#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kl8 n PHE 9 N 0.00 0.00 0.11 5.64 -0.00 -1.26 -3.85 117.46 118.11 3kl8 n PHE 9 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.57 3kl8 n PHE 9 Cb 0.00 -0.57 0.21 0.00 -0.00 0.00 0.00 39.48 39.13 3kl8 n PHE 9 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 3kl8 h SER 10 N -0.99 0.00 0.80 -2.13 0.02 -2.03 0.23 113.55 109.45 3kl8 h SER 10 Ca -0.10 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 3kl8 h SER 10 Cb 1.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 3kl8 h SER 10 CO -0.06 0.00 -0.49 0.44 -1.14 0.00 0.00 176.83 175.57 3kl8 h ASP 11 N 0.00 -1.25 0.00 3.07 5.19 -2.06 -3.42 116.42 117.96 3kl8 h ASP 11 Ca 0.20 0.07 -0.20 0.00 -0.62 0.00 0.00 57.03 56.47 3kl8 h ASP 11 Cb 2.30 0.36 -0.04 0.00 0.18 0.00 0.00 39.33 42.14 3kl8 h ASP 11 CO -0.00 -0.76 -1.77 0.59 -3.12 0.00 0.00 179.24 174.18 3kl8 n ASN 12 N -5.63 2.92 -4.82 6.45 4.13 0.71 -4.96 115.26 114.06 3kl8 n ASN 12 Ca -0.15 -0.07 -0.37 0.00 1.68 0.00 0.00 54.58 55.67 3kl8 n ASN 12 Cb 0.51 -0.16 -0.06 0.00 -1.54 0.00 0.00 39.78 38.53 3kl8 n ASN 12 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 3kl8 s TYR 13 N -2.27 3.69 -0.22 3.10 1.51 -0.66 -0.92 117.35 121.57 3kl8 s TYR 13 Ca -0.18 1.31 -0.00 0.00 -1.01 0.00 0.00 57.07 57.20 3kl8 s TYR 13 Cb 0.05 -2.55 0.03 0.00 -0.11 0.00 0.00 41.96 39.37 3kl8 s TYR 13 CO 0.32 0.42 -0.12 0.34 -1.11 0.00 0.00 175.55 175.41 3kl8 s ASP 14 N -1.52 3.92 0.38 2.29 2.15 -0.80 -4.56 116.67 118.53 3kl8 s ASP 14 Ca 0.38 -0.84 -0.26 0.00 0.43 0.00 0.00 52.55 52.27 3kl8 s ASP 14 Cb -0.17 -1.59 -0.09 0.00 -0.30 0.00 0.00 42.92 40.77 3kl8 s ASP 14 CO 0.21 -0.08 1.21 -0.69 -0.17 0.00 0.00 175.17 175.65 3kl8 s VAL 15 N 1.29 2.99 0.00 1.11 1.01 -1.26 -2.33 120.40 123.20 3kl8 s VAL 15 Ca 0.01 0.88 0.00 0.00 0.00 0.00 0.00 61.98 62.87 3kl8 s VAL 15 Cb -0.16 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.71 3kl8 s VAL 15 CO -0.07 0.12 0.00 0.29 0.00 0.00 0.00 175.10 175.44 3kl8 n LYS 16 N 0.28 3.10 -0.16 2.72 4.76 -1.06 -4.92 118.16 122.87 3kl8 n LYS 16 Ca 0.03 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.42 3kl8 n LYS 16 Cb 0.45 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.68 3kl8 n LYS 16 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 3kl8 n GLU 17 N 0.00 -1.49 -1.97 1.97 0.00 -1.26 -4.66 120.64 113.23 3kl8 n GLU 17 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 57.16 56.87 3kl8 n GLU 17 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 31.44 31.16 3kl8 n GLU 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3kl8 n GLU 18 N -2.13 1.30 0.00 3.44 0.28 -1.26 -1.49 120.64 120.77 3kl8 n GLU 18 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 3kl8 n GLU 18 Cb 0.10 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.97 3kl8 n GLU 18 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 3kl8 n SER 25 N -1.70 0.00 -4.86 -1.84 7.64 -1.05 -4.88 113.62 106.94 3kl8 n SER 25 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 3kl8 n SER 25 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 3kl8 n SER 25 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3kl8 s VAL 26 N 0.00 4.66 0.22 0.44 0.11 -1.19 -4.84 120.40 119.81 3kl8 s VAL 26 Ca 0.00 0.91 0.06 0.00 -2.93 0.00 0.00 61.98 60.02 3kl8 s VAL 26 Cb 0.00 -3.73 -0.05 0.00 -1.53 0.00 0.00 36.38 31.07 3kl8 s VAL 26 CO 0.00 -0.61 -0.08 -0.69 -3.33 0.00 0.00 175.10 170.38 3kl8 s VAL 27 N -2.51 1.45 -0.18 2.04 1.01 -1.26 -0.21 120.40 120.74 3kl8 s VAL 27 Ca 0.55 -2.12 -0.32 0.00 0.00 0.00 0.00 61.98 60.09 3kl8 s VAL 27 Cb -0.10 -2.19 0.14 0.00 0.00 0.00 0.00 36.38 34.23 3kl8 s VAL 27 CO 0.32 -0.48 1.14 0.00 0.00 0.00 0.00 175.10 176.07 3kl8 s ARG 28 N -3.73 0.40 1.23 2.72 1.70 -0.97 -4.63 118.95 115.67 3kl8 s ARG 28 Ca 0.25 -0.04 -0.19 0.00 -0.47 0.00 0.00 55.73 55.28 3kl8 s ARG 28 Cb 0.03 0.19 0.30 0.00 -0.57 0.00 0.00 34.95 34.89 3kl8 s ARG 28 CO 0.07 -0.15 1.05 0.50 -1.08 0.00 0.00 175.30 175.70 3kl8 s ARG 29 N -1.84 -1.45 0.00 3.89 3.52 -0.56 -0.80 118.95 121.72 3kl8 s ARG 29 Ca 0.05 0.13 0.00 0.00 -0.13 0.00 0.00 55.73 55.78 3kl8 s ARG 29 Cb -0.01 -1.55 0.00 0.00 -1.56 0.00 0.00 34.95 31.83 3kl8 s ARG 29 CO -0.04 -3.90 0.00 0.00 -0.81 0.00 0.00 175.30 170.55 3kl8 s VAL 31 N -2.00 -0.04 0.47 0.00 1.01 -0.99 -0.14 120.40 118.71 3kl8 s VAL 31 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 3kl8 s VAL 31 Cb 0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 36.38 36.23 3kl8 s VAL 31 CO 0.00 0.06 1.43 -2.28 0.00 0.00 0.00 175.10 174.31 3kl8 s HIS 32 N 0.71 2.40 -0.01 5.22 2.46 -1.19 -1.90 115.29 122.98 3kl8 s HIS 32 Ca -0.06 1.27 -0.21 0.00 0.47 0.00 0.00 55.06 56.52 3kl8 s HIS 32 Cb -0.08 -3.93 -0.22 0.00 -0.13 0.00 0.00 32.58 28.22 3kl8 s HIS 32 CO -0.02 -3.01 1.12 -0.22 -2.47 0.00 0.00 174.74 170.14 3kl8 h LYS 33 N 2.17 0.32 0.04 2.88 1.63 -1.40 -1.92 116.57 120.29 3kl8 h LYS 33 Ca -0.51 -0.30 -0.00 0.00 -0.85 0.00 0.00 60.65 58.98 3kl8 h LYS 33 Cb 1.27 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.98 3kl8 h LYS 33 CO 0.60 0.98 -0.02 1.15 -3.45 0.00 0.00 179.45 178.71 3kl8 h THR 34 N -0.22 0.00 0.00 1.00 2.02 -1.92 -3.38 112.91 110.41 3kl8 h THR 34 Ca -0.04 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.12 3kl8 h THR 34 Cb 1.09 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 3kl8 h THR 34 CO 0.08 0.00 -0.38 0.35 0.37 0.00 0.00 175.52 175.94 3kl8 n THR 35 N -2.19 0.23 -1.94 3.16 -2.24 -1.26 -4.95 114.28 105.07 3kl8 n THR 35 Ca -0.01 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.44 3kl8 n THR 35 Cb 0.02 -0.16 -0.04 0.00 -2.10 0.00 0.00 70.33 68.04 3kl8 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kl8 n GLY 36 N 1.41 0.72 3.65 3.38 0.00 -0.72 -4.95 105.19 108.68 3kl8 n GLY 36 Ca 0.05 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 3kl8 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kl8 s LEU 37 N -4.80 4.12 0.34 0.99 1.43 -1.26 -4.70 118.68 114.81 3kl8 s LEU 37 Ca 0.00 1.05 -0.28 0.00 -1.03 0.00 0.00 54.13 53.87 3kl8 s LEU 37 Cb 0.00 -3.16 -0.12 0.00 0.03 0.00 0.00 46.19 42.94 3kl8 s LEU 37 CO 0.00 -0.44 1.26 -0.62 0.23 0.00 0.00 176.35 176.78 3kl8 n GLU 38 N 5.58 2.04 -4.10 1.70 1.02 -1.26 -3.14 120.64 122.47 3kl8 n GLU 38 Ca 0.04 0.71 -0.19 0.00 -0.02 0.00 0.00 57.16 57.71 3kl8 n GLU 38 Cb 0.48 -2.28 -0.07 0.00 -0.02 0.00 0.00 31.44 29.55 3kl8 n GLU 38 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3kl8 n PHE 39 N 0.30 -0.67 -4.15 -0.32 3.72 0.80 -4.59 117.46 112.55 3kl8 n PHE 39 Ca 0.05 -2.61 -0.31 0.00 -0.05 0.00 0.00 57.45 54.54 3kl8 n PHE 39 Cb 0.36 0.25 -0.16 0.00 -0.94 0.00 0.00 39.48 38.98 3kl8 n PHE 39 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3kl8 s ALA 40 N -3.25 1.94 -0.34 4.37 0.00 -0.47 -2.41 121.76 121.60 3kl8 s ALA 40 Ca 0.36 -0.94 -0.06 0.00 0.00 0.00 0.00 51.96 51.31 3kl8 s ALA 40 Cb 0.02 -1.04 0.05 0.00 0.00 0.00 0.00 23.12 22.15 3kl8 s ALA 40 CO 0.25 -0.31 0.11 0.00 0.00 0.00 0.00 175.76 175.82 3kl8 s ALA 41 N 1.33 3.04 0.05 0.00 0.00 0.02 0.55 121.76 126.76 3kl8 s ALA 41 Ca 0.02 -1.81 -0.31 0.00 0.00 0.00 0.00 51.96 49.87 3kl8 s ALA 41 Cb -0.13 -2.27 -0.05 0.00 0.00 0.00 0.00 23.12 20.66 3kl8 s ALA 41 CO -0.09 -1.37 1.18 0.21 0.00 0.00 0.00 175.76 175.69 3kl8 s LYS 42 N 1.38 4.44 -0.27 0.00 2.20 -0.11 -2.28 119.74 125.09 3kl8 s LYS 42 Ca -0.01 1.74 0.02 0.00 -0.36 0.00 0.00 55.97 57.35 3kl8 s LYS 42 Cb -0.20 -3.36 0.07 0.00 -1.51 0.00 0.00 37.83 32.83 3kl8 s LYS 42 CO 0.02 -0.25 -0.03 0.42 -0.36 0.00 0.00 175.35 175.16 3kl8 s ILE 43 N 1.10 1.78 0.50 5.43 1.01 0.70 -0.74 121.20 130.97 3kl8 s ILE 43 Ca 0.58 -1.60 0.07 0.00 0.00 0.00 0.00 60.65 59.71 3kl8 s ILE 43 Cb -0.29 -2.10 0.04 0.00 0.01 0.00 0.00 42.46 40.13 3kl8 s ILE 43 CO 0.29 -0.26 0.68 -0.63 0.00 0.00 0.00 174.94 175.02 3kl8 s ILE 44 N 1.24 2.67 0.00 2.92 1.01 -0.14 -2.53 121.20 126.36 3kl8 s ILE 44 Ca -0.01 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.70 3kl8 s ILE 44 Cb -0.19 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.56 3kl8 s ILE 44 CO -0.08 0.00 0.00 -3.20 0.00 0.00 0.00 174.94 171.66 3kl8 n ASN 45 N -2.07 2.57 0.00 3.58 4.05 -1.26 -1.00 115.26 121.13 3kl8 n ASN 45 Ca 0.11 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.14 3kl8 n ASN 45 Cb 0.60 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.61 3kl8 n ASN 45 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3kl8 n ALA 51 N -2.16 0.00 0.90 5.20 0.00 -1.26 -4.90 120.51 118.29 3kl8 n ALA 51 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3kl8 n ALA 51 Cb 0.33 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.34 3kl8 n ALA 51 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kl8 n ARG 52 N 0.00 0.03 -0.26 0.00 0.63 -1.26 -1.07 116.66 114.73 