#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 -1.75 3.08 1.08 0.00 -1.23 -4.44 105.19 101.93 2klj n GLY 2 Ca 0.00 -0.52 0.05 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.68 0.19 0.27 1.61 2.20 -1.26 -4.50 119.74 113.58 2klj s LYS 3 Ca 0.00 0.11 0.10 0.00 -0.36 0.00 0.00 55.97 55.83 2klj s LYS 3 Cb 0.00 0.07 -0.05 0.00 -1.51 0.00 0.00 37.83 36.33 2klj s LYS 3 CO 0.00 -0.33 -0.16 0.96 -0.36 0.00 0.00 175.35 175.46 2klj s ILE 4 N 2.72 2.20 -0.46 5.43 -0.00 -1.05 -0.99 121.20 129.06 2klj s ILE 4 Ca 0.24 -2.31 0.02 0.00 -0.00 0.00 0.00 60.65 58.61 2klj s ILE 4 Cb -0.01 -2.31 0.12 0.00 -0.00 0.00 0.00 42.46 40.26 2klj s ILE 4 CO -0.21 -0.40 0.20 -0.89 -0.00 0.00 0.00 174.94 173.64 2klj s THR 5 N -2.68 2.69 0.03 8.37 2.01 0.21 -1.47 115.64 124.80 2klj s THR 5 Ca 0.29 -2.81 -0.30 0.00 0.31 0.00 0.00 61.69 59.17 2klj s THR 5 Cb -0.02 -2.88 -0.05 0.00 0.01 0.00 0.00 72.50 69.55 2klj s THR 5 CO 0.13 -0.73 1.23 -0.76 -0.69 0.00 0.00 174.62 173.80 2klj s LEU 6 N 0.30 4.35 -0.15 4.42 1.43 0.16 -2.37 118.68 126.82 2klj s LEU 6 Ca 0.14 2.00 -0.00 0.00 -1.03 0.00 0.00 54.13 55.24 2klj s LEU 6 Cb -0.22 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2klj s LEU 6 CO -0.04 -0.53 -0.13 -0.31 0.23 0.00 0.00 176.35 175.57 2klj s TYR 7 N 1.45 2.81 0.23 0.29 1.51 0.33 0.40 117.35 124.36 2klj s TYR 7 Ca 0.59 -0.82 -0.07 0.00 -1.01 0.00 0.00 57.07 55.76 2klj s TYR 7 Cb -0.29 -1.88 0.28 0.00 -0.11 0.00 0.00 41.96 39.96 2klj s TYR 7 CO 0.27 -0.34 1.84 1.49 -1.11 0.00 0.00 175.55 177.70 2klj h GLU 8 N 7.04 0.84 -6.49 -0.62 4.81 0.22 0.36 114.58 120.75 2klj h GLU 8 Ca -0.29 -0.05 -0.66 0.00 -0.13 0.00 0.00 59.36 58.22 2klj h GLU 8 Cb 1.20 -0.19 -0.15 0.00 0.63 0.00 0.00 28.75 30.24 2klj h GLU 8 CO 0.56 0.56 -0.72 -0.51 -0.73 0.00 0.00 179.01 178.17 2klj s ASP 9 N -5.71 4.56 1.10 1.04 1.01 -0.99 -2.25 116.67 115.43 2klj s ASP 9 Ca -0.13 -0.32 -0.13 0.00 0.71 0.00 0.00 52.55 52.69 2klj s ASP 9 Cb 0.17 -0.94 0.20 0.00 1.01 0.00 0.00 42.92 43.36 2klj s ASP 9 CO 0.78 0.18 0.45 -2.11 0.21 0.00 0.00 175.17 174.68 2klj n ARG 10 N 0.73 -2.59 -1.66 8.23 1.85 -1.26 -1.51 116.66 120.45 2klj n ARG 10 Ca -0.13 -0.75 -0.09 0.00 -1.00 0.00 0.00 57.85 55.88 2klj n ARG 10 Cb 0.52 -1.13 -0.03 0.00 -1.05 0.00 0.00 32.46 30.78 2klj n ARG 10 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2klj n GLY 11 N -2.54 0.40 3.68 2.89 0.00 0.21 -0.06 105.19 109.77 2klj n GLY 11 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.11 -2.41 -3.38 1.61 3.72 -1.19 -4.99 117.46 108.72 2klj n PHE 12 Ca -0.09 0.94 0.00 0.00 -0.05 0.00 0.00 57.45 58.24 2klj n PHE 12 Cb 0.39 -4.62 0.00 0.00 -0.94 0.00 0.00 39.48 34.31 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 -4.62 1.87 0.00 -1.08 6.02 0.91 -5.00 117.38 115.48 2klj n GLN 13 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2klj n GLN 13 Cb 0.59 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.85 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 5.00 0.96 3.77 1.08 0.00 -1.26 -2.35 105.19 112.38 2klj n GLY 14 Ca 0.00 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 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 4.05 0.13 1.61 1.81 -1.26 -4.77 118.95 120.52 2klj s ARG 15 Ca 0.00 1.82 0.05 0.00 -1.72 0.00 0.00 55.73 55.88 2klj s ARG 15 Cb 0.00 -2.66 -0.04 0.00 -0.45 0.00 0.00 34.95 31.80 2klj s ARG 15 CO 0.00 -0.32 -0.11 -3.38 -0.68 0.00 0.00 175.30 170.80 2klj s HIS 16 N -1.43 1.28 -0.13 -0.53 -3.43 -1.26 0.76 115.29 110.56 2klj s HIS 16 Ca 0.57 -0.67 -0.09 0.00 -0.80 0.00 0.00 55.06 54.08 2klj s HIS 16 Cb -0.30 -0.66 0.04 0.00 -1.43 0.00 0.00 32.58 30.23 2klj s HIS 16 CO 0.38 0.10 0.32 -0.47 -2.00 0.00 0.00 174.74 173.07 2klj s TYR 17 N -2.77 -0.40 -0.25 0.38 5.04 0.16 -4.99 117.35 114.52 2klj s TYR 17 Ca 0.12 0.93 -0.09 0.00 -2.44 0.00 0.00 57.07 55.59 2klj s TYR 17 Cb -0.01 0.13 -0.04 0.00 0.35 0.00 0.00 41.96 42.39 2klj s TYR 17 CO 0.01 -0.22 0.13 -2.00 -1.34 0.00 0.00 175.55 172.14 2klj s GLU 18 N 0.72 3.90 -0.22 4.97 2.12 -1.26 0.39 118.70 129.31 2klj s GLU 18 Ca -0.04 -0.35 -0.02 0.00 0.36 0.00 0.00 54.97 54.91 2klj s GLU 18 Cb -0.06 -3.49 0.01 0.00 0.26 0.00 0.00 34.13 30.86 2klj s GLU 18 CO -0.05 -0.07 -0.07 0.00 -0.54 0.00 0.00 175.26 174.53 2klj n SER 20 N 4.72 2.25 -3.61 0.00 3.41 -1.26 -2.51 113.62 116.62 2klj n SER 20 Ca -0.18 -2.14 -0.09 0.00 -0.26 0.00 0.00 58.87 56.21 2klj n SER 20 Cb 0.49 -0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 2klj n SER 20 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2klj s SER 21 N -1.21 -0.02 0.27 4.04 0.01 -1.26 -4.66 113.70 110.87 2klj s SER 21 Ca 0.09 -0.93 -0.31 0.00 1.31 0.00 0.00 55.95 56.11 2klj s SER 21 Cb 0.06 0.71 -0.12 0.00 0.21 0.00 0.00 66.02 66.88 2klj s SER 21 CO 0.03 -1.36 1.53 -0.90 0.41 0.00 0.00 173.24 172.95 2klj n ASP 22 N -0.77 3.43 -3.92 2.44 5.75 -1.26 -4.42 116.55 117.80 2klj n ASP 22 Ca -0.04 1.14 -0.14 0.00 -0.01 0.00 0.00 54.79 55.74 2klj n ASP 22 Cb 0.60 -1.53 -0.14 0.00 -1.03 0.00 0.00 41.12 39.02 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 0.04 0.27 -0.06 2.11 2.46 0.87 -4.96 115.29 116.02 2klj s HIS 23 Ca 0.66 -0.06 0.11 0.00 0.47 0.00 0.00 55.06 56.25 2klj s HIS 23 Cb -0.56 -0.18 -0.17 0.00 -0.13 0.00 0.00 32.58 31.55 2klj s HIS 23 CO 0.48 -0.01 0.26 0.25 -2.47 0.00 0.00 174.74 173.26 2klj n THR 24 N 2.99 0.00 -3.68 0.89 -2.24 -1.26 -2.11 114.28 108.87 2klj n THR 24 Ca -0.13 -0.25 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 