#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 -1.51 3.11 1.69 0.00 -1.26 -4.35 105.19 102.87 2klj n GLY 2 Ca 0.00 -0.55 0.05 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.68 0.13 0.35 1.61 2.20 -1.22 -4.54 119.74 114.58 2klj s LYS 3 Ca 0.00 0.10 0.09 0.00 -0.36 0.00 0.00 55.97 55.81 2klj s LYS 3 Cb 0.00 0.05 -0.06 0.00 -1.51 0.00 0.00 37.83 36.31 2klj s LYS 3 CO 0.00 -0.23 -0.08 0.96 -0.36 0.00 0.00 175.35 175.64 2klj s ILE 4 N 2.87 2.29 -0.21 5.43 -0.00 -1.00 -1.61 121.20 128.97 2klj s ILE 4 Ca 0.27 -2.17 0.01 0.00 -0.00 0.00 0.00 60.65 58.77 2klj s ILE 4 Cb -0.01 -2.67 0.05 0.00 -0.00 0.00 0.00 42.46 39.82 2klj s ILE 4 CO -0.22 -0.20 -0.10 -0.89 -0.00 0.00 0.00 174.94 173.53 2klj s THR 5 N -2.60 1.72 -0.16 8.37 2.01 0.20 -1.34 115.64 123.84 2klj s THR 5 Ca 0.33 -1.11 -0.14 0.00 0.31 0.00 0.00 61.69 61.07 2klj s THR 5 Cb 0.02 -1.81 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 2klj s THR 5 CO 0.17 0.13 0.31 -0.76 -0.69 0.00 0.00 174.62 173.78 2klj s LEU 6 N 1.35 4.24 -0.14 4.42 1.43 0.15 -1.07 118.68 129.06 2klj s LEU 6 Ca -0.02 0.53 -0.00 0.00 -1.03 0.00 0.00 54.13 53.60 2klj s LEU 6 Cb -0.17 -2.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.64 2klj s LEU 6 CO -0.08 0.08 -0.13 -0.31 0.23 0.00 0.00 176.35 176.15 2klj s TYR 7 N 0.52 2.81 0.21 0.29 1.51 0.97 -0.15 117.35 123.51 2klj s TYR 7 Ca 0.17 -0.71 -0.10 0.00 -1.01 0.00 0.00 57.07 55.42 2klj s TYR 7 Cb -0.13 -1.86 0.21 0.00 -0.11 0.00 0.00 41.96 40.07 2klj s TYR 7 CO 0.04 -0.26 1.82 1.49 -1.11 0.00 0.00 175.55 177.53 2klj h GLU 8 N 6.84 0.71 -6.96 -0.62 4.81 0.01 0.52 114.58 119.90 2klj h GLU 8 Ca -0.27 -0.04 -0.47 0.00 -0.13 0.00 0.00 59.36 58.44 2klj h GLU 8 Cb 1.21 -0.16 0.06 0.00 0.63 0.00 0.00 28.75 30.49 2klj h GLU 8 CO 0.56 0.47 0.04 0.34 -0.73 0.00 0.00 179.01 179.69 2klj s ASP 9 N -5.64 4.60 0.08 1.04 2.15 -1.24 -2.60 116.67 115.07 2klj s ASP 9 Ca -0.13 -0.52 -0.05 0.00 0.43 0.00 0.00 52.55 52.29 2klj s ASP 9 Cb 0.16 0.07 -0.05 0.00 -0.30 0.00 0.00 42.92 42.80 2klj s ASP 9 CO 0.76 -1.69 0.31 0.00 -0.17 0.00 0.00 175.17 174.39 2klj s ARG 10 N -4.98 3.58 0.00 4.34 1.70 -1.25 -3.81 118.95 118.52 2klj s ARG 10 Ca 0.65 -0.14 0.00 0.00 -0.47 0.00 0.00 55.73 55.77 2klj s ARG 10 Cb -0.05 -2.96 0.00 0.00 -0.57 0.00 0.00 34.95 31.37 2klj s ARG 10 CO 0.42 0.55 0.00 0.41 -1.08 0.00 0.00 175.30 175.61 2klj n GLY 11 N 0.46 0.46 3.29 3.88 0.00 0.24 -3.97 105.19 109.54 2klj n GLY 11 Ca -0.06 -0.90 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.47 -2.42 -2.96 1.61 3.72 -1.26 -5.02 117.46 107.65 2klj n PHE 12 Ca 0.00 0.83 0.00 0.00 -0.05 0.00 0.00 57.45 58.23 2klj n PHE 12 Cb 0.29 -4.06 0.00 0.00 -0.94 0.00 0.00 39.48 34.77 