3kl8 n ARG 52 Ca 0.00 0.05 -0.03 0.00 -0.92 0.00 0.00 57.85 56.95 3kl8 n ARG 52 Cb 0.00 -1.54 0.08 0.00 0.45 0.00 0.00 32.46 31.45 3kl8 n ARG 52 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3kl8 h ASP 53 N 0.00 0.78 -0.63 6.15 3.32 -2.04 -2.13 116.42 121.86 3kl8 h ASP 53 Ca 0.00 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3kl8 h ASP 53 Cb 0.50 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 3kl8 h ASP 53 CO 0.00 0.54 0.31 0.15 -1.72 0.00 0.00 179.24 178.53 3kl8 h PHE 54 N 0.92 0.93 0.00 4.55 3.04 -1.51 -2.64 116.94 122.23 3kl8 h PHE 54 Ca 0.29 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.21 3kl8 h PHE 54 Cb -0.01 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 38.21 3kl8 h PHE 54 CO -0.03 0.68 0.00 0.94 -2.02 0.00 0.00 178.31 177.88 3kl8 n GLN 55 N -4.34 0.23 0.06 1.11 7.27 -0.86 -0.99 117.38 119.86 3kl8 n GLN 55 Ca 0.06 0.09 -0.04 0.00 0.07 0.00 0.00 57.00 57.18 3kl8 n GLN 55 Cb 0.13 -1.50 -0.08 0.00 2.41 0.00 0.00 30.24 31.20 3kl8 n GLN 55 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 3kl8 h LYS 56 N 0.00 0.00 0.00 3.69 1.57 -1.03 -3.30 116.57 117.50 3kl8 h LYS 56 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 3kl8 h LYS 56 Cb 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 3kl8 h LYS 56 CO 0.00 0.66 -1.02 -0.07 -0.57 0.00 0.00 179.45 178.46 3kl8 h LEU 57 N 0.00 0.00 -0.07 2.94 3.38 -1.07 -2.61 115.31 117.88 3kl8 h LEU 57 Ca -0.09 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.89 3kl8 h LEU 57 Cb 1.70 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.44 3kl8 h LEU 57 CO 0.09 0.73 -0.13 -0.08 0.09 0.00 0.00 178.44 179.14 3kl8 h GLU 58 N 0.00 -0.11 0.03 1.13 4.57 -1.22 0.62 114.58 119.60 3kl8 h GLU 58 Ca -0.08 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 3kl8 h GLU 58 Cb 1.62 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 30.19 3kl8 h GLU 58 CO 0.08 -0.07 -0.35 -0.09 -1.18 0.00 0.00 179.01 177.40 3kl8 h ARG 59 N -0.11 -0.51 -0.63 1.92 2.43 -1.64 -2.32 114.38 113.53 3kl8 h ARG 59 Ca 0.01 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.33 3kl8 h ARG 59 Cb 0.15 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 29.73 3kl8 h ARG 59 CO -0.13 -0.34 0.19 1.49 -1.51 0.00 0.00 179.97 179.67 3kl8 h GLU 60 N -0.53 0.32 -0.28 0.20 4.81 -1.39 -2.70 114.58 115.02 3kl8 h GLU 60 Ca 0.05 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 3kl8 h GLU 60 Cb 0.60 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3kl8 h GLU 60 CO -0.26 0.21 0.03 0.00 -0.73 0.00 0.00 179.01 178.26 3kl8 h ALA 61 N 1.47 0.38 -0.97 2.92 0.00 -0.55 -2.43 119.26 120.08 3kl8 h ALA 61 Ca 0.33 -0.21 0.31 0.00 0.00 0.00 0.00 54.91 55.34 3kl8 h ALA 61 Cb 0.47 -0.10 -0.15 0.00 0.00 0.00 0.00 17.79 18.00 3kl8 h ALA 61 CO -0.37 0.09 0.47 -0.09 0.00 0.00 0.00 179.25 179.34 3kl8 h ARG 62 N 0.28 0.25 0.55 0.00 2.43 -1.09 -2.52 114.38 114.28 3kl8 h ARG 62 Ca 0.08 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 3kl8 h ARG 62 Cb 0.37 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 3kl8 h ARG 62 CO 0.01 0.17 -0.26 0.82 -1.51 0.00 0.00 179.97 179.19 3kl8 h ILE 63 N 0.26 0.43 0.00 1.20 2.04 -1.32 -2.67 117.51 117.45 3kl8 h ILE 63 Ca 0.69 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 66.39 3kl8 h ILE 63 Cb 1.57 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 3kl8 h ILE 63 CO -0.64 0.03 0.05 0.00 0.00 0.00 0.00 178.15 177.59 3kl8 h ARG 65 N 0.00 0.00 0.00 0.00 2.43 -1.27 -2.86 114.38 112.69 3kl8 h ARG 65 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3kl8 h ARG 65 Cb 0.11 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3kl8 h ARG 65 CO 0.00 0.00 -0.50 0.87 -1.51 0.00 0.00 179.97 178.83 3kl8 h LYS 66 N 0.00 0.00 -3.83 0.20 1.57 -0.36 -3.43 116.57 110.71 3kl8 h LYS 66 Ca 0.00 0.00 -0.77 0.00 -1.87 0.00 0.00 60.65 58.01 3kl8 h LYS 66 Cb 0.82 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 32.85 3kl8 h LYS 66 CO 0.00 0.01 -0.04 -0.51 -0.57 0.00 0.00 179.45 178.35 3kl8 s LEU 67 N -5.81 6.38 -0.54 2.94 1.43 -1.08 -4.98 118.68 117.03 3kl8 s LEU 67 Ca 0.03 -2.62 -0.01 0.00 -1.03 0.00 0.00 54.13 50.50 3kl8 s LEU 67 Cb 0.07 -2.13 0.14 0.00 0.03 0.00 0.00 46.19 44.30 3kl8 s LEU 67 CO 0.73 -0.56 0.33 -1.10 0.23 0.00 0.00 176.35 175.98 3kl8 s GLN 68 N 0.29 2.26 -0.04 1.70 -1.52 -1.26 -4.51 119.66 116.58 3kl8 s GLN 68 Ca 0.16 -2.33 -0.11 0.00 -1.95 0.00 0.00 55.36 51.12 3kl8 s GLN 68 Cb -0.14 -3.59 0.02 0.00 -0.22 0.00 0.00 33.01 29.07 3kl8 s GLN 68 CO -0.07 -1.12 0.26 -1.58 -0.25 0.00 0.00 175.29 172.53 3kl8 s HIS 69 N 0.25 -0.17 0.39 0.91 2.46 -1.26 -5.05 115.29 112.81 3kl8 s HIS 69 Ca 0.14 0.34 0.11 0.00 0.47 0.00 0.00 55.06 56.12 3kl8 s HIS 69 Cb -0.22 0.07 0.89 0.00 -0.13 0.00 0.00 32.58 33.19 3kl8 s HIS 69 CO -0.03 -0.28 1.92 -1.35 -2.47 0.00 0.00 174.74 172.53 3kl8 h PRO 70 N 4.60 0.58 -0.66 2.88 0.11 -1.98 0.18 132.00 137.71 3kl8 h PRO 70 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3kl8 h PRO 70 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3kl8 h PRO 70 CO 0.38 0.38 0.00 0.09 -0.21 0.00 0.00 178.00 178.64 3kl8 n ASN 71 N -4.50 3.98 -4.09 -2.05 4.13 -1.26 -4.78 115.26 106.69 3kl8 n ASN 71 Ca 0.14 -2.50 -0.31 0.00 1.68 0.00 0.00 54.58 53.59 3kl8 n ASN 71 Cb 0.41 -0.56 -0.16 0.00 -1.54 0.00 0.00 39.78 37.92 3kl8 n ASN 71 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3kl8 s ILE 72 N -2.01 1.78 -0.80 2.41 1.01 0.63 0.09 121.20 124.30 3kl8 s ILE 72 Ca 0.38 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 60.06 3kl8 s ILE 72 Cb 0.27 -1.61 -0.20 0.00 0.01 0.00 0.00 42.46 40.93 3kl8 s ILE 72 CO 0.14 0.49 2.09 0.52 0.00 0.00 0.00 174.94 178.19 3kl8 n VAL 73 N 4.34 0.00 -1.99 2.92 0.31 -0.80 -4.52 118.33 118.59 3kl8 n VAL 73 Ca -0.19 -0.42 -0.41 0.00 -0.01 0.00 0.00 64.34 63.31 3kl8 n VAL 73 Cb 0.51 -1.08 -0.02 0.00 -0.91 0.00 0.00 33.84 32.34 3kl8 n VAL 73 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3kl8 s ARG 74 N 7.71 4.26 -0.16 5.55 0.52 -1.26 -4.68 118.95 130.89 3kl8 s ARG 74 Ca 0.91 2.35 -0.19 0.00 -0.52 0.00 0.00 55.73 58.27 3kl8 s ARG 74 Cb -0.33 -3.06 -0.03 0.00 0.52 0.00 0.00 34.95 32.05 3kl8 s ARG 74 CO 0.25 -0.37 0.55 -1.17 0.02 0.00 0.00 175.30 174.58 3kl8 s LEU 75 N -1.36 4.21 -0.26 2.53 2.96 -1.26 -1.51 118.68 123.99 3kl8 s LEU 75 Ca 0.54 0.81 -0.10 0.00 -0.22 0.00 0.00 54.13 55.16 3kl8 s LEU 75 Cb -0.42 -2.79 -0.12 0.00 0.50 0.00 0.00 46.19 43.36 3kl8 s LEU 75 CO 0.52 -0.14 -0.31 1.41 -1.32 0.00 0.00 176.35 176.51 3kl8 n HIS 76 N 4.37 0.00 -3.93 5.38 8.25 0.73 -4.78 115.22 125.24 3kl8 n HIS 76 Ca -0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.32 3kl8 n HIS 76 Cb 0.51 -0.95 -0.11 0.00 1.12 0.00 0.00 29.99 30.57 3kl8 n HIS 76 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3kl8 s ASP 77 N -7.17 0.14 -0.11 0.41 2.15 -1.20 -5.00 116.67 105.90 3kl8 s ASP 77 Ca -0.36 -0.36 0.03 0.00 0.43 0.00 0.00 52.55 52.29 3kl8 s ASP 77 Cb 0.13 0.14 0.01 0.00 -0.30 0.00 0.00 42.92 42.90 3kl8 s ASP 77 CO 0.48 -0.32 -0.20 -0.55 -0.17 0.00 0.00 175.17 174.42 3kl8 s SER 78 N -1.38 2.76 -0.03 -0.34 0.15 -1.26 -0.97 113.70 112.62 3kl8 s SER 78 Ca -0.15 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.00 3kl8 s SER 78 Cb -0.09 -1.26 0.03 0.00 -1.71 0.00 0.00 66.02 62.99 3kl8 s SER 78 CO 0.00 0.09 0.01 -0.63 1.20 0.00 0.00 173.24 173.91 3kl8 s ILE 79 N 0.65 0.09 -0.29 6.45 1.01 -0.22 -5.01 121.20 123.89 3kl8 s ILE 79 Ca -0.13 0.14 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 3kl8 s ILE 79 Cb -0.16 -0.21 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 3kl8 s ILE 79 CO 0.03 0.13 0.23 -1.58 0.00 0.00 0.00 174.94 173.75 3kl8 s GLN 80 N 1.10 3.90 0.00 2.79 2.00 -1.26 -0.39 119.66 127.80 3kl8 s GLN 80 Ca -0.09 -0.31 0.00 0.00 -2.00 0.00 0.00 55.36 52.97 3kl8 s GLN 80 Cb -0.13 -3.68 0.00 0.00 0.80 0.00 0.00 33.01 30.00 3kl8 s GLN 80 CO -0.02 -0.23 0.00 0.39 -0.50 0.00 0.00 175.29 174.93 3kl8 n GLU 81 N 5.11 0.00 0.00 1.67 -0.58 -0.92 -4.69 120.64 121.23 3kl8 n GLU 81 Ca -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 3kl8 n GLU 81 Cb 0.52 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.39 3kl8 n GLU 81 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3kl8 n GLU 82 N 0.00 0.00 -0.00 3.49 1.02 -1.26 -4.84 120.64 119.05 3kl8 n GLU 82 Ca 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.21 3kl8 n GLU 82 Cb 0.00 -0.17 -0.09 0.00 -0.02 0.00 0.00 31.44 31.16 3kl8 n GLU 82 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3kl8 n SER 83 N -1.13 1.17 -4.90 1.62 3.41 -1.26 -4.99 113.62 107.54 3kl8 n SER 83 Ca 0.00 -0.45 -0.33 0.00 -0.26 0.00 0.00 58.87 57.82 3kl8 n SER 83 Cb 0.00 1.28 -0.05 0.00 -0.26 0.00 0.00 64.21 65.18 3kl8 n SER 83 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3kl8 s PHE 84 N -2.57 3.55 -0.06 7.33 2.99 -1.26 -4.31 117.98 123.65 3kl8 s PHE 84 Ca 0.01 0.43 0.03 0.00 0.00 0.00 0.00 56.93 57.39 3kl8 s PHE 84 Cb 0.10 -1.89 -0.03 0.00 0.00 0.00 0.00 43.02 41.20 3kl8 s PHE 84 CO 0.56 0.62 -0.12 -1.58 -0.00 0.00 0.00 175.22 174.69 3kl8 s HIS 85 N -1.36 2.77 -0.10 0.36 2.46 -0.17 -2.16 115.29 117.09 3kl8 s HIS 85 Ca 0.29 -0.15 0.02 0.00 0.47 0.00 0.00 55.06 55.69 3kl8 s HIS 85 Cb -0.13 -1.67 -0.01 0.00 -0.13 0.00 0.00 32.58 30.64 3kl8 s HIS 85 CO 0.19 0.19 -0.17 0.71 -2.47 0.00 0.00 174.74 173.19 3kl8 s TYR 86 N -0.66 2.69 -0.23 3.88 1.51 0.48 -0.97 117.35 124.04 3kl8 s TYR 86 Ca 0.10 -0.64 -0.00 0.00 -1.01 0.00 0.00 57.07 55.52 3kl8 s TYR 86 Cb -0.11 -1.75 0.06 0.00 -0.11 0.00 0.00 41.96 40.06 3kl8 s TYR 86 CO 0.01 -0.18 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.74 3kl8 s LEU 87 N 0.08 2.32 -0.41 -1.29 1.43 0.08 -1.05 118.68 119.83 3kl8 s LEU 87 Ca -0.07 -1.15 -0.22 0.00 -1.03 0.00 0.00 54.13 51.65 3kl8 s LEU 87 Cb -0.15 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 45.04 3kl8 s LEU 87 CO 0.05 -0.26 0.74 -0.69 0.23 0.00 0.00 176.35 176.42 3kl8 s VAL 88 N 1.49 4.73 0.22 -1.59 1.01 -0.15 -0.94 120.40 125.18 3kl8 s VAL 88 Ca -0.03 0.52 0.08 0.00 0.00 0.00 0.00 61.98 62.54 3kl8 s VAL 88 Cb -0.18 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 3kl8 s VAL 88 CO -0.08 -0.58 0.03 -0.36 0.00 0.00 0.00 175.10 174.11 3kl8 s PHE 89 N 3.10 2.82 0.45 5.22 0.40 0.19 -0.19 117.98 129.98 3kl8 s PHE 89 Ca 0.28 -0.17 -0.22 0.00 -0.60 0.00 0.00 56.93 56.23 3kl8 s PHE 89 Cb -0.13 -1.31 -0.11 0.00 0.51 0.00 0.00 43.02 41.98 3kl8 s PHE 89 CO 0.20 0.56 0.64 -0.25 0.70 0.00 0.00 175.22 177.07 3kl8 n ASP 90 N -0.60 -0.46 -4.57 1.36 10.43 -0.57 -1.36 116.55 120.78 3kl8 n ASP 90 Ca -0.08 0.90 -0.37 0.00 2.57 0.00 0.00 54.79 57.81 3kl8 n ASP 90 Cb 0.57 -1.18 -0.11 0.00 1.84 0.00 0.00 41.12 42.25 3kl8 n ASP 90 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3kl8 s LEU 91 N 1.04 3.88 -0.04 0.64 2.96 -1.26 -4.33 118.68 121.57 3kl8 s LEU 91 Ca 0.65 -0.02 0.05 0.00 -0.22 0.00 0.00 54.13 54.58 3kl8 s LEU 91 Cb -0.56 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.07 3kl8 s LEU 91 CO 0.57 -0.00 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.72 3kl8 s VAL 92 N 1.44 1.58 0.00 1.68 1.01 -1.26 -5.01 120.40 119.84 3kl8 s VAL 92 Ca 0.07 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3kl8 s VAL 92 Cb -0.15 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.89 3kl8 s VAL 92 CO 0.07 0.45 0.00 0.35 0.00 0.00 0.00 175.10 175.97 3kl8 n THR 93 N 3.01 0.00 0.00 3.92 -2.24 -1.25 -4.72 114.28 113.00 3kl8 n THR 93 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3kl8 n THR 93 Cb 0.53 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 3kl8 n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kl8 n GLY 94 N 2.57 0.00 6.42 3.38 0.00 -0.49 -4.91 105.19 112.16 3kl8 n GLY 94 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3kl8 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kl8 n GLY 95 N -0.66 -1.58 3.82 -0.02 0.00 -1.26 -4.53 105.19 100.97 3kl8 n GLY 95 Ca 0.00 -1.23 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 3kl8 n GLY 95 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kl8 s GLU 96 N -0.15 3.86 0.30 1.61 2.02 -1.26 -1.42 118.70 123.66 3kl8 s GLU 96 Ca 0.00 1.09 0.05 0.00 0.02 0.00 0.00 54.97 56.12 3kl8 s GLU 96 Cb 0.00 -2.12 0.49 0.00 0.10 0.00 0.00 34.13 32.60 3kl8 s GLU 96 CO 0.00 -0.35 1.75 1.25 0.02 0.00 0.00 175.26 177.93 3kl8 h LEU 97 N 1.09 0.38 -0.38 1.80 5.85 0.02 -2.76 115.31 121.30 3kl8 h LEU 97 Ca -0.48 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.20 3kl8 h LEU 97 Cb 1.20 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 42.03 3kl8 h LEU 97 CO 0.60 0.64 -0.32 0.15 -0.34 0.00 0.00 178.44 179.18 3kl8 h PHE 98 N 0.34 -0.87 -0.65 1.25 3.57 -1.76 -1.10 116.94 117.73 3kl8 h PHE 98 Ca 0.05 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.64 3kl8 h PHE 98 Cb 0.64 0.44 -0.04 0.00 2.79 0.00 0.00 35.95 39.78 3kl8 h PHE 98 CO 0.02 -0.38 0.39 0.93 -2.23 0.00 0.00 178.31 177.04 3kl8 h GLU 99 N -0.25 0.73 0.00 1.11 5.08 -1.84 -1.12 114.58 118.29 3kl8 h GLU 99 Ca 0.17 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3kl8 h GLU 99 Cb 0.53 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3kl8 h GLU 99 CO -0.52 0.48 0.00 0.22 -1.00 0.00 0.00 179.01 178.19 3kl8 h ASP 100 N 0.75 0.00 0.13 1.42 3.58 -1.05 0.40 116.42 121.65 3kl8 h ASP 100 Ca 0.27 0.00 -0.26 0.00 0.42 0.00 0.00 57.03 57.45 3kl8 h ASP 100 Cb 0.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.12 3kl8 h ASP 100 CO -0.12 0.00 -1.32 0.40 -2.88 0.00 0.00 179.24 175.32 3kl8 h ILE 101 N 0.00 1.12 -0.16 2.25 2.04 -0.03 -2.66 117.51 120.07 3kl8 h ILE 101 Ca 0.00 -2.44 -0.05 0.00 1.00 0.00 0.00 64.86 63.38 3kl8 h ILE 101 Cb 0.26 2.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 3kl8 h ILE 101 CO 0.00 0.71 -0.10 -0.37 0.00 0.00 0.00 178.15 178.39 3kl8 h VAL 102 N -0.29 1.17 0.50 1.67 -1.51 -1.15 0.90 116.25 117.54 3kl8 h VAL 102 Ca -0.27 -0.73 -0.02 0.00 -1.23 0.00 0.00 66.70 64.45 3kl8 h VAL 102 Cb 1.76 1.16 -0.01 0.00 -2.13 0.00 0.00 31.29 32.07 3kl8 h VAL 102 CO 0.09 0.23 -0.34 0.00 -1.23 0.00 0.00 177.57 176.31 3kl8 h ALA 103 N 1.66 -0.83 -0.01 5.19 0.00 -0.96 -3.15 119.26 121.15 3kl8 h ALA 103 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3kl8 h ALA 103 Cb 0.34 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3kl8 h ALA 103 CO 0.02 -0.99 -0.37 0.54 0.00 0.00 0.00 179.25 178.45 3kl8 n ARG 104 N -5.47 0.67 0.00 0.00 1.74 -1.00 -4.96 116.66 107.63 3kl8 n ARG 104 Ca -0.12 -0.43 0.00 0.00 -0.77 0.00 0.00 57.85 56.54 3kl8 n ARG 104 Cb 0.37 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 3kl8 n ARG 104 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3kl8 n GLU 105 N -0.80 0.00 0.00 5.56 1.02 0.30 -4.80 120.64 121.92 3kl8 n GLU 105 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 3kl8 n GLU 105 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.78 3kl8 n GLU 105 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 3kl8 n PHE 106 N 0.00 0.00 -1.32 -0.32 1.16 -1.25 -3.98 117.46 111.75 3kl8 n PHE 106 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.27 3kl8 n PHE 106 Cb 0.00 0.00 0.09 0.00 -1.61 0.00 0.00 39.48 37.96 3kl8 n PHE 106 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 3kl8 s TYR 107 N -0.82 2.60 0.70 2.97 4.12 0.37 -4.97 117.35 122.32 3kl8 s TYR 107 Ca 0.00 1.55 -0.11 0.00 0.02 0.00 0.00 57.07 58.53 3kl8 s TYR 107 Cb 0.00 -3.05 0.01 0.00 -1.52 0.00 0.00 41.96 37.40 3kl8 s TYR 107 CO 0.00 -1.77 1.08 -1.54 0.02 0.00 0.00 175.55 173.35 3kl8 s SER 108 N -3.33 5.45 0.35 2.29 1.04 -1.26 -4.62 113.70 113.62 3kl8 s SER 108 Ca 0.62 1.24 0.04 0.00 0.48 0.00 0.00 55.95 58.32 3kl8 s SER 108 Cb -0.17 -2.08 0.64 0.00 0.10 0.00 0.00 66.02 64.51 3kl8 s SER 108 CO 0.55 -1.35 1.92 -0.33 0.98 0.00 0.00 173.24 175.01 3kl8 h GLU 109 N -0.66 0.58 0.53 4.02 5.08 -1.96 0.32 114.58 122.49 3kl8 h GLU 109 Ca -0.45 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 57.79 3kl8 h GLU 109 Cb 1.24 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.40 3kl8 h GLU 109 CO 0.62 0.53 -0.25 0.00 -1.00 0.00 0.00 179.01 178.91 3kl8 h ALA 110 N 1.55 -0.71 -0.53 3.43 0.00 -1.98 0.94 119.26 121.96 3kl8 h ALA 110 Ca 0.13 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3kl8 h ALA 110 Cb 0.20 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3kl8 h ALA 110 CO -0.01 -0.80 0.31 -0.44 0.00 0.00 0.00 179.25 178.32 3kl8 h ASP 111 N -0.91 0.63 0.20 0.00 3.45 -1.88 -0.12 116.42 117.80 3kl8 h ASP 111 Ca -0.07 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.34 3kl8 h ASP 111 Cb 0.61 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 3kl8 h ASP 111 CO 0.12 0.49 -0.10 0.00 -1.57 0.00 0.00 179.24 178.19 3kl8 h ALA 112 N 1.62 -0.27 -0.68 3.45 0.00 -0.14 0.14 119.26 123.37 3kl8 h ALA 112 Ca 0.19 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 55.09 3kl8 h ALA 112 Cb -0.02 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.78 3kl8 h ALA 112 CO -0.04 -0.54 0.18 1.03 0.00 0.00 0.00 179.25 179.89 3kl8 h SER 113 N -0.50 0.06 -0.40 0.00 0.87 0.15 0.61 113.55 114.33 3kl8 h SER 113 Ca -0.03 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 3kl8 h SER 113 Cb 0.38 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 3kl8 h SER 113 CO 0.05 0.01 0.12 -0.74 -0.53 0.00 0.00 176.83 175.74 3kl8 h HIS 114 N 0.30 0.65 -0.69 2.24 6.17 -0.86 -1.82 115.15 121.14 3kl8 h HIS 114 Ca 0.37 -0.07 -0.08 0.00 0.71 0.00 0.00 60.37 61.31 3kl8 h HIS 114 Cb 0.59 -0.19 -0.03 0.00 2.52 0.00 0.00 27.41 30.30 3kl8 h HIS 114 CO -0.24 0.61 0.14 0.00 0.71 0.00 0.00 177.93 179.15 3kl8 h ILE 116 N 1.06 1.51 -0.09 0.00 6.09 -0.94 -2.96 