#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klj n GLY 2 N 0.00 -1.97 3.08 2.61 0.00 -1.23 -4.40 105.19 103.27 2klj n GLY 2 Ca 0.00 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.49 2klj n GLY 2 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2klj s LYS 3 N -4.66 0.16 0.35 1.61 2.20 -1.25 -4.47 119.74 113.68 2klj s LYS 3 Ca 0.00 0.10 0.09 0.00 -0.36 0.00 0.00 55.97 55.80 2klj s LYS 3 Cb 0.00 0.06 -0.06 0.00 -1.51 0.00 0.00 37.83 36.31 2klj s LYS 3 CO 0.00 -0.27 -0.08 0.96 -0.36 0.00 0.00 175.35 175.60 2klj s ILE 4 N 2.76 2.28 -0.17 5.43 -0.00 -0.87 -1.36 121.20 129.27 2klj s ILE 4 Ca 0.25 -2.17 0.01 0.00 -0.00 0.00 0.00 60.65 58.74 2klj s ILE 4 Cb -0.01 -2.68 0.03 0.00 -0.00 0.00 0.00 42.46 39.80 2klj s ILE 4 CO -0.21 -0.19 -0.14 -0.89 -0.00 0.00 0.00 174.94 173.50 2klj s THR 5 N -2.60 1.70 -0.17 8.37 2.01 0.23 -1.21 115.64 123.97 2klj s THR 5 Ca 0.33 -0.82 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 2klj s THR 5 Cb 0.02 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 2klj s THR 5 CO 0.17 0.38 0.10 -0.76 -0.69 0.00 0.00 174.62 173.83 2klj s LEU 6 N 1.42 4.09 -0.14 4.42 1.43 0.11 -0.47 118.68 129.53 2klj s LEU 6 Ca 0.03 0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 53.36 2klj s LEU 6 Cb -0.14 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 2klj s LEU 6 CO -0.10 0.24 -0.13 -0.31 0.23 0.00 0.00 176.35 176.27 2klj s TYR 7 N -0.01 2.81 0.24 0.29 1.51 0.13 -0.25 117.35 122.07 2klj s TYR 7 Ca 0.08 -0.80 -0.06 0.00 -1.01 0.00 0.00 57.07 55.28 2klj s TYR 7 Cb -0.12 -1.88 0.33 0.00 -0.11 0.00 0.00 41.96 40.19 2klj s TYR 7 CO 0.00 -0.33 1.84 1.49 -1.11 0.00 0.00 175.55 177.45 2klj h GLU 8 N 7.00 0.89 -6.84 -0.62 4.22 0.07 -0.97 114.58 118.33 2klj h GLU 8 Ca -0.29 -0.05 -0.47 0.00 0.08 0.00 0.00 59.36 58.63 2klj h GLU 8 Cb 1.20 -0.20 0.05 0.00 0.50 0.00 0.00 28.75 30.30 2klj h GLU 8 CO 0.56 0.59 -0.02 -0.51 -2.18 0.00 0.00 179.01 177.45 2klj s ASP 9 N -5.73 4.85 0.14 1.04 1.01 -1.22 -2.93 116.67 113.83 2klj s ASP 9 Ca -0.13 -0.51 -0.05 0.00 0.71 0.00 0.00 52.55 52.58 2klj s ASP 9 Cb 0.18 -0.05 -0.06 0.00 1.01 0.00 0.00 42.92 44.00 2klj s ASP 9 CO 0.79 -1.49 0.37 0.00 0.21 0.00 0.00 175.17 175.05 2klj s ARG 10 N -4.85 3.61 -0.01 8.23 1.70 -1.26 -3.78 118.95 122.59 2klj s ARG 10 Ca 0.63 -0.10 0.00 0.00 -0.47 0.00 0.00 55.73 55.78 2klj s ARG 10 Cb -0.06 -2.85 0.00 0.00 -0.57 0.00 0.00 34.95 31.46 2klj s ARG 10 CO 0.41 0.47 0.00 0.41 -1.08 0.00 0.00 175.30 175.50 2klj n GLY 11 N 0.08 0.37 3.26 3.88 0.00 0.68 -3.92 105.19 109.54 2klj n GLY 11 Ca -0.02 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.89 2klj n GLY 11 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2klj n PHE 12 N -3.60 -2.50 -3.28 1.61 3.72 -1.26 -5.02 117.46 107.13 2klj n PHE 12 Ca -0.00 0.87 0.00 0.00 -0.05 0.00 0.00 57.45 58.26 2klj n PHE 12 Cb 0.30 -4.05 0.00 0.00 -0.94 0.00 0.00 39.48 34.79 2klj n PHE 12 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2klj n GLN 13 N -3.09 1.09 0.00 -1.08 6.02 -1.25 -5.07 117.38 114.00 2klj n GLN 13 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 2klj n GLN 13 Cb 0.60 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.86 2klj n GLN 13 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2klj n GLY 14 N 1.58 0.79 3.78 1.08 0.00 -1.26 -3.45 105.19 107.71 2klj n GLY 14 Ca 0.00 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 2klj n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2klj s ARG 15 N 0.00 3.77 0.07 1.61 3.00 -1.26 -4.80 118.95 121.33 2klj s ARG 15 Ca 0.00 1.65 0.01 0.00 0.00 0.00 0.00 55.73 57.39 2klj s ARG 15 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 34.95 32.59 2klj s ARG 15 CO 0.00 -0.52 -0.05 -3.38 0.00 0.00 0.00 175.30 171.35 2klj s HIS 16 N -1.66 0.69 -0.10 -0.53 -3.43 -1.26 0.67 115.29 109.67 2klj s HIS 16 Ca 0.65 -0.91 -0.09 0.00 -0.80 0.00 0.00 55.06 53.90 2klj s HIS 16 Cb -0.25 -0.44 0.03 0.00 -1.43 0.00 0.00 32.58 30.49 2klj s HIS 16 CO 0.30 -0.23 0.26 -0.47 -2.00 0.00 0.00 174.74 172.60 2klj s TYR 17 N -3.40 -0.29 -0.20 0.38 5.04 0.66 -4.98 117.35 114.55 2klj s TYR 17 Ca 0.06 0.71 -0.06 0.00 -2.44 0.00 0.00 57.07 55.35 2klj s TYR 17 Cb 0.04 0.10 -0.03 0.00 0.35 0.00 0.00 41.96 42.42 2klj s TYR 17 CO -0.06 -0.14 0.02 -2.00 -1.34 0.00 0.00 175.55 172.02 2klj s GLU 18 N 0.17 3.66 -0.19 4.97 2.12 -1.26 0.06 118.70 128.24 2klj s GLU 18 Ca -0.00 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 54.81 2klj s GLU 18 Cb -0.02 -3.13 -0.01 0.00 0.26 0.00 0.00 34.13 31.23 2klj s GLU 18 CO 0.00 0.02 -0.08 0.00 -0.54 0.00 0.00 175.26 174.66 2klj n SER 20 N 4.30 1.87 -3.88 0.00 3.41 -1.26 -2.06 113.62 116.01 2klj n SER 20 Ca -0.18 -1.92 -0.08 0.00 -0.26 0.00 0.00 58.87 56.43 2klj n SER 20 Cb 0.51 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 2klj n SER 20 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2klj s SER 21 N -0.92 -0.22 0.23 4.04 1.04 -1.26 -4.64 113.70 111.97 2klj s SER 21 Ca 0.00 -0.67 -0.32 0.00 0.48 0.00 0.00 55.95 55.44 2klj s SER 21 Cb 0.00 0.67 -0.13 0.00 0.10 0.00 0.00 66.02 66.66 2klj s SER 21 CO 0.00 -1.25 1.48 -0.90 0.98 0.00 0.00 173.24 173.55 2klj n ASP 22 N -0.42 3.02 -4.08 7.02 5.75 -1.26 -4.57 116.55 122.01 2klj n ASP 22 Ca -0.04 1.13 -0.18 0.00 -0.01 0.00 0.00 54.79 55.69 2klj n ASP 22 Cb 0.60 -1.46 -0.13 0.00 -1.03 0.00 0.00 41.12 39.10 2klj n ASP 22 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2klj s HIS 23 N 0.16 0.95 -0.02 2.11 2.46 0.99 -4.99 115.29 116.96 2klj s HIS 23 Ca 0.70 -0.31 0.06 0.00 0.47 0.00 0.00 55.06 55.98 2klj s HIS 23 Cb -0.63 -0.58 -0.10 0.00 -0.13 0.00 0.00 32.58 31.15 2klj s HIS 23 CO 0.47 -0.00 0.12 0.25 -2.47 0.00 0.00 174.74 173.11 2klj n THR 24 N 2.12 