2klj n THR 24 Cb 0.59 0.32 -0.16 0.00 -2.10 0.00 0.00 70.33 68.98 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 -3.16 3.08 0.00 3.42 2.47 -1.22 -0.50 114.94 119.03 2klj s ASN 25 Ca -0.03 -0.98 0.25 0.00 0.42 0.00 0.00 52.86 52.51 2klj s ASN 25 Cb 0.07 -0.53 0.45 0.00 -1.45 0.00 0.00 41.25 39.80 2klj s ASN 25 CO 0.46 -0.35 1.38 0.18 -3.72 0.00 0.00 177.10 175.05 2klj n LEU 26 N 5.10 1.59 0.08 3.21 4.32 0.47 -4.31 117.00 127.45 2klj n LEU 26 Ca -0.07 -0.52 -0.13 0.00 -0.02 0.00 0.00 56.01 55.27 2klj n LEU 26 Cb 0.46 -0.06 -0.08 0.00 -1.62 0.00 0.00 43.42 42.12 2klj n LEU 26 CO 0.11 0.29 0.72 1.56 -1.22 0.00 0.00 177.39 178.85 2klj h GLN 27 N 2.02 -0.15 0.00 3.23 4.20 -1.71 1.07 115.11 123.77 2klj h GLN 27 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2klj h GLN 27 Cb 0.64 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.45 2klj h GLN 27 CO 0.00 0.07 0.00 -0.35 -0.67 0.00 0.00 178.83 177.88 2klj n PRO 28 N -5.07 0.05 0.00 1.46 -0.04 -1.26 -2.76 135.00 127.38 2klj n PRO 28 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2klj n PRO 28 Cb 0.17 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2klj n PRO 28 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2klj n TYR 29 N -0.69 0.00 -4.60 0.54 4.01 -0.99 -5.09 117.16 110.35 2klj n TYR 29 Ca 0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.50 2klj n TYR 29 Cb 0.00 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 38.87 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 -2.54 1.66 0.17 7.72 1.43 0.37 -4.67 118.68 122.81 2klj s LEU 30 Ca 0.00 -0.30 -0.08 0.00 -1.03 0.00 0.00 54.13 52.72 2klj s LEU 30 Cb 0.00 -0.84 0.05 0.00 0.03 0.00 0.00 46.19 45.43 2klj s LEU 30 CO 0.00 0.04 1.54 -1.28 0.23 0.00 0.00 176.35 176.88 2klj h SER 31 N 6.95 0.91 0.00 2.29 0.87 -1.80 -3.33 113.55 119.44 2klj h SER 31 Ca -0.31 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 59.87 2klj h SER 31 Cb 1.19 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 2klj h SER 31 CO 0.47 1.15 0.00 -2.11 -0.53 0.00 0.00 176.83 175.81 2klj n ARG 32 N -4.07 0.00 -2.25 2.24 1.85 -1.26 -4.84 116.66 108.32 2klj n ARG 32 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.82 2klj n ARG 32 Cb 0.50 -0.44 0.00 0.00 -1.05 0.00 0.00 32.46 31.47 2klj n ARG 32 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2klj n ASN 34 N -1.00 0.68 -3.85 0.00 4.05 0.12 -4.76 115.26 110.49 2klj n ASN 34 Ca 0.02 -0.48 -0.11 0.00 0.45 0.00 0.00 54.58 54.46 2klj n ASN 34 Cb 0.40 0.39 -0.09 0.00 1.23 0.00 0.00 39.78 41.71 2klj n ASN 34 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 2klj s SER 35 N -2.95 0.01 -0.13 1.20 1.04 -0.55 -0.03 113.70 112.30 2klj s SER 35 Ca 0.12 -0.24 -0.18 0.00 0.48 0.00 0.00 55.95 56.13 2klj s SER 35 Cb 0.17 0.25 0.04 0.00 0.10 0.00 0.00 66.02 66.58 2klj s SER 35 CO 0.72 -0.45 0.46 0.00 0.98 0.00 0.00 173.24 174.95 2klj s ALA 36 N -1.83 -1.15 -0.12 5.32 0.00 0.26 0.12 121.76 124.37 2klj s ALA 36 Ca -0.11 1.10 0.01 0.00 0.00 0.00 0.00 51.96 52.97 2klj s ALA 36 Cb -0.05 -0.50 0.02 0.00 0.00 0.00 0.00 23.12 22.59 2klj s ALA 36 CO -0.00 -0.25 -0.15 1.03 0.00 0.00 0.00 175.76 176.39 2klj s ARG 37 N -0.27 2.27 -0.12 0.00 0.52 -1.00 0.81 118.95 121.17 2klj s ARG 37 Ca -0.04 -0.57 -0.04 0.00 -0.52 0.00 0.00 55.73 54.56 2klj s ARG 37 Cb -0.03 -1.96 -0.03 0.00 0.52 0.00 0.00 34.95 33.44 2klj s ARG 37 CO 0.03 -0.10 0.02 0.08 0.02 0.00 0.00 175.30 175.35 2klj s VAL 38 N 1.08 4.43 -0.22 3.52 1.01 -0.35 0.63 120.40 130.51 2klj s VAL 38 Ca -0.04 -0.18 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 2klj s VAL 38 Cb -0.14 -2.92 -0.17 0.00 0.00 0.00 0.00 36.38 33.15 2klj s VAL 38 CO -0.03 0.55 0.07 -0.67 0.00 0.00 0.00 175.10 175.02 2klj n ASP 39 N 2.70 1.88 -3.15 3.32 -0.08 -0.16 -3.15 116.55 117.90 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 -0.00 0.00 2.34 0.00 0.00 41.12 43.06 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 -6.93 -0.61 0.00 1.67 0.15 -1.26 -4.86 113.70 101.86 2klj s SER 40 Ca -0.30 0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2klj s SER 40 Cb 0.08 1.39 0.00 0.00 -1.71 0.00 0.00 66.02 65.78 2klj s SER 40 CO 0.55 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.49 2klj n GLY 41 N 5.18 0.01 3.35 9.45 0.00 -1.26 -3.50 105.19 118.42 2klj n GLY 41 Ca 0.08 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 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 0.15 1.34 -0.05 0.00 0.52 0.11 -2.19 118.94 118.82 2klj s TRP 43 Ca -0.09 -0.39 0.05 0.00 0.02 0.00 0.00 56.10 55.69 2klj s TRP 43 Cb -0.15 -0.78 -0.00 0.00 -1.15 0.00 0.00 33.47 31.38 2klj s TRP 43 CO 0.05 0.06 -0.19 1.41 0.02 0.00 0.00 176.95 178.31 2klj s MET 44 N -1.36 1.97 0.15 4.98 1.75 -1.01 0.88 119.30 126.66 2klj s MET 44 Ca 0.02 -0.66 0.09 0.00 -1.25 0.00 0.00 55.69 53.88 2klj s MET 44 Cb -0.09 -1.68 -0.04 0.00 2.84 0.00 0.00 34.83 35.86 2klj s MET 44 CO 0.02 0.26 -0.12 -0.51 -0.65 0.00 0.00 175.02 174.01 2klj s LEU 45 N 0.04 2.90 -0.04 4.11 1.43 -0.96 -1.27 118.68 124.88 2klj s LEU 45 Ca -0.05 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.55 2klj s LEU 45 Cb -0.12 -1.65 -0.00 0.00 0.03 0.00 0.00 46.19 44.44 2klj s LEU 45 CO 0.03 0.14 -0.16 -0.31 0.23 0.00 0.00 176.35 176.27 2klj s TYR 46 N -1.46 1.66 0.58 0.29 1.51 0.25 -1.42 117.35 118.76 2klj s TYR 46 Ca 0.22 -0.49 0.27 0.00 -1.01 0.00 0.00 57.07 56.07 2klj s TYR 46 Cb -0.10 -1.13 1.64 0.00 -0.11 0.00 0.00 41.96 42.27 2klj s TYR 46 CO 0.13 -0.17 2.15 1.05 -1.11 0.00 0.00 175.55 177.60 2klj h GLU 47 N 6.32 0.00 -6.27 -0.62 4.11 -1.07 -1.50 114.58 115.55 2klj h GLU 47 Ca -0.32 0.00 -0.59 0.00 0.07 0.00 0.00 59.36 58.52 2klj h GLU 47 Cb 1.18 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.25 2klj h GLU 47 CO 0.48 0.00 -0.80 -0.65 0.07 0.00 0.00 179.01 178.11 2klj s GLN 48 N -4.71 1.42 0.98 1.06 -0.21 -1.22 -3.56 119.66 113.41 2klj s GLN 48 Ca -0.05 -1.49 -0.12 0.00 0.02 0.00 0.00 55.36 53.73 2klj s GLN 48 Cb 0.16 -1.60 0.18 0.00 1.00 0.00 0.00 33.01 32.74 2klj s GLN 48 CO 0.57 0.33 1.08 -1.25 -2.12 0.00 0.00 175.29 173.91 2klj s PRO 49 N -2.79 0.57 -1.43 2.91 0.04 -1.26 -3.71 135.00 129.33 2klj s PRO 49 Ca 0.19 0.93 -0.08 0.00 0.04 0.00 0.00 61.00 62.08 2klj s PRO 49 Cb -0.07 -1.72 0.01 0.00 0.04 0.00 0.00 34.50 32.77 2klj s PRO 49 CO 0.09 -2.74 1.00 0.09 0.04 0.00 0.00 177.00 175.47 2klj n ASN 50 N -4.24 -6.23 -3.60 6.66 5.03 0.35 -3.66 115.26 109.57 2klj n ASN 50 Ca 0.07 -0.47 -0.27 0.00 0.87 0.00 0.00 54.58 54.77 2klj n ASN 50 Cb 0.55 -4.94 0.01 0.00 -1.02 0.00 0.00 39.78 34.38 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 -4.84 -2.41 -3.36 3.10 4.01 -1.25 -4.99 117.16 107.42 2klj n TYR 51 Ca -0.03 0.99 -0.09 0.00 -0.16 0.00 0.00 57.90 58.61 2klj n TYR 51 Cb 0.58 -2.61 -0.08 0.00 -0.31 0.00 0.00 39.34 36.92 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 -2.47 0.21 0.00 7.72 0.15 -1.24 -5.10 113.70 112.97 2klj s SER 52 Ca 0.14 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.05 2klj s SER 52 Cb -0.02 1.13 0.00 0.00 -1.71 0.00 0.00 66.02 65.43 2klj s SER 52 CO 0.87 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.63 2klj n GLY 53 N 5.37 0.74 3.72 9.45 0.00 -1.26 -3.45 105.19 119.74 2klj n GLY 53 Ca -0.04 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 4.41 0.46 0.99 2.96 -1.26 -4.77 118.68 121.46 2klj s LEU 54 Ca 0.00 1.93 0.03 0.00 -0.22 0.00 0.00 54.13 55.87 2klj s LEU 54 Cb 0.00 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.08 2klj s LEU 54 CO 0.00 -0.33 0.03 0.00 -1.32 0.00 0.00 176.35 174.73 2klj s GLN 55 N 0.63 2.06 -0.03 1.98 0.00 -1.26 -0.71 119.66 122.33 2klj s GLN 55 Ca 0.54 -2.27 -0.01 0.00 -0.00 0.00 0.00 55.36 53.62 2klj s GLN 55 Cb -0.27 -1.32 0.03 0.00 0.00 0.00 0.00 33.01 31.45 2klj s GLN 55 CO 0.30 -0.31 0.06 0.71 0.00 0.00 0.00 175.29 176.05 2klj s TYR 56 N -2.94 0.00 -0.06 9.60 2.02 -0.51 -4.94 117.35 120.53 2klj s TYR 56 Ca 0.17 0.22 -0.29 0.00 -0.37 0.00 0.00 57.07 56.80 2klj s TYR 56 Cb 0.04 -0.27 -0.02 0.00 -0.40 0.00 0.00 41.96 41.30 2klj s TYR 56 CO 0.09 -0.13 0.96 0.12 -1.57 0.00 0.00 175.55 175.02 2klj s PHE 57 N 1.39 3.58 -0.02 2.71 5.36 -1.26 -2.27 117.98 127.47 2klj s PHE 57 Ca -0.05 1.60 0.07 0.00 -0.96 0.00 0.00 56.93 57.58 2klj s PHE 57 Cb -0.13 -3.11 -0.02 0.00 -0.34 0.00 0.00 43.02 39.42 2klj s PHE 57 CO -0.03 -0.10 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.90 2klj s LEU 58 N 1.44 2.04 0.10 6.12 1.02 0.26 -4.90 118.68 124.75 2klj s LEU 58 Ca 0.49 -0.41 0.02 0.00 0.02 0.00 0.00 54.13 54.25 2klj s LEU 58 Cb -0.19 -1.15 -0.04 0.00 0.02 0.00 0.00 46.19 44.82 2klj s LEU 58 CO 0.22 0.27 -0.08 -0.13 0.02 0.00 0.00 176.35 176.66 2klj s ARG 59 N -0.48 0.85 -0.17 1.70 0.52 -1.26 0.04 118.95 120.15 2klj s ARG 59 Ca 0.08 -1.29 -0.15 0.00 -0.52 0.00 0.00 55.73 53.84 2klj s ARG 59 Cb -0.09 -0.31 -0.07 0.00 0.52 0.00 0.00 34.95 35.00 2klj s ARG 59 CO -0.01 0.01 0.59 -2.13 0.02 0.00 0.00 175.30 173.79 2klj n ARG 60 N 0.11 0.00 0.00 3.54 0.63 -1.16 -4.80 116.66 114.98 2klj n ARG 60 Ca -0.13 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 2klj n ARG 60 Cb 0.60 -0.50 0.00 0.00 0.45 0.00 0.00 32.46 33.01 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 1.73 0.57 3.50 5.14 0.00 -1.19 -4.98 105.19 109.95 2klj n GLY 61 Ca 0.13 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 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 4.88 -0.29 1.61 -4.77 -1.26 -1.21 116.67 115.63 2klj s ASP 62 Ca 0.00 -0.13 0.02 0.00 -3.30 0.00 0.00 52.55 49.15 2klj s ASP 62 Cb 0.00 -1.81 0.08 0.00 -1.09 0.00 0.00 42.92 40.10 2klj s ASP 62 CO 0.00 0.15 -0.02 -0.31 0.70 0.00 0.00 175.17 175.69 2klj s TYR 63 N 0.50 3.07 -2.06 2.11 2.02 0.24 -4.95 117.35 118.27 2klj s TYR 63 Ca -0.02 -2.37 0.27 0.00 -0.37 0.00 0.00 57.07 54.58 2klj s TYR 63 Cb -0.14 -2.17 0.89 0.00 -0.40 0.00 0.00 41.96 40.14 2klj s TYR 63 CO 0.02 -0.88 1.65 0.00 -1.57 0.00 0.00 175.55 174.78 2klj n ALA 64 N 4.47 2.86 -2.89 3.71 0.00 -1.26 0.92 120.51 128.32 2klj n ALA 64 Ca -0.06 -0.42 -0.10 0.00 0.00 0.00 0.00 53.44 52.87 2klj n ALA 64 Cb 0.43 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 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 -2.29 -0.05 0.23 0.00 1.01 -1.06 0.64 116.67 115.14 2klj s ASP 65 Ca 0.30 -0.71 0.06 0.00 0.71 0.00 0.00 52.55 52.91 2klj s ASP 65 Cb 0.20 0.47 0.21 0.00 1.01 0.00 0.00 42.92 44.81 2klj s ASP 65 CO 0.44 -0.92 1.53 1.12 0.21 0.00 0.00 175.17 177.55 2klj h HIS 66 N 2.45 0.18 0.00 4.23 2.07 -0.75 -2.98 115.15 120.35 2klj h HIS 66 Ca -0.31 -0.08 -0.00 0.00 -2.85 0.00 0.00 60.37 57.13 2klj h HIS 66 Cb 1.24 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 31.19 2klj h HIS 66 CO 0.38 0.77 -0.02 -0.56 -3.07 0.00 0.00 177.93 175.44 2klj h GLN 67 N 0.09 0.00 -0.73 5.12 3.07 -1.86 1.05 115.11 121.86 2klj h GLN 67 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.70 2klj h GLN 67 Cb 1.21 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.74 