117.51 122.18 3kl8 h ILE 116 Ca 0.21 -2.71 -0.05 0.00 -1.37 0.00 0.00 64.86 60.94 3kl8 h ILE 116 Cb 0.42 2.54 -0.01 0.00 0.47 0.00 0.00 36.82 40.23 3kl8 h ILE 116 CO 0.01 0.79 -0.17 -0.61 -3.07 0.00 0.00 178.15 175.10 3kl8 h GLN 117 N 0.10 0.14 0.14 2.19 4.15 -1.12 0.15 115.11 120.86 3kl8 h GLN 117 Ca -0.05 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 3kl8 h GLN 117 Cb 1.57 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.25 3kl8 h GLN 117 CO 0.14 0.31 -0.07 1.96 -1.93 0.00 0.00 178.83 179.25 3kl8 h GLN 118 N 0.13 -0.18 -0.50 1.69 4.20 -1.37 -2.12 115.11 116.96 3kl8 h GLN 118 Ca 0.03 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.80 3kl8 h GLN 118 Cb 0.39 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 3kl8 h GLN 118 CO 0.03 0.23 0.23 0.82 -0.67 0.00 0.00 178.83 179.46 3kl8 h ILE 119 N -0.67 0.91 -0.28 2.54 2.04 -1.32 -2.14 117.51 118.59 3kl8 h ILE 119 Ca -0.02 -0.15 0.05 0.00 1.00 0.00 0.00 64.86 65.74 3kl8 h ILE 119 Cb 0.50 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 3kl8 h ILE 119 CO 0.03 0.08 -0.01 -0.07 0.00 0.00 0.00 178.15 178.18 3kl8 h LEU 120 N 0.44 -0.13 -1.20 1.44 3.38 -0.74 0.17 115.31 118.67 3kl8 h LEU 120 Ca 0.23 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.34 3kl8 h LEU 120 Cb 0.18 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3kl8 h LEU 120 CO -0.19 -0.03 0.57 -0.33 0.09 0.00 0.00 178.44 178.55 3kl8 h GLU 121 N 0.07 0.90 0.07 1.13 5.08 -1.06 0.40 114.58 121.17 3kl8 h GLU 121 Ca 0.13 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3kl8 h GLU 121 Cb 0.18 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3kl8 h GLU 121 CO -0.23 0.60 -0.03 0.66 -1.00 0.00 0.00 179.01 179.00 3kl8 h SER 122 N 0.93 -0.08 -0.03 1.42 4.64 -0.65 -2.08 113.55 117.70 3kl8 h SER 122 Ca 0.39 -0.41 0.03 0.00 -0.47 0.00 0.00 61.79 61.34 3kl8 h SER 122 Cb 0.30 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.35 3kl8 h SER 122 CO -0.15 0.38 -0.44 0.40 -0.87 0.00 0.00 176.83 176.14 3kl8 h ILE 123 N -0.56 0.12 -0.95 0.95 1.08 -0.36 -0.26 117.51 117.53 3kl8 h ILE 123 Ca -0.01 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.58 3kl8 h ILE 123 Cb 0.48 0.12 -0.14 0.00 -3.07 0.00 0.00 36.82 34.21 3kl8 h ILE 123 CO 0.02 0.00 -0.48 0.00 -0.69 0.00 0.00 178.15 176.99 3kl8 h ALA 124 N -0.08 -0.21 -0.38 1.87 0.00 -0.22 0.13 119.26 120.37 3kl8 h ALA 124 Ca 0.05 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.20 3kl8 h ALA 124 Cb 0.66 1.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.57 3kl8 h ALA 124 CO -0.34 -0.80 0.07 -0.92 0.00 0.00 0.00 179.25 177.26 3kl8 h TYR 125 N -0.03 0.11 -0.51 0.00 3.20 -0.85 0.82 116.97 119.72 3kl8 h TYR 125 Ca 0.25 0.02 0.09 0.00 3.14 0.00 0.00 58.73 62.23 3kl8 h TYR 125 Cb 0.51 0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.72 3kl8 h TYR 125 CO -0.92 0.01 0.08 0.00 -1.64 0.00 0.00 178.16 175.68 3kl8 h HIS 127 N 0.21 0.39 0.00 0.00 3.86 -0.31 0.85 115.15 120.14 3kl8 h HIS 127 Ca 0.26 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 3kl8 h HIS 127 Cb 0.36 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.75 3kl8 h HIS 127 CO -0.25 0.75 0.00 -1.13 0.86 0.00 0.00 177.93 178.16 3kl8 n SER 128 N -4.56 0.00 -0.17 2.45 3.41 0.23 -0.54 113.62 114.43 3kl8 n SER 128 Ca -0.07 -0.09 0.06 0.00 -0.26 0.00 0.00 58.87 58.51 3kl8 n SER 128 Cb 0.37 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.40 3kl8 n SER 128 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3kl8 n ASN 129 N -0.91 1.57 -0.14 4.04 3.02 -0.87 -5.00 115.26 116.96 3kl8 n ASN 129 Ca 0.02 -2.59 -0.02 0.00 -0.03 0.00 0.00 54.58 51.96 3kl8 n ASN 129 Cb 0.01 -0.30 -0.01 0.00 -0.61 0.00 0.00 39.78 38.87 3kl8 n ASN 129 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kl8 n GLY 130 N -0.89 0.49 3.65 7.41 0.00 0.29 -4.95 105.19 111.20 3kl8 n GLY 130 Ca 0.09 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 3kl8 n GLY 130 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kl8 s ILE 131 N -1.83 4.56 -0.11 -0.61 -1.09 0.24 -0.21 121.20 122.16 3kl8 s ILE 131 Ca 0.00 -0.13 0.02 0.00 -2.23 0.00 0.00 60.65 58.31 3kl8 s ILE 131 Cb 0.00 -3.00 -0.01 0.00 -1.58 0.00 0.00 42.46 37.87 3kl8 s ILE 131 CO 0.00 0.52 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.37 3kl8 s VAL 132 N -0.12 2.73 -0.14 2.92 1.01 -0.72 -3.30 120.40 122.79 3kl8 s VAL 132 Ca 0.06 -0.79 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 3kl8 s VAL 132 Cb -0.12 -2.10 -0.19 0.00 0.00 0.00 0.00 36.38 33.96 3kl8 s VAL 132 CO 0.02 0.54 0.52 -0.74 0.00 0.00 0.00 175.10 175.44 3kl8 h HIS 133 N 6.50 0.00 0.00 5.22 2.76 -1.88 -2.32 115.15 125.42 3kl8 h HIS 133 Ca -0.27 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.90 3kl8 h HIS 133 Cb 1.21 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.17 3kl8 h HIS 133 CO 0.49 0.84 0.00 0.54 -1.30 0.00 0.00 177.93 178.49 3kl8 n ARG 134 N -4.62 0.00 -0.99 5.26 1.74 -1.26 -3.16 116.66 113.63 3kl8 n ARG 134 Ca -0.11 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.81 3kl8 n ARG 134 Cb 0.41 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.82 3kl8 n ARG 134 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3kl8 n ASN 135 N 3.38 6.10 -4.58 0.55 5.15 -1.26 -4.62 115.26 119.97 3kl8 n ASN 135 Ca 0.00 -2.90 -0.43 0.00 -0.60 0.00 0.00 54.58 50.65 3kl8 n ASN 135 Cb 0.00 -1.17 -0.04 0.00 -0.53 0.00 0.00 39.78 38.04 3kl8 n ASN 135 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3kl8 s LEU 136 N -1.32 4.00 0.20 1.20 2.96 -1.26 -4.88 118.68 119.57 3kl8 s LEU 136 Ca 0.38 0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 54.49 3kl8 s LEU 136 Cb 0.25 -3.22 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 3kl8 s LEU 136 CO -0.06 -0.97 0.36 -1.59 -1.32 0.00 0.00 176.35 172.78 3kl8 s LYS 137 N 3.64 1.34 0.33 1.98 -2.85 -1.26 -4.83 119.74 118.08 3kl8 s LYS 137 Ca 0.37 -1.24 0.03 0.00 -1.00 0.00 0.00 55.97 54.13 3kl8 s LYS 137 Cb -0.11 0.41 0.61 0.00 -2.06 0.00 0.00 37.83 36.68 3kl8 s LYS 137 CO 0.23 -0.52 1.94 -1.35 0.10 0.00 0.00 175.35 175.75 3kl8 h PRO 138 N 2.41 0.89 0.00 1.78 0.11 -1.94 -1.64 132.00 133.61 3kl8 h PRO 138 Ca -0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3kl8 h PRO 138 Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3kl8 h PRO 138 CO 0.43 0.59 0.00 0.39 -0.21 0.00 0.00 178.00 179.20 3kl8 n GLU 139 N -4.47 0.40 0.00 1.05 4.71 -1.26 -1.80 120.64 119.27 3kl8 n GLU 139 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.27 3kl8 n GLU 139 Cb 0.18 -1.45 0.00 0.00 -1.01 0.00 0.00 31.44 29.17 3kl8 n GLU 139 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3kl8 n ASN 140 N -0.95 1.77 -4.41 1.62 3.02 -0.62 -4.94 115.26 110.75 3kl8 n ASN 140 Ca 0.09 -1.79 -0.35 0.00 -0.03 0.00 0.00 54.58 52.50 3kl8 n ASN 140 Cb 0.04 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.08 3kl8 n ASN 140 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3kl8 s LEU 141 N -0.79 3.18 0.05 3.41 1.43 -0.74 -1.98 118.68 123.24 3kl8 s LEU 141 Ca 0.00 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3kl8 s LEU 141 Cb 0.00 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 3kl8 s LEU 141 CO 0.00 0.03 0.09 -0.76 0.23 0.00 0.00 176.35 175.94 3kl8 s LEU 142 N 1.18 3.87 -0.01 1.79 1.43 0.09 0.56 118.68 127.58 3kl8 s LEU 142 Ca 0.03 0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.17 3kl8 s LEU 142 Cb -0.14 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.58 3kl8 s LEU 142 CO 0.01 0.20 0.12 -0.76 0.23 0.00 0.00 176.35 176.15 3kl8 s LEU 143 N -2.19 4.10 0.08 1.79 1.43 -0.51 0.46 118.68 123.84 3kl8 s LEU 143 Ca 0.28 0.24 -0.21 0.00 -1.03 0.00 0.00 54.13 53.41 3kl8 s LEU 143 Cb -0.12 -2.39 -0.10 0.00 0.03 0.00 0.00 46.19 43.61 3kl8 s LEU 143 CO 0.20 0.28 1.62 0.00 0.23 0.00 0.00 176.35 178.68 3kl8 h ALA 144 N 4.04 0.21 -3.57 4.21 0.00 -1.19 -1.29 119.26 121.67 3kl8 h ALA 144 Ca -0.49 -0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.12 3kl8 h ALA 144 Cb 1.19 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 3kl8 h ALA 144 CO 0.65 -0.20 -0.10 -1.13 0.00 0.00 0.00 179.25 178.47 3kl8 n SER 145 N -4.86 -0.92 -1.72 0.00 3.41 -1.26 -3.11 113.62 105.15 3kl8 n SER 145 Ca -0.05 -2.28 -0.10 0.00 -0.26 0.00 0.00 58.87 56.18 3kl8 n SER 145 Cb 0.12 1.72 0.17 0.00 -0.26 0.00 0.00 64.21 65.96 3kl8 n SER 145 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3kl8 n LYS 146 N -0.39 2.38 -0.63 4.33 5.02 -1.26 -4.66 118.16 122.94 3kl8 n LYS 146 Ca 0.00 -2.07 -0.31 0.00 -2.02 0.00 0.00 58.31 53.91 3kl8 n LYS 146 Cb 0.40 -1.87 0.19 0.00 -0.02 0.00 0.00 35.03 33.73 3kl8 n LYS 146 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kl8 n ALA 147 N -0.31 -3.05 -2.32 7.82 0.00 -1.26 -4.87 120.51 116.51 3kl8 n ALA 147 Ca 0.34 -1.03 -0.41 0.00 0.00 0.00 0.00 53.44 52.34 