kl1 n SER 305 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1kl1 n SER 305 Cb 0.38 -0.98 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1kl1 n SER 305 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1kl1 n GLY 306 N -1.98 0.47 0.00 5.00 0.00 -0.44 -4.87 105.19 103.37 1kl1 n GLY 306 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1kl1 n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kl1 n GLY 307 N -2.97 -0.00 3.45 -0.02 0.00 -1.24 -4.94 105.19 99.46 1kl1 n GLY 307 Ca 0.00 -1.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.83 1kl1 n GLY 307 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1kl1 s THR 308 N -4.00 0.01 -1.10 2.61 -1.32 -1.26 -4.82 115.64 105.76 1kl1 s THR 308 Ca 0.00 -0.12 0.09 0.00 -1.21 0.00 0.00 61.69 60.45 1kl1 s THR 308 Cb 0.00 -0.93 0.09 0.00 -1.51 0.00 0.00 72.50 70.15 1kl1 s THR 308 CO 0.00 -0.07 0.84 0.47 -2.21 0.00 0.00 174.62 173.65 1kl1 n ASP 309 N 0.80 1.88 0.00 8.08 10.43 0.12 -4.80 116.55 133.06 1kl1 n ASP 309 Ca -0.19 -1.45 0.00 0.00 2.57 0.00 0.00 54.79 55.72 1kl1 n ASP 309 Cb 0.58 -0.02 0.00 0.00 1.84 0.00 0.00 41.12 43.52 1kl1 n ASP 309 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 1kl1 n ASN 310 N 0.49 0.00 -0.03 -2.24 0.23 -1.23 -4.82 115.26 107.66 1kl1 n ASN 310 Ca 0.06 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.23 1kl1 n ASN 310 Cb 0.25 0.00 0.26 0.00 -2.08 0.00 0.00 39.78 38.21 1kl1 n ASN 310 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1kl1 n HIS 311 N 0.00 0.00 -4.31 -2.53 1.44 -1.26 -4.47 115.22 104.09 1kl1 n HIS 311 Ca 0.00 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.54 1kl1 n HIS 311 Cb 0.00 -0.23 -0.10 0.00 0.12 0.00 0.00 29.99 29.78 1kl1 n HIS 311 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 1kl1 s LEU 312 N -2.93 2.54 0.04 2.39 0.05 -1.26 -1.76 118.68 117.76 1kl1 s LEU 312 Ca 0.13 -1.01 -0.05 0.00 0.05 0.00 0.00 54.13 53.25 1kl1 s LEU 312 Cb 0.18 -0.55 -0.01 0.00 -2.05 0.00 0.00 46.19 43.75 1kl1 s LEU 312 CO 0.68 -0.23 0.08 -1.48 -0.55 0.00 0.00 176.35 174.85 1kl1 s LEU 313 N -3.24 1.89 -0.14 1.48 0.05 0.11 -4.59 118.68 114.24 1kl1 s LEU 313 Ca 0.20 -0.61 0.02 0.00 0.05 0.00 0.00 54.13 53.79 1kl1 s LEU 313 Cb 0.00 0.56 0.02 0.00 -2.05 0.00 0.00 46.19 44.72 1kl1 s LEU 313 CO 0.04 -0.53 -0.18 -0.76 -0.55 0.00 0.00 176.35 174.37 1kl1 s LEU 314 N -2.27 1.90 -0.15 1.48 1.43 -1.26 -1.38 118.68 118.43 1kl1 s LEU 314 Ca -0.03 -0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 52.36 1kl1 s LEU 314 Cb 0.00 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 1kl1 s LEU 314 CO -0.06 0.02 0.51 -0.69 0.23 0.00 0.00 176.35 176.37 1kl1 s VAL 315 N 1.06 5.14 -0.50 -1.59 1.01 -0.39 0.15 120.40 125.28 1kl1 s VAL 315 Ca -0.03 0.99 -0.22 0.00 0.00 0.00 0.00 61.98 62.73 1kl1 s VAL 315 Cb -0.14 -3.85 0.04 0.00 0.00 0.00 0.00 36.38 32.43 1kl1 s VAL 315 CO -0.05 0.26 0.76 -0.62 0.00 0.00 0.00 175.10 175.44 1kl1 s ASP 316 N 0.85 6.30 0.00 3.32 2.15 0.18 -2.52 116.67 126.96 1kl1 s ASP 316 Ca 0.26 -0.53 0.21 0.00 0.43 0.00 0.00 52.55 52.92 1kl1 s ASP 316 Cb -0.15 -2.36 0.88 0.00 -0.30 0.00 0.00 42.92 40.99 1kl1 s ASP 316 CO 0.10 -0.99 1.61 0.18 -0.17 0.00 0.00 175.17 175.91 1kl1 n LEU 317 N 6.70 1.22 -0.28 -1.34 4.77 -0.12 -4.20 117.00 123.75 1kl1 n LEU 317 Ca -0.02 -0.50 0.03 0.00 -0.03 0.00 0.00 56.01 55.49 1kl1 n LEU 317 Cb 0.47 -0.07 0.17 0.00 -2.33 0.00 0.00 43.42 41.66 1kl1 n LEU 317 CO 0.58 0.25 1.11 0.03 -1.33 0.00 0.00 177.39 178.03 1kl1 h ARG 318 N 1.65 0.68 -0.32 3.23 3.08 -1.74 -0.40 114.38 120.57 1kl1 h ARG 318 Ca 0.00 -0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.10 1kl1 h ARG 318 Cb 0.36 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1kl1 h ARG 318 CO 0.00 0.45 0.26 -1.35 -1.07 0.00 0.00 179.97 178.26 1kl1 h PRO 319 N 0.70 0.00 -0.11 0.04 0.11 -1.94 0.49 132.00 131.30 1kl1 h PRO 319 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1kl1 h PRO 319 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 1kl1 h PRO 319 CO -0.28 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 178.55 1kl1 n GLN 320 N -4.20 2.11 -3.74 1.05 3.00 -0.21 -4.96 117.38 110.44 1kl1 n GLN 320 Ca 0.05 -1.63 -0.25 0.00 -0.01 0.00 0.00 57.00 55.16 1kl1 n GLN 320 Cb 0.42 -1.47 0.04 0.00 0.00 0.00 0.00 30.24 29.24 1kl1 n GLN 320 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1kl1 n GLN 321 N 0.93 -5.86 -4.41 -1.09 1.13 0.17 -5.00 117.38 103.26 1kl1 n GLN 321 Ca 0.17 0.67 -0.27 0.00 -1.94 0.00 0.00 57.00 55.63 1kl1 n GLN 321 Cb 0.50 -5.49 -0.13 0.00 0.11 0.00 0.00 30.24 25.23 1kl1 n GLN 321 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1kl1 s LEU 322 N -6.99 2.29 0.48 1.08 1.43 -1.11 -5.04 118.68 110.82 1kl1 s LEU 322 Ca 0.36 -0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1kl1 s LEU 322 Cb -0.17 -1.06 -0.00 0.00 0.03 0.00 0.00 46.19 44.98 1kl1 s LEU 322 CO 0.80 0.13 0.73 0.42 0.23 0.00 0.00 176.35 178.66 1kl1 s THR 323 N -1.06 3.93 0.27 5.49 -4.23 -1.26 -4.23 115.64 114.55 1kl1 s THR 323 Ca 0.10 -0.36 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 1kl1 s THR 323 Cb -0.10 -3.48 0.12 0.00 1.34 0.00 0.00 72.50 70.38 1kl1 s THR 323 CO 0.05 -0.38 1.78 1.23 -0.54 0.00 0.00 174.62 176.75 1kl1 h GLY 324 N 0.26 0.81 0.92 3.99 0.00 -0.84 -2.22 103.07 105.99 1kl1 h GLY 324 Ca -0.46 -0.53 0.02 0.00 0.00 0.00 0.00 47.33 46.35 1kl1 h GLY 324 CO 0.58 0.49 0.25 1.70 0.00 0.00 0.00 176.54 179.57 1kl1 h LYS 325 N 0.71 0.49 -0.25 4.80 3.64 -1.59 0.20 116.57 124.58 1kl1 h LYS 325 Ca 0.14 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1kl1 h LYS 325 Cb 0.43 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1kl1 h LYS 325 CO 0.02 0.33 0.09 1.15 -2.27 0.00 0.00 179.45 178.76 1kl1 h THR 326 N 0.51 1.19 -0.60 1.00 2.02 -1.80 -1.91 112.91 113.31 1kl1 h THR 326 Ca 0.16 -0.58 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1kl1 h THR 326 Cb -0.00 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1kl1 h THR 326 CO -0.07 0.19 0.23 0.00 0.37 0.00 0.00 175.52 176.24 1kl1 h ALA 327 N 0.92 0.78 -0.59 6.16 0.00 -1.10 -2.01 119.26 123.42 1kl1 h ALA 327 Ca 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1kl1 h ALA 327 Cb 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1kl1 h ALA 327 CO -0.00 0.41 0.37 1.49 0.00 0.00 0.00 179.25 181.51 1kl1 h GLU 328 N 0.84 0.80 -0.11 0.00 4.81 -0.53 -1.18 114.58 119.20 1kl1 h GLU 328 Ca 0.20 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1kl1 h GLU 328 Cb 0.22 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1kl1 h GLU 328 CO -0.01 0.56 0.06 -0.22 -0.73 0.00 0.00 179.01 178.67 1kl1 h LYS 329 N 0.80 0.16 -0.30 1.92 3.64 -1.10 -1.11 116.57 120.58 1kl1 h LYS 329 Ca 0.21 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.45 1kl1 h LYS 329 Cb -0.04 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1kl1 h LYS 329 CO -0.04 0.17 -0.34 -0.24 -2.27 0.00 0.00 179.45 176.73 1kl1 h VAL 330 N 0.10 1.29 -0.30 2.00 3.04 -1.32 -2.34 116.25 118.72 1kl1 h VAL 330 Ca 0.04 -1.48 -0.08 0.00 -1.01 