#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 -0.70 3.09 1.08 0.00 -1.20 -4.64 105.19 102.82 2klj n GLY 2 Ca 0.00 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.91 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 -4.39 0.24 0.34 1.61 2.20 -1.25 -4.48 119.74 114.00 2klj s LYS 3 Ca 0.00 0.15 0.10 0.00 -0.36 0.00 0.00 55.97 55.85 2klj s LYS 3 Cb 0.00 0.08 -0.06 0.00 -1.51 0.00 0.00 37.83 36.34 2klj s LYS 3 CO 0.00 -0.42 -0.08 0.96 -0.36 0.00 0.00 175.35 175.45 2klj s ILE 4 N 2.72 2.36 -0.19 5.43 -0.00 -1.07 -1.15 121.20 129.30 2klj s ILE 4 Ca 0.23 -2.17 0.01 0.00 -0.00 0.00 0.00 60.65 58.71 2klj s ILE 4 Cb -0.02 -2.65 0.04 0.00 -0.00 0.00 0.00 42.46 39.82 2klj s ILE 4 CO -0.21 -0.22 -0.12 -0.89 -0.00 0.00 0.00 174.94 173.50 2klj s THR 5 N -2.58 1.68 -0.16 8.37 2.01 0.24 -1.49 115.64 123.71 2klj s THR 5 Ca 0.33 -0.96 -0.11 0.00 0.31 0.00 0.00 61.69 61.26 2klj s THR 5 Cb 0.01 -1.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.77 2klj s THR 5 CO 0.17 0.24 0.20 -0.76 -0.69 0.00 0.00 174.62 173.79 2klj s LEU 6 N 1.39 4.27 -0.16 4.42 1.43 0.15 -0.73 118.68 129.45 2klj s LEU 6 Ca 0.00 0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 53.50 2klj s LEU 6 Cb -0.15 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 43.84 2klj s LEU 6 CO -0.09 0.20 -0.11 -0.31 0.23 0.00 0.00 176.35 176.27 2klj s TYR 7 N 0.07 2.85 0.25 0.29 1.51 0.17 0.09 117.35 122.59 2klj s TYR 7 Ca 0.13 -0.85 -0.04 0.00 -1.01 0.00 0.00 57.07 55.30 2klj s TYR 7 Cb -0.12 -1.93 0.38 0.00 -0.11 0.00 0.00 41.96 40.17 2klj s TYR 7 CO 0.02 -0.38 1.86 1.49 -1.11 0.00 0.00 175.55 177.42 2klj h GLU 8 N 7.28 1.00 -6.88 -0.62 4.22 0.12 -0.71 114.58 118.99 2klj h GLU 8 Ca -0.33 -0.06 -0.46 0.00 0.08 0.00 0.00 59.36 58.59 2klj h GLU 8 Cb 1.19 -0.23 0.06 0.00 0.50 0.00 0.00 28.75 30.27 2klj h GLU 8 CO 0.58 0.66 -0.00 0.34 -2.18 0.00 0.00 179.01 178.41 2klj s ASP 9 N -5.80 4.82 0.04 1.04 2.15 -1.23 -3.03 116.67 114.66 2klj s ASP 9 Ca -0.12 -0.43 -0.05 0.00 0.43 0.00 0.00 52.55 52.37 2klj s ASP 9 Cb 0.19 -0.15 -0.05 0.00 -0.30 0.00 0.00 42.92 42.62 2klj s ASP 9 CO 0.80 -1.50 0.28 0.00 -0.17 0.00 0.00 175.17 174.58 2klj s ARG 10 N -4.88 3.57 0.00 4.34 1.70 -1.26 -3.75 118.95 118.67 2klj s ARG 10 Ca 0.62 -0.12 0.00 0.00 -0.47 0.00 0.00 55.73 55.76 2klj s ARG 10 Cb -0.07 -3.03 0.00 0.00 -0.57 0.00 0.00 34.95 31.28 2klj s ARG 10 CO 0.41 0.61 0.00 0.41 -1.08 0.00 0.00 175.30 175.65 2klj n GLY 11 N 0.84 0.58 3.26 3.88 0.00 0.10 -4.09 105.19 109.75 2klj n GLY 11 Ca -0.09 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.33 -2.51 -3.12 1.61 3.72 -1.26 -5.02 117.46 107.55 2klj n PHE 12 Ca 0.00 0.87 0.00 0.00 -0.05 0.00 0.00 57.45 58.27 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 -3.05 0.56 0.00 -1.08 6.02 -1.26 -5.07 117.38 113.51 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 0.75 0.82 3.78 1.08 0.00 -1.26 -3.53 105.19 106.84 2klj n GLY 14 Ca 0.00 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 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 3.89 0.07 1.61 3.00 -1.26 -4.82 118.95 121.44 2klj s ARG 15 Ca 0.00 1.55 0.01 0.00 0.00 0.00 0.00 55.73 57.29 2klj s ARG 15 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 34.95 32.58 2klj s ARG 15 CO 0.00 -0.39 -0.06 -3.38 0.00 0.00 0.00 175.30 171.47 2klj s HIS 16 N -1.72 0.74 -0.10 -0.53 -3.43 -1.26 0.72 115.29 109.70 2klj s HIS 16 Ca 0.63 -0.83 -0.09 0.00 -0.80 0.00 0.00 55.06 53.97 2klj s HIS 16 Cb -0.22 -0.45 0.03 0.00 -1.43 0.00 0.00 32.58 30.51 2klj s HIS 16 CO 0.27 -0.18 0.28 -0.47 -2.00 0.00 0.00 174.74 172.64 2klj s TYR 17 N -3.07 -0.31 -0.13 0.38 5.04 0.11 -4.98 117.35 114.40 2klj s TYR 17 Ca 0.05 0.75 -0.05 0.00 -2.44 0.00 0.00 57.07 55.38 2klj s TYR 17 Cb 0.02 0.10 -0.04 0.00 0.35 0.00 0.00 41.96 42.39 2klj s TYR 17 CO -0.04 -0.16 0.03 -2.00 -1.34 0.00 0.00 175.55 172.04 2klj s GLU 18 N 0.25 3.48 -0.17 4.97 2.12 -1.26 0.34 118.70 128.43 2klj s GLU 18 Ca -0.01 -0.37 0.01 0.00 0.36 0.00 0.00 54.97 54.96 2klj s GLU 18 Cb -0.03 -3.00 0.02 0.00 0.26 0.00 0.00 34.13 31.38 2klj s GLU 18 CO -0.01 0.50 -0.19 0.00 -0.54 0.00 0.00 175.26 175.02 2klj n SER 20 N 4.59 2.03 -3.47 0.00 7.64 -1.26 -2.59 113.62 120.56 2klj n SER 20 Ca -0.20 -2.14 -0.08 0.00 1.01 0.00 0.00 58.87 57.46 2klj n SER 20 Cb 0.50 -0.06 -0.00 0.00 -1.01 0.00 0.00 64.21 63.64 2klj n SER 20 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2klj s SER 21 N -1.25 -0.15 0.17 6.43 0.01 -1.26 -4.76 113.70 112.89 2klj s SER 21 Ca 0.04 -0.84 -0.33 0.00 1.31 0.00 0.00 55.95 56.14 2klj s SER 21 Cb 0.04 0.78 -0.13 0.00 0.21 0.00 0.00 66.02 66.92 2klj s SER 21 CO 0.00 -1.49 1.66 -0.90 0.41 0.00 0.00 173.24 172.92 2klj n ASP 22 N -0.86 3.52 -4.03 2.44 5.75 -1.26 -4.21 116.55 117.90 2klj n ASP 22 Ca -0.06 1.07 -0.19 0.00 -0.01 0.00 0.00 54.79 55.60 2klj n ASP 22 Cb 0.59 -1.49 -0.15 0.00 -1.03 0.00 0.00 41.12 39.04 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 1.19 0.88 -0.04 2.11 2.46 0.20 -4.97 115.29 117.12 2klj s HIS 23 Ca 0.78 -0.17 0.09 0.00 0.47 0.00 0.00 55.06 56.23 2klj s HIS 23 Cb -0.60 -0.57 -0.13 0.00 -0.13 0.00 0.00 32.58 31.15 2klj s HIS 23 CO 0.36 -0.02 0.15 0.25 -2.47 0.00 0.00 174.74 173.01 2klj n THR 24 N 2.87 0.18 -3.77 0.89 -2.24 -1.26 -1.95 114.28 109.01 2klj n THR 24 Ca -0.14 -0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.15 2klj n THR 24 Cb 0.56 -0.04 -0.18 0.00 -2.10 0.00 0.00 70.33 68.58 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 -3.38 1.57 0.00 3.42 2.47 -1.21 -1.09 114.94 116.71 2klj s ASN 25 Ca -0.04 -0.08 0.02 0.00 0.42 0.00 0.00 52.86 53.19 2klj s ASN 25 Cb 0.05 -0.43 0.00 0.00 -1.45 0.00 0.00 41.25 39.43 2klj s ASN 25 CO 0.38 -0.20 0.41 0.18 -3.72 0.00 0.00 177.10 174.15 2klj n LEU 26 N 5.15 0.82 -0.19 3.21 4.77 0.10 -4.73 117.00 126.15 2klj n LEU 26 Ca -0.07 -0.83 -0.01 0.00 -0.03 0.00 0.00 56.01 55.07 2klj n LEU 26 Cb 0.50 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.68 2klj n LEU 26 CO 0.10 0.19 0.98 1.56 -1.33 0.00 0.00 177.39 178.89 2klj h GLN 27 N 0.29 0.38 -0.75 3.23 4.20 -1.74 1.09 115.11 121.82 2klj h GLN 27 Ca 0.00 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.74 2klj h GLN 27 Cb 0.08 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 2klj h GLN 27 CO 0.00 0.25 0.49 -1.35 -0.67 0.00 0.00 178.83 177.55 2klj h PRO 28 N 0.39 0.81 0.01 1.46 0.11 -1.96 -3.21 132.00 129.61 2klj h PRO 28 Ca 0.28 -0.05 -0.25 0.00 0.11 0.00 0.00 66.00 66.09 2klj h PRO 28 Cb 0.32 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.21 2klj h PRO 28 CO -0.28 0.54 -1.35 0.66 -0.21 0.00 0.00 178.00 177.35 2klj n TYR 29 N -4.47 1.02 -4.43 0.65 4.01 -0.59 -4.90 117.16 108.45 2klj n TYR 29 Ca 0.10 0.42 -0.33 0.00 -0.16 0.00 0.00 57.90 57.93 2klj n TYR 29 Cb 0.18 -1.10 -0.15 0.00 -0.31 0.00 0.00 39.34 37.96 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 -7.79 2.52 0.16 7.72 1.43 0.37 -4.72 118.68 118.37 2klj s LEU 30 Ca -0.29 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.38 2klj s LEU 30 Cb 0.06 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 2klj s LEU 30 CO 0.60 0.07 1.37 -1.28 0.23 0.00 0.00 176.35 177.34 2klj h SER 31 N 7.41 0.24 0.00 2.29 0.87 -1.80 -3.34 113.55 119.22 2klj h SER 31 Ca -0.34 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 2klj h SER 31 Cb 1.18 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2klj h SER 31 CO 0.58 1.01 -0.15 0.54 -0.53 0.00 0.00 176.83 178.28 2klj n ARG 32 N -3.64 0.15 -3.10 2.24 1.74 -1.26 -4.87 116.66 107.93 2klj n ARG 32 Ca -0.03 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.97 2klj n ARG 32 Cb 0.82 -0.58 0.01 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 -1.27 2.39 -3.92 0.00 6.94 -0.30 -4.65 115.26 114.45 2klj n ASN 34 Ca -0.00 -1.70 -0.10 0.00 -0.02 0.00 0.00 54.58 52.76 2klj n ASN 34 Cb 0.52 0.29 -0.12 0.00 -2.36 0.00 0.00 39.78 38.11 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 -2.29 0.12 -0.04 0.53 1.04 -1.04 0.32 113.70 112.34 2klj s SER 35 Ca 0.22 -0.28 -0.13 0.00 0.48 0.00 0.00 55.95 56.24 2klj s SER 35 Cb 0.19 0.11 0.02 0.00 0.10 0.00 0.00 66.02 66.44 2klj s SER 35 CO 0.46 -0.23 0.31 0.00 0.98 0.00 0.00 173.24 174.76 2klj s ALA 36 N -1.00 -0.77 -0.05 5.32 0.00 0.28 0.45 121.76 125.99 2klj s ALA 36 Ca -0.11 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2klj s ALA 36 Cb -0.07 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.98 2klj s ALA 36 CO -0.00 -0.23 -0.03 1.03 0.00 0.00 0.00 175.76 176.53 2klj s ARG 37 N -0.91 0.73 -0.10 0.00 0.52 0.09 0.14 118.95 119.43 2klj s ARG 37 Ca -0.10 -0.04 -0.02 0.00 -0.52 0.00 0.00 55.73 55.05 2klj s ARG 37 Cb -0.05 -0.84 -0.03 0.00 0.52 0.00 0.00 34.95 34.55 2klj s ARG 37 CO 0.03 -0.14 -0.01 0.08 0.02 0.00 0.00 175.30 175.28 2klj s VAL 38 N 1.18 4.20 -0.24 3.52 1.01 -0.54 0.81 120.40 130.35 2klj s VAL 38 Ca -0.07 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 2klj s VAL 38 Cb -0.14 -2.77 -0.16 0.00 0.00 0.00 0.00 36.38 33.31 2klj s VAL 38 CO -0.02 0.58 -0.03 -0.67 0.00 0.00 0.00 175.10 174.96 2klj n ASP 39 N 2.40 1.90 -3.15 3.32 2.03 -0.30 -3.72 116.55 119.03 2klj n ASP 39 Ca -0.18 0.39 0.05 0.00 0.52 0.00 0.00 54.79 55.57 2klj n ASP 39 Cb 0.53 -0.90 -0.00 0.00 -0.72 0.00 0.00 41.12 40.03 2klj n ASP 39 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2klj s SER 40 N -7.11 -0.75 0.00 1.67 1.04 -1.26 -4.92 113.70 102.37 2klj s SER 40 Ca -0.33 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2klj s SER 40 Cb 0.10 1.51 0.00 0.00 0.10 0.00 0.00 66.02 67.72 2klj s SER 40 CO 0.54 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.24 2klj n GLY 41 N 5.26 0.22 3.44 7.32 0.00 -1.26 -3.22 105.19 116.95 2klj n GLY 41 Ca 0.05 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.07 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 -0.72 0.55 -0.04 0.00 0.52 -0.04 -2.39 118.94 116.81 2klj s TRP 43 Ca 0.11 -0.44 0.03 0.00 0.02 0.00 0.00 56.10 55.83 2klj s TRP 43 Cb -0.10 -0.34 0.00 0.00 -1.15 0.00 0.00 33.47 31.88 2klj s TRP 43 CO 0.01 -0.09 -0.14 1.41 0.02 0.00 0.00 176.95 178.16 2klj s MET 44 N -1.34 1.55 0.13 4.98 1.75 -1.06 0.42 119.30 125.73 2klj s MET 44 Ca -0.09 -0.48 0.10 0.00 -1.25 0.00 0.00 55.69 53.97 2klj s MET 44 Cb -0.09 -1.35 -0.04 0.00 2.84 0.00 0.00 34.83 36.19 2klj s MET 44 CO 0.00 0.16 -0.24 -0.51 -0.65 0.00 0.00 175.02 173.78 2klj s LEU 45 N 0.23 2.44 -0.07 4.11 1.43 -0.75 -1.86 118.68 124.21 2klj s LEU 45 Ca -0.06 -0.69 0.04 0.00 -1.03 0.00 0.00 54.13 52.39 2klj s LEU 45 Cb -0.12 -1.