3kl8 n ALA 147 Cb 1.18 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.83 3kl8 n ALA 147 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3kl8 n LYS 148 N -3.18 4.49 0.00 0.00 3.00 -1.26 -3.66 118.16 117.56 3kl8 n LYS 148 Ca 0.04 -3.84 0.00 0.00 -0.00 0.00 0.00 58.31 54.51 3kl8 n LYS 148 Cb 0.57 -2.66 0.00 0.00 0.00 0.00 0.00 35.03 32.94 3kl8 n LYS 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3kl8 n GLY 149 N 1.62 0.00 3.35 3.14 0.00 -1.26 -5.14 105.19 106.89 3kl8 n GLY 149 Ca 0.49 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 3kl8 n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kl8 n ALA 150 N 0.00 -2.43 -1.80 4.61 0.00 -1.24 -4.92 120.51 114.73 3kl8 n ALA 150 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 53.44 53.20 3kl8 n ALA 150 Cb 0.00 -1.58 0.02 0.00 0.00 0.00 0.00 19.45 17.89 3kl8 n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kl8 s ALA 151 N -1.70 3.00 -0.04 0.00 0.00 -1.26 -4.78 121.76 116.96 3kl8 s ALA 151 Ca 0.61 -0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.59 3kl8 s ALA 151 Cb -0.58 -3.11 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 3kl8 s ALA 151 CO 0.61 -0.77 -0.14 0.08 0.00 0.00 0.00 175.76 175.54 3kl8 s VAL 152 N -3.08 3.11 0.07 0.00 1.01 -1.26 -0.66 120.40 119.58 3kl8 s VAL 152 Ca 0.56 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.89 3kl8 s VAL 152 Cb -0.12 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3kl8 s VAL 152 CO 0.52 0.57 -0.23 -0.54 0.00 0.00 0.00 175.10 175.42 3kl8 s LYS 153 N -0.80 1.42 -0.07 2.72 -0.14 0.17 -4.48 119.74 118.56 3kl8 s LYS 153 Ca 0.12 -1.09 -0.12 0.00 -1.36 0.00 0.00 55.97 53.52 3kl8 s LYS 153 Cb -0.11 -1.64 -0.05 0.00 -1.68 0.00 0.00 37.83 34.35 3kl8 s LYS 153 CO 0.01 0.41 0.29 -1.17 -0.76 0.00 0.00 175.35 174.13 3kl8 s LEU 154 N -1.50 4.40 0.27 3.17 2.96 0.11 -0.74 118.68 127.36 3kl8 s LEU 154 Ca 0.09 0.70 -0.03 0.00 -0.22 0.00 0.00 54.13 54.67 3kl8 s LEU 154 Cb -0.10 -2.36 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 3kl8 s LEU 154 CO 0.03 0.32 0.34 0.00 -1.32 0.00 0.00 176.35 175.71 3kl8 s ALA 155 N -0.78 0.77 -0.29 5.97 0.00 -0.84 -1.91 121.76 124.68 3kl8 s ALA 155 Ca 0.19 -1.48 -0.02 0.00 0.00 0.00 0.00 51.96 50.65 3kl8 s ALA 155 Cb -0.14 1.25 0.00 0.00 0.00 0.00 0.00 23.12 24.23 3kl8 s ALA 155 CO 0.08 -0.73 0.08 -3.47 0.00 0.00 0.00 175.76 171.73 3kl8 n ASP 156 N -0.77 -7.39 -1.81 0.00 2.03 -1.26 -4.87 116.55 102.48 3kl8 n ASP 156 Ca 0.01 1.17 -0.08 0.00 0.52 0.00 0.00 54.79 56.41 3kl8 n ASP 156 Cb 0.63 -4.89 0.26 0.00 -0.72 0.00 0.00 41.12 36.40 3kl8 n ASP 156 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3kl8 n PHE 157 N 0.49 2.23 -0.33 -0.67 3.72 -1.26 -4.57 117.46 117.07 3kl8 n PHE 157 Ca 0.02 -1.37 0.16 0.00 -0.05 0.00 0.00 57.45 56.20 3kl8 n PHE 157 Cb 0.06 -0.68 0.39 0.00 -0.94 0.00 0.00 39.48 38.32 3kl8 n PHE 157 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3kl8 h GLY 158 N 1.96 1.53 -1.62 1.37 0.00 -1.92 -0.54 103.07 103.85 3kl8 h GLY 158 Ca 0.31 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3kl8 h GLY 158 CO 0.71 -0.08 -0.04 1.04 0.00 0.00 0.00 176.54 178.17 3kl8 n LEU 159 N -4.70 2.68 -4.64 3.11 4.77 -1.26 -4.97 117.00 111.97 3kl8 n LEU 159 Ca 0.23 -0.97 -0.38 0.00 -0.03 0.00 0.00 56.01 54.86 3kl8 n LEU 159 Cb 0.66 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.80 3kl8 n LEU 159 CO 0.23 0.46 0.65 0.00 -1.33 0.00 0.00 177.39 177.40 3kl8 n ALA 160 N 1.06 0.48 -3.10 -1.18 0.00 -0.21 -4.70 120.51 112.86 3kl8 n ALA 160 Ca 0.12 0.05 -0.12 0.00 0.00 0.00 0.00 53.44 53.49 3kl8 n ALA 160 Cb 0.52 -2.16 -0.09 0.00 0.00 0.00 0.00 19.45 17.71 3kl8 n ALA 160 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3kl8 s ILE 161 N -1.44 0.08 -0.14 0.00 -4.36 -0.87 -5.00 121.20 109.47 3kl8 s ILE 161 Ca 0.75 -0.67 -0.10 0.00 -0.26 0.00 0.00 60.65 60.36 3kl8 s ILE 161 Cb -0.43 -0.55 -0.05 0.00 1.25 0.00 0.00 42.46 42.69 3kl8 s ILE 161 CO 0.48 -0.37 0.21 -1.83 0.24 0.00 0.00 174.94 173.67 3kl8 s GLU 162 N -1.54 3.90 0.06 0.37 -1.05 -1.26 -1.75 118.70 117.43 3kl8 s GLU 162 Ca -0.13 -0.03 -0.09 0.00 -0.15 0.00 0.00 54.97 54.57 3kl8 s GLU 162 Cb -0.06 -3.31 0.00 0.00 -0.44 0.00 0.00 34.13 30.32 3kl8 s GLU 162 CO 0.02 0.51 0.18 0.14 0.95 0.00 0.00 175.26 177.06 3kl8 s VAL 163 N -0.30 0.12 0.43 1.83 -7.23 0.71 -5.01 120.40 110.95 3kl8 s VAL 163 Ca 0.15 -1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 59.26 3kl8 s VAL 163 Cb -0.13 -1.08 0.09 0.00 0.56 0.00 0.00 36.38 35.83 3kl8 s VAL 163 CO 0.04 -0.57 0.59 -0.46 -0.31 0.00 0.00 175.10 174.39 3kl8 n ASN 164 N 0.41 0.51 0.00 4.85 0.23 -1.26 -4.58 115.26 115.42 3kl8 n ASN 164 Ca -0.17 -1.50 0.10 0.00 -0.53 0.00 0.00 54.58 52.48 3kl8 n ASN 164 Cb 0.60 -0.41 0.57 0.00 -2.08 0.00 0.00 39.78 38.46 3kl8 n ASN 164 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3kl8 n ASP 165 N -3.11 0.00 -4.65 0.53 5.68 -1.26 -4.76 116.55 108.98 3kl8 n ASP 165 Ca 0.09 -0.46 -0.39 0.00 -0.50 0.00 0.00 54.79 53.53 3kl8 n ASP 165 Cb 0.31 -0.08 -0.08 0.00 -1.14 0.00 0.00 41.12 40.14 3kl8 n ASP 165 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3kl8 s SER 166 N -2.15 6.41 0.26 -1.12 0.01 -1.26 -5.04 113.70 110.81 3kl8 s SER 166 Ca 0.27 0.49 -0.29 0.00 1.31 0.00 0.00 55.95 57.72 3kl8 s SER 166 Cb 0.14 -2.24 -0.09 0.00 0.21 0.00 0.00 66.02 64.03 3kl8 s SER 166 CO 0.25 -0.15 1.26 -1.61 0.41 0.00 0.00 173.24 173.40 3kl8 s GLU 167 N 1.67 4.44 0.00 12.44 2.02 -1.26 -4.95 118.70 133.06 3kl8 s GLU 167 Ca 0.19 2.04 0.00 0.00 0.02 0.00 0.00 54.97 57.22 3kl8 s GLU 167 Cb -0.15 -3.15 0.00 0.00 0.10 0.00 0.00 34.13 30.92 3kl8 s GLU 167 CO 0.09 -0.12 0.00 0.00 0.02 0.00 0.00 175.26 175.25 3kl8 n ALA 168 N 1.69 0.00 -3.61 5.21 0.00 -1.18 -4.86 120.51 117.76 3kl8 n ALA 168 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.14 3kl8 n ALA 168 Cb 0.43 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.80 3kl8 n ALA 168 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3kl8 n TRP 169 N 0.00 3.68 -1.21 0.00 -0.00 -1.26 0.28 117.44 118.93 3kl8 n TRP 169 Ca 0.00 -4.06 -0.36 0.00 -0.00 0.00 0.00 57.50 53.08 3kl8 n TRP 169 Cb 0.00 -0.88 -0.03 0.00 -0.00 0.00 0.00 31.31 30.40 3kl8 n TRP 169 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 3kl8 n HIS 170 N 1.80 2.24 -0.56 5.87 8.25 -1.26 -4.88 115.22 126.68 3kl8 n HIS 170 Ca 0.23 -2.87 0.05 0.00 -0.26 0.00 0.00 57.72 54.88 3kl8 n HIS 170 Cb 0.37 -2.34 -0.01 0.00 1.12 0.00 0.00 29.99 29.13 3kl8 n HIS 170 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kl8 n GLY 171 N 3.63 -2.15 2.72 -1.41 0.00 -1.26 -4.84 105.19 101.89 3kl8 n GLY 171 Ca 0.71 -1.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 3kl8 n GLY 171 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kl8 s PHE 172 N -1.30 1.29 0.21 1.61 5.36 -1.26 -5.09 117.98 118.80 3kl8 s PHE 172 Ca 0.00 -1.26 -0.20 0.00 -0.96 0.00 0.00 56.93 54.51 3kl8 s PHE 172 Cb 0.00 -1.32 0.04 0.00 -0.34 0.00 0.00 43.02 41.40 3kl8 s PHE 172 CO 0.00 -0.75 0.60 0.00 -1.46 0.00 0.00 175.22 173.61 3kl8 s ALA 173 N 1.76 -1.22 0.00 11.12 0.00 -1.26 -5.17 121.76 127.00 3kl8 s ALA 173 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3kl8 s ALA 173 Cb -0.17 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.81 3kl8 s ALA 173 CO -0.18 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.14 3kl8 n GLY 174 N -0.38 1.86 3.71 0.00 0.00 -1.26 -4.85 105.19 104.27 3kl8 n GLY 174 Ca -0.11 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 3kl8 n GLY 174 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kl8 s THR 175 N -1.43 5.11 -0.22 2.61 2.01 -1.26 -4.99 115.64 117.47 3kl8 s THR 175 Ca 0.00 1.18 -0.29 0.00 0.31 0.00 0.00 61.69 62.89 3kl8 s THR 175 Cb 0.00 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 3kl8 s THR 175 CO 0.00 0.27 1.78 -2.84 -0.69 0.00 0.00 174.62 173.14 3kl8 s PRO 176 N 0.85 3.62 0.00 4.92 0.02 -1.26 -1.81 135.00 141.34 3kl8 s PRO 176 Ca 0.31 1.75 0.00 0.00 0.02 0.00 0.00 61.00 63.08 3kl8 s PRO 176 Cb -0.16 -4.13 0.00 0.00 0.02 0.00 0.00 34.50 30.22 3kl8 s PRO 176 CO 0.13 -1.51 0.00 0.41 -0.33 0.00 0.00 177.00 175.70 3kl8 n GLY 177 N 4.99 2.59 0.10 0.52 0.00 -1.26 -4.88 105.19 107.25 3kl8 n GLY 177 Ca 0.21 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.91 3kl8 n GLY 177 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kl8 n TYR 178 N 0.00 0.00 -1.73 1.61 4.01 -0.75 -4.79 117.16 115.51 3kl8 n TYR 178 Ca 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.36 3kl8 n TYR 178 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.08 3kl8 n TYR 178 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3kl8 n LEU 179 N -0.93 5.52 -4.86 7.72 4.77 -1.06 -4.27 117.00 123.89 3kl8 n LEU 179 Ca 0.04 0.92 -0.32 0.00 -0.03 0.00 0.00 56.01 56.61 3kl8 n LEU 