0.00 0.00 66.70 64.17 1kl1 h VAL 330 Cb 0.06 1.43 -0.02 0.00 -2.01 0.00 0.00 31.29 30.75 1kl1 h VAL 330 CO -0.01 0.48 -0.15 -0.07 -1.01 0.00 0.00 177.57 176.81 1kl1 h LEU 331 N 0.55 0.50 -1.54 3.16 3.38 -1.13 -1.83 115.31 118.40 1kl1 h LEU 331 Ca 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1kl1 h LEU 331 Cb 0.85 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1kl1 h LEU 331 CO 0.07 0.68 0.10 -0.78 0.09 0.00 0.00 178.44 178.60 1kl1 h ASP 332 N 0.47 0.36 0.33 -0.43 3.58 -0.84 -1.62 116.42 118.27 1kl1 h ASP 332 Ca 0.08 -0.03 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 1kl1 h ASP 332 Cb 0.53 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.49 1kl1 h ASP 332 CO 0.03 0.34 -0.15 -0.33 -2.88 0.00 0.00 179.24 176.26 1kl1 h GLU 333 N 0.40 0.00 -0.22 0.28 5.08 -0.80 -2.63 114.58 116.69 1kl1 h GLU 333 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1kl1 h GLU 333 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1kl1 h GLU 333 CO -0.01 0.15 0.00 1.33 -1.00 0.00 0.00 179.01 179.48 1kl1 n VAL 334 N -3.82 0.30 -0.08 3.13 0.24 -0.69 -4.96 118.33 112.44 1kl1 n VAL 334 Ca -0.02 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.63 1kl1 n VAL 334 Cb 0.25 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 1kl1 n VAL 334 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1kl1 n GLY 335 N 1.27 0.96 3.34 7.63 0.00 -0.99 -4.35 105.19 113.06 1kl1 n GLY 335 Ca 0.15 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1kl1 n GLY 335 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kl1 s ILE 336 N -2.00 3.39 -0.33 -0.61 1.01 -0.74 -0.86 121.20 121.07 1kl1 s ILE 336 Ca 0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 1kl1 s ILE 336 Cb 0.00 -2.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 1kl1 s ILE 336 CO 0.00 0.45 0.28 -0.89 0.00 0.00 0.00 174.94 174.77 1kl1 s THR 337 N 1.17 5.25 0.36 2.92 2.01 -0.41 -3.09 115.64 123.85 1kl1 s THR 337 Ca 0.02 -0.08 0.04 0.00 0.31 0.00 0.00 61.69 61.97 1kl1 s THR 337 Cb -0.14 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.60 1kl1 s THR 337 CO -0.01 -0.01 0.13 0.68 -0.69 0.00 0.00 174.62 174.72 1kl1 s VAL 338 N 1.82 0.58 0.05 3.82 -7.23 -1.26 -0.80 120.40 117.39 1kl1 s VAL 338 Ca 0.08 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.32 1kl1 s VAL 338 Cb -0.17 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 1kl1 s VAL 338 CO 0.11 0.00 -0.19 0.54 -0.31 0.00 0.00 175.10 175.25 1kl1 s ASN 339 N -3.50 2.21 0.67 4.85 4.22 -1.18 -4.92 114.94 117.29 1kl1 s ASN 339 Ca 0.30 -0.54 -0.16 0.00 -2.14 0.00 0.00 52.86 50.32 1kl1 s ASN 339 Cb 0.04 -0.16 0.01 0.00 1.28 0.00 0.00 41.25 42.42 1kl1 s ASN 339 CO 0.16 0.09 1.18 -1.59 -2.04 0.00 0.00 177.10 174.90 1kl1 s LYS 340 N -1.33 2.56 -0.28 3.55 -2.85 -1.26 -0.18 119.74 119.95 1kl1 s LYS 340 Ca 0.05 1.68 -0.18 0.00 -1.00 0.00 0.00 55.97 56.52 1kl1 s LYS 340 Cb -0.09 -1.89 0.09 0.00 -2.06 0.00 0.00 37.83 33.88 1kl1 s LYS 340 CO 0.02 -1.49 0.76 1.21 0.10 0.00 0.00 175.35 175.95 1kl1 s ASN 341 N -2.05 -0.82 0.72 0.03 2.47 -0.41 -4.67 114.94 110.21 1kl1 s ASN 341 Ca 0.73 1.35 -0.16 0.00 0.42 0.00 0.00 52.86 55.21 1kl1 s ASN 341 Cb -0.27 1.34 0.03 0.00 -1.45 0.00 0.00 41.25 40.91 1kl1 s ASN 341 CO 0.40 -0.22 1.25 0.42 -3.72 0.00 0.00 177.10 175.24 1kl1 s THR 342 N 1.35 2.06 0.29 -5.21 -4.23 -1.26 -2.80 115.64 105.84 1kl1 s THR 342 Ca -0.08 0.03 0.09 0.00 -1.18 0.00 0.00 61.69 60.55 1kl1 s THR 342 Cb -0.05 -2.73 -0.04 0.00 1.34 0.00 0.00 72.50 71.03 1kl1 s THR 342 CO -0.16 -0.01 0.09 0.27 -0.54 0.00 0.00 174.62 174.27 1kl1 s ILE 343 N -1.77 3.53 0.30 2.99 -4.36 -1.26 -4.87 121.20 115.76 1kl1 s ILE 343 Ca 0.78 -1.73 -0.29 0.00 -0.26 0.00 0.00 60.65 59.15 1kl1 s ILE 343 Cb -0.33 -3.01 -0.12 0.00 1.25 0.00 0.00 42.46 40.25 1kl1 s ILE 343 CO 0.45 -0.31 1.40 -2.65 0.24 0.00 0.00 174.94 174.07 1kl1 n PRO 344 N -1.05 2.24 -2.65 0.37 -0.02 -1.24 -1.63 135.00 131.02 1kl1 n PRO 344 Ca -0.06 0.79 -0.21 0.00 -2.02 0.00 0.00 63.50 62.00 1kl1 n PRO 344 Cb 0.59 -2.45 0.01 0.00 -0.02 0.00 0.00 33.50 31.64 1kl1 n PRO 344 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1kl1 n TYR 345 N 1.19 -1.38 -1.98 6.00 4.02 -1.26 -4.93 117.16 118.82 1kl1 n TYR 345 Ca 0.07 0.21 -0.42 0.00 -0.01 0.00 0.00 57.90 57.76 1kl1 n TYR 345 Cb 0.35 -4.18 -0.03 0.00 -0.02 0.00 0.00 39.34 35.46 1kl1 n TYR 345 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1kl1 s ASP 346 N -2.33 6.63 0.36 7.72 3.68 -0.65 -4.90 116.67 127.18 1kl1 s ASP 346 Ca 0.12 2.59 0.26 0.00 2.13 0.00 0.00 52.55 57.65 1kl1 s ASP 346 Cb -0.05 -2.60 0.81 0.00 -1.45 0.00 0.00 42.92 39.63 1kl1 s ASP 346 CO 0.15 -0.78 1.76 1.55 0.13 0.00 0.00 175.17 177.98 1kl1 h PRO 347 N 6.47 0.00 -6.27 4.34 0.13 -1.91 -3.45 132.00 131.31 1kl1 h PRO 347 Ca -0.43 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.19 1kl1 h PRO 347 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1kl1 h PRO 347 CO 0.88 0.00 -0.33 -1.21 -0.23 0.00 0.00 178.00 177.11 1kl1 s GLU 348 N -3.29 3.49 0.96 0.86 0.41 -1.26 -5.09 118.70 114.78 1kl1 s GLU 348 Ca 0.06 -0.45 -0.12 0.00 -0.41 0.00 0.00 54.97 54.05 1kl1 s GLU 348 Cb 0.09 -2.82 0.17 0.00 -1.78 0.00 0.00 34.13 29.79 1kl1 s GLU 348 CO 0.57 0.36 1.09 -1.54 -0.49 0.00 0.00 175.26 175.25 1kl1 s SER 349 N -3.55 2.88 0.23 -0.19 1.04 -1.26 -4.49 113.70 108.36 1kl1 s SER 349 Ca 0.37 1.34 0.21 0.00 0.48 0.00 0.00 55.95 58.36 1kl1 s SER 349 Cb -0.10 -2.01 0.93 0.00 0.10 0.00 0.00 66.02 64.94 1kl1 s SER 349 CO 0.31 -2.99 1.65 -0.81 0.98 0.00 0.00 173.24 172.37 1kl1 n PRO 350 N -4.10 0.15 0.00 4.02 -0.04 -1.26 -0.41 135.00 133.37 1kl1 n PRO 350 Ca 0.06 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 1kl1 n PRO 350 Cb 0.56 -1.83 0.28 0.00 -0.04 0.00 0.00 33.50 32.48 1kl1 n PRO 350 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1kl1 n PHE 351 N -2.12 0.00 0.05 0.54 3.01 -1.26 -4.55 117.46 113.12 1kl1 n PHE 351 Ca 0.02 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 58.47 1kl1 n PHE 351 Cb 0.18 -0.21 -0.00 0.00 -0.01 0.00 0.00 39.48 39.44 1kl1 n PHE 351 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1kl1 n VAL 352 N -1.24 1.25 -0.97 -4.37 0.31 -0.46 -4.88 118.33 107.97 1kl1 n VAL 352 Ca 0.07 0.40 0.12 0.00 -0.01 0.00 0.00 64.34 64.92 1kl1 n VAL 352 Cb 0.34 -1.62 -0.06 0.00 -0.91 0.00 0.00 33.84 31.60 1kl1 n VAL 352 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1kl1 n THR 353 N -3.53 -0.35 -1.08 2.52 -2.24 0.46 -1.90 114.28 108.15 1kl1 n THR 353 Ca -0.00 0.50 0.09 0.00 -2.27 0.00 0.00 64.05 62.36 1kl1 n THR 353 Cb 0.02 -0.82 0.20 0.00 -2.10 0.00 0.00 70.33 67.62 1kl1 n THR 353 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1kl1 n SER 354 N -3.64 3.00 -3.74 3.42 7.64 -1.26 -0.64 113.62 118.40 1kl1 n SER 354 Ca -0.05 -3.13 -0.12 0.00 1.01 0.00 0.00 58.87 56.59 1kl1 n SER 354 Cb 0.46 -0.49 -0.06 0.00 -1.01 0.00 0.00 64.21 63.10 1kl1 n SER 354 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1kl1 s GLY 355 N -2.47 1.06 -0.01 0.23 0.00 -1.12 -0.95 107.32 104.06 1kl1 