0.09 -3.75 0.89 -2.24 -1.26 -2.26 114.28 107.87 2klj n THR 24 Ca -0.17 -0.18 -0.23 0.00 -2.27 0.00 0.00 64.05 61.20 2klj n THR 24 Cb 0.55 0.10 -0.17 0.00 -2.10 0.00 0.00 70.33 68.71 2klj n THR 24 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2klj s ASN 25 N -2.98 1.74 -0.00 3.42 2.47 -1.22 -0.83 114.94 117.54 2klj s ASN 25 Ca -0.03 -0.18 0.02 0.00 0.42 0.00 0.00 52.86 53.09 2klj s ASN 25 Cb 0.04 -0.41 -0.03 0.00 -1.45 0.00 0.00 41.25 39.40 2klj s ASN 25 CO 0.27 -0.22 0.09 0.18 -3.72 0.00 0.00 177.10 173.70 2klj n LEU 26 N 5.16 0.09 -0.15 3.21 4.77 0.13 -4.74 117.00 125.47 2klj n LEU 26 Ca -0.07 -0.42 -0.07 0.00 -0.03 0.00 0.00 56.01 55.43 2klj n LEU 26 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 2klj n LEU 26 CO 0.10 0.02 0.64 1.56 -1.33 0.00 0.00 177.39 178.38 2klj h GLN 27 N 0.00 -0.20 -0.43 3.23 4.20 -1.72 1.47 115.11 121.65 2klj h GLN 27 Ca 0.00 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.82 2klj h GLN 27 Cb 0.06 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2klj h GLN 27 CO 0.00 -0.14 0.30 -1.00 -0.67 0.00 0.00 178.83 177.32 2klj h PRO 28 N -0.21 0.18 0.11 1.46 0.13 -1.96 -2.80 132.00 128.92 2klj h PRO 28 Ca 0.20 -0.01 -0.35 0.00 -0.87 0.00 0.00 66.00 64.97 2klj h PRO 28 Cb 0.54 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 2klj h PRO 28 CO -0.60 0.12 -1.91 0.66 -0.23 0.00 0.00 178.00 176.04 2klj n TYR 29 N -4.45 1.27 -4.35 1.56 4.01 0.20 -4.89 117.16 110.50 2klj n TYR 29 Ca 0.07 0.29 -0.26 0.00 -0.16 0.00 0.00 57.90 57.84 2klj n TYR 29 Cb 0.38 -1.16 -0.17 0.00 -0.31 0.00 0.00 39.34 38.08 2klj n TYR 29 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2klj s LEU 30 N -7.15 1.53 0.22 7.72 1.43 0.48 -4.69 118.68 118.22 2klj s LEU 30 Ca -0.23 -0.33 0.17 0.00 -1.03 0.00 0.00 54.13 52.72 2klj s LEU 30 Cb 0.06 -0.88 0.03 0.00 0.03 0.00 0.00 46.19 45.43 2klj s LEU 30 CO 0.75 -0.02 1.23 -1.28 0.23 0.00 0.00 176.35 177.27 2klj h SER 31 N 7.42 0.00 0.00 2.29 0.87 -1.82 -3.32 113.55 118.99 2klj h SER 31 Ca -0.31 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 2klj h SER 31 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2klj h SER 31 CO 0.46 0.41 -0.15 0.54 -0.53 0.00 0.00 176.83 177.56 2klj n ARG 32 N -3.05 0.00 -3.35 2.24 1.74 -1.26 -4.92 116.66 108.07 2klj n ARG 32 Ca -0.01 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.97 2klj n ARG 32 Cb 0.72 -0.47 0.00 0.00 -1.02 0.00 0.00 32.46 31.69 2klj n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2klj n ASN 34 N -2.13 2.63 -3.94 0.00 6.94 -0.39 -4.63 115.26 113.73 2klj n ASN 34 Ca -0.12 -1.83 -0.10 0.00 -0.02 0.00 0.00 54.58 52.51 2klj n ASN 34 Cb 0.58 0.13 -0.11 0.00 -2.36 0.00 0.00 39.78 38.01 2klj n ASN 34 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2klj s SER 35 N -2.13 0.16 -0.00 0.53 1.04 -1.07 0.18 113.70 112.41 2klj s SER 35 Ca 0.26 -0.36 -0.14 0.00 0.48 0.00 0.00 55.95 56.19 2klj s SER 35 Cb 0.20 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.44 2klj s SER 35 CO 0.38 -0.25 0.30 0.00 0.98 0.00 0.00 173.24 174.64 2klj s ALA 36 N -1.16 -0.73 -0.04 5.32 0.00 0.29 0.22 121.76 125.65 2klj s ALA 36 Ca -0.13 0.23 -0.00 0.00 0.00 0.00 0.00 51.96 52.06 2klj s ALA 36 Cb -0.08 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.19 2klj s ALA 36 CO -0.00 -0.29 0.01 1.03 0.00 0.00 0.00 175.76 176.51 2klj s ARG 37 N -1.57 0.33 -0.10 0.00 0.52 0.38 0.95 118.95 119.46 2klj s ARG 37 Ca -0.12 0.12 -0.02 0.00 -0.52 0.00 0.00 55.73 55.19 2klj s ARG 37 Cb -0.04 -0.61 -0.03 0.00 0.52 0.00 0.00 34.95 34.79 2klj s ARG 37 CO 0.03 -0.20 -0.02 0.08 0.02 0.00 0.00 175.30 175.21 2klj s VAL 38 N 1.40 4.14 -0.22 3.52 1.01 -0.60 0.76 120.40 130.40 2klj s VAL 38 Ca -0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 61.98 61.44 2klj s VAL 38 Cb -0.13 -2.76 -0.17 0.00 0.00 0.00 0.00 36.38 33.32 2klj s VAL 38 CO -0.03 0.57 0.07 -0.67 0.00 0.00 0.00 175.10 175.05 2klj n ASP 39 N 2.55 1.88 -3.15 3.32 -0.08 -0.46 -3.48 116.55 117.13 2klj n ASP 39 Ca -0.18 0.41 0.05 0.00 -1.51 0.00 0.00 54.79 53.56 2klj n ASP 39 Cb 0.53 -0.93 -0.01 0.00 2.34 0.00 0.00 41.12 43.05 2klj n ASP 39 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2klj s SER 40 N -6.96 -0.49 0.00 1.67 0.15 -1.26 -4.89 113.70 101.92 2klj s SER 40 Ca -0.31 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2klj s SER 40 Cb 0.08 1.35 0.00 0.00 -1.71 0.00 0.00 66.02 65.73 2klj s SER 40 CO 0.56 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.52 2klj n GLY 41 N 5.28 0.92 3.73 9.45 0.00 -1.26 -3.54 105.19 119.76 2klj n GLY 41 Ca 0.02 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.11 2klj n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klj s TRP 43 N -1.17 -0.19 -0.08 0.00 0.52 -0.37 -2.56 118.94 115.09 2klj s TRP 43 Ca 0.22 0.46 0.04 0.00 0.02 0.00 0.00 56.10 56.85 2klj s TRP 43 Cb -0.12 0.05 -0.00 0.00 -1.15 0.00 0.00 33.47 32.25 2klj s TRP 43 CO 0.13 -0.10 -0.23 1.41 0.02 0.00 0.00 176.95 178.18 2klj s MET 44 N 0.23 2.71 0.11 4.98 1.75 -0.79 0.54 119.30 128.84 2klj s MET 44 Ca -0.01 -0.83 0.09 0.00 -1.25 0.00 0.00 55.69 53.69 2klj s MET 44 Cb -0.02 -2.14 -0.04 0.00 2.84 0.00 0.00 34.83 35.47 2klj s MET 44 CO -0.01 0.23 -0.20 -0.51 -0.65 0.00 0.00 175.02 173.88 2klj s LEU 45 N 0.21 2.59 -0.05 4.11 1.43 -0.92 -0.74 118.68 125.30 2klj s LEU 45 Ca -0.13 -0.59 0.04 0.00 -1.03 0.00 0.00 54.13 52.41 2klj s LEU 45 Cb -0.16 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.60 2klj s LEU 45 CO 0.07 0.19 -0.16 -0.31 0.23 0.00 0.00 176.35 176.37 2klj s TYR 46 N -1.09 1.60 0.56 0.29 1.51 0.21 -1.20 117.35 119.23 2klj s TYR 46 Ca 0.16 -0.48 0.24 0.00 -1.01 0.00 0.00 57.07 55.99 2klj s TYR 46 Cb -0.10 -1.09 1.54 0.00 -0.11 0.00 0.00 41.96 42.19 