179 Cb 0.23 -1.55 -0.06 0.00 -2.33 0.00 0.00 43.42 39.72 3kl8 n LEU 179 CO 0.23 -0.83 0.40 -0.94 -1.33 0.00 0.00 177.39 174.92 3kl8 s SER 180 N -1.09 6.71 0.17 -1.43 1.04 -1.26 -4.98 113.70 112.86 3kl8 s SER 180 Ca 0.76 1.21 -0.15 0.00 0.48 0.00 0.00 55.95 58.24 3kl8 s SER 180 Cb -0.41 -2.35 0.13 0.00 0.10 0.00 0.00 66.02 63.50 3kl8 s SER 180 CO 0.46 -0.22 1.70 -0.65 0.98 0.00 0.00 173.24 175.50 3kl8 h PRO 181 N 2.12 0.11 -0.26 4.02 0.11 -1.89 -2.29 132.00 133.94 3kl8 h PRO 181 Ca -0.48 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.70 3kl8 h PRO 181 Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3kl8 h PRO 181 CO 0.66 0.07 0.24 1.05 -0.21 0.00 0.00 178.00 179.81 3kl8 h GLU 182 N 0.12 0.00 0.00 1.05 9.09 -1.95 -0.62 114.58 122.26 3kl8 h GLU 182 Ca 0.21 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.37 3kl8 h GLU 182 Cb 0.30 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.36 3kl8 h GLU 182 CO -0.35 0.00 -1.33 0.28 0.05 0.00 0.00 179.01 177.66 3kl8 h VAL 183 N 0.00 1.31 0.00 -1.06 2.07 -1.71 0.06 116.25 116.93 3kl8 h VAL 183 Ca 0.12 -3.09 -0.10 0.00 0.82 0.00 0.00 66.70 64.46 3kl8 h VAL 183 Cb 0.60 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 3kl8 h VAL 183 CO -0.00 0.75 -0.46 -0.07 0.02 0.00 0.00 177.57 177.81 3kl8 h LEU 184 N 0.00 0.00 -0.99 2.57 3.38 -0.95 -2.81 115.31 116.51 3kl8 h LEU 184 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3kl8 h LEU 184 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 3kl8 h LEU 184 CO 0.11 0.46 0.00 0.29 0.09 0.00 0.00 178.44 179.38 3kl8 n LYS 185 N -3.31 1.64 -1.85 1.13 5.02 -0.35 -4.86 118.16 115.57 3kl8 n LYS 185 Ca 0.01 -0.87 -0.10 0.00 -2.02 0.00 0.00 58.31 55.33 3kl8 n LYS 185 Cb 0.66 -1.26 -0.02 0.00 -0.02 0.00 0.00 35.03 34.39 3kl8 n LYS 185 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3kl8 n LYS 186 N 0.19 -1.79 -1.46 1.97 4.76 -1.06 -4.93 118.16 115.84 3kl8 n LYS 186 Ca 0.08 0.52 -0.29 0.00 -2.87 0.00 0.00 58.31 55.75 3kl8 n LYS 186 Cb 0.25 -4.90 0.17 0.00 -1.84 0.00 0.00 35.03 28.71 3kl8 n LYS 186 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3kl8 s ASP 187 N -1.92 2.79 0.24 4.39 1.01 0.01 -5.01 116.67 118.17 3kl8 s ASP 187 Ca 0.00 0.80 -0.28 0.00 0.71 0.00 0.00 52.55 53.78 3kl8 s ASP 187 Cb 0.00 -1.24 -0.09 0.00 1.01 0.00 0.00 42.92 42.61 3kl8 s ASP 187 CO 0.00 -2.99 0.90 -2.84 0.21 0.00 0.00 175.17 170.46 3kl8 s PRO 188 N -5.37 4.74 0.26 8.23 0.02 -1.26 -4.69 135.00 136.94 3kl8 s PRO 188 Ca 0.67 1.38 0.02 0.00 0.02 0.00 0.00 61.00 63.09 3kl8 s PRO 188 Cb -0.12 -3.19 -0.05 0.00 0.02 0.00 0.00 34.50 31.15 3kl8 s PRO 188 CO 0.54 0.49 0.08 1.52 -0.33 0.00 0.00 177.00 179.30 3kl8 s TYR 189 N -1.25 1.59 0.00 6.54 -0.85 0.14 -4.76 117.35 118.77 3kl8 s TYR 189 Ca 0.41 -1.11 0.00 0.00 -0.52 0.00 0.00 57.07 55.85 3kl8 s TYR 189 Cb -0.24 -0.95 0.00 0.00 0.38 0.00 0.00 41.96 41.15 3kl8 s TYR 189 CO 0.29 -0.24 0.00 0.45 -1.52 0.00 0.00 175.55 174.53 3kl8 n SER 190 N -0.49 0.39 -0.28 -0.18 2.88 -1.26 -3.10 113.62 111.58 3kl8 n SER 190 Ca -0.01 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.61 3kl8 n SER 190 Cb 0.66 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.32 3kl8 n SER 190 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3kl8 h LYS 191 N 0.00 0.12 0.00 -1.46 1.57 -1.95 -2.74 116.57 112.10 3kl8 h LYS 191 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3kl8 h LYS 191 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3kl8 h LYS 191 CO 0.00 0.08 0.03 -2.30 -0.57 0.00 0.00 179.45 176.69 3kl8 n PRO 192 N -5.34 0.00 0.24 3.15 -0.02 -1.26 -1.24 135.00 130.54 3kl8 n PRO 192 Ca 0.16 0.45 0.17 0.00 -2.02 0.00 0.00 63.50 62.26 3kl8 n PRO 192 Cb 0.55 -1.53 0.87 0.00 -0.02 0.00 0.00 33.50 33.36 3kl8 n PRO 192 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3kl8 h VAL 193 N 0.00 0.46 0.14 -1.45 -1.51 -1.91 -2.13 116.25 109.86 3kl8 h VAL 193 Ca 0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 66.70 65.26 3kl8 h VAL 193 Cb 0.06 0.89 0.02 0.00 -2.13 0.00 0.00 31.29 30.12 3kl8 h VAL 193 CO 0.00 0.00 -0.98 0.44 -1.23 0.00 0.00 177.57 175.80 3kl8 h ASP 194 N 0.00 0.46 -0.15 4.19 3.45 -1.43 -3.05 116.42 119.88 3kl8 h ASP 194 Ca 0.06 -0.93 0.04 0.00 0.43 0.00 0.00 57.03 56.63 3kl8 h ASP 194 Cb 0.33 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 3kl8 h ASP 194 CO -0.00 1.46 0.14 0.40 -1.57 0.00 0.00 179.24 179.66 3kl8 h ILE 195 N -0.34 0.68 -0.05 0.35 1.08 -1.64 -0.46 117.51 117.13 3kl8 h ILE 195 Ca -0.19 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 3kl8 h ILE 195 Cb 1.69 0.90 -0.00 0.00 -3.07 0.00 0.00 36.82 36.33 3kl8 h ILE 195 CO 0.13 0.00 0.01 -0.25 -0.69 0.00 0.00 178.15 177.35 3kl8 h TRP 196 N 0.00 0.08 -0.72 1.37 2.91 -1.36 -2.76 115.95 115.47 3kl8 h TRP 196 Ca 0.07 -0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.17 3kl8 h TRP 196 Cb 0.35 -0.02 -0.07 0.00 -0.51 0.00 0.00 29.16 28.90 3kl8 h TRP 196 CO 0.00 0.29 0.37 0.00 -1.03 0.00 0.00 178.44 178.07 3kl8 h ALA 197 N 0.78 0.99 -0.01 2.65 0.00 -1.04 -2.45 119.26 120.18 3kl8 h ALA 197 Ca 0.01 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3kl8 h ALA 197 Cb 0.25 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 3kl8 h ALA 197 CO 0.00 -0.03 -0.52 0.00 0.00 0.00 0.00 179.25 178.71 3kl8 h GLY 199 N -0.64 1.98 0.81 0.00 0.00 -1.15 0.55 103.07 104.62 3kl8 h GLY 199 Ca 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 3kl8 h GLY 199 CO -0.35 -0.48 -0.08 -2.08 0.00 0.00 0.00 176.54 173.55 3kl8 h VAL 200 N 0.30 0.91 0.81 4.60 2.07 -1.06 0.40 116.25 124.29 3kl8 h VAL 200 Ca 0.74 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.82 3kl8 h VAL 200 Cb 1.75 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 32.68 3kl8 h VAL 200 CO -0.58 0.09 -0.39 0.40 0.02 0.00 0.00 177.57 177.11 3kl8 h ILE 201 N -0.43 0.00 -1.18 4.57 2.04 0.13 -0.39 117.51 122.24 3kl8 h ILE 201 Ca -0.02 -0.01 0.34 0.00 1.00 0.00 0.00 64.86 66.17 3kl8 h ILE 201 Cb 0.33 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.33 3kl8 h ILE 201 CO 0.04 0.00 0.80 0.25 0.00 0.00 0.00 178.15 179.24 3kl8 h LEU 202 N -1.10 0.24 -0.20 1.44 5.85 -0.38 0.62 115.31 121.77 3kl8 h LEU 202 Ca -0.11 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 3kl8 h LEU 202 Cb 0.84 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3kl8 h LEU 202 CO 0.18 0.00 0.01 0.22 -0.34 0.00 0.00 178.44 178.52 3kl8 h TYR 203 N 0.19 0.38 0.12 1.25 5.03 -0.45 -3.12 116.97 120.37 3kl8 h TYR 203 Ca 0.64 -0.06 -0.01 0.00 2.58 0.00 0.00 58.73 61.88 3kl8 h TYR 203 Cb 2.06 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 40.24 3kl8 h TYR 203 CO -0.00 0.53 -0.06 0.82 -1.32 0.00 0.00 178.16 178.13 3kl8 h ILE 204 N 0.13 0.92 -0.87 1.81 2.04 0.19 -2.91 117.51 118.80 3kl8 h ILE 204 Ca 0.06 -0.15 0.19 0.00 1.00 0.00 0.00 64.86 65.96 3kl8 h ILE 204 Cb 0.37 1.02 -0.16 0.00 -0.74 0.00 0.00 36.82 37.30 3kl8 h ILE 204 CO 0.01 0.04 -0.13 -0.07 0.00 0.00 0.00 178.15 178.00 3kl8 h LEU 205 N -0.23 -0.66 -1.29 1.44 3.38 -1.02 2.13 115.31 119.06 3kl8 h LEU 205 Ca -0.02 0.25 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 3kl8 h LEU 205 Cb 0.19 0.49 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3kl8 h LEU 205 CO 0.03 -0.28 -0.19 -0.07 0.09 0.00 0.00 178.44 178.02 3kl8 h LEU 206 N 0.02 0.00 0.00 1.67 3.38 -1.45 0.11 115.31 119.04 3kl8 h LEU 206 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.42 3kl8 h LEU 206 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3kl8 h LEU 206 CO -0.86 0.19 -0.19 1.33 0.09 0.00 0.00 178.44 179.00 3kl8 n VAL 207 N -3.41 0.00 -0.91 1.22 0.24 -0.11 -4.71 118.33 110.66 3kl8 n VAL 207 Ca -0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 3kl8 n VAL 207 Cb 0.38 0.38 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 3kl8 n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kl8 n GLY 208 N 0.56 0.85 3.51 7.63 0.00 0.70 -4.84 105.19 113.60 3kl8 n GLY 208 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3kl8 n GLY 208 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kl8 s TYR 209 N -3.36 2.35 0.64 1.61 -0.85 -1.26 -5.02 117.35 111.46 3kl8 s TYR 209 Ca 0.00 -0.41 -0.10 0.00 -0.52 0.00 0.00 57.07 56.04 3kl8 s TYR 209 Cb 0.00 -1.18 -0.02 0.00 0.38 0.00 0.00 41.96 41.14 3kl8 s TYR 209 CO 0.00 0.65 1.03 -2.14 -1.52 0.00 0.00 175.55 173.57 3kl8 s PRO 210 N -3.56 3.30 -0.10 -3.49 0.02 -1.26 -4.12 135.00 125.79 3kl8 s PRO 210 Ca 0.31 0.57 -0.24 0.00 0.02 0.00 0.00 61.00 61.66 3kl8 s PRO 210 Cb -0.01 -2.09 -0.20 0.00 0.02 0.00 0.00 34.50 32.21 3kl8 s PRO 210 CO 0.16 -0.71 0.81 -1.35 -0.33 0.00 0.00 177.00 175.57 3kl8 h PRO 211 N -0.39 -0.04 -5.22 5.54 0.11 -1.93 -3.44 132.00 126.63 3kl8 h PRO 211 Ca -0.45 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.03 3kl8 h PRO 211 Cb 1.22 