s GLY 355 Ca 0.37 -1.27 0.04 0.00 0.00 0.00 0.00 44.72 43.87 1kl1 s GLY 355 CO 0.05 -0.91 -0.14 -0.26 0.00 0.00 0.00 173.10 171.84 1kl1 s ILE 356 N -3.67 1.12 -0.15 0.90 -4.36 -1.05 -1.29 121.20 112.70 1kl1 s ILE 356 Ca 0.28 -0.61 -0.07 0.00 -0.26 0.00 0.00 60.65 59.99 1kl1 s ILE 356 Cb 0.01 -0.94 -0.04 0.00 1.25 0.00 0.00 42.46 42.74 1kl1 s ILE 356 CO 0.14 0.32 0.11 -0.60 0.24 0.00 0.00 174.94 175.14 1kl1 s ARG 357 N -0.32 3.74 -0.01 0.37 3.52 0.75 -1.26 118.95 125.73 1kl1 s ARG 357 Ca 0.05 -0.23 0.03 0.00 -0.13 0.00 0.00 55.73 55.45 1kl1 s ARG 357 Cb -0.06 -3.22 -0.00 0.00 -1.56 0.00 0.00 34.95 30.11 1kl1 s ARG 357 CO -0.01 0.52 -0.08 0.42 -0.81 0.00 0.00 175.30 175.34 1kl1 s ILE 358 N -0.29 0.69 0.07 4.11 1.01 -0.48 -3.08 121.20 123.23 1kl1 s ILE 358 Ca 0.10 -0.36 0.02 0.00 0.00 0.00 0.00 60.65 60.41 1kl1 s ILE 358 Cb -0.12 -0.59 -0.03 0.00 0.01 0.00 0.00 42.46 41.73 1kl1 s ILE 358 CO 0.01 0.20 -0.07 -0.83 0.00 0.00 0.00 174.94 174.25 1kl1 s GLY 359 N -0.11 0.62 0.00 6.18 0.00 -0.21 -0.71 107.32 113.08 1kl1 s GLY 359 Ca 0.02 -1.06 0.16 0.00 0.00 0.00 0.00 44.72 43.84 1kl1 s GLY 359 CO -0.00 -1.14 1.14 -1.30 0.00 0.00 0.00 173.10 171.79 1kl1 n THR 360 N 0.68 0.35 -0.24 0.90 -2.24 -0.72 -4.52 114.28 108.50 1kl1 n THR 360 Ca -0.17 -0.68 -0.01 0.00 -2.27 0.00 0.00 64.05 60.92 1kl1 n THR 360 Cb 0.58 1.04 0.10 0.00 -2.10 0.00 0.00 70.33 69.95 1kl1 n THR 360 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kl1 h ALA 361 N 3.08 0.91 -0.08 6.98 0.00 -1.84 -0.42 119.26 127.90 1kl1 h ALA 361 Ca 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1kl1 h ALA 361 Cb 0.73 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1kl1 h ALA 361 CO 0.00 0.06 -0.15 0.00 0.00 0.00 0.00 179.25 179.16 1kl1 h ALA 362 N 1.35 0.12 0.00 0.00 0.00 -1.83 -1.93 119.26 116.98 1kl1 h ALA 362 Ca 0.30 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1kl1 h ALA 362 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1kl1 h ALA 362 CO -0.18 0.03 -0.26 -0.39 0.00 0.00 0.00 179.25 178.45 1kl1 h VAL 363 N -0.23 0.99 -0.34 0.00 -1.51 -1.70 -1.68 116.25 111.77 1kl1 h VAL 363 Ca 0.00 -0.96 -0.11 0.00 -1.23 0.00 0.00 66.70 64.40 1kl1 h VAL 363 Cb 0.74 1.55 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 1kl1 h VAL 363 CO 0.03 0.26 -0.20 0.74 -1.23 0.00 0.00 177.57 177.17 1kl1 h THR 364 N 0.00 1.29 -0.83 7.19 2.02 -1.00 -0.67 112.91 120.91 1kl1 h THR 364 Ca -0.00 -1.34 0.04 0.00 0.77 0.00 0.00 66.41 65.88 1kl1 h THR 364 Cb 0.53 1.41 -0.05 0.00 -1.74 0.00 0.00 68.15 68.30 1kl1 h THR 364 CO 0.03 0.44 0.55 0.74 0.37 0.00 0.00 175.52 177.65 1kl1 h THR 365 N 0.52 1.12 0.00 3.16 2.02 -0.50 -0.42 112.91 118.82 1kl1 h THR 365 Ca 0.07 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1kl1 h THR 365 Cb 0.75 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1kl1 h THR 365 CO 0.06 0.18 0.00 -2.11 0.37 0.00 0.00 175.52 174.02 1kl1 n ARG 366 N -4.45 0.91 0.00 6.66 1.85 -0.86 -4.87 116.66 115.90 1kl1 n ARG 366 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.96 1kl1 n ARG 366 Cb 0.12 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.13 1kl1 n ARG 366 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1kl1 n GLY 367 N 0.75 0.85 3.77 2.89 0.00 -0.16 -5.08 105.19 108.20 1kl1 n GLY 367 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1kl1 n GLY 367 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1kl1 s PHE 368 N -2.00 2.92 0.00 1.61 2.99 -0.27 -5.01 117.98 118.22 1kl1 s PHE 368 