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 -3.30 1.30 0.00 -1.08 6.02 -1.25 -5.07 117.38 114.00 2klj n GLN 13 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 2klj n GLN 13 Cb 0.62 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.88 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 1.63 0.78 3.77 1.08 0.00 -1.26 -3.60 105.19 107.60 2klj n GLY 14 Ca 0.00 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 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 3.97 0.08 1.61 1.81 -1.26 -4.81 118.95 120.34 2klj s ARG 15 Ca 0.00 1.73 0.03 0.00 -1.72 0.00 0.00 55.73 55.77 2klj s ARG 15 Cb 0.00 -2.54 -0.03 0.00 -0.45 0.00 0.00 34.95 31.93 2klj s ARG 15 CO 0.00 -0.37 -0.09 -3.38 -0.68 0.00 0.00 175.30 170.78 2klj s HIS 16 N -1.52 0.94 -0.11 -0.53 -3.43 -1.26 0.63 115.29 110.00 2klj s HIS 16 Ca 0.60 -0.64 -0.10 0.00 -0.80 0.00 0.00 55.06 54.12 2klj s HIS 16 Cb -0.28 -0.53 0.03 0.00 -1.43 0.00 0.00 32.58 30.37 2klj s HIS 16 CO 0.34 -0.04 0.29 -0.47 -2.00 0.00 0.00 174.74 172.86 2klj s TYR 17 N -2.25 -0.31 -0.08 0.38 5.04 0.79 -4.99 117.35 115.92 2klj s TYR 17 Ca 0.02 0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 55.40 2klj s TYR 17 Cb -0.04 0.11 -0.03 0.00 0.35 0.00 0.00 41.96 42.34 2klj s TYR 17 CO -0.01 -0.16 -0.01 -2.00 -1.34 0.00 0.00 175.55 172.03 2klj s GLU 18 N 0.11 2.93 -0.14 4.97 2.12 -1.26 0.30 118.70 127.74 2klj s GLU 18 Ca -0.00 -0.44 0.01 0.00 0.36 0.00 0.00 54.97 54.90 2klj s GLU 18 Cb -0.02 -2.75 0.02 0.00 0.26 0.00 0.00 34.13 31.64 2klj s GLU 18 CO 0.00 0.69 -0.14 0.00 -0.54 0.00 0.00 175.26 175.27 2klj n SER 20 N 4.62 2.18 -3.70 0.00 3.41 -1.26 -2.37 113.62 116.50 2klj n SER 20 Ca -0.17 -1.99 -0.07 0.00 -0.26 0.00 0.00 58.87 56.37 2klj n SER 20 Cb 0.50 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.39 2klj n SER 20 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2klj s SER 21 N -0.99 -0.20 0.24 4.04 0.15 -1.26 -4.67 113.70 111.00 2klj s SER 21 Ca 0.05 -0.72 -0.31 0.00 0.70 0.00 0.00 55.95 55.67 2klj s SER 21 Cb 0.02 0.75 -0.13 0.00 -1.71 0.00 0.00 66.02 64.95 2klj s SER 21 CO 0.03 -1.40 1.47 -0.90 1.20 0.00 0.00 173.24 173.63 2klj n ASP 22 N -0.63 3.01 -4.13 5.45 5.75 -1.26 -4.57 116.55 120.17 2klj n ASP 22 Ca -0.05 1.13 -0.20 0.00 -0.01 0.00 0.00 54.79 55.66 2klj n ASP 22 Cb 0.59 -1.46 -0.14 0.00 -1.03 0.00 0.00 41.12 39.09 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 0.09 1.20 -0.01 2.11 2.46 0.15 -4.98 115.29 116.31 2klj s HIS 23 Ca 0.69 -0.32 0.04 0.00 0.47 0.00 0.00 55.06 55.94 2klj s HIS 23 Cb -0.62 -0.73 -0.06 0.00 -0.13 0.00 0.00 32.58 31.03 2klj s HIS 23 CO 0.48 0.02 0.08 0.25 -2.47 0.00 0.00 174.74 173.10 2klj n THR 24 N 2.09 0.04 -3.63 0.89 -2.24 -1.26 -2.38 114.28 107.79 2klj n THR 24 Ca -0.17 -0.11 -0.23 0.00 -2.27 0.00 0.00 64.05 61.27 2klj n THR 24 Cb 0.55 0.22 -0.17 0.00 -2.10 0.00 0.00 70.33 68.83 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 -2.64 1.83 0.00 3.42 2.47 -1.23 -0.72 114.94 118.07 2klj s ASN 25 Ca -0.02 -0.32 0.14 0.00 0.42 0.00 0.00 52.86 53.09 2klj s ASN 25 Cb 0.03 -0.17 -0.02 0.00 -1.45 0.00 0.00 41.25 39.64 2klj s ASN 25 CO 0.18 -0.31 0.78 0.18 -3.72 0.00 0.00 177.10 174.20 2klj n LEU 26 N 5.29 1.44 -0.21 3.21 4.77 0.12 -4.56 117.00 127.07 2klj n LEU 26 Ca -0.05 -0.74 -0.03 0.00 -0.03 0.00 0.00 56.01 55.15 2klj n LEU 26 Cb 0.49 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.66 2klj n LEU 26 CO 0.08 0.28 1.07 1.56 -1.33 0.00 0.00 177.39 179.06 2klj h GLN 27 N 1.47 0.62 -0.87 3.23 4.20 -1.71 1.41 115.11 123.46 2klj h GLN 27 Ca 0.00 -0.04 0.11 0.00 0.06 0.00 0.00 58.65 58.78 2klj h GLN 27 Cb 0.48 -0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.05 2klj h GLN 27 CO 0.00 0.41 0.56 -1.35 -0.67 0.00 0.00 178.83 177.78 2klj h PRO 28 N 0.64 0.78 0.00 1.46 0.11 -1.96 -3.26 132.00 129.78 2klj h PRO 28 Ca 0.27 -0.05 -0.28 0.00 0.11 0.00 0.00 66.00 66.05 2klj h PRO 28 Cb 0.14 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 31.03 2klj h PRO 28 CO -0.16 0.52 -1.73 0.66 -0.21 0.00 0.00 178.00 177.08 2klj n TYR 29 N -4.53 0.41 -5.19 0.65 4.01 -0.78 -4.96 117.16 106.77 2klj n TYR 29 Ca 0.15 0.18 -0.32 0.00 -0.16 0.00 0.00 57.90 57.75 2klj n TYR 29 Cb 0.35 -0.94 -0.17 0.00 -0.31 0.00 0.00 39.34 38.28 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 -7.75 2.11 0.00 7.72 1.43 0.48 -4.82 118.68 117.85 2klj s LEU 30 Ca -0.32 -0.55 0.22 0.00 -1.03 0.00 0.00 54.13 52.45 2klj s LEU 30 Cb 0.09 -1.42 -0.10 0.00 0.03 0.00 0.00 46.19 44.80 2klj s LEU 30 CO 0.48 0.16 0.95 -0.24 0.23 0.00 0.00 176.35 177.93 2klj n SER 31 N 3.54 0.77 0.00 2.29 2.88 -1.26 -3.30 113.62 118.54 2klj n SER 31 Ca -0.19 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.67 2klj n SER 31 Cb 0.53 0.96 0.00 0.00 -0.75 0.00 0.00 64.21 64.95 2klj n SER 31 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2klj n ARG 32 N -1.64 0.00 -2.99 -1.46 1.74 -1.26 -4.85 116.66 106.20 2klj n ARG 32 Ca 0.03 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2klj n ARG 32 Cb 0.37 -0.14 0.00 0.00 -1.02 0.00 0.00 32.46 31.67 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 -1.69 4.23 0.00 0.00 4.13 0.18 -4.67 115.26 117.44 2klj n ASN 34 Ca 0.00 -3.67 0.00 0.00 1.68 0.00 0.00 54.58 52.60 2klj n ASN 34 Cb 0.50 -0.83 0.00 0.00 -1.54 0.00 0.00 39.78 37.91 2klj n ASN 34 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2klj n SER 35 N -1.10 0.00 -3.77 6.41 3.41 -1.11 -3.15 113.62 