0.01 -0.21 0.00 0.11 0.00 0.00 31.00 32.12 3kl8 h PRO 211 CO 0.63 0.66 -0.65 -0.06 -0.21 0.00 0.00 178.00 178.37 3kl8 s PHE 212 N -2.76 3.07 -0.29 0.65 2.99 -1.26 -4.76 117.98 115.62 3kl8 s PHE 212 Ca -0.15 -0.30 -0.18 0.00 0.00 0.00 0.00 56.93 56.30 3kl8 s PHE 212 Cb -0.01 -2.03 0.13 0.00 0.00 0.00 0.00 43.02 41.11 3kl8 s PHE 212 CO 0.58 -0.09 0.96 -0.46 -0.00 0.00 0.00 175.22 176.21 3kl8 s TRP 213 N 0.63 -0.60 0.11 0.36 -0.00 -1.26 -4.92 118.94 113.26 3kl8 s TRP 213 Ca -0.01 1.24 -0.07 0.00 -0.00 0.00 0.00 56.10 57.26 3kl8 s TRP 213 Cb -0.14 0.38 -0.01 0.00 -0.00 0.00 0.00 33.47 33.70 3kl8 s TRP 213 CO 0.02 -0.29 0.18 0.34 -0.00 0.00 0.00 176.95 177.20 3kl8 s ASP 214 N 1.11 0.15 0.21 5.86 -1.08 -1.26 -4.98 116.67 116.69 3kl8 s ASP 214 Ca -0.06 -0.79 -0.10 0.00 -0.52 0.00 0.00 52.55 51.08 3kl8 s ASP 214 Cb -0.04 0.35 0.18 0.00 -1.46 0.00 0.00 42.92 41.94 3kl8 s ASP 214 CO -0.13 -0.76 1.88 -0.33 0.52 0.00 0.00 175.17 176.34 3kl8 h GLU 215 N 2.75 0.98 -5.42 4.34 4.39 -2.02 -3.41 114.58 116.18 3kl8 h GLU 215 Ca -0.33 -0.06 -0.62 0.00 0.34 0.00 0.00 59.36 58.69 3kl8 h GLU 215 Cb 1.20 -0.22 -0.12 0.00 -0.10 0.00 0.00 28.75 29.51 3kl8 h GLU 215 CO 0.55 0.65 0.06 0.34 -1.16 0.00 0.00 179.01 179.46 3kl8 s ASP 216 N -5.87 6.49 0.29 1.42 2.15 -1.26 -4.97 116.67 114.92 3kl8 s ASP 216 Ca -0.13 0.57 0.03 0.00 0.43 0.00 0.00 52.55 53.45 3kl8 s ASP 216 Cb 0.15 -2.31 0.72 0.00 -0.30 0.00 0.00 42.92 41.19 3kl8 s ASP 216 CO 0.78 -0.34 1.69 -0.61 -0.17 0.00 0.00 175.17 176.51 3kl8 h GLN 217 N 8.00 0.35 -0.04 4.34 4.15 -2.00 -0.61 115.11 129.29 3kl8 h GLN 217 Ca -0.28 -0.02 -0.21 0.00 0.77 0.00 0.00 58.65 58.91 3kl8 h GLN 217 Cb 1.13 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 28.76 3kl8 h GLN 217 CO 0.75 0.23 -0.80 0.45 -1.93 0.00 0.00 178.83 177.52 3kl8 h HIS 218 N 0.36 0.89 -1.09 3.99 3.86 -1.95 -1.61 115.15 119.60 3kl8 h HIS 218 Ca 0.56 -0.45 0.30 0.00 -1.16 0.00 0.00 60.37 59.61 3kl8 h HIS 218 Cb 1.07 -0.11 -0.10 0.00 1.06 0.00 0.00 27.41 29.33 3kl8 h HIS 218 CO -0.16 1.28 0.70 0.00 0.86 0.00 0.00 177.93 180.60 3kl8 h ARG 219 N 0.25 0.33 0.13 2.45 2.47 -1.55 -1.79 114.38 116.67 3kl8 h ARG 219 Ca -0.09 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 3kl8 h ARG 219 Cb 1.47 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.71 3kl8 h ARG 219 CO 0.16 0.22 -0.06 1.25 0.56 0.00 0.00 179.97 182.09 3kl8 h LEU 220 N 0.33 -0.15 -1.80 3.04 5.85 -0.55 -2.75 115.31 119.29 3kl8 h LEU 220 Ca 0.65 0.01 0.41 0.00 0.84 0.00 0.00 57.88 59.78 3kl8 h LEU 220 Cb 1.71 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.70 3kl8 h LEU 220 CO -0.34 -0.05 0.98 1.88 -0.34 0.00 0.00 178.44 180.58 3kl8 h TYR 221 N -0.31 0.19 0.23 1.25 0.05 -1.13 0.74 116.97 117.99 3kl8 h TYR 221 Ca -0.02 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 3kl8 h TYR 221 Cb 0.14 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.83 3kl8 h TYR 221 CO 0.09 -0.03 -0.11 0.00 -1.05 0.00 0.00 178.16 177.06 3kl8 h ALA 222 N 1.37 -0.31 -0.43 3.88 0.00 -1.33 0.27 119.26 122.71 3kl8 h ALA 222 Ca 0.72 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.55 3kl8 h ALA 222 Cb 2.63 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 20.51 3kl8 h ALA 222 CO -0.12 -0.62 0.24 0.37 0.00 0.00 0.00 179.25 179.11 3kl8 h GLN 223 N -0.41 0.46 0.33 0.00 4.15 0.73 -0.28 115.11 120.09 3kl8 h GLN 223 Ca -0.03 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 3kl8 h GLN 223 Cb 0.31 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 3kl8 h GLN 223 CO 0.05 0.30 -0.24 0.82 -1.93 0.00 0.00 178.83 177.83 3kl8 h ILE 224 N 0.47 0.00 -1.05 2.39 2.04 -1.03 -0.72 117.51 119.61 3kl8 h ILE 224 Ca 0.17 0.00 0.35 0.00 1.00 0.00 0.00 64.86 66.38 3kl8 h ILE 224 Cb 0.04 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 35.98 3kl8 h ILE 224 CO -0.10 0.00 0.61 0.11 0.00 0.00 0.00 178.15 178.77 3kl8 h LYS 225 N -0.55 0.24 -0.01 2.37 1.57 -0.84 0.44 116.57 119.80 3kl8 h LYS 225 Ca -0.04 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3kl8 h LYS 225 Cb 0.45 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3kl8 h LYS 225 CO 0.02 0.16 -0.49 0.00 -0.57 0.00 0.00 179.45 178.56 3kl8 h ALA 226 N 1.82 1.17 0.00 3.86 0.00 -0.88 -3.47 119.26 121.76 3kl8 h ALA 226 Ca 0.76 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3kl8 h ALA 226 Cb 1.88 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3kl8 h ALA 226 CO -0.58 0.62 0.00 0.41 0.00 0.00 0.00 179.25 179.70 3kl8 n GLY 227 N -0.11 0.83 3.48 0.00 0.00 0.16 -5.02 105.19 104.54 3kl8 n GLY 227 Ca -0.02 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3kl8 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kl8 s ALA 228 N -2.00 3.42 0.08 4.61 0.00 -0.33 -4.95 121.76 122.58 3kl8 s ALA 228 Ca 0.00 -2.84 -0.00 0.00 0.00 0.00 0.00 51.96 49.11 3kl8 s ALA 228 Cb 0.00 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 18.89 3kl8 s ALA 228 CO 0.00 -3.06 -0.03 1.52 0.00 0.00 0.00 175.76 174.19 3kl8 s TYR 229 N 2.89 0.69 0.35 0.00 1.13 -1.26 -4.77 117.35 116.38 3kl8 s TYR 229 Ca 0.39 -1.04 0.01 0.00 -1.41 0.00 0.00 57.07 55.02 3kl8 s TYR 229 Cb -0.03 -0.45 -0.01 0.00 -1.10 0.00 0.00 41.96 40.38 3kl8 s TYR 229 CO -0.06 -0.32 0.42 0.16 -2.51 0.00 0.00 175.55 173.24 3kl8 s ASP 230 N -2.98 1.24 -0.75 -0.18 -4.77 -1.26 -5.10 116.67 102.87 3kl8 s ASP 230 Ca 0.11 -1.61 0.03 0.00 -3.30 0.00 0.00 52.55 47.78 3kl8 s ASP 230 Cb 0.07 0.64 0.21 0.00 -1.09 0.00 0.00 42.92 42.75 3kl8 s ASP 230 CO -0.07 -1.24 0.67 -1.22 0.70 0.00 0.00 175.17 174.02 3kl8 n TYR 231 N -0.60 3.54 -1.66 2.11 0.53 -1.26 -5.06 117.16 114.76 3kl8 n TYR 231 Ca 0.03 -4.16 -0.44 0.00 -1.02 0.00 0.00 57.90 52.31 3kl8 n TYR 231 Cb 0.62 -0.75 -0.02 0.00 -1.03 0.00 0.00 39.34 38.16 3kl8 n TYR 231 CO 0.00 0.00 0.00 -2.30 -1.02 0.00 0.00 176.86 173.54 3kl8 n PRO 232 N 1.70 1.86 -2.83 -0.72 -0.02 -1.26 -4.66 135.00 129.07 3kl8 n PRO 232 Ca 0.23 0.66 -0.31 0.00 -2.02 0.00 0.00 63.50 62.06 3kl8 n PRO 232 Cb 0.37 -2.20 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 3kl8 n PRO 232 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3kl8 s SER 233 N -0.18 6.58 0.00 2.55 0.01 -1.26 -2.28 113.70 119.11 3kl8 s SER 233 Ca 0.61 1.22 0.23 0.00 1.31 0.00 0.00 55.95 59.32 3kl8 s SER 233 Cb -0.64 -2.36 0.21 0.00 0.21 0.00 0.00 66.02 63.45 3kl8 s SER 233 CO 0.58 -0.40 1.21 -0.81 0.41 0.00 0.00 173.24 174.23 3kl8 n PRO 234 N -1.19 0.07 -0.18 12.44 -0.05 -1.26 -4.90 135.00 139.93 3kl8 n PRO 234 Ca 0.03 -0.05 -0.06 0.00 -0.05 0.00 0.00 63.50 63.37 3kl8 n PRO 234 Cb 0.54 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.49 3kl8 n PRO 234 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 175.50 176.50 3kl8 h GLU 235 N 0.12 -0.17 0.00 0.54 9.09 -1.95 -0.70 114.58 121.51 3kl8 h GLU 235 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.42 3kl8 h GLU 235 Cb 0.51 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.65 3kl8 h GLU 235 CO 0.00 -0.11 0.00 0.91 0.05 0.00 0.00 179.01 179.86 3kl8 n TRP 236 N -5.43 0.82 0.26 2.06 7.02 -0.97 -3.35 117.44 117.86 3kl8 n TRP 236 Ca 0.03 0.26 0.17 0.00 -1.02 0.00 0.00 57.50 56.95 3kl8 n TRP 236 Cb 0.35 -0.93 0.80 0.00 -2.42 0.00 0.00 31.31 29.11 3kl8 n TRP 236 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3kl8 h ASP 237 N 0.00 0.00 0.00 -0.99 3.32 -1.34 -2.51 116.42 114.90 3kl8 h ASP 237 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 3kl8 h ASP 237 Cb 0.60 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.04 3kl8 h ASP 237 CO 0.00 0.00 -0.61 0.35 -1.72 0.00 0.00 179.24 177.26 3kl8 n THR 238 N -3.16 1.51 -4.00 0.35 -2.24 -1.21 -4.98 114.28 100.55 3kl8 n THR 238 Ca 0.01 -2.46 -0.35 0.00 -2.27 0.00 0.00 64.05 58.98 3kl8 n THR 238 Cb 0.45 0.12 -0.10 0.00 -2.10 0.00 0.00 70.33 68.70 3kl8 n THR 238 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3kl8 s VAL 239 N -2.22 4.68 0.15 2.28 1.01 -0.95 -5.05 120.40 120.30 3kl8 s VAL 239 Ca 0.35 -0.07 -0.34 0.00 0.00 0.00 0.00 61.98 61.92 3kl8 s VAL 239 Cb 0.36 -3.12 -0.15 0.00 0.00 0.00 0.00 36.38 33.47 3kl8 s VAL 239 CO -0.09 0.44 1.48 0.35 0.00 0.00 0.00 175.10 177.28 3kl8 n THR 240 N 3.74 0.14 -0.32 3.92 -2.24 -1.26 -4.82 114.28 113.45 3kl8 n THR 240 Ca -0.16 -0.04 0.15 0.00 -2.27 0.00 0.00 64.05 61.73 3kl8 n THR 240 Cb 0.52 -1.30 0.33 0.00 -2.10 0.00 0.00 70.33 67.78 3kl8 n THR 240 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3kl8 h PRO 241 N 5.25 0.45 -0.71 -0.78 0.11 -1.96 0.13 132.00 134.50 3kl8 h PRO 241 Ca -0.46 -0.03 0.20 0.00 0.11 0.00 0.00 66.00 65.83 3kl8 h PRO 241 Cb 1.28 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 3kl8 h PRO 241 CO 0.84 0.30 0.64 0.93 -0.21 0.00 0.00 178.00 180.50 3kl8 h GLU 242 N 0.47 0.00 0.15 1.05 3.07 -1.99 0.26 114.58 117.59 3kl8 h GLU 242 Ca 0.59 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 59.14 3kl8 h GLU 242 Cb 1.11 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.03 3kl8 h GLU 242 CO -0.51 0.00 -1.52 0.00 -1.40 0.00 0.00 179.01 175.58 3kl8 h ALA 243 N 1.38 0.13 0.72 3.43 0.00 -1.08 -2.94 119.26 120.91 3kl8 h ALA 243 Ca 0.34 -1.