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 56.93 58.47 1kl1 s PHE 368 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 43.02 39.63 1kl1 s PHE 368 CO 0.00 -1.48 0.00 0.41 -0.00 0.00 0.00 175.22 174.15 1kl1 n GLY 369 N 0.49 6.68 0.26 4.36 0.00 -1.26 -4.53 105.19 111.19 1kl1 n GLY 369 Ca 0.07 -1.77 -0.06 0.00 0.00 0.00 0.00 46.02 44.25 1kl1 n GLY 369 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1kl1 h LEU 370 N 0.00 0.76 -1.11 0.99 3.38 -1.95 -1.37 115.31 115.99 1kl1 h LEU 370 Ca 0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1kl1 h LEU 370 Cb 0.00 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1kl1 h LEU 370 CO 0.00 0.61 0.20 -0.33 0.09 0.00 0.00 178.44 179.01 1kl1 h GLU 371 N 0.84 0.83 -0.42 1.13 4.39 -2.00 -1.66 114.58 117.69 1kl1 h GLU 371 Ca 0.22 -0.14 -0.12 0.00 0.34 0.00 0.00 59.36 59.67 1kl1 h GLU 371 Cb 0.01 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 1kl1 h GLU 371 CO -0.04 0.70 -0.21 0.93 -1.16 0.00 0.00 179.01 179.23 1kl1 h GLU 372 N 0.81 0.83 -0.70 2.33 3.07 -1.84 -2.36 114.58 116.72 1kl1 h GLU 372 Ca 0.19 -0.33 -0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1kl1 h GLU 372 Cb 0.20 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.03 1kl1 h GLU 372 CO -0.01 0.96 0.42 0.52 -1.40 0.00 0.00 179.01 179.50 1kl1 h MET 373 N 0.72 0.95 -0.74 2.33 2.86 -0.59 0.44 114.93 120.91 1kl1 h MET 373 Ca 0.10 -0.09 0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1kl1 h MET 373 Cb 0.73 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 1kl1 h MET 373 CO 0.06 0.68 0.48 -0.44 1.06 0.00 0.00 176.91 178.75 1kl1 h ASP 374 N 0.95 0.82 -0.39 1.22 3.32 -1.08 -1.49 116.42 119.77 1kl1 h ASP 374 Ca 0.25 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.19 1kl1 h ASP 374 Cb -0.03 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1kl1 h ASP 374 CO -0.05 0.59 -0.14 -0.08 -1.72 0.00 0.00 179.24 177.84 1kl1 h GLU 375 N 0.97 0.78 -0.48 3.56 4.57 -0.92 -1.31 114.58 121.76 1kl1 h GLU 375 Ca 0.28 -0.32 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1kl1 h GLU 375 Cb -0.07 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.46 1kl1 h GLU 375 CO -0.08 0.94 0.30 0.82 -1.18 0.00 0.00 179.01 179.81 1kl1 h ILE 376 N 0.58 1.09 -0.64 2.32 2.04 -0.71 0.18 117.51 122.37 1kl1 h ILE 376 Ca 0.09 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1kl1 h ILE 376 Cb 0.68 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1kl1 h ILE 376 CO 0.05 0.11 0.40 0.00 0.00 0.00 0.00 178.15 178.71 1kl1 h ALA 377 N 1.19 0.82 -0.62 1.87 0.00 -1.16 -0.73 119.26 120.62 1kl1 h ALA 377 Ca 0.18 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1kl1 h ALA 377 Cb -0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1kl1 h ALA 377 CO -0.06 0.27 0.19 0.00 0.00 0.00 0.00 179.25 179.65 1kl1 h ALA 378 N 1.21 1.16 -0.29 0.00 0.00 -0.47 0.39 119.26 121.25 1kl1 h ALA 378 Ca 0.23 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1kl1 h ALA 378 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1kl1 h ALA 378 CO -0.05 0.58 -0.01 0.82 0.00 0.00 0.00 179.25 180.60 1kl1 h ILE 379 N 0.91 1.26 -0.87 0.00 2.04 -0.32 -1.48 117.51 119.07 1kl1 h ILE 379 Ca 0.20 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1kl1 h ILE 379 Cb 0.27 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 1kl1 h ILE 379 CO -0.01 0.31 0.55 0.40 0.00 0.00 0.00 178.15 179.40 1kl1 h ILE 380 N 0.31 1.23 -0.18 -0.67 2.04 -0.82 -1.24 117.51 118.19 1kl1 h ILE 380 Ca 0.08 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1kl1 