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.78 2klj s LEU 45 CO 0.02 0.18 -0.21 -0.31 0.23 0.00 0.00 176.35 176.26 2klj s TYR 46 N -1.10 2.16 0.52 0.29 1.51 0.14 -1.07 117.35 119.80 2klj s TYR 46 Ca 0.15 -0.75 0.16 0.00 -1.01 0.00 0.00 57.07 55.62 2klj s TYR 46 Cb -0.10 -1.45 1.27 0.00 -0.11 0.00 0.00 41.96 41.57 2klj s TYR 46 CO 0.07 -0.29 2.15 1.05 -1.11 0.00 0.00 175.55 177.42 2klj h GLU 47 N 6.48 0.00 -6.31 -0.62 -0.00 -0.32 -1.91 114.58 111.90 2klj h GLU 47 Ca -0.27 -0.00 -0.66 0.00 -0.00 0.00 0.00 59.36 58.42 2klj h GLU 47 Cb 1.20 -0.00 -0.14 0.00 -0.00 0.00 0.00 28.75 29.81 2klj h GLU 47 CO 0.47 0.00 -0.68 -0.65 -0.00 0.00 0.00 179.01 178.15 2klj s GLN 48 N -5.07 2.55 0.95 1.06 -0.21 -0.58 -3.45 119.66 114.90 2klj s GLN 48 Ca -0.05 -0.78 -0.11 0.00 0.02 0.00 0.00 55.36 54.45 2klj s GLN 48 Cb 0.17 -2.53 0.16 0.00 1.00 0.00 0.00 33.01 31.82 2klj s GLN 48 CO 0.67 0.57 1.11 -1.25 -2.12 0.00 0.00 175.29 174.28 2klj s PRO 49 N -1.86 0.79 -1.66 2.91 0.04 -1.26 -2.56 135.00 131.40 2klj s PRO 49 Ca 0.21 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.55 2klj s PRO 49 Cb -0.11 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2klj s PRO 49 CO 0.13 -2.71 0.00 0.09 0.04 0.00 0.00 177.00 174.55 2klj n ASN 50 N -4.26 -5.48 -2.93 6.66 5.03 -0.25 -3.76 115.26 110.26 2klj n ASN 50 Ca 0.09 0.02 -0.11 0.00 0.87 0.00 0.00 54.58 55.45 2klj n ASN 50 Cb 0.53 -4.54 0.01 0.00 -1.02 0.00 0.00 39.78 34.76 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 -3.89 -3.39 -3.87 3.10 4.01 -1.23 -5.06 117.16 106.84 2klj n TYR 51 Ca -0.22 1.37 -0.09 0.00 -0.16 0.00 0.00 57.90 58.79 2klj n TYR 51 Cb 0.67 -3.84 -0.05 0.00 -0.31 0.00 0.00 39.34 35.82 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 -2.50 -0.15 0.17 7.72 0.15 -1.06 -5.05 113.70 112.99 2klj s SER 52 Ca 0.26 -0.71 0.00 0.00 0.70 0.00 0.00 55.95 56.20 2klj s SER 52 Cb -0.06 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 2klj s SER 52 CO 0.78 -1.07 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2klj n GLY 53 N -0.34 -0.82 3.75 9.45 0.00 -1.26 -1.53 105.19 114.44 2klj n GLY 53 Ca -0.06 -1.17 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 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 4.40 0.18 0.99 1.98 -1.26 -4.75 118.68 120.22 2klj s LEU 54 Ca 0.00 2.64 0.09 0.00 -2.89 0.00 0.00 54.13 53.97 2klj s LEU 54 Cb 0.00 -3.63 -0.04 0.00 0.66 0.00 0.00 46.19 43.18 2klj s LEU 54 CO 0.00 -0.65 -0.18 0.00 -1.89 0.00 0.00 176.35 173.62 2klj s GLN 55 N -0.57 1.33 -0.04 1.98 0.00 -1.26 0.19 119.66 121.28 2klj s GLN 55 Ca 0.57 -1.46 -0.00 0.00 -0.00 0.00 0.00 55.36 54.47 2klj s GLN 55 Cb -0.41 -1.38 0.03 0.00 0.00 0.00 0.00 33.01 31.25 2klj s GLN 55 CO 0.44 0.27 0.01 0.71 0.00 0.00 0.00 175.29 176.72 2klj s TYR 56 N -2.16 0.38 -0.03 9.60 1.51 -0.24 -4.97 117.35 121.45 2klj s TYR 56 Ca 0.18 -0.01 -0.26 0.00 -1.01 0.00 0.00 57.07 55.97 2klj s TYR 56 Cb -0.05 -0.52 -0.04 0.00 -0.11 0.00 0.00 41.96 41.24 2klj s TYR 56 CO 0.07 -0.19 0.80 0.12 -1.11 0.00 0.00 175.55 175.25 2klj s PHE 57 N 1.40 3.63 0.00 2.71 5.36 -1.26 -1.81 117.98 128.02 2klj s PHE 57 Ca -0.04 1.42 0.07 0.00 -0.96 0.00 0.00 56.93 57.42 2klj s PHE 57 Cb -0.13 -2.91 -0.02 0.00 -0.34 0.00 0.00 43.02 39.62 2klj s PHE 57 CO -0.03 0.09 -0.22 -0.51 -1.46 0.00 0.00 175.22 173.09 2klj s LEU 58 N 0.74 2.09 0.11 6.12 1.02 0.17 -4.91 118.68 124.01 2klj s LEU 58 Ca 0.42 -0.44 0.03 0.00 0.02 0.00 0.00 54.13 54.16 2klj s LEU 58 Cb -0.19 -1.09 -0.04 0.00 0.02 0.00 0.00 46.19 44.89 2klj s LEU 58 CO 0.22 0.24 -0.08 -0.13 0.02 0.00 0.00 176.35 176.62 2klj s ARG 59 N -0.75 0.91 -0.26 1.70 0.52 -1.26 -0.86 118.95 118.95 2klj s ARG 59 Ca 0.08 -1.35 -0.23 0.00 -0.52 0.00 0.00 55.73 53.71 2klj s ARG 59 Cb -0.09 -0.37 -0.10 0.00 0.52 0.00 0.00 34.95 34.91 2klj s ARG 59 CO 0.00 0.02 1.02 -2.13 0.02 0.00 0.00 175.30 174.23 2klj n ARG 60 N -0.02 0.00 0.00 3.54 0.63 -1.19 -4.77 116.66 114.85 2klj n ARG 60 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 2klj n ARG 60 Cb 0.60 -0.78 0.00 0.00 0.45 0.00 0.00 32.46 32.73 2klj n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2klj n GLY 61 N 3.28 0.59 3.52 5.14 0.00 -1.24 -5.00 105.19 111.48 2klj n GLY 61 Ca 0.24 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 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 4.89 -0.29 1.61 -4.77 -1.26 -1.47 116.67 115.37 2klj s ASP 62 Ca 0.00 -0.09 0.02 0.00 -3.30 0.00 0.00 52.55 49.18 2klj s ASP 62 Cb 0.00 -1.77 0.08 0.00 -1.09 0.00 0.00 42.92 40.14 2klj s ASP 62 CO 0.00 0.18 -0.00 -0.31 0.70 0.00 0.00 175.17 175.74 2klj s TYR 63 N 0.27 3.02 -1.11 2.11 2.02 0.36 -4.96 117.35 119.07 2klj s TYR 63 Ca -0.02 -2.37 0.26 0.00 -0.37 0.00 0.00 57.07 54.56 2klj s TYR 63 Cb -0.14 -2.21 0.68 0.00 -0.40 0.00 0.00 41.96 39.89 2klj s TYR 63 CO 0.03 -0.88 1.53 0.00 -1.57 0.00 0.00 175.55 174.66 2klj n ALA 64 N 4.48 3.27 -3.21 3.71 0.00 -1.26 0.98 120.51 128.48 2klj n ALA 64 Ca -0.04 -0.31 -0.13 0.00 0.00 0.00 0.00 53.44 52.95 2klj n ALA 64 Cb 0.43 -1.19 -0.10 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 -0.20 0.36 0.00 1.01 -1.11 0.00 116.67 113.81 2klj s ASP 65 Ca 0.14 0.21 0.07 0.00 0.71 0.00 0.00 52.55 53.68 2klj s ASP 65 Cb 0.18 0.39 0.77 0.00 1.01 0.00 0.00 42.92 45.27 2klj s ASP 65 CO 0.64 -0.33 1.92 1.12 0.21 0.00 0.00 175.17 178.73 2klj h HIS 66 N 4.47 0.79 0.00 4.23 2.07 0.49 0.14 115.15 127.34 2klj h HIS 66 Ca -0.29 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.25 2klj h HIS 66 Cb 1.18 -0.25 0.00 0.00 2.57 0.00 0.00 27.41 30.91 2klj h HIS 66 CO 0.50 0.37 0.06 1.96 -3.07 0.00 0.00 177.93 177.74 2klj h GLN 67 N 0.74 0.00 -0.34 5.12 7.50 -1.81 0.66 115.11 126.98 2klj h GLN 67 Ca 0.37 0.00 -0.14 0.00 0.50 0.00 0.00 58.65 59.38 2klj h GLN 67 Cb 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.97 2klj h GLN 67 CO -0.14 0.00 -0.33 1.96 -1.50 0.00 0.00 178.83 178.82 2klj h GLN 68 N 0.00 0.82 -0.72 1.46 1.08 -1.01 -2.95 115.11 113.78 2klj h GLN 68 Ca 0.00 -0.43 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 