2klj h GLN 67 CO 0.10 0.02 0.35 1.96 0.09 0.00 0.00 178.83 181.34 2klj h GLN 68 N 0.00 1.05 -0.78 0.06 4.20 -1.85 -2.29 115.11 115.50 2klj h GLN 68 Ca -0.00 -0.16 -0.10 0.00 0.06 0.00 0.00 58.65 58.45 2klj h GLN 68 Cb 0.03 -0.19 -0.06 0.00 0.30 0.00 0.00 27.48 27.56 2klj h GLN 68 CO 0.00 0.82 0.13 -2.67 -0.67 0.00 0.00 178.83 176.44 2klj n TRP 69 N -4.41 1.72 -0.99 2.96 2.14 -0.97 -4.82 117.44 113.07 2klj n TRP 69 Ca 0.06 -0.78 0.00 0.00 2.07 0.00 0.00 57.50 58.85 2klj n TRP 69 Cb 0.13 -0.50 0.00 0.00 -0.81 0.00 0.00 31.31 30.14 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 0.15 -0.50 -1.51 -2.67 2.81 -0.86 -4.50 117.12 110.04 2klj n MET 70 Ca 0.27 0.13 -0.49 0.00 -1.81 0.00 0.00 57.70 55.79 2klj n MET 70 Cb 1.06 -3.51 -0.06 0.00 -0.71 0.00 0.00 33.22 30.00 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 -1.92 0.70 0.14 3.03 0.00 0.36 -4.77 105.19 102.74 2klj n GLY 71 Ca 0.00 0.90 -0.22 0.00 0.00 0.00 0.00 46.02 46.70 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 12.37 0.72 -8.11 0.99 4.07 -1.91 -3.31 115.31 120.14 2klj h LEU 72 Ca -0.32 -0.89 -0.52 0.00 0.08 0.00 0.00 57.88 56.22 2klj h LEU 72 Cb 1.30 -0.23 -0.32 0.00 1.08 0.00 0.00 40.66 42.49 2klj h LEU 72 CO 1.00 1.55 -0.82 -0.55 -1.08 0.00 0.00 178.44 178.54 2klj s SER 73 N -7.30 1.88 0.00 -0.43 0.15 -1.26 -5.00 113.70 101.74 2klj s SER 73 Ca -0.11 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.23 2klj s SER 73 Cb 0.03 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 2klj s SER 73 CO 0.90 0.10 0.87 -0.67 1.20 0.00 0.00 173.24 175.64 2klj n ASP 74 N 3.36 0.14 -3.62 5.45 -0.08 -1.26 -4.30 116.55 116.24 2klj n ASP 74 Ca -0.19 -1.88 -0.41 0.00 -1.51 0.00 0.00 54.79 50.79 2klj n ASP 74 Cb 0.53 -0.07 -0.00 0.00 2.34 0.00 0.00 41.12 43.92 2klj n ASP 74 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2klj n SER 75 N -0.42 7.08 -4.51 1.67 3.41 -1.26 -4.16 113.62 115.43 2klj n SER 75 Ca 0.00 -3.16 -0.43 0.00 -0.26 0.00 0.00 58.87 55.02 2klj n SER 75 Cb 0.03 -1.39 -0.08 0.00 -0.26 0.00 0.00 64.21 62.52 2klj n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2klj s VAL 76 N -0.86 4.95 -0.68 -3.33 1.01 -1.17 -4.08 120.40 116.23 2klj s VAL 76 Ca 0.48 -0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.49 2klj s VAL 76 Cb 0.15 -4.11 0.09 0.00 0.00 0.00 0.00 36.38 32.51 2klj s VAL 76 CO -0.06 -0.48 0.85 0.54 0.00 0.00 0.00 175.10 175.95 2klj n ARG 77 N 5.95 0.91 -3.71 2.72 1.74 -0.60 -4.62 116.66 119.06 2klj n ARG 77 Ca -0.04 -1.19 -0.14 0.00 -0.77 0.00 0.00 57.85 55.71 2klj n ARG 77 Cb 0.48 -1.13 -0.09 0.00 -1.02 0.00 0.00 32.46 30.70 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 -0.68 -0.42 -0.14 0.55 0.15 -0.99 0.18 113.70 112.35 2klj s SER 78 Ca 0.09 0.66 -0.19 0.00 0.70 0.00 0.00 55.95 57.22 2klj s SER 78 Cb 0.06 0.71 0.05 0.00 -1.71 0.00 0.00 66.02 65.13 2klj s SER 78 CO 0.08 -0.29 0.49 0.00 1.20 0.00 0.00 173.24 174.72 2klj s ARG 80 N -0.21 1.13 -0.17 0.00 1.70 -0.40 -0.09 118.95 120.92 2klj s ARG 80 Ca -0.04 -1.58 -0.06 0.00 -0.47 0.00 0.00 55.73 53.58 2klj s ARG 80 Cb -0.03 0.13 -0.04 0.00 -0.57 0.00 0.00 34.95 34.44 2klj s ARG 80 CO 0.03 -0.31 0.02 -1.17 -1.08 0.00 0.00 175.30 172.79 2klj s LEU 81 N -3.15 3.59 -0.43 -1.89 2.96 -1.26 -2.40 118.68 116.10 2klj s LEU 81 Ca 0.33 0.01 -0.17 0.00 -0.22 0.00 0.00 54.13 54.07 2klj s LEU 81 Cb 0.07 -1.89 0.03 0.00 0.50 0.00 0.00 46.19 44.90 2klj s LEU 81 CO 0.08 0.18 0.43 -0.63 -1.32 0.00 0.00 176.35 175.09 2klj s ILE 82 N 0.30 5.11 0.81 6.68 1.01 -0.93 -4.83 121.20 129.34 2klj s ILE 82 Ca 0.01 -0.46 -0.15 0.00 0.00 0.00 0.00 60.65 60.04 2klj s ILE 82 Cb -0.13 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 2klj s ILE 82 CO 0.01 -0.45 0.40 -2.65 0.00 0.00 0.00 174.94 172.25 2klj n PRO 83 N 5.55 0.07 0.00 2.79 -0.02 -1.26 -4.48 135.00 137.65 2klj n PRO 83 Ca -0.08 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2klj n PRO 83 Cb 0.47 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 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 -2.79 0.00 0.00 6.00 8.25 -1.26 -4.00 115.22 121.41 2klj n HIS 84 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2klj n HIS 84 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 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 -0.10 0.41 7.64 0.58 -3.95 113.62 118.20 2klj n SER 85 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 2klj n SER 85 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 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 -1.50 -2.35 0.23 0.00 -1.88 -3.42 103.07 94.15 2klj h GLY 86 Ca 0.00 0.81 -0.46 0.00 0.00 0.00 0.00 47.33 47.68 2klj h GLY 86 CO 0.00 -0.42 -0.13 -0.56 0.00 0.00 0.00 176.54 175.43 2klj s SER 87 N -4.02 5.90 -0.07 0.19 0.01 -1.26 -4.81 113.70 109.65 2klj s SER 87 Ca -0.07 0.25 -0.00 0.00 1.31 0.00 0.00 55.95 57.44 2klj s SER 87 Cb 0.05 -1.56 0.02 0.00 0.21 0.00 0.00 66.02 64.75 2klj s SER 87 CO 0.33 -0.62 -0.03 -1.00 0.41 0.00 0.00 173.24 172.32 2klj s HIS 88 N -2.49 0.87 -0.20 2.43 0.09 -1.26 -4.30 115.29 110.44 2klj s HIS 88 Ca 0.47 -0.30 -0.13 0.00 -0.00 0.00 0.00 55.06 55.10 2klj s HIS 88 Cb -0.10 -0.84 0.06 0.00 -0.00 0.00 0.00 32.58 31.70 2klj s HIS 88 CO 0.37 -0.31 0.50 0.50 -0.00 0.00 0.00 174.74 175.80 2klj s ARG 89 N 1.49 0.51 -0.03 1.40 3.52 -1.26 -4.27 118.95 120.31 2klj s ARG 89 Ca -0.02 0.89 -0.04 0.00 -0.13 0.00 0.00 55.73 56.43 2klj s ARG 89 Cb -0.13 0.08 0.01 0.00 -1.56 0.00 0.00 34.95 33.35 2klj s ARG 89 