2klj s TYR 46 CO 0.08 -0.18 2.14 1.05 -1.11 0.00 0.00 175.55 177.53 2klj h GLU 47 N 6.38 0.00 -6.54 -0.62 4.11 -1.19 -0.33 114.58 116.40 2klj h GLU 47 Ca -0.32 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.45 2klj h GLU 47 Cb 1.18 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.27 2klj h GLU 47 CO 0.48 0.00 -0.74 -0.65 0.07 0.00 0.00 179.01 178.17 2klj s GLN 48 N -4.83 2.10 0.95 1.06 -0.21 -0.58 -3.31 119.66 114.85 2klj s GLN 48 Ca -0.05 -1.09 -0.11 0.00 0.02 0.00 0.00 55.36 54.13 2klj s GLN 48 Cb 0.16 -2.27 0.16 0.00 1.00 0.00 0.00 33.01 32.07 2klj s GLN 48 CO 0.61 0.49 1.09 -1.25 -2.12 0.00 0.00 175.29 174.12 2klj s PRO 49 N -2.37 0.76 -1.57 2.91 0.04 -1.26 -2.78 135.00 130.74 2klj s PRO 49 Ca 0.22 1.10 -0.04 0.00 0.04 0.00 0.00 61.00 62.32 2klj s PRO 49 Cb -0.11 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.71 2klj s PRO 49 CO 0.14 -2.66 0.40 0.09 0.04 0.00 0.00 177.00 175.01 2klj n ASN 50 N -4.21 -5.75 -3.10 6.66 5.03 -0.01 -3.54 115.26 110.34 2klj n ASN 50 Ca 0.08 -0.20 -0.13 0.00 0.87 0.00 0.00 54.58 55.20 2klj n ASN 50 Cb 0.54 -4.70 0.01 0.00 -1.02 0.00 0.00 39.78 34.61 2klj n ASN 50 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2klj n TYR 51 N -4.27 -3.10 -3.85 3.10 4.01 -1.24 -5.04 117.16 106.77 2klj n TYR 51 Ca -0.14 1.24 -0.10 0.00 -0.16 0.00 0.00 57.90 58.74 2klj n TYR 51 Cb 0.63 -3.59 -0.08 0.00 -0.31 0.00 0.00 39.34 35.99 2klj n TYR 51 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2klj s SER 52 N -2.56 0.07 0.00 7.72 0.15 -1.12 -5.05 113.70 112.92 2klj s SER 52 Ca 0.18 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.36 2klj s SER 52 Cb -0.04 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 2klj s SER 52 CO 0.79 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2klj n GLY 53 N 0.43 -0.75 3.74 9.45 0.00 -1.26 -1.53 105.19 115.27 2klj n GLY 53 Ca -0.17 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 2klj n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2klj s LEU 54 N 0.00 4.37 0.18 0.99 1.98 -1.26 -4.79 118.68 120.15 2klj s LEU 54 Ca 0.00 2.76 0.11 0.00 -2.89 0.00 0.00 54.13 54.11 2klj s LEU 54 Cb 0.00 -3.62 -0.04 0.00 0.66 0.00 0.00 46.19 43.19 2klj s LEU 54 CO 0.00 -0.81 -0.24 0.00 -1.89 0.00 0.00 176.35 173.42 2klj s GLN 55 N -0.04 1.47 -0.05 1.98 0.00 -1.26 -1.09 119.66 120.68 2klj s GLN 55 Ca 0.63 -1.49 -0.01 0.00 -0.00 0.00 0.00 55.36 54.50 2klj s GLN 55 Cb -0.44 -1.80 0.03 0.00 0.00 0.00 0.00 33.01 30.80 2klj s GLN 55 CO 0.42 0.39 0.00 0.71 0.00 0.00 0.00 175.29 176.81 2klj s TYR 56 N -1.62 0.45 -0.02 9.60 2.02 -0.34 -4.96 117.35 122.48 2klj s TYR 56 Ca 0.19 -0.04 -0.27 0.00 -0.37 0.00 0.00 57.07 56.58 2klj s TYR 56 Cb -0.08 -0.59 -0.04 0.00 -0.40 0.00 0.00 41.96 40.86 2klj s TYR 56 CO 0.09 -0.22 0.85 0.12 -1.57 0.00 0.00 175.55 174.82 2klj s PHE 57 N 1.52 3.64 0.06 2.71 5.36 -1.26 -2.17 117.98 127.84 2klj s PHE 57 Ca -0.02 1.50 0.07 0.00 -0.96 0.00 0.00 56.93 57.52 2klj s PHE 57 Cb -0.13 -2.97 -0.03 0.00 -0.34 0.00 0.00 43.02 39.56 2klj s PHE 57 CO -0.03 0.06 -0.20 -0.51 -1.46 0.00 0.00 175.22 173.07 2klj s LEU 58 N 0.82 2.20 0.09 6.12 1.02 0.19 -4.90 118.68 124.21 2klj s LEU 58 Ca 0.45 -0.56 0.01 0.00 0.02 0.00 0.00 54.13 54.05 2klj s LEU 58 Cb -0.20 -0.93 -0.04 0.00 0.02 0.00 0.00 46.19 45.05 2klj s LEU 58 CO 0.24 0.13 -0.05 -0.13 0.02 0.00 0.00 176.35 176.55 2klj s ARG 59 N -1.36 0.79 -0.30 1.70 0.52 -1.26 -1.24 118.95 117.79 2klj s ARG 59 Ca 0.07 -1.31 -0.28 0.00 -0.52 0.00 0.00 55.73 53.69 2klj s ARG 59 Cb -0.09 -0.09 -0.12 0.00 0.52 0.00 0.00 34.95 35.17 2klj s ARG 59 CO 0.02 -0.05 1.16 2.89 0.02 0.00 0.00 175.30 179.34 2klj n ARG 60 N -0.01 0.00 0.00 3.54 1.85 -1.22 -4.78 116.66 116.04 2klj n ARG 60 Ca -0.12 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.73 2klj n ARG 60 Cb 0.61 -0.91 0.00 0.00 -1.05 0.00 0.00 32.46 31.11 2klj n ARG 60 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2klj n GLY 61 N 3.65 1.44 3.59 2.89 0.00 -1.23 -4.99 105.19 110.54 2klj n GLY 61 Ca 0.27 -1.04 -0.35 0.00 0.00 0.00 0.00 46.02 44.91 2klj n GLY 61 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2klj s ASP 62 N 0.00 5.49 -0.30 1.61 -4.77 -1.26 -1.56 116.67 115.88 2klj s ASP 62 Ca 0.00 0.02 0.03 0.00 -3.30 0.00 0.00 52.55 49.29 2klj s ASP 62 Cb 0.00 -1.95 0.09 0.00 -1.09 0.00 0.00 42.92 39.97 2klj s ASP 62 CO 0.00 0.14 0.01 -0.31 0.70 0.00 0.00 175.17 175.70 2klj s TYR 63 N 0.60 3.13 -1.11 2.11 2.02 0.27 -4.95 117.35 119.42 2klj s TYR 63 Ca 0.03 -2.47 0.26 0.00 -0.37 0.00 0.00 57.07 54.52 2klj s TYR 63 Cb -0.13 -2.32 0.72 0.00 -0.40 0.00 0.00 41.96 39.82 2klj s TYR 63 CO 0.01 -0.90 1.56 0.00 -1.57 0.00 0.00 175.55 174.66 2klj n ALA 64 N 4.45 3.22 -2.60 3.71 0.00 -1.26 0.11 120.51 128.13 2klj n ALA 64 Ca -0.03 -0.30 -0.09 0.00 0.00 0.00 0.00 53.44 53.02 2klj n ALA 64 Cb 0.42 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.59 2klj n ALA 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2klj s ASP 65 N -2.92 0.16 0.12 0.00 1.01 -1.15 -0.23 116.67 113.66 2klj s ASP 65 Ca 0.14 -0.61 -0.17 0.00 0.71 0.00 0.00 52.55 52.62 2klj s ASP 65 Cb 0.18 0.29 -0.04 0.00 1.01 0.00 0.00 42.92 44.36 2klj s ASP 65 CO 0.64 -0.63 1.66 1.12 0.21 0.00 0.00 175.17 178.16 2klj h HIS 66 N 3.14 0.49 -0.62 4.23 2.07 0.16 -2.49 115.15 122.13 2klj h HIS 66 Ca -0.33 -0.04 0.18 0.00 -2.85 0.00 0.00 60.37 57.33 2klj h HIS 66 Cb 1.19 -0.15 -0.02 0.00 2.57 0.00 0.00 27.41 31.00 2klj h HIS 66 CO 0.48 0.47 0.76 -0.56 -3.07 0.00 0.00 177.93 176.01 2klj h GLN 67 N 0.37 0.00 -0.71 5.12 3.07 -1.85 0.19 115.11 121.29 2klj h GLN 67 Ca 0.11 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.78 2klj h GLN 67 Cb 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.72 2klj