2klj h GLN 68 Cb 0.11 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2klj h GLN 68 CO 0.00 1.06 0.00 -2.67 -0.95 0.00 0.00 178.83 176.27 2klj n TRP 69 N -4.17 1.02 -0.98 2.96 2.14 -0.72 -4.80 117.44 112.89 2klj n TRP 69 Ca -0.03 -0.37 0.00 0.00 2.07 0.00 0.00 57.50 59.17 2klj n TRP 69 Cb 0.50 -0.27 0.00 0.00 -0.81 0.00 0.00 31.31 30.73 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 0.38 0.00 -2.04 -2.67 2.81 -1.11 -4.54 117.12 109.95 2klj n MET 70 Ca 0.14 0.29 -0.43 0.00 -1.81 0.00 0.00 57.70 55.90 2klj n MET 70 Cb 0.69 -3.53 -0.03 0.00 -0.71 0.00 0.00 33.22 29.65 2klj n MET 70 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2klj s GLY 71 N -2.58 1.32 -0.07 3.03 0.00 0.22 -4.85 107.32 104.39 2klj s GLY 71 Ca 0.00 0.70 -0.06 0.00 0.00 0.00 0.00 44.72 45.36 2klj s GLY 71 CO 0.00 3.07 0.56 0.17 0.00 0.00 0.00 173.10 176.89 2klj h LEU 72 N 11.23 0.45 -9.39 0.66 -0.00 -1.94 -3.12 115.31 113.20 2klj h LEU 72 Ca -0.37 -0.82 -0.65 0.00 -0.00 0.00 0.00 57.88 56.05 2klj h LEU 72 Cb 1.17 -0.15 -0.13 0.00 -0.00 0.00 0.00 40.66 41.55 2klj h LEU 72 CO 0.98 1.71 -0.70 -0.94 -0.00 0.00 0.00 178.44 179.50 2klj s SER 73 N -7.05 4.68 -0.70 0.17 1.04 -1.26 -5.01 113.70 105.57 2klj s SER 73 Ca -0.17 -0.33 -0.00 0.00 0.48 0.00 0.00 55.95 55.93 2klj s SER 73 Cb 0.06 -0.99 0.39 0.00 0.10 0.00 0.00 66.02 65.59 2klj s SER 73 CO 0.81 0.15 1.81 -0.67 0.98 0.00 0.00 173.24 176.32 2klj n ASP 74 N 0.45 6.88 -3.33 7.02 2.03 -1.26 -4.75 116.55 123.59 2klj n ASP 74 Ca -0.12 -3.80 -0.25 0.00 0.52 0.00 0.00 54.79 51.14 2klj n ASP 74 Cb 0.53 -0.89 -0.08 0.00 -0.72 0.00 0.00 41.12 39.96 2klj n ASP 74 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2klj n SER 75 N -0.62 0.78 -4.50 1.67 2.88 -1.20 -4.32 113.62 108.31 2klj n SER 75 Ca 0.53 -2.77 -0.43 0.00 -1.33 0.00 0.00 58.87 54.86 2klj n SER 75 Cb 0.45 -0.63 -0.06 0.00 -0.75 0.00 0.00 64.21 63.22 2klj n SER 75 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2klj s VAL 76 N -1.10 4.71 -1.70 2.46 1.01 -1.18 -4.16 120.40 120.43 2klj s VAL 76 Ca 0.35 0.01 0.14 0.00 0.00 0.00 0.00 61.98 62.47 2klj s VAL 76 Cb 0.12 -4.33 0.12 0.00 0.00 0.00 0.00 36.38 32.28 2klj s VAL 76 CO -0.12 -0.81 0.95 0.54 0.00 0.00 0.00 175.10 175.66 2klj n ARG 77 N 6.59 0.96 -3.72 2.72 1.74 -0.77 -4.57 116.66 119.61 2klj n ARG 77 Ca -0.02 -1.34 -0.14 0.00 -0.77 0.00 0.00 57.85 55.58 2klj n ARG 77 Cb 0.47 -1.26 -0.09 0.00 -1.02 0.00 0.00 32.46 30.55 2klj n ARG 77 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2klj s SER 78 N -1.14 -0.40 -0.11 0.55 1.04 -0.91 0.03 113.70 112.76 2klj s SER 78 Ca 0.16 0.67 -0.22 0.00 0.48 0.00 0.00 55.95 57.04 2klj s SER 78 Cb 0.12 0.72 0.05 0.00 0.10 0.00 0.00 66.02 67.01 2klj s SER 78 CO 0.17 -0.25 0.55 0.00 0.98 0.00 0.00 173.24 174.69 2klj s ARG 80 N -0.61 1.09 -0.26 0.00 1.70 -0.78 0.59 118.95 120.68 2klj s ARG 80 Ca -0.07 -1.20 -0.13 0.00 -0.47 0.00 0.00 55.73 53.86 2klj s ARG 80 Cb -0.03 0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 34.66 2klj s ARG 80 CO 0.05 -0.38 0.29 -1.17 -1.08 0.00 0.00 175.30 173.01 2klj s LEU 81 N -2.97 4.05 -0.28 -1.89 0.20 -1.26 -2.55 118.68 113.98 2klj s LEU 81 Ca 0.17 0.19 -0.29 0.00 0.69 0.00 0.00 54.13 54.89 2klj s LEU 81 Cb 0.04 -2.29 0.01 0.00 -0.43 0.00 0.00 46.19 43.51 2klj s LEU 81 CO -0.01 -0.10 1.19 -0.63 -0.29 0.00 0.00 176.35 176.51 2klj s ILE 82 N 1.78 4.35 0.45 6.68 1.01 -1.01 -4.82 121.20 129.64 2klj s ILE 82 Ca 0.12 1.57 -0.23 0.00 0.00 0.00 0.00 60.65 62.10 2klj s ILE 82 Cb -0.16 -4.24 -0.10 0.00 0.01 0.00 0.00 42.46 37.98 2klj s ILE 82 CO 0.09 -0.39 0.92 -2.65 0.00 0.00 0.00 174.94 172.91 2klj n PRO 83 N 6.94 1.14 -4.54 2.79 -0.02 -1.26 -4.63 135.00 135.42 2klj n PRO 83 Ca 0.13 0.42 -0.25 0.00 -2.02 0.00 0.00 63.50 61.78 2klj n PRO 83 Cb 0.46 -1.96 -0.11 0.00 -0.02 0.00 0.00 33.50 31.87 2klj n PRO 83 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2klj s HIS 84 N -1.35 2.28 0.02 6.00 -3.43 -1.26 -3.74 115.29 113.81 2klj s HIS 84 Ca 0.65 -0.75 -0.15 0.00 -0.80 0.00 0.00 55.06 54.01 2klj s HIS 84 Cb -0.54 -1.53 0.02 0.00 -1.43 0.00 0.00 32.58 29.11 2klj s HIS 84 CO 0.56 0.31 0.33 -1.12 -2.00 0.00 0.00 174.74 172.81 2klj s SER 85 N -3.61 -0.18 0.05 7.38 0.01 -1.26 -4.72 113.70 111.37 2klj s SER 85 Ca 0.35 -0.03 -0.32 0.00 1.31 0.00 0.00 55.95 57.26 2klj s SER 85 Cb 0.08 0.35 -0.18 0.00 0.21 0.00 0.00 66.02 66.48 2klj s SER 85 CO 0.17 -0.55 1.45 1.23 0.41 0.00 0.00 173.24 175.94 2klj h GLY 86 N 3.46 -1.00 -2.67 3.44 0.00 -1.99 -3.41 103.07 100.89 2klj h GLY 86 Ca -0.31 0.37 -0.45 0.00 0.00 0.00 0.00 47.33 46.94 2klj h GLY 86 CO 0.43 -0.37 -0.26 -0.56 0.00 0.00 0.00 176.54 175.79 2klj s SER 87 N -4.40 6.03 -0.01 0.19 0.01 -1.26 -4.87 113.70 109.39 2klj s SER 87 Ca -0.17 0.08 -0.01 0.00 1.31 0.00 0.00 55.95 57.17 2klj s SER 87 Cb 0.02 -1.53 0.01 0.00 0.21 0.00 0.00 66.02 64.73 2klj s SER 87 CO 0.56 -0.44 0.03 -1.00 0.41 0.00 0.00 173.24 172.80 2klj s HIS 88 N -2.28 -0.02 -0.29 2.43 3.76 -1.26 -4.24 115.29 113.39 2klj s HIS 88 Ca 0.44 0.08 -0.15 0.00 -0.15 0.00 0.00 55.06 55.27 2klj s HIS 88 Cb -0.10 -0.01 0.12 0.00 1.11 0.00 0.00 32.58 33.70 2klj s HIS 88 CO 0.33 -0.02 0.83 -0.98 -0.85 0.00 0.00 174.74 174.05 2klj s ARG 89 N 0.12 0.51 0.01 1.40 1.70 -1.26 -4.59 118.95 116.85 2klj s ARG 89 Ca -0.01 0.98 0.00 0.00 -0.47 0.00 0.00 55.73 56.24 2klj s ARG 89 Cb -0.01 0.26 -0.01 0.00 -0.57 0.00 0.00 34.95 34.61 2klj s ARG 89 CO -0.00 -0.12 -0.02 -1.50 -1.08 0.00 0.00 175.30 172.57 2klj s ILE 90 N 1.81 0.09 -0.36 4.99 2.07 -0.86 -3.12 121.20 125.82 2klj s ILE 90 Ca -0.08 -0.51 0.04 0.00 -1.41 0.00 0.00 60.65 58.68 2klj s ILE 90 Cb -0.06 -0.17 0.10 0.00 0.13 0.00 0.00 42.46 42.47 2klj s ILE 90 CO -0.18 -0.26 0.08 -0.13 -1.91 0.00 0.00 174.94 172.54 2klj s ARG 91 N -0.81 1.47 0.21 3.50 0.52 -0.96 -1.31 118.95 121.58 2klj s ARG 91 Ca -0.08 -1.90 -0.30 0.00 -0.52 0.00 0.00 55.73 52.93 2klj s ARG 91 Cb -0.06 -3.11 -0.08 0.00 0.52 0.00 0.00 34.95 32.22 2klj s ARG 91 CO -0.00 -0.97 0.99 -0.51 0.02 0.00 0.00 175.30 174.83 2klj s LEU 92 N 0.82 4.59 -0.10 2.53 1.43 -0.82 -1.24 118.68 125.88 2klj s LEU 92 Ca 0.12 1.99 0.01 0.00 -1.03 0.00 0.00 54.13 55.22 2klj s LEU 92 Cb -0.20 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 2klj s LEU 92 CO -0.08 0.02 -0.12 -0.31 0.23 0.00 0.00 176.35 176.08 2klj s TYR 93 N -0.83 2.80 0.41 0.29 2.02 0.22 -2.03 117.35 120.22 2klj s TYR 93 Ca 0.44 -0.39 0.12 0.00 -0.37 0.00 0.00 57.07 56.86 2klj s TYR 93 Cb -0.27 -1.76 0.86 0.00 -0.40 0.00 0.00 41.96 40.39 2klj s TYR 93 CO 0.33 -0.01 1.93 1.49 -1.57 0.00 0.00 175.55 177.72 2klj h GLU 94 N 6.10 0.11 -5.70 -0.62 4.81 0.09 -2.33 114.58 117.04 2klj h GLU 94 Ca -0.35 -0.03 -0.47 0.00 -0.13 0.00 0.00 59.36 58.38 2klj h GLU 94 Cb 1.19 -0.01 -0.18 0.00 0.63 0.00 0.00 28.75 30.37 2klj h GLU 94 CO 0.54 0.30 -0.77 1.03 -0.73 0.00 0.00 179.01 179.37 2klj s ARG 95 N -4.61 1.13 0.77 1.92 0.52 -1.13 -3.84 118.95 113.71 2klj s ARG 95 Ca -0.04 -1.30 -0.16 0.00 -0.52 0.00 0.00 55.73 53.70 2klj s ARG 95 Cb 0.15 -1.12 -0.09 0.00 0.52 0.00 0.00 34.95 34.41 2klj s ARG 95 CO 0.72 0.23 0.02 0.39 0.02 0.00 0.00 175.30 176.67 2klj n GLU 96 N 0.49 0.09 0.00 3.54 1.02 -1.07 -3.72 120.64 121.00 2klj n GLU 96 Ca -0.15 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2klj n GLU 96 Cb 0.57 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 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 1.24 0.00 -2.81 1.62 8.00 0.01 -3.01 116.55 121.60 2klj n ASP 97 Ca 0.06 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.55 2klj n ASP 97 Cb 0.51 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.67 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 3.34 0.86 -3.63 1.24 4.01 -1.26 -4.71 117.16 117.01 2klj n TYR 98 Ca 0.00 -2.15 -0.17 0.00 -0.16 0.00 0.00 57.90 55.42 2klj n TYR 98 Cb 0.00 -0.03 0.01 0.00 -0.31 0.00 0.00 39.34 39.01 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 -0.65 0.89 -0.67 -0.72 1.74 -1.17 -5.04 116.66 111.04 2klj n ARG 99 Ca 0.04 -2.33 0.09 0.00 -0.77 0.00 0.00 57.85 54.89 2klj n ARG 99 Cb 0.81 0.18 -0.02 0.00 -1.02 0.00 0.00 32.46 32.40 2klj n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2klj n GLY 100 N 0.38 -1.52 3.77 -0.13 0.00 -1.26 -2.84 105.19 103.60 2klj n GLY 100 Ca 0.01 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.09 3.89 -0.00 1.61 2.00 -1.26 -4.65 119.66 120.16 2klj s GLN 101 Ca 0.00 1.86 0.05 0.00 -2.00 0.00 0.00 55.36 55.26 2klj s GLN 101 Cb 0.00 -2.56 -0.01 0.00 0.80 0.00 0.00 33.01 31.24 2klj s GLN 101 CO 0.00 -0.46 -0.15 1.41 -0.50 0.00 0.00 175.29 175.59 2klj s MET 102 N -2.48 1.18 -0.01 1.67 -2.45 -1.26 0.66 119.30 116.61 2klj s MET 102 Ca 0.60 -0.56 0.01 0.00 -1.25 0.00 0.00 55.69 54.49 2klj s MET 102 Cb -0.31 -1.15 0.00 0.00 1.25 0.00 0.00 34.83 34.62 2klj s MET 102 CO 0.38 0.31 -0.04 -1.50 1.05 0.00 0.00 175.02 175.23 2klj s ILE 103 N -0.41 0.32 0.11 10.11 2.07 -0.86 -5.01 121.20 127.53 2klj s ILE 103 Ca 0.05 -0.14 0.03 0.00 -1.41 0.00 0.00 60.65 59.18 2klj s ILE 103 Cb -0.06 -0.30 -0.04 0.00 0.13 0.00 0.00 42.46 42.19 2klj s ILE 103 CO -0.00 0.11 0.14 -0.70 -1.91 0.00 0.00 174.94 172.57 2klj s GLU 104 N 0.11 3.03 -0.01 3.50 2.12 -1.26 -1.95 118.70 124.24 2klj s GLU 104 Ca -0.01 -0.69 0.03 0.00 0.36 0.00 0.00 54.97 54.66 2klj s GLU 104 Cb -0.04 -2.78 -0.01 0.00 0.26 0.00 0.00 34.13 31.57 2klj s GLU 104 CO -0.00 0.55 -0.09 -0.06 -0.54 0.00 0.00 175.26 175.11 2klj s PHE 105 N -1.54 0.83 -0.03 5.30 0.08 -0.43 -4.99 117.98 117.19 2klj s PHE 105 Ca 0.31 -0.16 0.17 0.00 0.12 0.00 0.00 56.93 57.37 2klj s PHE 105 Cb -0.12 -0.54 0.31 0.00 -0.57 0.00 0.00 43.02 42.10 2klj s PHE 105 CO 0.24 -0.02 1.13 0.25 -0.10 0.00 0.00 175.22 176.72 2klj n THR 106 N 2.87 0.37 -3.77 0.64 -2.24 -1.26 -2.02 114.28 108.86 2klj n THR 106 Ca -0.14 -1.07 -0.05 0.00 -2.27 0.00 0.00 64.05 60.52 2klj n THR 106 Cb 0.57 0.65 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 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 0.06 0.80 -2.28 -0.78 0.28 -1.26 -4.89 120.64 112.57 2klj n GLU 107 Ca 0.06 -1.65 -0.41 0.00 -0.16 0.00 0.00 57.16 55.01 2klj n GLU 107 Cb 0.95 2.13 -0.03 0.00 1.43 0.00 0.00 31.44 35.91 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 -2.99 7.00 -0.18 -1.84 -4.77 -1.26 -4.55 116.67 108.08 2klj s ASP 108 Ca 0.17 2.45 0.01 0.00 -3.30 0.00 0.00 52.55 51.88 2klj s ASP 108 Cb -0.03 -2.63 0.04 0.00 -1.09 0.00 0.00 42.92 39.20 2klj s ASP 108 CO 0.08 -0.38 -0.11 0.00 0.70 0.00 0.00 175.17 175.46 2klj n SER 110 N 4.74 2.55 -2.72 0.00 3.41 -1.26 -1.33 113.62 119.01 2klj n SER 110 Ca -0.15 -1.86 -0.05 0.00 -0.26 0.00 0.00 58.87 56.55 2klj n SER 110 Cb 0.48 -0.15 0.04 0.00 -0.26 0.00 0.00 64.21 64.32 2klj n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2klj h LEU 112 N 4.15 0.87 -0.30 0.00 3.38 -1.55 -1.09 115.31 120.78 2klj h LEU 112 Ca -0.08 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2klj h LEU 112 Cb 1.