CO -0.03 -0.14 0.11 -1.50 -0.81 0.00 0.00 175.30 172.92 2klj s ILE 90 N 1.24 0.02 -0.35 4.11 2.07 -0.25 -2.64 121.20 125.40 2klj s ILE 90 Ca -0.08 -0.17 0.02 0.00 -1.41 0.00 0.00 60.65 59.01 2klj s ILE 90 Cb -0.07 -0.21 0.10 0.00 0.13 0.00 0.00 42.46 42.41 2klj s ILE 90 CO -0.12 -0.09 0.08 -0.13 -1.91 0.00 0.00 174.94 172.77 2klj s ARG 91 N -0.27 1.64 0.31 3.50 0.52 -0.42 -0.64 118.95 123.60 2klj s ARG 91 Ca -0.03 -1.85 -0.25 0.00 -0.52 0.00 0.00 55.73 53.08 2klj s ARG 91 Cb -0.02 -3.29 -0.10 0.00 0.52 0.00 0.00 34.95 32.05 2klj s ARG 91 CO 0.00 -0.96 0.91 -0.51 0.02 0.00 0.00 175.30 174.76 2klj s LEU 92 N 0.97 4.31 -0.03 2.53 1.43 -0.88 -0.40 118.68 126.61 2klj s LEU 92 Ca 0.10 1.76 0.07 0.00 -1.03 0.00 0.00 54.13 55.03 2klj s LEU 92 Cb -0.20 -3.98 -0.02 0.00 0.03 0.00 0.00 46.19 42.02 2klj s LEU 92 CO -0.07 -0.07 -0.24 -0.31 0.23 0.00 0.00 176.35 175.89 2klj s TYR 93 N -1.64 2.22 0.00 0.29 1.51 0.30 -2.13 117.35 117.90 2klj s TYR 93 Ca 0.50 -0.47 0.00 0.00 -1.01 0.00 0.00 57.07 56.09 2klj s TYR 93 Cb -0.18 -1.44 0.00 0.00 -0.11 0.00 0.00 41.96 40.24 2klj s TYR 93 CO 0.23 -0.07 0.98 -1.91 -1.11 0.00 0.00 175.55 173.66 2klj n GLU 94 N 2.58 0.00 -2.89 -0.62 2.13 0.15 -1.96 120.64 120.03 2klj n GLU 94 Ca -0.16 0.54 -0.20 0.00 0.66 0.00 0.00 57.16 58.00 2klj n GLU 94 Cb 0.52 -1.48 0.05 0.00 0.27 0.00 0.00 31.44 30.80 2klj n GLU 94 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2klj s ARG 95 N -2.92 2.34 0.80 5.31 1.70 -1.26 -1.29 118.95 123.63 2klj s ARG 95 Ca 0.00 -1.33 -0.14 0.00 -0.47 0.00 0.00 55.73 53.79 2klj s ARG 95 Cb 0.00 -2.59 0.03 0.00 -0.57 0.00 0.00 34.95 31.82 2klj s ARG 95 CO 0.00 -0.81 0.85 0.39 -1.08 0.00 0.00 175.30 174.65 2klj n GLU 96 N -2.27 0.17 0.00 3.89 1.02 -1.19 -4.37 120.64 117.89 2klj n GLU 96 Ca 0.13 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2klj n GLU 96 Cb 0.60 -2.14 0.00 0.00 -0.02 0.00 0.00 31.44 29.88 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 -1.91 0.00 -2.69 1.62 8.00 -0.33 -3.61 116.55 117.63 2klj n ASP 97 Ca 0.11 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.56 2klj n ASP 97 Cb 0.51 0.00 0.12 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 7.18 -2.03 0.51 1.24 4.01 -1.26 -4.82 117.16 121.99 2klj n TYR 98 Ca 0.00 -1.93 0.07 0.00 -0.16 0.00 0.00 57.90 55.88 2klj n TYR 98 Cb 0.00 1.42 -0.09 0.00 -0.31 0.00 0.00 39.34 40.36 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 -0.83 1.71 -1.12 -0.72 3.00 -1.24 -5.00 116.66 112.45 2klj n ARG 99 Ca -0.06 -0.04 -0.03 0.00 -0.01 0.00 0.00 57.85 57.71 2klj n ARG 99 Cb 0.86 -1.24 0.01 0.00 0.00 0.00 0.00 32.46 32.09 2klj n ARG 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2klj n GLY 100 N 1.42 1.45 3.76 -0.13 0.00 -1.26 -4.99 105.19 105.44 2klj n GLY 100 Ca 0.01 -2.07 -0.36 0.00 0.00 0.00 0.00 46.02 43.60 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 -2.54 3.38 -0.02 1.61 2.00 -1.26 -4.64 119.66 118.19 2klj s GLN 101 Ca 0.09 1.79 0.03 0.00 -2.00 0.00 0.00 55.36 55.27 2klj s GLN 101 Cb -0.01 -2.15 -0.00 0.00 0.80 0.00 0.00 33.01 31.65 2klj s GLN 101 CO 0.06 -0.87 -0.10 1.41 -0.50 0.00 0.00 175.29 175.28 2klj s MET 102 N -3.05 0.99 -0.02 1.67 -2.45 -1.26 0.32 119.30 115.51 2klj s MET 102 Ca 0.71 -0.35 0.02 0.00 -1.25 0.00 0.00 55.69 54.81 2klj s MET 102 Cb -0.29 -0.93 0.00 0.00 1.25 0.00 0.00 34.83 34.86 2klj s MET 102 CO 0.33 0.16 -0.06 -1.50 1.05 0.00 0.00 175.02 175.01 2klj s ILE 103 N 0.03 0.51 0.09 10.11 2.07 -0.90 -5.01 121.20 128.10 2klj s ILE 103 Ca -0.01 -0.22 0.01 0.00 -1.41 0.00 0.00 60.65 59.03 2klj s ILE 103 Cb -0.07 -0.47 -0.04 0.00 0.13 0.00 0.00 42.46 42.01 2klj s ILE 103 CO 0.00 0.17 0.21 -0.70 -1.91 0.00 0.00 174.94 172.71 2klj s GLU 104 N 0.21 3.34 -0.03 3.50 2.12 -1.26 -2.07 118.70 124.50 2klj s GLU 104 Ca -0.02 -0.54 0.02 0.00 0.36 0.00 0.00 54.97 54.78 2klj s GLU 104 Cb -0.07 -2.96 0.01 0.00 0.26 0.00 0.00 34.13 31.38 2klj s GLU 104 CO -0.00 0.57 -0.06 -0.06 -0.54 0.00 0.00 175.26 175.17 2klj s PHE 105 N -1.57 0.75 -0.02 5.30 0.08 0.19 -4.98 117.98 117.72 2klj s PHE 105 Ca 0.34 -0.19 0.04 0.00 0.12 0.00 0.00 56.93 57.24 2klj s PHE 105 Cb -0.12 -0.60 0.06 0.00 -0.57 0.00 0.00 43.02 41.79 2klj s PHE 105 CO 0.27 -0.13 0.91 0.25 -0.10 0.00 0.00 175.22 176.43 2klj n THR 106 N 3.61 0.85 -3.67 0.64 -2.24 -1.26 -1.09 114.28 111.12 2klj n THR 106 Ca -0.21 -0.92 -0.07 0.00 -2.27 0.00 0.00 64.05 60.58 2klj n THR 106 Cb 0.53 0.47 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 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 -0.52 0.46 -2.19 -0.78 0.28 -1.26 -4.73 120.64 111.90 2klj n GLU 107 Ca 0.03 -1.36 -0.41 0.00 -0.16 0.00 0.00 57.16 55.26 2klj n GLU 107 Cb 0.42 1.44 -0.03 0.00 1.43 0.00 0.00 31.44 34.71 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 -2.13 6.87 -0.62 -1.84 -4.77 -1.26 -4.59 116.67 108.33 2klj s ASP 108 Ca 0.13 2.50 0.04 0.00 -3.30 0.00 0.00 52.55 51.92 2klj s ASP 108 Cb -0.01 -2.62 0.16 0.00 -1.09 0.00 0.00 42.92 39.35 2klj s ASP 108 CO 0.09 -0.51 0.41 0.00 0.70 0.00 0.00 175.17 175.86 2klj n SER 110 N 2.41 0.76 -2.73 0.00 3.41 -1.26 0.39 113.62 116.60 2klj n SER 110 Ca 0.16 -1.87 -0.06 0.00 -0.26 0.00 0.00 58.87 56.85 2klj n SER 110 Cb 0.35 -0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.26 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 4.10 0.73 -0.25 0.00 6.46 -1.32 -1.91 115.31 123.12 2klj h LEU 112 Ca -0.10 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 2klj h LEU 112 