h GLN 67 CO -0.01 0.00 0.21 1.96 0.09 0.00 0.00 178.83 181.08 2klj h GLN 68 N 0.00 1.11 -0.74 0.06 1.08 -1.78 -2.60 115.11 112.25 2klj h GLN 68 Ca 0.29 -0.24 -0.10 0.00 -1.45 0.00 0.00 58.65 57.15 2klj h GLN 68 Cb 1.81 -0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 29.03 2klj h GLN 68 CO -0.00 0.96 0.12 -2.67 -0.95 0.00 0.00 178.83 176.29 2klj n TRP 69 N -4.25 1.91 -0.99 2.96 2.14 0.57 -4.84 117.44 114.94 2klj n TRP 69 Ca 0.06 -0.83 0.00 0.00 2.07 0.00 0.00 57.50 58.80 2klj n TRP 69 Cb 0.24 -0.53 0.00 0.00 -0.81 0.00 0.00 31.31 30.21 2klj n TRP 69 CO 0.00 0.00 0.00 -1.33 2.07 0.00 0.00 177.69 178.43 2klj n MET 70 N 0.20 -0.39 -1.49 -2.67 2.81 -0.98 -4.51 117.12 110.10 2klj n MET 70 Ca 0.29 0.10 -0.45 0.00 -1.81 0.00 0.00 57.70 55.82 2klj n MET 70 Cb 1.13 -3.38 -0.07 0.00 -0.71 0.00 0.00 33.22 30.19 2klj n MET 70 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2klj n GLY 71 N -2.15 0.34 0.21 3.03 0.00 -0.56 -4.74 105.19 101.32 2klj n GLY 71 Ca 0.00 0.89 0.07 0.00 0.00 0.00 0.00 46.02 46.98 2klj n GLY 71 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2klj h LEU 72 N 14.26 0.00 -8.87 0.99 3.38 -1.91 -3.33 115.31 119.83 2klj h LEU 72 Ca -0.25 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.38 2klj h LEU 72 Cb 1.30 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.91 2klj h LEU 72 CO 1.09 0.29 -0.62 -0.44 0.09 0.00 0.00 178.44 178.86 2klj s SER 73 N -6.43 1.17 -0.68 -0.43 0.01 -1.26 -5.06 113.70 101.02 2klj s SER 73 Ca -0.01 -1.38 -0.01 0.00 1.31 0.00 0.00 55.95 55.86 2klj s SER 73 Cb 0.12 0.17 0.43 0.00 0.21 0.00 0.00 66.02 66.94 2klj s SER 73 CO 0.66 -0.73 1.95 -0.67 0.41 0.00 0.00 173.24 174.86 2klj n ASP 74 N -0.45 7.38 -4.03 2.44 -0.08 -1.26 -4.88 116.55 115.67 2klj n ASP 74 Ca -0.00 -3.80 -0.21 0.00 -1.51 0.00 0.00 54.79 49.27 2klj n ASP 74 Cb 0.66 -0.94 -0.15 0.00 2.34 0.00 0.00 41.12 43.03 2klj n ASP 74 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2klj s SER 75 N -1.84 1.35 -0.39 1.67 0.15 -1.23 -4.44 113.70 108.97 2klj s SER 75 Ca 0.60 -0.21 0.05 0.00 0.70 0.00 0.00 55.95 57.09 2klj s SER 75 Cb 0.48 -0.33 0.17 0.00 -1.71 0.00 0.00 66.02 64.63 2klj s SER 75 CO -0.11 0.09 0.47 -0.69 1.20 0.00 0.00 173.24 174.21 2klj s VAL 76 N 0.09 -0.56 -2.59 4.45 1.01 -1.25 -3.85 120.40 117.70 2klj s VAL 76 Ca -0.02 -0.69 0.26 0.00 0.00 0.00 0.00 61.98 61.53 2klj s VAL 76 Cb -0.08 -0.43 0.32 0.00 0.00 0.00 0.00 36.38 36.19 2klj s VAL 76 CO 0.01 -0.38 1.46 0.54 0.00 0.00 0.00 175.10 176.72 2klj n ARG 77 N 4.22 1.82 -3.57 2.72 1.74 -0.18 -4.48 116.66 118.93 2klj n ARG 77 Ca 0.12 -1.32 -0.16 0.00 -0.77 0.00 0.00 57.85 55.72 2klj n ARG 77 Cb 0.49 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.40 2klj n ARG 77 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2klj s SER 78 N -2.09 -0.51 -0.02 0.55 0.15 -0.93 0.21 113.70 111.05 2klj s SER 78 Ca 0.31 0.43 -0.29 0.00 0.70 0.00 0.00 55.95 57.09 2klj s SER 78 Cb 0.20 0.49 0.08 0.00 -1.71 0.00 0.00 66.02 65.08 2klj s SER 78 CO 0.36 -0.63 0.72 0.00 1.20 0.00 0.00 173.24 174.89 2klj s ARG 80 N -1.81 0.84 -0.24 0.00 1.70 0.08 -0.01 118.95 119.51 2klj s ARG 80 Ca -0.06 -1.28 -0.13 0.00 -0.47 0.00 0.00 55.73 53.79 2klj s ARG 80 Cb -0.00 0.26 -0.05 0.00 -0.57 0.00 0.00 34.95 34.59 2klj s ARG 80 CO 0.03 -0.23 0.26 -1.17 -1.08 0.00 0.00 175.30 173.11 2klj s LEU 81 N -2.98 4.10 -0.36 -1.89 2.96 -1.26 -1.88 118.68 117.37 2klj s LEU 81 Ca 0.15 0.23 -0.24 0.00 -0.22 0.00 0.00 54.13 54.05 2klj s LEU 81 Cb 0.07 -2.26 0.01 0.00 0.50 0.00 0.00 46.19 44.51 2klj s LEU 81 CO -0.04 -0.02 0.83 -0.63 -1.32 0.00 0.00 176.35 175.17 2klj s ILE 82 N 1.35 4.69 0.51 6.68 1.01 -1.06 -4.89 121.20 129.50 2klj s ILE 82 Ca 0.12 1.01 -0.21 0.00 0.00 0.00 0.00 60.65 61.57 2klj s ILE 82 Cb -0.14 -4.25 -0.09 0.00 0.01 0.00 0.00 42.46 37.99 2klj s ILE 82 CO 0.07 -0.46 0.82 -2.65 0.00 0.00 0.00 174.94 172.73 2klj n PRO 83 N 6.52 0.91 0.00 2.79 -0.02 -1.26 -4.41 135.00 139.54 2klj n PRO 83 Ca 0.04 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2klj n PRO 83 Cb 0.48 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2klj n PRO 83 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2klj n HIS 84 N -1.21 0.00 0.00 6.00 8.25 -1.26 -4.12 115.22 122.87 2klj n HIS 84 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2klj n HIS 84 Cb 0.44 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.55 2klj n HIS 84 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2klj n SER 85 N 0.00 0.00 0.11 0.41 7.64 -1.26 -4.19 113.62 116.33 2klj n SER 85 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 2klj n SER 85 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 2klj n SER 85 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2klj h GLY 86 N 0.00 -0.43 -2.37 0.23 0.00 -1.96 -3.37 103.07 95.17 2klj h GLY 86 Ca 0.00 0.17 -0.48 0.00 0.00 0.00 0.00 47.33 47.02 2klj h GLY 86 CO 0.00 -0.15 -0.06 -0.56 0.00 0.00 0.00 176.54 175.76 2klj s SER 87 N -2.50 6.23 -0.23 0.19 0.01 -1.26 -4.83 113.70 111.30 2klj s SER 87 Ca -0.04 0.62 -0.03 0.00 1.31 0.00 0.00 55.95 57.80 2klj s SER 87 Cb 0.01 -2.06 0.07 0.00 0.21 0.00 0.00 66.02 64.25 2klj s SER 87 CO 0.14 -0.45 0.08 -1.00 0.41 0.00 0.00 173.24 172.41 2klj s HIS 88 N -2.51 0.79 -0.03 2.43 0.09 -1.26 -4.32 115.29 110.48 2klj s HIS 88 Ca 0.44 -0.87 -0.01 0.00 -0.00 0.00 0.00 55.06 54.62 2klj s HIS 88 Cb -0.10 -1.03 0.03 0.00 -0.00 0.00 0.00 32.58 31.48 2klj s HIS 88 CO 0.40 -0.67 0.06 -0.98 -0.00 0.00 0.00 174.74 173.54 2klj s ARG 89 N 1.94 -0.00 0.01 1.40 1.70 -1.26 -4.38 118.95 118.35 2klj s ARG 89 Ca 0.03 0.21 -0.00 0.00 -0.47 0.00 0.00 55.73 55.50 2klj s ARG 89 Cb -0.17 -0.20 -0.01 0.00 -0.57 0.00 0.00 34.95 34.00 2klj s ARG 89 CO -0.17 -0.15 -0.01 -1.50 -1.08 0.00 0.00 175.30 172.39 2klj s ILE 90 N 0.98 0.06 -0.23 4.99 2.07 -0.94 -3.40 121.20 124.73 2klj s ILE 90 Ca -0.08 -0.54 0.01 0.00 -1.41 0.00 0.00 60.65 58.63 2klj s ILE 90 Cb -0.11 -0.17 0.06 0.00 0.13 0.00 0.00 42.46 42.37 2klj s ILE 90 CO -0.03 -0.30 -0.06 0.00 -1.91 0.00 0.00 174.94 172.64 2klj s ARG 91 N -0.87 1.66 0.13 3.50 1.70 -1.01 -1.41 118.95 122.64 2klj s ARG 91 Ca -0.10 -0.96 -0.06 0.00 -0.47 0.00 0.00 55.73 54.14 2klj s ARG 91 Cb -0.06 -2.55 -0.06 0.00 -0.57 0.00 0.00 34.95 31.71 2klj s ARG 91 CO -0.01 -0.57 0.39 -0.51 -1.08 0.00 0.00 175.30 173.52 2klj s LEU 92 N 1.40 4.28 -0.02 -1.89 1.02 -0.90 -0.12 118.68 122.45 2klj s LEU 92 Ca -0.05 0.66 0.07 0.00 0.02 0.00 0.00 54.13 54.83 2klj s LEU 92 Cb -0.18 -3.23 -0.02 0.00 0.02 0.00 0.00 46.19 42.79 2klj s LEU 92 CO -0.06 0.08 -0.22 -0.31 0.02 0.00 0.00 176.35 175.86 2klj s TYR 93 N -1.59 2.02 -0.49 0.29 1.51 0.24 -2.29 117.35 117.06 2klj s TYR 93 Ca 0.39 -0.42 0.26 0.00 -1.01 0.00 0.00 57.07 56.28 2klj s TYR 93 Cb -0.13 -1.31 0.78 0.00 -0.11 0.00 0.00 41.96 41.20 2klj s TYR 93 CO 0.22 -0.06 1.75 1.05 -1.11 0.00 0.00 175.55 177.39 2klj h GLU 94 N 5.69 0.00 -5.98 -0.62 -0.00 -1.64 -1.15 114.58 110.88 2klj h GLU 94 Ca -0.39 0.00 -0.52 0.00 -0.00 0.00 0.00 59.36 58.45 2klj h GLU 94 Cb 1.14 0.00 -0.21 0.00 -0.00 0.00 0.00 28.75 29.68 2klj h GLU 94 CO 0.48 0.00 -0.81 0.50 -0.00 0.00 0.00 179.01 179.18 2klj s ARG 95 N -3.25 1.12 0.75 1.06 3.52 -1.26 -3.48 118.95 117.40 2klj s ARG 95 Ca 0.07 -1.20 -0.16 0.00 -0.13 0.00 0.00 55.73 54.30 2klj s ARG 95 Cb 0.09 -1.28 -0.06 0.00 -1.56 0.00 0.00 34.95 32.13 2klj s ARG 95 CO 0.57 0.29 0.24 0.39 -0.81 0.00 0.00 175.30 175.98 2klj n GLU 96 N 0.88 0.15 0.00 5.12 1.02 -0.96 -4.18 120.64 122.67 2klj n GLU 96 Ca -0.18 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2klj n GLU 96 Cb 0.55 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2klj n GLU 96 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2klj n ASP 97 N 0.53 0.00 -2.69 1.62 8.00 0.18 -3.64 116.55 120.55 2klj n ASP 97 Ca 0.08 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.51 2klj n ASP 97 Cb 0.51 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.72 2klj n ASP 97 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2klj n TYR 98 N 8.97 -2.31 -0.07 1.24 4.01 -1.26 -4.58 117.16 123.16 2klj n TYR 98 Ca 0.00 -1.82 -0.09 0.00 -0.16 0.00 0.00 57.90 55.83 2klj n TYR 98 Cb 0.00 1.58 -0.08 0.00 -0.31 0.00 0.00 39.34 40.53 2klj n TYR 98 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2klj n ARG 99 N -0.63 0.98 0.00 -0.72 5.12 -1.24 -5.03 116.66 115.14 2klj n ARG 99 Ca -0.05 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2klj n ARG 99 Cb 0.84 -1.30 0.00 0.00 -1.16 0.00 0.00 32.46 30.83 2klj n ARG 99 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2klj n GLY 100 N 2.60 -2.22 3.73 -0.13 0.00 -1.26 -4.98 105.19 102.93 2klj n GLY 100 Ca -0.24 -1.46 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 2klj n GLY 100 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2klj s GLN 101 N -2.28 2.28 -0.01 1.61 2.00 -1.26 -4.75 119.66 117.24 2klj s GLN 101 Ca 0.00 1.72 0.03 0.00 -2.00 0.00 0.00 55.36 55.11 2klj s GLN 101 Cb 0.00 -1.85 -0.01 0.00 0.80 0.00 0.00 33.01 31.95 2klj s GLN 101 CO 0.00 -1.72 -0.10 1.41 -0.50 0.00 0.00 175.29 174.38 2klj s MET 102 N -3.90 0.87 -0.04 1.67 -2.45 -1.26 -2.00 119.30 112.19 2klj s MET 102 Ca 0.74 -0.37 -0.03 0.00 -1.25 0.00 0.00 55.69 54.78 2klj s MET 102 Cb -0.28 -0.83 0.01 0.00 1.25 0.00 0.00 34.83 34.98 2klj s MET 102 CO 0.44 0.21 0.10 -1.50 1.05 0.00 0.00 175.02 175.32 2klj s ILE 103 N -0.19 -0.01 0.14 10.11 2.07 -0.97 -5.02 121.20 127.33 2klj s ILE 103 Ca 0.03 0.04 0.05 0.00 -1.41 0.00 0.00 60.65 59.36 2klj s ILE 103 Cb -0.05 -0.15 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 2klj s ILE 103 CO -0.00 0.02 0.07 -0.70 -1.91 0.00 0.00 174.94 172.42 2klj s GLU 104 N 0.27 2.73 0.02 3.50 2.12 -1.26 -2.12 118.70 123.95 2klj s GLU 104 Ca -0.02 -0.89 0.02 0.00 0.36 0.00 0.00 54.97 54.44 2klj s GLU 104 Cb -0.03 -2.58 -0.01 0.00 0.26 0.00 0.00 34.13 31.77 2klj s GLU 104 CO -0.01 0.50 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.08 2klj s PHE 105 N -1.62 0.60 -0.00 5.30 0.08 -0.50 -5.01 117.98 116.83 2klj s PHE 105 Ca 0.29 -0.30 0.00 0.00 0.12 0.00 0.00 56.93 57.04 2klj s PHE 105 Cb -0.10 -0.37 0.01 0.00 -0.57 0.00 0.00 43.02 41.98 2klj s PHE 105 CO 0.21 -0.04 0.72 0.25 -0.10 0.00 0.00 175.22 176.26 2klj n THR 106 N 2.18 0.06 -3.89 0.64 -2.24 -1.26 -2.22 114.28 107.55 2klj n THR 106 Ca -0.18 -0.07 -0.11 0.00 -2.27 0.00 0.00 64.05 61.42 2klj n THR 106 Cb 0.56 0.77 -0.00 0.00 -2.10 0.00 0.00 70.33 69.56 2klj n THR 106 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2klj n GLU 107 N -0.04 0.84 -2.02 -0.78 0.28 -1.26 -4.90 120.64 112.75 2klj n GLU 107 Ca 0.00 -2.37 -0.42 0.00 -0.16 0.00 0.00 57.16 54.21 2klj n GLU 107 Cb 0.57 2.55 -0.03 0.00 1.43 0.00 0.00 31.44 35.97 2klj n GLU 107 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 2klj s ASP 108 N -2.98 6.67 -0.74 -1.84 -4.77 -1.26 -4.57 116.67 107.18 2klj s ASP 108 Ca 0.22 2.58 0.02 0.00 -3.30 0.00 0.00 52.55 52.07 2klj s ASP 108 Cb -0.03 -2.61 0.18 0.00 -1.09 0.00 0.00 42.92 39.38 2klj s ASP 108 CO 0.16 -0.72 0.56 0.00 0.70 0.00 0.00 175.17 175.86 2klj h SER 110 N 5.80 0.25 -2.93 0.00 4.64 -1.92 -0.35 113.55 119.03 2klj h SER 110 Ca 0.12 -0.08 -0.59 0.00 -0.47 0.00 0.00 61.79 60.76 2klj h SER 110 Cb 0.80 -0.07 -0.39 0.00 -0.31 0.00 0.00 62.40 62.43 2klj h SER 110 CO 0.76 0.53 -0.81 0.00 -0.87 0.00 0.00 176.83 176.43 2klj h LEU 112 N 6.70 1.02 0.00 0.00 6.46 -1.73 -1.91 115.31 125.85 2klj h LEU 112 Ca 0.06 