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2klj h LEU 112 CO 0.05 0.42 0.45 0.00 0.09 0.00 0.00 178.44 179.45 2klj n GLN 113 N -4.67 0.04 0.01 1.13 3.00 -1.26 0.30 117.38 115.93 2klj n GLN 113 Ca 0.20 0.39 0.07 0.00 -0.01 0.00 0.00 57.00 57.66 2klj n GLN 113 Cb 0.41 -2.06 -0.12 0.00 0.00 0.00 0.00 30.24 28.47 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 -1.64 0.29 -0.11 1.08 8.00 -0.41 -4.59 116.55 119.17 2klj n ASP 114 Ca -0.00 0.12 -0.19 0.00 0.71 0.00 0.00 54.79 55.42 2klj n ASP 114 Cb 0.46 1.32 -0.09 0.00 -0.02 0.00 0.00 41.12 42.79 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 -2.48 0.50 -4.57 -1.24 5.12 0.87 -5.03 116.66 109.83 2klj n ARG 115 Ca -0.07 0.16 -0.22 0.00 -1.93 0.00 0.00 57.85 55.79 2klj n ARG 115 Cb 0.66 -1.37 -0.15 0.00 -1.16 0.00 0.00 32.46 30.45 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 -2.42 1.28 0.00 -1.55 -0.71 0.60 -5.10 117.98 110.09 2klj s PHE 116 Ca -0.30 -0.28 0.00 0.00 -1.04 0.00 0.00 56.93 55.31 2klj s PHE 116 Cb 0.10 -0.80 0.00 0.00 -1.21 0.00 0.00 43.02 41.10 2klj s PHE 116 CO 0.44 -0.00 0.04 0.54 -1.34 0.00 0.00 175.22 174.91 2klj n ARG 117 N 2.46 0.00 -0.91 1.99 1.74 -1.26 -4.17 116.66 116.52 2klj n ARG 117 Ca -0.15 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.60 2klj n ARG 117 Cb 0.55 -0.30 -0.09 0.00 -1.02 0.00 0.00 32.46 31.60 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 -0.17 0.55 0.53 -1.55 -1.74 -1.26 -4.67 117.46 109.16 2klj n PHE 118 Ca 0.00 0.37 0.01 0.00 -0.56 0.00 0.00 57.45 57.27 2klj n PHE 118 Cb 0.00 -1.53 0.06 0.00 1.52 0.00 0.00 39.48 39.53 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 5.96 0.00 -4.11 5.98 6.94 -1.26 -4.56 115.26 124.21 2klj n ASN 119 Ca 0.40 -0.46 -0.30 0.00 -0.02 0.00 0.00 54.58 54.19 2klj n ASN 119 Cb -0.00 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.25 2klj n ASN 119 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2klj s GLU 120 N -2.00 2.62 -0.25 -3.83 2.02 -1.26 -0.10 118.70 115.89 2klj s GLU 120 Ca 0.03 -0.71 -0.06 0.00 0.02 0.00 0.00 54.97 54.26 2klj s GLU 120 Cb 0.01 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 32.08 2klj s GLU 120 CO 0.03 -0.03 0.02 0.42 0.02 0.00 0.00 175.26 175.72 2klj s ILE 121 N 0.88 3.82 -0.38 -1.63 -1.09 -1.11 -4.69 121.20 117.00 2klj s ILE 121 Ca -0.07 -0.43 0.06 0.00 -2.23 0.00 0.00 60.65 57.97 2klj s ILE 121 Cb -0.15 -2.81 0.48 0.00 -1.58 0.00 0.00 42.46 38.39 2klj s ILE 121 CO -0.01 0.31 1.50 1.41 -1.23 0.00 0.00 174.94 176.92 2klj n HIS 122 N 4.85 2.23 0.00 3.97 8.25 -0.88 -4.55 115.22 129.09 2klj n HIS 122 Ca -0.17 -2.17 0.00 0.00 -0.26 0.00 0.00 57.72 55.12 2klj n HIS 122 Cb 0.50 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.95 2klj n HIS 122 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2klj n SER 123 N -0.93 0.00 -3.48 0.41 3.41 -1.20 -2.58 113.62 109.25 2klj n SER 123 Ca 0.45 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.93 2klj n SER 123 Cb 0.94 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.85 2klj n SER 123 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2klj s LEU 124 N 0.00 -0.53 -0.34 1.04 0.05 -0.92 0.72 118.68 118.70 2klj s LEU 124 Ca 0.00 0.23 0.03 0.00 0.05 0.00 0.00 54.13 54.44 2klj s LEU 124 Cb 0.00 2.39 0.10 0.00 -2.05 0.00 0.00 46.19 46.63 2klj s LEU 124 CO 0.00 -0.74 0.07 0.21 -0.55 0.00 0.00 176.35 175.34 2klj s ASN 125 N -2.11 4.58 -0.52 1.48 2.47 -0.37 -0.36 114.94 120.11 2klj s ASN 125 Ca -0.02 -2.05 -0.24 0.00 0.42 0.00 0.00 52.86 50.98 2klj s ASN 125 Cb -0.01 -1.44 0.04 0.00 -1.45 0.00 0.00 41.25 38.39 2klj s ASN 125 CO -0.05 -0.39 0.88 -0.69 -3.72 0.00 0.00 177.10 173.14 2klj s VAL 126 N 1.05 4.49 -0.17 -5.21 1.01 -0.86 -2.26 120.40 118.44 2klj s VAL 126 Ca 0.11 0.26 -0.24 0.00 0.00 0.00 0.00 61.98 62.11 2klj s VAL 126 Cb -0.19 -4.47 -0.22 0.00 0.00 0.00 0.00 36.38 31.51 2klj s VAL 126 CO -0.12 -1.00 0.46 -0.07 0.00 0.00 0.00 175.10 174.38 2klj h LEU 127 N 10.67 0.00 0.00 3.92 -0.00 -1.84 -0.84 115.31 127.22 2klj h LEU 127 Ca -0.26 -0.72 0.00 0.00 -0.00 0.00 0.00 57.88 56.90 2klj h LEU 127 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.74 2klj h LEU 127 CO 1.05 1.22 0.00 -0.62 -0.00 0.00 0.00 178.44 180.09 2klj n GLU 128 N -4.53 0.70 0.00 1.13 -0.58 -1.24 -4.86 120.64 111.26 2klj n GLU 128 Ca -0.20 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.54 2klj n GLU 128 Cb 0.56 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.43 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 5.00 -3.19 3.39 0.62 0.00 -1.26 -4.42 105.19 105.33 2klj n GLY 129 Ca 0.00 -0.74 -0.22 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.12 3.03 0.39 1.61 0.01 -1.25 -3.78 113.70 111.59 2klj s SER 130 Ca 0.00 -0.95 0.04 0.00 1.31 0.00 0.00 55.95 56.35 2klj s SER 130 Cb 0.00 -0.21 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 2klj s SER 130 CO 0.00 -0.02 0.05 0.26 0.41 0.00 0.00 173.24 173.94 2klj s TRP 131 N -2.35 2.03 -0.04 2.43 0.52 -1.07 -1.49 118.94 118.97 2klj s TRP 131 Ca 0.22 -0.96 0.02 0.00 0.02 0.00 0.00 56.10 55.40 2klj s TRP 131 Cb -0.05 -1.41 0.01 0.00 -1.15 0.00 0.00 33.47 30.87 2klj s TRP 131 CO 0.10 0.07 -0.08 0.08 0.02 0.00 0.00 176.95 177.14 2klj s VAL 132 N -3.10 0.73 -0.05 4.03 1.01 -0.20 -2.59 120.40 120.23 2klj s VAL 132 Ca 0.29 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 2klj s VAL 132 Cb 0.07 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 2klj s VAL 132 CO 0.14 0.25 -0.00 -0.76 0.00 0.00 0.00 175.10 174.73 2klj s LEU 133 N 0.51 3.54 -0.04 3.92 1.43 -0.99 -1.70 118.68 125.34 2klj s LEU 133 Ca -0.08 0.08 0.07 0.00 -1.03 0.00 0.00 54.13 53.17 2klj s LEU 133 Cb -0.12 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.20 2klj s LEU 133 CO 0.01 0.34 -0.25 -0.31 0.23 0.00 0.00 176.35 176.37 2klj s TYR 134 N -0.96 2.41 0.57 0.29 1.51 0.99 -1.81 117.35 120.36 2klj s TYR 134 Ca 0.16 -0.59 0.27 0.00 -1.01 0.00 0.00 57.07 55.89 2klj s TYR 134 Cb -0.11 -1.56 1.61 0.00 -0.11 0.00 0.00 41.96 41.79 2klj s TYR 134 CO 0.05 -0.13 2.12 1.49 -1.11 0.00 0.00 175.55 177.97 2klj h GLU 135 N 5.82 0.00 0.00 -0.62 4.81 -1.72 0.56 114.58 123.43 2klj h GLU 135 Ca -0.37 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2klj h GLU 135 Cb 1.