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.14 3kl8 h ALA 243 Cb 1.61 0.43 0.01 0.00 0.00 0.00 0.00 17.79 19.84 3kl8 h ALA 243 CO -0.00 0.87 -0.35 0.87 0.00 0.00 0.00 179.25 180.63 3kl8 h LYS 244 N -0.12 -0.94 -0.98 0.00 1.57 -0.75 -2.51 116.57 112.84 3kl8 h LYS 244 Ca -0.31 0.06 0.34 0.00 -1.87 0.00 0.00 60.65 58.87 3kl8 h LYS 244 Cb 1.91 0.21 -0.16 0.00 0.08 0.00 0.00 32.23 34.28 3kl8 h LYS 244 CO 0.13 -0.63 0.45 1.03 -0.57 0.00 0.00 179.45 179.86 3kl8 h SER 245 N -0.98 0.26 -0.07 0.86 0.87 -0.72 0.62 113.55 114.40 3kl8 h SER 245 Ca -0.10 0.23 -0.10 0.00 -1.23 0.00 0.00 61.79 60.59 3kl8 h SER 245 Cb 0.75 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 3kl8 h SER 245 CO 0.16 -0.27 -0.26 0.25 -0.53 0.00 0.00 176.83 176.18 3kl8 h LEU 246 N 0.16 0.52 0.27 2.23 5.85 -1.29 -2.02 115.31 121.02 3kl8 h LEU 246 Ca 0.73 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 59.26 3kl8 h LEU 246 Cb 1.74 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.63 3kl8 h LEU 246 CO -0.71 0.77 -0.13 0.40 -0.34 0.00 0.00 178.44 178.43 3kl8 h ILE 247 N 0.45 0.75 -1.27 4.05 2.04 0.28 -2.92 117.51 120.89 3kl8 h ILE 247 Ca 0.06 -0.68 0.41 0.00 1.00 0.00 0.00 64.86 65.65 3kl8 h ILE 247 Cb 0.69 1.10 -0.12 0.00 -0.74 0.00 0.00 36.82 37.74 3kl8 h ILE 247 CO 0.05 0.13 0.81 0.44 0.00 0.00 0.00 178.15 179.59 3kl8 h ASP 248 N -0.75 0.28 0.81 1.72 3.32 0.10 0.69 116.42 122.60 3kl8 h ASP 248 Ca -0.04 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3kl8 h ASP 248 Cb 0.50 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3kl8 h ASP 248 CO 0.06 -0.15 -0.49 -1.54 -1.72 0.00 0.00 179.24 175.41 3kl8 n SER 249 N -4.70 0.58 -0.04 6.45 3.41 -0.77 -2.26 113.62 116.29 3kl8 n SER 249 Ca 0.35 0.08 -0.12 0.00 -0.26 0.00 0.00 58.87 58.92 3kl8 n SER 249 Cb 1.34 0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 65.20 3kl8 n SER 249 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3kl8 n MET 250 N -1.89 0.67 -0.71 4.33 2.81 0.21 -2.46 117.12 120.08 3kl8 n MET 250 Ca 0.04 0.21 -0.13 0.00 -1.81 0.00 0.00 57.70 56.01 3kl8 n MET 250 Cb 0.40 -1.69 0.12 0.00 -0.71 0.00 0.00 33.22 31.33 3kl8 n MET 250 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3kl8 n LEU 251 N -3.08 5.10 -4.68 4.03 4.77 0.68 -4.11 117.00 119.72 3kl8 n LEU 251 Ca -0.26 -2.68 -0.42 0.00 -0.03 0.00 0.00 56.01 52.62 3kl8 n LEU 251 Cb 1.07 -0.69 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 3kl8 n LEU 251 CO 0.43 0.80 1.13 -0.89 -1.33 0.00 0.00 177.39 177.52 3kl8 s THR 252 N -1.95 3.85 0.23 -5.08 2.01 -0.96 -4.94 115.64 108.81 3kl8 s THR 252 Ca 0.33 1.18 0.07 0.00 0.31 0.00 0.00 61.69 63.58 3kl8 s THR 252 Cb 0.28 -3.76 -0.07 0.00 0.01 0.00 0.00 72.50 68.97 3kl8 s THR 252 CO 0.07 -0.03 1.53 0.58 -0.69 0.00 0.00 174.62 176.08 3kl8 h VAL 253 N 5.11 1.46 -2.87 3.82 2.07 -1.89 -3.41 116.25 120.54 3kl8 h VAL 253 Ca -0.36 -2.27 -0.56 0.00 0.82 0.00 0.00 66.70 64.34 3kl8 h VAL 253 Cb 1.16 2.21 -0.09 0.00 -1.52 0.00 0.00 31.29 33.06 3kl8 h VAL 253 CO 0.92 0.66 0.93 0.21 0.02 0.00 0.00 177.57 180.30 3kl8 s ASN 254 N -6.86 6.32 0.24 0.57 2.47 -1.26 -4.71 114.94 111.71 3kl8 s ASN 254 Ca -0.02 -0.21 -0.08 0.00 0.42 0.00 0.00 52.86 52.97 3kl8 s ASN 254 Cb 0.12 -2.53 0.42 0.00 -1.45 0.00 0.00 41.25 37.80 3kl8 s ASN 254 CO 0.79 -1.57 1.63 -0.65 -3.72 0.00 0.00 177.10 173.57 3kl8 h PRO 255 N 9.69 0.08 -0.88 0.43 0.11 -1.95 0.88 132.00 140.35 3kl8 h PRO 255 Ca -0.26 -0.00 0.26 0.00 0.11 0.00 0.00 66.00 66.10 3kl8 h PRO 255 Cb 1.06 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3kl8 h PRO 255 CO 1.21 0.05 0.65 0.87 -0.21 0.00 0.00 178.00 180.57 3kl8 h LYS 256 N 0.08 0.00 -0.18 1.05 1.79 -1.96 -1.86 116.57 115.49 3kl8 h LYS 256 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 3kl8 h LYS 256 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 3kl8 h LYS 256 CO -0.68 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.32 3kl8 n LYS 257 N -4.22 2.53 -2.80 3.15 5.02 0.26 -4.96 118.16 117.14 3kl8 n LYS 257 Ca 0.18 -1.71 -0.42 0.00 -2.02 0.00 0.00 58.31 54.34 3kl8 n LYS 257 Cb 0.96 -1.16 -0.03 0.00 -0.02 0.00 0.00 35.03 34.78 3kl8 n LYS 257 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3kl8 s ARG 258 N -0.94 4.26 0.18 1.97 3.52 -0.70 -4.99 118.95 122.25 3kl8 s ARG 258 Ca 0.13 1.13 -0.25 0.00 -0.13 0.00 0.00 55.73 56.62 3kl8 s ARG 258 Cb 0.07 -3.61 -0.15 0.00 -1.56 0.00 0.00 34.95 29.70 3kl8 s ARG 258 CO 0.09 -0.47 0.45 1.51 -0.81 0.00 0.00 175.30 176.08 3kl8 n ILE 259 N 5.04 1.75 -2.56 4.11 3.06 -1.03 -4.99 119.36 124.74 3kl8 n ILE 259 Ca 0.07 -0.44 -0.22 0.00 -2.50 0.00 0.00 62.75 59.66 3kl8 n ILE 259 Cb 0.48 0.00 0.06 0.00 0.54 0.00 0.00 39.64 40.72 3kl8 n ILE 259 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 3kl8 s THR 260 N -0.88 2.44 0.05 9.51 -4.23 -1.26 -4.89 115.64 116.39 3kl8 s THR 260 Ca 0.56 -0.59 -0.32 0.00 -1.18 0.00 0.00 61.69 60.16 3kl8 s THR 260 Cb -0.81 -2.85 -0.19 0.00 1.34 0.00 0.00 72.50 69.99 3kl8 s THR 260 CO 0.49 0.00 1.50 0.00 -0.54 0.00 0.00 174.62 176.07 3kl8 h ALA 261 N -0.22 -0.97 0.00 3.99 0.00 -1.94 -1.82 119.26 118.30 3kl8 h ALA 261 Ca -0.40 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3kl8 h ALA 261 Cb 1.29 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3kl8 h ALA 261 CO 0.49 -1.01 0.01 -0.25 0.00 0.00 0.00 179.25 178.50 3kl8 n ASP 262 N -5.48 0.30 -0.03 0.00 8.00 -1.26 -1.07 116.55 117.01 3kl8 n ASP 262 Ca -0.14 0.63 -0.20 0.00 0.71 0.00 0.00 54.79 55.80 3kl8 n ASP 262 Cb 0.40 -0.67 -0.13 0.00 -0.02 0.00 0.00 41.12 40.69 3kl8 n ASP 262 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kl8 n GLN 263 N -1.91 0.73 0.11 -1.24 6.02 -1.07 -4.09 117.38 115.93 3kl8 n GLN 263 Ca -0.01 0.23 0.04 0.00 -0.01 0.00 0.00 57.00 57.25 3kl8 n GLN 263 Cb 0.03 -1.66 0.45 0.00 1.02 0.00 0.00 30.24 30.08 3kl8 n GLN 263 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3kl8 h ALA 264 N 0.10 1.65 0.00 -1.58 0.00 -0.23 -2.04 119.26 117.17 3kl8 h ALA 264 Ca -0.46 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3kl8 h ALA 264 Cb 2.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3kl8 h ALA 264 CO 0.04 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.83 3kl8 n LEU 265 N -4.38 0.07 -1.00 0.00 4.77 -0.89 -2.52 117.00 113.06 3kl8 n LEU 265 Ca -0.00 0.52 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 3kl8 n LEU 265 Cb 0.18 -0.51 0.24 0.00 -2.33 0.00 0.00 43.42 41.00 3kl8 n LEU 265 CO 0.36 -0.26 0.71 0.29 -1.33 0.00 0.00 177.39 177.16 3kl8 n LYS 266 N -1.58 3.09 -3.00 3.23 5.02 -0.77 -4.59 118.16 119.57 3kl8 n LYS 266 Ca 0.04 -2.50 -0.39 0.00 -2.02 0.00 0.00 58.31 53.44 3kl8 n LYS 266 Cb 0.19 -1.58 -0.06 0.00 -0.02 0.00 0.00 35.03 33.56 3kl8 n LYS 266 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3kl8 s VAL 267 N -1.61 4.39 0.09 -0.18 1.01 -1.05 -4.87 120.40 118.18 3kl8 s VAL 267 Ca 0.37 1.66 -0.18 0.00 0.00 0.00 0.00 61.98 63.83 3kl8 s VAL 267 Cb 0.23 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3kl8 s VAL 267 CO 0.18 0.49 1.10 -2.65 0.00 0.00 0.00 175.10 174.23 3kl8 n PRO 268 N 1.51 -0.25 0.00 2.72 -0.02 -1.26 0.61 135.00 138.31 3kl8 n PRO 268 Ca -0.05 1.08 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 3kl8 n PRO 268 Cb 0.49 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 3kl8 n PRO 268 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 3kl8 n TRP 269 N -4.36 0.00 0.00 6.00 -0.00 -1.26 -0.08 117.44 117.74 3kl8 n TRP 269 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.51 3kl8 n TRP 269 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.46 3kl8 n TRP 269 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 3kl8 n ILE 270 N -0.95 0.00 0.27 5.87 2.08 0.72 -4.76 119.36 122.59 3kl8 n ILE 270 Ca 0.00 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.29 3kl8 n ILE 270 Cb 0.00 -0.70 0.11 0.00 -0.75 0.00 0.00 39.64 38.30 3kl8 n ILE 270 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3kl8 n ASN 272 N 0.08 2.74 -4.21 0.00 4.13 -0.99 -4.91 115.26 112.11 3kl8 n ASN 272 Ca 0.15 -3.17 -0.44 0.00 1.68 0.00 0.00 54.58 52.80 3kl8 n ASN 272 Cb 0.74 -0.71 0.00 0.00 -1.54 0.00 0.00 39.78 38.27 3kl8 n ASN 272 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 3kl8 n ARG 273 N 1.76 3.90 0.00 3.52 1.85 -1.26 -5.08 116.66 121.34 3kl8 n ARG 273 Ca 0.23 -4.46 0.00 0.00 -1.00 0.00 0.00 57.85 52.62 3kl8 n ARG 273 Cb 0.38 -2.56 0.00 0.00 -1.05 0.00 0.00 32.46 29.24 3kl8 n ARG 273 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77