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2klj h LEU 112 Cb 0.94 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.63 2klj h LEU 112 CO 0.37 0.71 0.26 0.00 -0.62 0.00 0.00 178.44 179.16 2klj n GLN 113 N -4.43 0.00 0.03 1.25 3.00 -1.26 0.27 117.38 116.23 2klj n GLN 113 Ca 0.12 0.21 0.09 0.00 -0.01 0.00 0.00 57.00 57.41 2klj n GLN 113 Cb 0.08 -1.76 -0.10 0.00 0.00 0.00 0.00 30.24 28.46 2klj n GLN 113 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2klj n ASP 114 N -1.20 0.37 -0.09 1.08 8.00 -0.72 -4.56 116.55 119.43 2klj n ASP 114 Ca 0.00 0.15 -0.16 0.00 0.71 0.00 0.00 54.79 55.49 2klj n ASP 114 Cb 0.26 1.24 -0.08 0.00 -0.02 0.00 0.00 41.12 42.52 2klj n ASP 114 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2klj n ARG 115 N -2.49 0.44 -4.80 -1.24 5.12 0.75 -5.03 116.66 109.41 2klj n ARG 115 Ca -0.05 0.13 -0.25 0.00 -1.93 0.00 0.00 57.85 55.76 2klj n ARG 115 Cb 0.62 -1.31 -0.16 0.00 -1.16 0.00 0.00 32.46 30.46 2klj n ARG 115 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2klj s PHE 116 N -2.36 1.56 0.00 -1.55 -0.71 0.39 -5.09 117.98 110.22 2klj s PHE 116 Ca -0.26 -0.35 0.00 0.00 -1.04 0.00 0.00 56.93 55.29 2klj s PHE 116 Cb 0.08 -1.02 0.00 0.00 -1.21 0.00 0.00 43.02 40.87 2klj s PHE 116 CO 0.40 -0.07 0.19 0.54 -1.34 0.00 0.00 175.22 174.94 2klj n ARG 117 N 2.83 0.00 -1.38 1.99 1.74 -1.26 -4.19 116.66 116.39 2klj n ARG 117 Ca -0.16 0.32 -0.28 0.00 -0.77 0.00 0.00 57.85 56.96 2klj n ARG 117 Cb 0.54 -0.93 -0.18 0.00 -1.02 0.00 0.00 32.46 30.86 2klj n ARG 117 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 2klj n PHE 118 N -1.45 0.23 0.00 -1.55 -1.74 -1.26 -4.63 117.46 107.06 2klj n PHE 118 Ca 0.00 0.16 0.00 0.00 -0.56 0.00 0.00 57.45 57.05 2klj n PHE 118 Cb 0.00 -1.24 0.00 0.00 1.52 0.00 0.00 39.48 39.76 2klj n PHE 118 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 2klj n ASN 119 N 7.14 0.00 -4.05 5.98 0.23 -1.26 -4.45 115.26 118.85 2klj n ASN 119 Ca 0.62 0.00 -0.26 0.00 -0.53 0.00 0.00 54.58 54.41 2klj n ASN 119 Cb 0.08 0.00 -0.17 0.00 -2.08 0.00 0.00 39.78 37.62 2klj n ASN 119 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2klj s GLU 120 N -1.82 1.94 -0.24 -3.83 2.02 -1.26 -0.03 118.70 115.48 2klj s GLU 120 Ca 0.00 -0.49 -0.06 0.00 0.02 0.00 0.00 54.97 54.44 2klj s GLU 120 Cb 0.00 -1.59 -0.02 0.00 0.10 0.00 0.00 34.13 32.62 2klj s GLU 120 CO 0.00 0.03 0.03 0.42 0.02 0.00 0.00 175.26 175.76 2klj s ILE 121 N 0.70 3.94 -0.37 -1.63 -1.09 -1.09 -4.55 121.20 117.11 2klj s ILE 121 Ca -0.14 -0.32 0.05 0.00 -2.23 0.00 0.00 60.65 58.01 2klj s ILE 121 Cb -0.16 -2.84 0.46 0.00 -1.58 0.00 0.00 42.46 38.34 2klj s ILE 121 CO 0.03 0.35 1.37 1.41 -1.23 0.00 0.00 174.94 176.88 2klj n HIS 122 N 4.87 2.85 0.00 3.97 8.25 -0.46 -4.44 115.22 130.27 2klj n HIS 122 Ca -0.17 -2.39 0.00 0.00 -0.26 0.00 0.00 57.72 54.90 2klj n HIS 122 Cb 0.51 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 31.04 2klj n HIS 122 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2klj n SER 123 N -0.75 0.00 -3.51 0.41 7.64 -1.05 -2.27 113.62 114.09 2klj n SER 123 Ca 0.48 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.26 2klj n SER 123 Cb 0.90 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 64.08 2klj n SER 123 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2klj s LEU 124 N 0.00 -0.40 -0.30 -3.43 0.05 -0.97 0.81 118.68 114.44 2klj s LEU 124 Ca 0.00 0.09 0.01 0.00 0.05 0.00 0.00 54.13 54.29 2klj s LEU 124 Cb 0.00 2.09 0.09 0.00 -2.05 0.00 0.00 46.19 46.32 2klj s LEU 124 CO 0.00 -0.62 0.04 0.21 -0.55 0.00 0.00 176.35 175.43 2klj s ASN 125 N -2.25 4.21 -0.42 1.48 2.47 0.82 -0.56 114.94 120.69 2klj s ASN 125 Ca 0.03 -1.67 -0.22 0.00 0.42 0.00 0.00 52.86 51.42 2klj s ASN 125 Cb -0.01 -1.21 0.02 0.00 -1.45 0.00 0.00 41.25 38.60 2klj s ASN 125 CO -0.07 -0.35 0.73 -0.69 -3.72 0.00 0.00 177.10 173.00 2klj s VAL 126 N 1.32 4.74 -0.16 -5.21 1.01 -0.93 -2.41 120.40 118.76 2klj s VAL 126 Ca 0.06 0.43 -0.17 0.00 0.00 0.00 0.00 61.98 62.30 2klj s VAL 126 Cb -0.18 -4.25 -0.14 0.00 0.00 0.00 0.00 36.38 31.81 2klj s VAL 126 CO -0.14 -0.60 0.24 -0.07 0.00 0.00 0.00 175.10 174.53 2klj h LEU 127 N 9.87 0.00 0.00 3.92 -0.00 -1.86 -2.47 115.31 124.77 2klj h LEU 127 Ca -0.25 -0.44 0.00 0.00 -0.00 0.00 0.00 57.88 57.19 2klj h LEU 127 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2klj h LEU 127 CO 0.92 1.03 0.00 -0.62 -0.00 0.00 0.00 178.44 179.77 2klj n GLU 128 N -4.58 2.93 0.00 1.13 -0.58 -1.24 -4.88 120.64 113.42 2klj n GLU 128 Ca -0.15 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 2klj n GLU 128 Cb 0.42 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.29 2klj n GLU 128 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2klj n GLY 129 N 4.74 -3.13 3.55 0.62 0.00 -1.26 -4.44 105.19 105.27 2klj n GLY 129 Ca 0.00 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.13 2klj n GLY 129 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2klj s SER 130 N -1.98 3.52 0.27 1.61 0.01 -1.26 -3.37 113.70 112.51 2klj s SER 130 Ca 0.00 -1.28 0.02 0.00 1.31 0.00 0.00 55.95 56.00 2klj s SER 130 Cb 0.00 -0.32 -0.05 0.00 0.21 0.00 0.00 66.02 65.87 2klj s SER 130 CO 0.00 -0.35 0.12 0.26 0.41 0.00 0.00 173.24 173.68 2klj s TRP 131 N -2.77 1.54 -0.06 2.43 0.52 -0.94 -2.17 118.94 117.51 2klj s TRP 131 Ca 0.33 -1.26 0.02 0.00 0.02 0.00 0.00 56.10 55.21 2klj s TRP 131 Cb 0.06 -0.87 0.02 0.00 -1.15 0.00 0.00 33.47 31.52 2klj s TRP 131 CO 0.16 -0.41 -0.09 0.08 0.02 0.00 0.00 176.95 176.71 2klj s VAL 132 N -3.71 0.91 0.03 4.03 1.01 -0.36 -2.07 120.40 120.23 2klj s VAL 132 Ca 0.37 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.03 2klj s VAL 132 Cb 0.07 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 2klj s VAL 132 CO 0.15 