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2klj h GLU 135 CO 0.47 0.00 0.00 1.47 -0.73 0.00 0.00 179.01 180.22 2klj n LEU 136 N -3.96 0.00 -4.99 1.64 -0.00 -1.26 -3.07 117.00 105.37 2klj n LEU 136 Ca 0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.80 2klj n LEU 136 Cb 0.28 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 43.78 2klj n LEU 136 CO 0.29 0.00 0.46 -0.94 -0.00 0.00 0.00 177.39 177.20 2klj s SER 137 N -0.98 4.78 -1.07 1.45 1.04 -1.26 -2.90 113.70 114.75 2klj s SER 137 Ca 0.00 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.17 2klj s SER 137 Cb 0.00 -0.33 0.00 0.00 0.10 0.00 0.00 66.02 65.79 2klj s SER 137 CO 0.00 -1.54 0.00 0.59 0.98 0.00 0.00 173.24 173.27 2klj n ASN 138 N -2.59 -3.52 -3.40 7.02 5.03 -0.73 -3.24 115.26 113.83 2klj n ASN 138 Ca 0.12 0.24 -0.33 0.00 0.87 0.00 0.00 54.58 55.48 2klj n ASN 138 Cb 0.60 -3.10 0.03 0.00 -1.02 0.00 0.00 39.78 36.29 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 -2.83 -2.28 -2.83 3.10 4.01 -1.26 -4.93 117.16 110.14 2klj n TYR 139 Ca -0.13 0.95 -0.01 0.00 -0.16 0.00 0.00 57.90 58.56 2klj n TYR 139 Cb 0.53 -1.83 0.05 0.00 -0.31 0.00 0.00 39.34 37.78 2klj n TYR 139 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2klj n ARG 140 N -0.80 1.71 0.00 -0.72 0.00 -1.20 -5.09 116.66 110.57 2klj n ARG 140 Ca -0.14 -3.50 0.00 0.00 -0.00 0.00 0.00 57.85 54.21 2klj n ARG 140 Cb 0.63 -1.60 0.00 0.00 0.00 0.00 0.00 32.46 31.49 2klj n ARG 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2klj n GLY 141 N -0.58 3.73 3.86 5.14 0.00 -1.26 -4.95 105.19 111.13 2klj n GLY 141 Ca 0.07 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 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 4.81 2.84 -0.02 1.61 1.81 -1.26 -4.89 118.95 123.86 2klj s ARG 142 Ca 0.00 0.60 -0.02 0.00 -1.72 0.00 0.00 55.73 54.59 2klj s ARG 142 Cb 0.00 -2.01 0.01 0.00 -0.45 0.00 0.00 34.95 32.50 2klj s ARG 142 CO 0.00 -1.08 0.06 -0.65 -0.68 0.00 0.00 175.30 172.95 2klj s GLN 143 N -5.25 0.06 0.22 3.54 1.11 -1.26 -2.65 119.66 115.43 2klj s GLN 143 Ca 0.58 0.10 0.11 0.00 0.01 0.00 0.00 55.36 56.16 2klj s GLN 143 Cb -0.12 -0.00 -0.05 0.00 -1.01 0.00 0.00 33.01 31.83 2klj s GLN 143 CO 0.53 -0.03 -0.21 0.71 0.01 0.00 0.00 175.29 176.30 2klj s TYR 144 N 0.17 2.20 -0.15 0.91 2.02 -0.75 -4.95 117.35 116.80 2klj s TYR 144 Ca -0.01 -0.37 -0.00 0.00 -0.37 0.00 0.00 57.07 56.31 2klj s TYR 144 Cb -0.02 -1.03 -0.01 0.00 -0.40 0.00 0.00 41.96 40.50 2klj s TYR 144 CO -0.00 0.56 -0.13 -1.17 -1.57 0.00 0.00 175.55 173.23 2klj s LEU 145 N -3.04 2.65 -0.47 -1.29 0.20 -1.26 -2.36 118.68 113.11 2klj s LEU 145 Ca 0.24 -0.39 -0.02 0.00 0.69 0.00 0.00 54.13 54.65 2klj s LEU 145 Cb -0.06 -1.61 0.12 0.00 -0.43 0.00 0.00 46.19 44.22 2klj s LEU 145 CO 0.11 0.11 0.26 -0.76 -0.29 0.00 0.00 176.35 175.79 2klj s LEU 146 N 0.65 5.16 1.02 -0.68 2.01 -1.07 -4.92 118.68 120.86 2klj s LEU 146 Ca -0.07 -2.33 -0.12 0.00 0.01 0.00 0.00 54.13 51.62 2klj s LEU 146 Cb -0.15 -1.81 0.20 0.00 0.01 0.00 0.00 46.19 44.44 2klj s LEU 146 CO 0.02 -0.47 1.09 -0.04 1.01 0.00 0.00 176.35 177.97 2klj s MET 147 N 0.70 0.25 -0.50 1.70 -1.94 -1.26 -2.61 119.30 115.64 2klj s MET 147 Ca 0.11 0.53 -0.27 0.00 -1.71 0.00 0.00 55.69 54.35 2klj s MET 147 Cb -0.22 -1.71 -0.04 0.00 2.01 0.00 0.00 34.83 34.87 2klj s MET 147 CO -0.04 -2.86 2.07 -2.14 -0.01 0.00 0.00 175.02 172.04 2klj s PRO 148 N -4.92 2.58 0.00 2.03 0.02 -1.25 -4.63 135.00 128.83 2klj s PRO 148 Ca 0.66 1.10 0.00 0.00 0.02 0.00 0.00 61.00 62.78 2klj s PRO 148 Cb -0.19 -4.43 0.00 0.00 0.02 0.00 0.00 34.50 29.90 2klj s PRO 148 CO 0.58 -2.75 0.00 0.41 -0.33 0.00 0.00 177.00 174.91 2klj n GLY 149 N 5.77 0.41 3.68 0.52 0.00 -0.32 -4.99 105.19 110.25 2klj n GLY 149 Ca 0.27 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 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 6.72 -0.10 1.61 2.15 -1.26 -2.03 116.67 123.75 2klj s ASP 150 Ca 0.00 0.87 0.01 0.00 0.43 0.00 0.00 52.55 53.86 2klj s ASP 150 Cb 0.00 -2.34 -0.02 0.00 -0.30 0.00 0.00 42.92 40.26 2klj s ASP 150 CO 0.00 -0.18 -0.13 -0.31 -0.17 0.00 0.00 175.17 174.37 2klj s TYR 151 N 1.45 2.78 -1.03 -5.34 1.51 0.52 -4.99 117.35 112.24 2klj s TYR 151 Ca 0.29 -0.48 0.10 0.00 -1.01 0.00 0.00 57.07 55.97 2klj s TYR 151 Cb -0.16 -1.78 0.16 0.00 -0.11 0.00 0.00 41.96 40.08 2klj s TYR 151 CO 0.11 -0.08 0.99 0.54 -1.11 0.00 0.00 175.55 176.01 2klj n ARG 152 N 3.12 1.49 -3.69 -0.62 1.74 -1.26 -2.16 116.66 115.28 2klj n ARG 152 Ca -0.18 -1.49 -0.02 0.00 -0.77 0.00 0.00 57.85 55.39 2klj n ARG 152 Cb 0.53 -1.21 -0.01 0.00 -1.02 0.00 0.00 32.46 30.75 2klj n ARG 152 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2klj s ARG 153 N -0.90 0.90 0.37 5.56 1.70 -1.19 -0.81 118.95 124.58 2klj s ARG 153 Ca 0.15 -0.48 0.20 0.00 -0.47 0.00 0.00 55.73 55.13 2klj s ARG 153 Cb 0.09 0.31 0.42 0.00 -0.57 0.00 0.00 34.95 35.21 2klj s ARG 