h ILE 380 Cb 0.45 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1kl1 h ILE 380 CO 0.02 0.23 0.08 1.23 0.00 0.00 0.00 178.15 179.71 1kl1 h GLY 381 N 1.19 0.28 0.65 5.37 0.00 -0.67 -0.80 103.07 109.08 1kl1 h GLY 381 Ca 0.31 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.56 1kl1 h GLY 381 CO -0.06 0.13 0.20 -2.00 0.00 0.00 0.00 176.54 174.81 1kl1 h LEU 382 N 0.15 0.25 0.23 3.11 5.85 -0.89 -1.74 115.31 122.28 1kl1 h LEU 382 Ca 0.06 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1kl1 h LEU 382 Cb 0.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1kl1 h LEU 382 CO -0.01 0.18 -0.11 0.58 -0.34 0.00 0.00 178.44 178.74 1kl1 h VAL 383 N 0.40 0.75 0.00 1.05 2.07 -1.09 -2.95 116.25 116.47 1kl1 h VAL 383 Ca 0.22 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 1kl1 h VAL 383 Cb 0.18 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1kl1 h VAL 383 CO -0.19 0.17 -0.25 -0.07 0.02 0.00 0.00 177.57 177.25 1kl1 h LEU 384 N -0.83 0.00 -0.22 2.57 3.38 -1.15 -1.97 115.31 117.09 1kl1 h LEU 384 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1kl1 h LEU 384 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1kl1 h LEU 384 CO 0.05 0.25 -0.29 0.29 0.09 0.00 0.00 178.44 178.82 1kl1 n LYS 385 N -3.60 0.43 -2.64 1.13 5.02 -0.66 -4.23 118.16 113.61 1kl1 n LYS 385 Ca -0.01 -0.22 -0.11 0.00 -2.02 0.00 0.00 58.31 55.95 1kl1 n LYS 385 Cb 0.38 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1kl1 n LYS 385 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1kl1 n ASN 386 N -1.09 1.94 0.27 4.39 4.13 -0.78 -4.95 115.26 119.17 1kl1 n ASN 386 Ca 0.10 -2.82 0.11 0.00 1.68 0.00 0.00 54.58 53.65 1kl1 n ASN 386 Cb 0.33 -0.52 0.76 0.00 -1.54 0.00 0.00 39.78 38.81 1kl1 n ASN 386 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1kl1 h VAL 387 N 3.09 0.77 -0.11 2.41 2.07 -1.62 -1.98 116.25 120.89 1kl1 h VAL 387 Ca -0.04 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1kl1 h VAL 387 Cb 1.15 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1kl1 h VAL 387 CO 0.53 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.75 1kl1 n GLY 388 N -1.35 0.13 3.42 2.17 0.00 -1.26 -4.82 105.19 103.47 1kl1 n GLY 388 Ca -0.03 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1kl1 n GLY 388 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1kl1 s SER 389 N -1.73 5.86 0.42 1.61 0.15 -0.75 -4.95 113.70 114.33 1kl1 s SER 389 Ca 0.34 -0.87 0.18 0.00 0.70 0.00 0.00 55.95 56.31 1kl1 s SER 389 Cb 0.19 -2.07 0.94 0.00 -1.71 0.00 0.00 66.02 63.36 1kl1 s SER 389 CO 0.29 -0.37 1.90 -0.33 1.20 0.00 0.00 173.24 175.92 1kl1 h GLU 390 N 8.49 0.00 -0.42 5.44 4.39 -1.87 -2.21 114.58 128.40 1kl1 h GLU 390 Ca -0.27 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.29 1kl1 h GLU 390 Cb 1.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 1kl1 h GLU 390 CO 0.68 0.28 -0.29 -0.56 -1.16 0.00 0.00 179.01 177.96 1kl1 h GLN 391 N 0.00 0.92 -0.62 2.33 3.07 -1.96 -0.73 115.11 118.12 1kl1 h GLN 391 Ca -0.00 -0.43 -0.07 0.00 0.09 0.00 0.00 58.65 58.24 1kl1 h GLN 391 Cb 0.57 -0.01 -0.03 0.00 0.08 0.00 0.00 27.48 28.08 1kl1 h GLN 391 CO 0.04 1.08 0.12 0.00 0.09 0.00 0.00 178.83 180.16 1kl1 h ALA 392 N 0.88 1.04 -0.38 0.06 0.00 -1.76 -1.41 119.26 117.70 1kl1 h ALA 392 Ca 0.09 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1kl1 h ALA 392 Cb 0.86 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1kl1 h ALA 392 CO 0.08 0.62 -0.20 -0.07 0.00 0.00 0.00 179.25 179.68 1kl1 h LEU 393 N 