0.31 -0.01 -0.76 0.00 0.00 0.00 175.10 174.78 2klj s LEU 133 N 0.76 3.42 0.52 3.92 1.43 -1.02 -1.56 118.68 126.15 2klj s LEU 133 Ca -0.13 -0.09 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 2klj s LEU 133 Cb -0.15 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 2klj s LEU 133 CO 0.02 0.25 0.01 -0.31 0.23 0.00 0.00 176.35 176.56 2klj s TYR 134 N -1.14 1.82 -0.06 0.29 1.51 0.16 -0.18 117.35 119.75 2klj s TYR 134 Ca 0.21 -0.97 0.20 0.00 -1.01 0.00 0.00 57.07 55.50 2klj s TYR 134 Cb -0.11 -1.61 -0.31 0.00 -0.11 0.00 0.00 41.96 39.81 2klj s TYR 134 CO 0.12 0.19 0.38 -1.91 -1.11 0.00 0.00 175.55 173.23 2klj n GLU 135 N -1.30 0.67 -1.67 -0.62 2.13 -1.01 -0.01 120.64 118.83 2klj n GLU 135 Ca -0.19 -0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.47 2klj n GLU 135 Cb 0.67 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.88 2klj n GLU 135 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 2klj n LEU 136 N -2.33 0.00 -5.00 4.31 -0.00 -1.26 -3.25 117.00 109.47 2klj n LEU 136 Ca -0.10 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.70 2klj n LEU 136 Cb 0.67 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 44.17 2klj n LEU 136 CO 0.44 0.00 0.44 -0.94 -0.00 0.00 0.00 177.39 177.33 2klj s SER 137 N -0.67 4.80 -0.94 1.45 1.04 -0.93 -3.05 113.70 115.40 2klj s SER 137 Ca 0.00 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.02 2klj s SER 137 Cb 0.00 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2klj s SER 137 CO 0.00 -1.52 0.00 0.59 0.98 0.00 0.00 173.24 173.29 2klj n ASN 138 N -2.53 -3.38 -3.42 7.02 5.03 0.17 -3.20 115.26 114.95 2klj n ASN 138 Ca 0.13 0.24 -0.27 0.00 0.87 0.00 0.00 54.58 55.55 2klj n ASN 138 Cb 0.60 -2.94 0.02 0.00 -1.02 0.00 0.00 39.78 36.44 2klj n ASN 138 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2klj n TYR 139 N -3.02 -2.01 -2.77 3.10 4.01 -1.26 -4.93 117.16 110.29 2klj n TYR 139 Ca -0.12 0.83 -0.03 0.00 -0.16 0.00 0.00 57.90 58.42 2klj n TYR 139 Cb 0.56 -1.97 0.06 0.00 -0.31 0.00 0.00 39.34 37.67 2klj n TYR 139 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 2klj n ARG 140 N -1.36 1.51 0.00 -0.72 1.85 -1.20 -5.09 116.66 111.66 2klj n ARG 140 Ca -0.19 -3.04 0.00 0.00 -1.00 0.00 0.00 57.85 53.62 2klj n ARG 140 Cb 0.60 -1.16 0.00 0.00 -1.05 0.00 0.00 32.46 30.85 2klj n ARG 140 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2klj n GLY 141 N -0.61 3.70 3.83 2.89 0.00 -1.26 -4.95 105.19 108.80 2klj n GLY 141 Ca 0.03 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 2klj n GLY 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2klj s ARG 142 N 4.70 2.19 0.23 1.61 1.81 -1.26 -4.88 118.95 123.35 2klj s ARG 142 Ca 0.00 0.50 0.00 0.00 -1.72 0.00 0.00 55.73 54.51 2klj s ARG 142 Cb 0.00 -1.94 -0.04 0.00 -0.45 0.00 0.00 34.95 32.52 2klj s ARG 142 CO 0.00 -1.52 0.17 1.14 -0.68 0.00 0.00 175.30 174.42 2klj s GLN 143 N -5.27 1.32 0.14 3.54 0.00 -1.26 -2.41 119.66 115.74 2klj s GLN 143 Ca 0.60 -1.69 -0.17 0.00 -0.00 0.00 0.00 55.36 54.11 2klj s GLN 143 Cb -0.13 0.29 0.04 0.00 0.00 0.00 0.00 33.01 33.20 2klj s GLN 143 CO 0.53 -0.45 0.44 0.71 0.00 0.00 0.00 175.29 176.52 2klj s TYR 144 N -4.01 -0.20 -0.12 9.60 2.02 0.74 -4.91 117.35 120.47 2klj s TYR 144 Ca 0.39 -0.11 0.03 0.00 -0.37 0.00 0.00 57.07 57.01 2klj s TYR 144 Cb 0.06 0.31 0.01 0.00 -0.40 0.00 0.00 41.96 41.93 2klj s TYR 144 CO 0.15 -0.76 -0.22 -1.17 -1.57 0.00 0.00 175.55 171.98 2klj s LEU 145 N -2.82 2.06 -0.36 -1.29 0.20 -1.26 -2.44 118.68 112.77 2klj s LEU 145 Ca 0.04 -0.57 -0.00 0.00 0.69 0.00 0.00 54.13 54.29 2klj s LEU 145 Cb 0.01 -1.39 0.10 0.00 -0.43 0.00 0.00 46.19 44.48 2klj s LEU 145 CO -0.10 0.10 0.11 -0.76 -0.29 0.00 0.00 176.35 175.41 2klj s LEU 146 N 0.66 4.81 0.49 -0.68 2.01 -0.88 -4.95 118.68 120.14 2klj s LEU 146 Ca -0.11 -1.94 -0.19 0.00 0.01 0.00 0.00 54.13 51.90 2klj s LEU 146 Cb -0.16 -1.73 -0.09 0.00 0.01 0.00 0.00 46.19 44.22 2klj s LEU 146 CO 0.02 -0.43 1.00 -0.04 1.01 0.00 0.00 176.35 177.90 2klj s MET 147 N 1.07 3.93 -0.42 1.70 -1.94 -1.26 -2.20 119.30 120.18 2klj s MET 147 Ca 0.06 1.15 -0.43 0.00 -1.71 0.00 0.00 55.69 54.77 2klj s MET 147 Cb -0.21 -2.13 -0.17 0.00 2.01 0.00 0.00 34.83 34.33 2klj s MET 147 CO -0.05 -0.29 1.85 -0.35 -0.01 0.00 0.00 175.02 176.16 2klj n PRO 148 N -1.13 0.47 0.00 2.03 -0.04 -1.22 -4.81 135.00 130.30 2klj n PRO 148 Ca 0.08 0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2klj n PRO 148 Cb 0.53 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 2klj n PRO 148 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2klj n GLY 149 N 5.24 1.33 3.64 0.55 0.00 -0.93 -5.01 105.19 110.01 2klj n GLY 149 Ca 0.37 -0.96 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 2klj n GLY 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2klj s ASP 150 N 0.00 6.34 -0.09 1.61 -1.08 -1.26 -2.18 116.67 120.02 2klj s ASP 150 Ca 0.00 0.40 0.02 0.00 -0.52 0.00 0.00 52.55 52.45 2klj s ASP 150 Cb 0.00 -2.22 -0.02 0.00 -1.46 0.00 0.00 42.92 39.22 2klj s ASP 150 CO 0.00 -0.12 -0.13 -0.31 0.52 0.00 0.00 175.17 175.13 2klj s TYR 151 N 1.62 2.77 -0.07 -5.34 1.51 0.27 -5.00 117.35 113.11 2klj s TYR 151 Ca 0.17 -0.34 0.08 0.00 -1.01 0.00 0.00 57.07 55.96 2klj s TYR 151 Cb -0.15 -1.73 0.13 0.00 -0.11 0.00 0.00 41.96 40.10 2klj s TYR 151 CO 0.08 0.03 1.07 2.89 -1.11 0.00 0.00 175.55 178.51 2klj n ARG 152 N 2.82 2.29 -3.61 -0.62 1.85 -1.26 -2.30 116.66 115.83 2klj n ARG 152 Ca -0.18 -1.97 0.01 0.00 -1.00 0.00 0.00 57.85 54.72 2klj n ARG 152 Cb 0.52 -1.22 -0.01 0.00 -1.05 0.00 0.00 32.46 30.71 2klj n ARG 152 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 2klj s ARG 153 N -1.79 0.34 0.40 2.89 1.70 -1.19 0.48 118.95 121.79 2klj s ARG 153 Ca 0.14 -0.18 0.22 