Cb 1.09 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.88 2klj h LEU 112 CO 0.12 0.49 0.43 0.00 -0.62 0.00 0.00 178.44 178.86 2klj n GLN 113 N -4.67 0.03 0.01 1.25 3.00 -1.25 0.27 117.38 116.02 2klj n GLN 113 Ca 0.08 0.35 0.04 0.00 -0.01 0.00 0.00 57.00 57.46 2klj n GLN 113 Cb 0.11 -2.03 -0.10 0.00 0.00 0.00 0.00 30.24 28.22 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 -1.56 0.47 -0.13 1.08 8.00 -0.72 -4.52 116.55 119.18 2klj n ASP 114 Ca -0.00 0.20 -0.19 0.00 0.71 0.00 0.00 54.79 55.51 2klj n ASP 114 Cb 0.44 0.87 -0.12 0.00 -0.02 0.00 0.00 41.12 42.29 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 -2.65 0.65 -4.47 -1.24 5.12 0.75 -5.01 116.66 109.81 2klj n ARG 115 Ca -0.10 0.16 -0.21 0.00 -1.93 0.00 0.00 57.85 55.76 2klj n ARG 115 Cb 0.76 -1.52 -0.14 0.00 -1.16 0.00 0.00 32.46 30.41 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 -2.52 1.28 0.00 -1.55 -0.71 -0.07 -5.10 117.98 109.31 2klj s PHE 116 Ca -0.35 -0.32 0.00 0.00 -1.04 0.00 0.00 56.93 55.22 2klj s PHE 116 Cb 0.09 -0.78 0.00 0.00 -1.21 0.00 0.00 43.02 41.12 2klj s PHE 116 CO 0.59 0.02 0.15 0.54 -1.34 0.00 0.00 175.22 175.19 2klj n ARG 117 N 2.16 0.00 -1.43 1.99 1.74 -1.26 -4.32 116.66 115.54 2klj n ARG 117 Ca -0.17 0.00 -0.50 0.00 -0.77 0.00 0.00 57.85 56.41 2klj n ARG 117 Cb 0.55 -0.63 -0.04 0.00 -1.02 0.00 0.00 32.46 31.32 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 -0.46 -0.15 0.67 -1.55 -1.74 -1.26 -4.84 117.46 108.13 2klj n PHE 118 Ca 0.00 0.97 0.12 0.00 -0.56 0.00 0.00 57.45 57.98 2klj n PHE 118 Cb 0.00 -2.00 0.24 0.00 1.52 0.00 0.00 39.48 39.23 2klj n PHE 118 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 2klj n ASN 119 N 1.87 2.97 -4.26 5.98 3.02 -1.26 -4.85 115.26 118.73 2klj n ASN 119 Ca 0.18 -1.92 -0.37 0.00 -0.03 0.00 0.00 54.58 52.44 2klj n ASN 119 Cb 0.22 -0.16 -0.13 0.00 -0.61 0.00 0.00 39.78 39.09 2klj n ASN 119 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2klj s GLU 120 N -1.67 2.70 -0.35 3.52 2.02 -1.26 -0.23 118.70 123.43 2klj s GLU 120 Ca 0.35 -1.11 -0.12 0.00 0.02 0.00 0.00 54.97 54.12 2klj s GLU 120 Cb 0.21 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 31.09 2klj s GLU 120 CO 0.30 -0.59 0.21 0.42 0.02 0.00 0.00 175.26 175.63 2klj s ILE 121 N 1.39 4.87 -0.41 -1.63 -1.09 -1.11 -4.49 121.20 118.73 2klj s ILE 121 Ca -0.01 -0.51 0.05 0.00 -2.23 0.00 0.00 60.65 57.95 2klj s ILE 121 Cb -0.19 -3.58 0.44 0.00 -1.58 0.00 0.00 42.46 37.55 2klj s ILE 121 CO 0.01 -0.08 1.29 1.41 -1.23 0.00 0.00 174.94 176.34 2klj n HIS 122 N 5.04 3.05 0.00 3.97 8.25 -0.41 -4.49 115.22 130.64 2klj n HIS 122 Ca -0.13 -2.63 0.00 0.00 -0.26 0.00 0.00 57.72 54.70 2klj n HIS 122 Cb 0.48 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.63 0.00 -3.55 0.41 7.64 -1.23 -2.93 113.62 113.34 2klj n SER 123 Ca 0.44 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 60.17 2klj n SER 123 Cb 0.78 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.93 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 -0.27 -0.30 -3.43 0.05 -1.04 0.11 118.68 113.80 2klj s LEU 124 Ca 0.00 0.33 0.02 0.00 0.05 0.00 0.00 54.13 54.52 2klj s LEU 124 Cb 0.00 2.27 0.09 0.00 -2.05 0.00 0.00 46.19 46.50 2klj s LEU 124 CO 0.00 -0.70 0.04 0.21 -0.55 0.00 0.00 176.35 175.35 2klj s ASN 125 N -1.78 4.28 -0.46 1.48 2.47 0.46 -1.08 114.94 120.32 2klj s ASN 125 Ca -0.07 -1.72 -0.22 0.00 0.42 0.00 0.00 52.86 51.28 2klj s ASN 125 Cb -0.01 -1.26 0.03 0.00 -1.45 0.00 0.00 41.25 38.56 2klj s ASN 125 CO 0.01 -0.35 0.72 -0.69 -3.72 0.00 0.00 177.10 173.07 2klj s VAL 126 N 1.27 4.73 -0.16 -5.21 1.01 -0.86 -1.30 120.40 119.87 2klj s VAL 126 Ca 0.06 0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.98 2klj s VAL 126 Cb -0.18 -4.28 -0.20 0.00 0.00 0.00 0.00 36.38 31.71 2klj s VAL 126 CO -0.13 -0.70 0.47 -0.07 0.00 0.00 0.00 175.10 174.67 2klj h LEU 127 N 9.95 0.00 0.00 3.92 -0.00 -1.77 -2.28 115.31 125.13 2klj h LEU 127 Ca -0.25 -0.70 0.00 0.00 -0.00 0.00 0.00 57.88 56.92 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 0.94 1.11 0.00 -0.62 -0.00 0.00 0.00 178.44 179.87 2klj n GLU 128 N -4.56 3.23 0.00 1.13 -0.58 -1.20 -4.88 120.64 113.78 2klj n GLU 128 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2klj n GLU 128 Cb 0.50 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.37 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 -3.00 3.39 0.62 0.00 -1.25 -4.52 105.19 105.42 2klj n GLY 129 Ca 0.00 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.26 2klj n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2klj s SER 130 N -1.99 2.56 0.37 1.61 1.04 -1.26 -3.44 113.70 112.59 2klj s SER 130 Ca 0.00 -1.15 0.04 0.00 0.48 0.00 0.00 55.95 55.32 2klj s SER 130 Cb 0.00 -0.13 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 2klj s SER 130 CO 0.00 -0.32 0.13 0.26 0.98 0.00 0.00 173.24 174.29 2klj s TRP 131 N -3.07 1.77 -0.02 5.02 0.52 -0.88 -0.03 118.94 122.24 2klj s TRP 131 Ca 0.27 -1.27 0.01 0.00 0.02 0.00 0.00 56.10 55.14 2klj s TRP 131 Cb 0.03 -1.09 0.01 0.00 -1.15 0.00 0.00 33.47 31.27 2klj s TRP 131 CO 0.10 -0.32 -0.04 0.08 0.02 0.00 0.00 176.95 176.79 2klj s VAL 132 N -3.33 0.39 -0.05 4.03 1.01 0.39 -1.99 120.40 120.86 2klj s VAL 132 Ca 0.29 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.15 2klj s VAL 132 Cb 0.04 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2klj s VAL 132 CO 0.16 0.16 0.02 -0.76 0.00 0.00 0.00 175.10 174.68 2klj s LEU 133 N 0.49 3.66 -0.07 3.92 1.43 -0.60 -1.57 118.68 125.95 2klj s LEU 133 Ca -0.06 0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.21 2klj s LEU 133 Cb -0.09 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 2klj s LEU 133 CO -0.00 0.33 -0.24 -0.31 0.23 0.00 0.00 176.35 176.36 2klj s TYR 134 N -1.01 2.48 -0.45 0.29 2.02 0.21 -0.03 117.35 120.85 2klj s TYR 134 Ca 0.17 -0.76 0.14 0.00 -0.37 0.00 0.00 57.07 56.25 2klj s TYR 134 Cb -0.12 -1.63 0.75 0.00 -0.40 0.00 0.00 41.96 40.57 2klj s TYR 134 CO 0.07 -0.24 1.41 -1.91 -1.57 0.00 0.00 175.55 173.31 2klj n GLU 135 N 3.04 0.09 -0.73 -0.62 2.13 -0.90 0.76 120.64 124.40 2klj n GLU 135 Ca -0.18 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.22 2klj n GLU 135 Cb 0.52 -1.81 0.00 0.00 0.27 0.00 0.00 31.44 30.42 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 -1.98 0.00 -4.96 4.31 -0.00 -1.26 -3.85 117.00 109.27 2klj n LEU 136 Ca -0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.78 2klj n LEU 136 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.45 2klj n LEU 136 CO 0.06 0.00 0.08 -0.44 -0.00 0.00 0.00 177.39 177.09 2klj s SER 137 N 0.27 6.29 -0.86 1.45 0.01 -1.26 -0.96 113.70 118.63 2klj s SER 137 Ca 0.00 0.27 -0.04 0.00 1.31 0.00 0.00 55.95 57.49 2klj s SER 137 Cb 0.00 -1.93 0.04 0.00 0.21 0.00 0.00 66.02 64.34 2klj s SER 137 CO 0.00 -0.21 0.18 0.59 0.41 0.00 0.00 173.24 174.21 2klj n ASN 138 N -1.63 -2.84 -3.57 2.44 3.02 0.99 -2.73 115.26 110.94 2klj n ASN 138 Ca -0.06 0.02 -0.21 0.00 -0.03 0.00 0.00 54.58 54.29 2klj n ASN 138 Cb 0.57 -2.44 0.01 0.00 -0.61 0.00 0.00 39.78 37.31 2klj n ASN 138 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2klj n TYR 139 N -3.33 -2.38 -1.78 3.10 4.01 -1.26 -4.92 117.16 110.59 2klj n TYR 139 Ca -0.05 0.96 -0.00 0.00 -0.16 0.00 0.00 57.90 58.65 2klj n TYR 139 Cb 0.55 -2.93 0.15 0.00 -0.31 0.00 0.00 39.34 36.80 2klj n TYR 139 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2klj n ARG 140 N -1.99 1.89 0.00 -0.72 5.12 -1.11 -5.03 116.66 114.82 2klj n ARG 140 Ca -0.21 -3.39 0.00 0.00 -1.93 0.00 0.00 57.85 52.32 2klj n ARG 140 Cb 0.65 -1.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.32 2klj n ARG 140 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2klj n GLY 141 N -0.90 2.82 3.93 -0.13 0.00 -1.26 -4.94 105.19 104.72 2klj n GLY 141 Ca 0.23 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 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 4.17 2.20 -0.06 1.61 1.81 -1.26 -4.91 118.95 122.52 2klj s ARG 142 Ca 0.00 -0.30 -0.11 0.00 -1.72 0.00 0.00 55.73 53.60 2klj s ARG 142 Cb 0.00 -2.19 0.02 0.00 -0.45 0.00 0.00 34.95 32.33 2klj s ARG 142 CO 0.00 -1.22 0.26 1.14 -0.68 0.00 0.00 175.30 174.80 2klj s GLN 143 N -5.22 0.45 0.31 3.54 0.00 -1.26 -2.12 119.66 115.36 2klj s GLN 143 Ca 0.60 0.07 0.10 0.00 -0.00 0.00 0.00 55.36 56.14 2klj s GLN 143 Cb -0.11 0.20 -0.06 0.00 0.00 0.00 0.00 33.01 33.05 2klj s GLN 143 CO 0.44 -0.09 -0.14 0.71 0.00 0.00 0.00 175.29 176.21 2klj s TYR 144 N -0.56 2.32 -0.08 9.60 1.51 0.95 -4.94 117.35 126.15 2klj s TYR 144 Ca -0.07 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 2klj s TYR 144 Cb -0.04 -1.18 0.01 0.00 -0.11 0.00 0.00 41.96 40.63 2klj s TYR 144 CO 0.02 0.63 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.73 2klj s LEU 145 N -3.55 1.91 -0.30 -1.29 0.20 -1.26 -1.55 118.68 112.83 2klj s LEU 145 Ca 0.31 -0.45 0.01 0.00 0.69 0.00 0.00 54.13 54.69 2klj s LEU 145 Cb -0.01 -1.16 0.07 0.00 -0.43 0.00 0.00 46.19 44.65 2klj s LEU 145 CO 0.15 0.11 -0.01 -0.76 -0.29 0.00 0.00 176.35 175.55 2klj s LEU 146 N 0.46 4.00 0.79 -0.68 2.01 -0.84 -4.96 118.68 119.47 2klj s LEU 146 Ca -0.17 -1.52 -0.12 0.00 0.01 0.00 0.00 54.13 52.34 2klj s LEU 146 Cb -0.17 -1.66 0.07 0.00 0.01 0.00 0.00 46.19 44.44 2klj s LEU 146 CO 0.07 -0.28 1.10 -0.04 1.01 0.00 0.00 176.35 178.21 2klj s MET 147 N 1.14 2.11 -0.13 1.70 -1.94 -1.26 -2.08 119.30 118.84 2klj s MET 147 Ca -0.03 0.59 -0.29 0.00 -1.71 0.00 0.00 55.69 54.25 2klj s MET 147 Cb -0.20 -1.93 -0.07 0.00 2.01 0.00 0.00 34.83 34.64 2klj s MET 147 CO -0.04 -1.59 2.12 -0.35 -0.01 0.00 0.00 175.02 175.16 2klj n PRO 148 N -3.40 2.24 -1.01 2.03 -0.04 -1.22 -4.75 135.00 128.84 2klj n PRO 148 Ca 0.07 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 2klj n PRO 148 Cb 0.57 -3.10 0.00 0.00 -0.04 0.00 0.00 33.50 30.93 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 5.33 -0.67 3.02 0.55 0.00 -0.86 -5.01 105.19 107.56 2klj n GLY 149 Ca 0.27 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.00 1.61 -0.06 1.61 -1.08 -1.26 -2.04 116.67 111.45 2klj s ASP 150 Ca 0.00 -0.26 0.05 0.00 -0.52 0.00 0.00 52.55 51.82 2klj s ASP 150 Cb 0.00 -0.63 -0.01 0.00 -1.46 0.00 0.00 42.92 40.82 2klj s ASP 150 CO 0.00 0.05 -0.23 -0.31 0.52 0.00 0.00 175.17 175.20 2klj s TYR 151 N 0.48 2.29 -1.41 -5.34 1.51 -0.24 -5.01 117.35 109.63 2klj s TYR 151 Ca -0.10 -0.72 0.12 0.00 -1.01 0.00 0.00 57.07 55.36 2klj s TYR 151 Cb -0.13 -1.51 0.15 0.00 -0.11 0.00 0.00 41.96 40.35 2klj s TYR 151 CO 0.02 -0.23 0.97 0.54 -1.11 0.00 0.00 175.55 175.74 2klj n ARG 152 N 3.07 1.15 -3.79 -0.62 5.12 -1.26 -2.48 116.66 117.86 2klj n ARG 152 Ca -0.18 -1.41 -0.02 0.00 -1.93 0.00 0.00 57.85 54.30 2klj n ARG 152 Cb 0.52 -1.25 -0.00 0.00 -1.16 0.00 0.00 32.46 30.58 2klj n ARG 152 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 2klj s ARG 153 N -1.01 1.09 0.30 5.56 1.70 -1.15 -1.18 118.95 124.26 2klj s ARG 153 Ca 0.17 -0.65 0.16 0.00 -0.47 0.00 0.00 55.73 54.94 2klj s ARG 