0.94 0.74 -0.47 0.00 3.38 -1.19 -0.81 115.31 117.89 1kl1 h LEU 393 Ca 0.19 -0.25 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 1kl1 h LEU 393 Cb 0.38 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1kl1 h LEU 393 CO 0.01 0.93 -0.40 -0.08 0.09 0.00 0.00 178.44 178.98 1kl1 h GLU 394 N 0.64 0.82 -0.47 1.13 4.57 -0.92 -1.00 114.58 119.35 1kl1 h GLU 394 Ca 0.09 -0.43 -0.02 0.00 -1.18 0.00 0.00 59.36 57.82 1kl1 h GLU 394 Cb 0.69 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 1kl1 h GLU 394 CO 0.05 1.07 0.22 1.49 -1.18 0.00 0.00 179.01 180.66 1kl1 h GLU 395 N 0.67 0.68 -0.36 1.92 4.81 -1.09 -2.09 114.58 119.12 1kl1 h GLU 395 Ca 0.05 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1kl1 h GLU 395 Cb 0.97 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 1kl1 h GLU 395 CO 0.09 0.58 0.13 0.00 -0.73 0.00 0.00 179.01 179.08 1kl1 h ALA 396 N 1.06 0.42 -0.88 2.92 0.00 -0.94 -0.69 119.26 121.16 1kl1 h ALA 396 Ca 0.16 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.19 1kl1 h ALA 396 Cb 0.13 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 1kl1 h ALA 396 CO -0.02 -0.26 0.53 0.00 0.00 0.00 0.00 179.25 179.50 1kl1 h ARG 397 N 0.28 0.90 -0.30 0.00 3.08 -0.91 0.13 114.38 117.57 1kl1 h ARG 397 Ca 0.16 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 1kl1 h ARG 397 Cb 0.13 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1kl1 h ARG 397 CO -0.16 0.59 -0.28 1.96 -1.07 0.00 0.00 179.97 181.01 1kl1 h GLN 398 N 0.93 0.61 -0.15 0.04 4.20 -0.95 -1.23 115.11 118.55 1kl1 h GLN 398 Ca 0.40 -0.26 -0.14 0.00 0.06 0.00 0.00 58.65 58.72 1kl1 h GLN 398 Cb 0.28 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1kl1 h GLN 398 CO -0.21 0.83 -0.49 0.00 -0.67 0.00 0.00 178.83 178.29 1kl1 h ARG 399 N 0.53 0.40 -0.25 1.46 3.08 -0.12 -1.20 114.38 118.29 1kl1 h ARG 399 Ca 0.07 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1kl1 h ARG 399 Cb 0.76 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1kl1 h ARG 399 CO 0.06 0.80 0.05 0.28 -1.07 0.00 0.00 179.97 180.09 1kl1 h VAL 400 N 0.32 1.22 -0.90 2.04 2.07 -0.64 -2.54 116.25 117.82 1kl1 h VAL 400 Ca 0.02 -0.73 0.05 0.00 0.82 0.00 0.00 66.70 66.86 1kl1 h VAL 400 Cb 0.98 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 1kl1 h VAL 400 CO 0.08 0.23 0.59 0.00 0.02 0.00 0.00 177.57 178.49 1kl1 h ALA 401 N 0.87 1.49 -0.50 1.67 0.00 -1.06 -1.25 119.26 120.47 1kl1 h ALA 401 Ca 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1kl1 h ALA 401 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1kl1 h ALA 401 CO 0.00 0.39 0.16 0.00 0.00 0.00 0.00 179.25 179.81 1kl1 h ALA 402 N 1.50 1.34 -0.19 0.00 0.00 -1.01 -0.49 119.26 120.41 1kl1 h ALA 402 Ca 0.38 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.91 1kl1 h ALA 402 Cb 0.14 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1kl1 h ALA 402 CO -0.13 0.48 -0.71 -0.07 0.00 0.00 0.00 179.25 178.82 1kl1 h LEU 403 N 0.73 0.93 0.00 0.00 3.38 -0.85 -3.30 115.31 116.20 1kl1 h LEU 403 Ca 0.17 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1kl1 h LEU 403 Cb 0.21 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1kl1 h LEU 403 CO -0.01 1.38 -0.53 0.35 0.09 0.00 0.00 178.44 179.71 1kl1 n THR 404 N -3.95 0.07 -0.76 0.22 -2.24 -0.60 -5.12 114.28 101.90 1kl1 n THR 404 Ca -0.06 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1kl1 n THR 404 Cb 0.71 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 1kl1 n THR 404 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83