0.00 -0.47 0.00 0.00 55.73 55.44 2klj s ARG 153 Cb 0.12 0.12 0.60 0.00 -0.57 0.00 0.00 34.95 35.22 2klj s ARG 153 CO 0.02 -0.16 1.69 0.10 -1.08 0.00 0.00 175.30 175.87 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.81 -3.05 116.97 119.99 2klj h TYR 154 Ca -0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.40 2klj h TYR 154 Cb 1.20 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.92 2klj h TYR 154 CO 0.31 0.24 -0.23 1.96 -0.00 0.00 0.00 178.16 180.44 2klj h GLN 155 N 0.00 0.00 -0.76 0.10 4.20 -1.96 -2.71 115.11 113.99 2klj h GLN 155 Ca -0.00 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.78 2klj h GLN 155 Cb 0.96 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.68 2klj h GLN 155 CO 0.03 0.23 0.43 -0.44 -0.67 0.00 0.00 178.83 178.42 2klj h ASP 156 N 0.00 0.64 -0.54 1.46 3.32 -1.92 0.70 116.42 120.08 2klj h ASP 156 Ca -0.00 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 2klj h ASP 156 Cb 0.82 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.22 2klj h ASP 156 CO 0.03 0.39 0.14 -2.67 -1.72 0.00 0.00 179.24 175.41 2klj n TRP 157 N -4.75 1.84 -3.26 4.55 2.14 -1.21 -4.94 117.44 111.81 2klj n TRP 157 Ca 0.11 -0.83 -0.10 0.00 2.07 0.00 0.00 57.50 58.75 2klj n TRP 157 Cb 0.22 -0.52 0.00 0.00 -0.81 0.00 0.00 31.31 30.20 2klj n TRP 157 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2klj n GLY 158 N 0.15 -1.18 3.10 -1.67 0.00 0.24 -4.84 105.19 100.99 2klj n GLY 158 Ca 0.28 0.66 -0.24 0.00 0.00 0.00 0.00 46.02 46.72 2klj n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klj s ALA 159 N -2.85 1.29 0.43 4.61 0.00 -1.03 -5.01 121.76 119.20 2klj s ALA 159 Ca 0.06 -0.58 0.14 0.00 0.00 0.00 0.00 51.96 51.58 2klj s ALA 159 Cb -0.01 -0.41 0.96 0.00 0.00 0.00 0.00 23.12 23.65 2klj s ALA 159 CO 0.80 0.25 1.96 0.00 0.00 0.00 0.00 175.76 178.77 2klj h THR 160 N 5.18 1.15 -2.60 0.00 1.03 -1.95 -3.41 112.91 112.31 2klj h THR 160 Ca -0.33 -0.73 -0.06 0.00 -0.01 0.00 0.00 66.41 65.27 2klj h THR 160 Cb 1.17 1.40 -0.17 0.00 -1.07 0.00 0.00 68.15 69.48 2klj h THR 160 CO 0.48 0.21 0.08 0.20 -0.01 0.00 0.00 175.52 176.49 2klj s ASN 161 N -6.98 -0.50 0.33 0.00 0.02 -1.26 -5.04 114.94 101.50 2klj s ASN 161 Ca -0.04 0.30 0.16 0.00 -1.02 0.00 0.00 52.86 52.26 2klj s ASN 161 Cb 0.15 0.51 0.48 0.00 0.02 0.00 0.00 41.25 42.41 2klj s ASN 161 CO 0.70 -0.71 1.64 0.00 0.02 0.00 0.00 177.10 178.75 2klj h ALA 162 N 2.80 0.90 -0.08 0.60 0.00 -1.87 -3.47 119.26 118.15 2klj h ALA 162 Ca -0.30 -0.43 -0.34 0.00 0.00 0.00 0.00 54.91 53.84 2klj h ALA 162 Cb 1.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2klj h ALA 162 CO 0.40 0.59 0.51 2.89 0.00 0.00 0.00 179.25 183.65 2klj n ARG 163 N -3.52 0.00 -5.17 0.00 -4.01 -1.26 -2.68 116.66 100.03 2klj n ARG 163 Ca -0.00 0.00 -0.31 0.00 -1.04 0.00 0.00 57.85 56.50 2klj n ARG 163 Cb 0.59 -0.64 -0.17 0.00 -3.04 0.00 0.00 32.46 29.20 2klj n ARG 163 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2klj s VAL 164 N 2.33 1.95 -0.04 8.89 1.01 0.96 -4.49 120.40 131.00 2klj s VAL 164 Ca 0.50 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.56 2klj s VAL 164 Cb -0.64 -1.67 0.08 0.00 0.00 0.00 0.00 36.38 34.15 2klj s VAL 164 CO 0.30 0.54 1.00 0.61 0.00 0.00 0.00 175.10 177.55 2klj n GLY 165 N 3.31 2.98 0.00 4.51 0.00 0.99 -4.67 105.19 112.32 2klj n GLY 165 Ca -0.19 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2klj n GLY 165 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2klj n SER 166 N -0.72 0.00 -3.53 1.61 3.41 -1.17 -2.19 113.62 111.04 2klj n SER 166 Ca 0.05 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.55 2klj n SER 166 Cb 0.40 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.32 2klj n SER 166 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2klj s LEU 167 N 0.00 -0.40 0.10 1.04 2.34 -0.14 0.36 118.68 121.98 2klj s LEU 167 Ca 0.00 0.22 -0.10 0.00 0.06 0.00 0.00 54.13 54.31 2klj s LEU 167 Cb 0.00 2.03 0.01 0.00 -0.56 0.00 0.00 46.19 47.67 2klj s LEU 167 CO 0.00 -0.53 0.23 0.00 -1.06 0.00 0.00 176.35 175.00 2klj s ARG 168 N -2.21 0.90 -0.14 1.48 1.70 -0.60 0.60 118.95 120.67 2klj s ARG 168 Ca 0.01 -0.92 -0.29 0.00 -0.47 0.00 0.00 55.73 54.06 2klj s ARG 168 Cb -0.01 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.72 2klj s ARG 168 CO -0.03 -0.30 1.33 -0.98 -1.08 0.00 0.00 175.30 174.24 2klj s ARG 169 N -3.85 4.23 -0.43 3.89 3.03 -1.26 -1.22 118.95 123.33 2klj s ARG 169 Ca 0.05 1.76 -0.05 0.00 2.03 0.00 0.00 55.73 59.51 2klj s ARG 169 Cb 0.04 -3.80 -0.15 0.00 -1.03 0.00 0.00 34.95 30.02 2klj s ARG 169 CO -0.11 -0.73 2.66 1.55 -1.13 0.00 0.00 175.30 177.54 2klj n VAL 170 N 5.37 2.54 -4.05 4.99 3.14 -0.92 -4.78 118.33 124.62 2klj n VAL 170 Ca 0.14 -1.38 -0.09 0.00 -2.96 0.00 0.00 64.34 60.06 2klj n VAL 170 Cb 0.44 -2.03 -0.09 0.00 -1.06 0.00 0.00 33.84 31.11 2klj n VAL 170 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2klj s ILE 171 N 2.05 0.13 0.00 1.55 1.09 -1.26 -4.82 121.20 119.94 2klj s ILE 171 Ca 0.50 -1.65 0.00 0.00 -1.10 0.00 0.00 60.65 58.40 2klj s ILE 171 Cb 0.20 -1.77 0.00 0.00 -1.06 0.00 0.00 42.46 39.82 2klj s ILE 171 CO -0.02 -0.57 0.82 -0.67 -0.10 0.00 0.00 174.94 174.40 2klj n ASP 172 N -0.07 -0.72 0.00 3.58 -0.08 -1.26 -5.02 116.55 112.98 2klj n ASP 172 Ca -0.09 -1.64 0.00 0.00 -1.51 0.00 0.00 54.79 51.55 2klj n ASP 172 Cb 0.63 0.21 0.00 0.00 2.34 0.00 0.00 41.12 44.30 2klj n ASP 172 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2klj n PHE 173 N 0.00 -0.13 1.73 -0.67 3.72 -1.26 -5.01 117.46 115.84 2klj n PHE 173 Ca -0.20 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.34 2klj n PHE 173 Cb 0.62 0.26 0.82 0.00 -0.94 0.00 0.00 39.48 40.24 2klj n PHE 173 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14