153 Cb 0.11 0.34 0.27 0.00 -0.57 0.00 0.00 34.95 35.10 2klj s ARG 153 CO 0.16 -0.51 1.54 0.10 -1.08 0.00 0.00 175.30 175.51 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.79 -3.18 116.97 119.90 2klj h TYR 154 Ca -0.26 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 0.74 0.49 -0.23 1.96 -0.00 0.00 0.00 178.16 181.12 2klj h GLN 155 N 0.00 0.00 -0.72 0.10 4.20 -1.90 -3.05 115.11 113.74 2klj h GLN 155 Ca -0.00 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.85 2klj h GLN 155 Cb 1.24 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.92 2klj h GLN 155 CO 0.06 0.23 0.24 -0.44 -0.67 0.00 0.00 178.83 178.25 2klj h ASP 156 N 0.00 0.16 -0.52 1.46 3.32 -1.92 0.71 116.42 119.64 2klj h ASP 156 Ca -0.00 0.12 -0.21 0.00 0.02 0.00 0.00 57.03 56.96 2klj h ASP 156 Cb 0.71 0.13 -0.12 0.00 0.22 0.00 0.00 39.33 40.26 2klj h ASP 156 CO 0.03 0.05 0.26 -2.67 -1.72 0.00 0.00 179.24 175.19 2klj n TRP 157 N -5.06 1.67 -3.40 4.55 2.14 -1.20 -4.91 117.44 111.22 2klj n TRP 157 Ca 0.13 -1.01 -0.12 0.00 2.07 0.00 0.00 57.50 58.58 2klj n TRP 157 Cb 0.41 -0.56 0.00 0.00 -0.81 0.00 0.00 31.31 30.35 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 -0.19 -1.27 3.13 -1.67 0.00 0.25 -4.89 105.19 100.55 2klj n GLY 158 Ca 0.30 0.54 -0.25 0.00 0.00 0.00 0.00 46.02 46.61 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 -2.98 1.43 0.39 4.61 0.00 -1.16 -5.02 121.76 119.04 2klj s ALA 159 Ca 0.00 -0.67 0.12 0.00 0.00 0.00 0.00 51.96 51.41 2klj s ALA 159 Cb -0.00 -0.44 0.81 0.00 0.00 0.00 0.00 23.12 23.48 2klj s ALA 159 CO 0.82 0.29 1.89 0.00 0.00 0.00 0.00 175.76 178.76 2klj h THR 160 N 5.09 1.21 -2.09 0.00 1.03 -1.95 -3.39 112.91 112.82 2klj h THR 160 Ca -0.34 -0.98 -0.01 0.00 -0.01 0.00 0.00 66.41 65.07 2klj h THR 160 Cb 1.17 1.48 -0.00 0.00 -1.07 0.00 0.00 68.15 69.72 2klj h THR 160 CO 0.48 0.29 -0.01 0.59 -0.01 0.00 0.00 175.52 176.85 2klj n ASN 161 N -4.20 -0.04 -0.00 0.00 5.03 -1.26 -5.07 115.26 109.72 2klj n ASN 161 Ca -0.02 -1.07 0.03 0.00 0.87 0.00 0.00 54.58 54.39 2klj n ASN 161 Cb 0.33 0.07 -0.04 0.00 -1.02 0.00 0.00 39.78 39.12 2klj n ASN 161 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2klj n ALA 162 N -2.92 2.58 -1.34 5.41 0.00 -1.26 -4.88 120.51 118.10 2klj n ALA 162 Ca -0.00 -0.17 -0.54 0.00 0.00 0.00 0.00 53.44 52.73 2klj n ALA 162 Cb 0.02 -0.22 -0.12 0.00 0.00 0.00 0.00 19.45 19.13 2klj n ALA 162 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2klj n ARG 163 N -1.37 0.08 -5.17 0.00 1.85 -1.24 -2.74 116.66 108.06 2klj n ARG 163 Ca 0.00 0.02 -0.32 0.00 -1.00 0.00 0.00 57.85 56.55 2klj n ARG 163 Cb 0.12 -1.59 -0.16 0.00 -1.05 0.00 0.00 32.46 29.78 2klj n ARG 163 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2klj s VAL 164 N 7.04 2.21 -0.11 8.89 1.01 0.68 -4.42 120.40 135.70 2klj s VAL 164 Ca 1.24 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 62.32 2klj s VAL 164 Cb -1.37 -1.84 -0.13 0.00 0.00 0.00 0.00 36.38 33.04 2klj s VAL 164 CO 0.60 0.56 0.02 0.61 0.00 0.00 0.00 175.10 176.89 2klj n GLY 165 N 3.28 -0.49 3.66 4.51 0.00 0.23 -4.77 105.19 111.61 2klj n GLY 165 Ca -0.18 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 2klj n GLY 165 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2klj s SER 166 N -4.37 -0.34 -0.03 1.61 0.01 -0.14 -1.18 113.70 109.27 2klj s SER 166 Ca -0.06 -0.30 -0.29 0.00 1.31 0.00 0.00 55.95 56.60 2klj s SER 166 Cb 0.03 0.58 0.08 0.00 0.21 0.00 0.00 66.02 66.92 2klj s SER 166 CO 0.42 -1.03 0.72 -1.48 0.41 0.00 0.00 173.24 172.29 2klj s LEU 167 N -2.81 -0.59 0.21 2.44 2.34 0.16 0.63 118.68 121.07 2klj s LEU 167 Ca 0.08 0.51 -0.01 0.00 0.06 0.00 0.00 54.13 54.77 2klj s LEU 167 Cb -0.03 2.42 -0.04 0.00 -0.56 0.00 0.00 46.19 47.99 2klj s LEU 167 CO -0.02 -0.63 0.14 0.00 -1.06 0.00 0.00 176.35 174.78 2klj s ARG 168 N -1.74 1.24 0.00 1.48 1.70 -0.61 0.11 118.95 121.14 2klj s ARG 168 Ca -0.07 -1.65 -0.19 0.00 -0.47 0.00 0.00 55.73 53.36 2klj s ARG 168 Cb -0.00 0.28 -0.06 0.00 -0.57 0.00 0.00 34.95 34.60 2klj s ARG 168 CO 0.04 -0.41 0.53 -0.98 -1.08 0.00 0.00 175.30 173.39 2klj s ARG 169 N -4.11 4.20 -1.60 3.89 1.70 -1.26 -0.46 118.95 121.31 2klj s ARG 169 Ca 0.39 0.62 -0.11 0.00 -0.47 0.00 0.00 55.73 56.16 2klj s ARG 169 Cb 0.07 -3.30 -0.07 0.00 -0.57 0.00 0.00 34.95 31.08 2klj s ARG 169 CO 0.13 0.48 2.84 0.28 -1.08 0.00 0.00 175.30 177.96 2klj n VAL 170 N 2.40 4.21 -3.76 4.99 0.31 0.95 -4.83 118.33 122.60 2klj n VAL 170 Ca -0.09 -2.68 -0.12 0.00 -0.01 0.00 0.00 64.34 61.43 2klj n VAL 170 Cb 0.51 -2.61 -0.08 0.00 -0.91 0.00 0.00 33.84 30.76 2klj n VAL 170 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2klj s ILE 171 N 2.26 0.08 0.00 2.52 1.09 -1.26 -4.68 121.20 121.21 2klj s ILE 171 Ca 0.66 -0.63 0.00 0.00 -1.10 0.00 0.00 60.65 59.58 2klj s ILE 171 Cb 0.17 -0.86 0.00 0.00 -1.06 0.00 0.00 42.46 40.71 2klj s ILE 171 CO -0.06 -0.35 0.58 -0.67 -0.10 0.00 0.00 174.94 174.34 2klj n ASP 172 N 0.75 0.00 0.00 3.58 2.03 -1.26 -5.00 116.55 116.64 2klj n ASP 172 Ca -0.19 -1.34 0.00 0.00 0.52 0.00 0.00 54.79 53.78 2klj n ASP 172 Cb 0.59 -0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 2klj n ASP 172 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2klj n PHE 173 N 0.00 -0.02 0.32 -0.67 3.01 -1.26 -5.06 117.46 113.77 2klj n PHE 173 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.50 2klj n PHE 173 Cb 0.57 0.06 0.03 0.00 -0.01 0.00 0.00 39.48 40.13 2klj n PHE 173 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64