153 CO 0.13 -0.41 1.61 0.10 -1.08 0.00 0.00 175.30 175.65 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.80 -3.13 116.97 119.93 2klj h TYR 154 Ca -0.25 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.42 2klj h TYR 154 Cb 1.22 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.94 2klj h TYR 154 CO 0.35 0.31 -0.25 1.96 -0.00 0.00 0.00 178.16 180.54 2klj h GLN 155 N 0.00 0.00 -0.70 0.10 4.20 -1.95 -2.95 115.11 113.80 2klj h GLN 155 Ca -0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 2klj h GLN 155 Cb 1.09 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.78 2klj h GLN 155 CO 0.04 0.25 0.28 -0.44 -0.67 0.00 0.00 178.83 178.29 2klj h ASP 156 N 0.00 0.28 -0.46 1.46 3.32 -1.93 0.35 116.42 119.44 2klj h ASP 156 Ca -0.00 0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 2klj h ASP 156 Cb 0.78 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.36 2klj h ASP 156 CO 0.03 0.13 0.09 -2.67 -1.72 0.00 0.00 179.24 175.10 2klj n TRP 157 N -4.99 1.59 -3.23 4.55 2.14 -1.20 -4.94 117.44 111.36 2klj n TRP 157 Ca 0.12 -0.68 -0.09 0.00 2.07 0.00 0.00 57.50 58.91 2klj n TRP 157 Cb 0.35 -0.46 0.00 0.00 -0.81 0.00 0.00 31.31 30.40 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 0.23 -1.19 3.13 -1.67 0.00 0.12 -4.82 105.19 101.00 2klj n GLY 158 Ca 0.24 0.65 -0.26 0.00 0.00 0.00 0.00 46.02 46.65 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 -2.86 1.49 0.36 4.61 0.00 -1.12 -5.02 121.76 119.22 2klj s ALA 159 Ca 0.06 -0.69 0.09 0.00 0.00 0.00 0.00 51.96 51.42 2klj s ALA 159 Cb -0.01 -0.48 0.67 0.00 0.00 0.00 0.00 23.12 23.30 2klj s ALA 159 CO 0.80 0.28 1.84 0.00 0.00 0.00 0.00 175.76 178.68 2klj h THR 160 N 5.18 1.23 -2.65 0.00 1.03 -1.95 -3.41 112.91 112.34 2klj h THR 160 Ca -0.33 -1.06 -0.10 0.00 -0.01 0.00 0.00 66.41 64.92 2klj h THR 160 Cb 1.17 1.39 -0.20 0.00 -1.07 0.00 0.00 68.15 69.44 2klj h THR 160 CO 0.48 0.32 -0.11 0.20 -0.01 0.00 0.00 175.52 176.40 2klj s ASN 161 N -6.88 -0.38 0.41 0.00 0.02 -1.26 -5.03 114.94 101.83 2klj s ASN 161 Ca -0.05 0.39 0.28 0.00 -1.02 0.00 0.00 52.86 52.46 2klj s ASN 161 Cb 0.15 0.46 0.94 0.00 0.02 0.00 0.00 41.25 42.81 2klj s ASN 161 CO 0.74 -0.47 1.80 0.00 0.02 0.00 0.00 177.10 179.20 2klj h ALA 162 N 3.75 1.00 -0.04 0.60 0.00 -1.87 -3.46 119.26 119.25 2klj h ALA 162 Ca -0.29 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 53.93 2klj h ALA 162 Cb 1.16 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2klj h ALA 162 CO 0.37 0.00 1.15 0.54 0.00 0.00 0.00 179.25 181.32 2klj n ARG 163 N -2.80 0.00 -4.73 0.00 1.74 -1.26 -2.76 116.66 106.85 2klj n ARG 163 Ca 0.03 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.82 2klj n ARG 163 Cb 0.37 -1.34 -0.17 0.00 -1.02 0.00 0.00 32.46 30.30 2klj n ARG 163 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2klj s VAL 164 N 5.24 1.60 -0.12 1.55 1.01 0.85 -4.42 120.40 126.11 2klj s VAL 164 Ca 1.06 -0.73 0.16 0.00 0.00 0.00 0.00 61.98 62.48 2klj s VAL 164 Cb -1.34 -1.42 -0.24 0.00 0.00 0.00 0.00 36.38 33.38 2klj s VAL 164 CO 0.59 0.46 0.18 0.61 0.00 0.00 0.00 175.10 176.94 2klj n GLY 165 N 3.88 -0.83 3.74 4.51 0.00 0.19 -4.68 105.19 112.00 2klj n GLY 165 Ca -0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 46.02 45.45 2klj n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2klj s SER 166 N -4.72 -0.15 -0.00 1.61 1.04 -1.07 -1.46 113.70 108.95 2klj s SER 166 Ca -0.08 -0.37 -0.28 0.00 0.48 0.00 0.00 55.95 55.70 2klj s SER 166 Cb 0.07 0.44 0.09 0.00 0.10 0.00 0.00 66.02 66.72 2klj s SER 166 CO 0.71 -0.81 0.80 -1.48 0.98 0.00 0.00 173.24 173.44 2klj s LEU 167 N -2.96 -0.47 0.32 2.42 2.34 -0.44 -0.01 118.68 119.88 2klj s LEU 167 Ca 0.13 0.21 -0.04 0.00 0.06 0.00 0.00 54.13 54.49 2klj s LEU 167 Cb -0.00 2.23 -0.00 0.00 -0.56 0.00 0.00 46.19 47.86 2klj s LEU 167 CO 0.01 -0.65 0.44 0.00 -1.06 0.00 0.00 176.35 175.09 2klj s ARG 168 N -2.53 1.80 -0.19 1.48 1.70 -0.69 0.98 118.95 121.50 2klj s ARG 168 Ca -0.00 -1.68 -0.22 0.00 -0.47 0.00 0.00 55.73 53.35 2klj s ARG 168 Cb -0.01 0.43 -0.02 0.00 -0.57 0.00 0.00 34.95 34.78 2klj s ARG 168 CO -0.04 -0.73 0.69 -0.98 -1.08 0.00 0.00 175.30 173.15 2klj s ARG 169 N -3.30 4.24 -0.06 3.89 1.70 -1.26 -1.03 118.95 123.13 2klj s ARG 169 Ca 0.30 0.74 -0.02 0.00 -0.47 0.00 0.00 55.73 56.28 2klj s ARG 169 Cb 0.00 -3.57 -0.07 0.00 -0.57 0.00 0.00 34.95 30.74 2klj s ARG 169 CO 0.18 -0.26 2.60 1.55 -1.08 0.00 0.00 175.30 178.30 2klj n VAL 170 N 4.68 2.50 -4.20 4.99 3.14 -0.56 -4.84 118.33 124.04 2klj n VAL 170 Ca 0.00 -1.10 -0.34 0.00 -2.96 0.00 0.00 64.34 59.94 2klj n VAL 170 Cb 0.49 -1.66 -0.13 0.00 -1.06 0.00 0.00 33.84 31.49 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 -0.02 3.73 -0.44 1.55 1.09 -1.26 -4.76 121.20 121.09 2klj s ILE 171 Ca 0.29 -0.40 0.10 0.00 -1.10 0.00 0.00 60.65 59.55 2klj s ILE 171 Cb 0.16 -2.66 -0.12 0.00 -1.06 0.00 0.00 42.46 38.77 2klj s ILE 171 CO -0.01 0.45 0.42 -0.67 -0.10 0.00 0.00 174.94 175.03 2klj n ASP 172 N 4.10 0.71 -0.07 3.58 2.03 -1.26 -4.60 116.55 121.04 2klj n ASP 172 Ca -0.17 -0.67 -0.13 0.00 0.52 0.00 0.00 54.79 54.34 2klj n ASP 172 Cb 0.52 1.05 -0.12 0.00 -0.72 0.00 0.00 41.12 41.85 2klj n ASP 172 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 2klj h PHE 173 N 0.00 0.00 0.00 -0.67 -1.00 -1.92 -3.42 116.94 109.94 2klj h PHE 173 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2klj h PHE 173 Cb 0.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.83 2klj h PHE 173 CO 0.00 0.93 0.00 -1.13 -1.61 0.00 0.00 178.31 176.50