114.31 2klj n SER 35 Ca 0.57 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 59.05 2klj n SER 35 Cb 1.42 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 65.28 2klj n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2klj s ALA 36 N -1.56 -0.76 -0.06 7.33 0.00 0.30 -0.02 121.76 126.99 2klj s ALA 36 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2klj s ALA 36 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.08 2klj s ALA 36 CO 0.00 -0.23 -0.04 1.03 0.00 0.00 0.00 175.76 176.52 2klj s ARG 37 N -0.97 0.89 -0.09 0.00 0.52 -0.23 0.15 118.95 119.21 2klj s ARG 37 Ca -0.10 -0.07 -0.01 0.00 -0.52 0.00 0.00 55.73 55.03 2klj s ARG 37 Cb -0.05 -1.00 -0.03 0.00 0.52 0.00 0.00 34.95 34.39 2klj s ARG 37 CO 0.03 -0.17 -0.04 0.08 0.02 0.00 0.00 175.30 175.22 2klj s VAL 38 N 1.34 3.90 -0.25 3.52 1.01 -0.18 0.60 120.40 130.33 2klj s VAL 38 Ca -0.04 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 2klj s VAL 38 Cb -0.13 -2.63 -0.17 0.00 0.00 0.00 0.00 36.38 33.45 2klj s VAL 38 CO -0.02 0.58 -0.20 -0.67 0.00 0.00 0.00 175.10 174.78 2klj n ASP 39 N 2.52 1.99 -3.44 3.32 2.03 -0.63 -3.41 116.55 118.93 2klj n ASP 39 Ca -0.18 -0.03 -0.11 0.00 0.52 0.00 0.00 54.79 54.99 2klj n ASP 39 Cb 0.53 -0.52 -0.02 0.00 -0.72 0.00 0.00 41.12 40.39 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 -6.73 -0.53 0.18 1.67 1.04 -1.26 -4.91 113.70 103.16 2klj s SER 40 Ca -0.35 0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2klj s SER 40 Cb 0.10 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.78 2klj s SER 40 CO 0.59 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.52 2klj n GLY 41 N -0.35 -1.98 3.58 7.32 0.00 -1.26 -3.44 105.19 109.05 2klj n GLY 41 Ca -0.15 -1.37 -0.24 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.48 -0.38 -0.17 0.00 0.52 -0.43 -2.62 118.94 113.38 2klj s TRP 43 Ca 0.32 0.89 -0.06 0.00 0.02 0.00 0.00 56.10 57.27 2klj s TRP 43 Cb -0.03 0.04 -0.04 0.00 -1.15 0.00 0.00 33.47 32.30 2klj s TRP 43 CO 0.18 -0.28 0.02 1.41 0.02 0.00 0.00 176.95 178.30 2klj s MET 44 N 1.63 3.82 0.01 4.98 1.75 -0.87 -1.58 119.30 129.05 2klj s MET 44 Ca -0.06 -0.41 0.03 0.00 -1.25 0.00 0.00 55.69 54.00 2klj s MET 44 Cb -0.11 -3.08 -0.03 0.00 2.84 0.00 0.00 34.83 34.44 2klj s MET 44 CO -0.09 0.29 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.00 2klj s LEU 45 N 0.30 3.21 -0.10 4.11 1.43 -1.06 -0.64 118.68 125.93 2klj s LEU 45 Ca 0.01 -0.15 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 2klj s LEU 45 Cb -0.13 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 2klj s LEU 45 CO 0.01 0.27 -0.21 -0.31 0.23 0.00 0.00 176.35 176.35 2klj s TYR 46 N -1.04 2.61 0.55 0.29 1.51 0.17 -1.40 117.35 120.04 2klj s TYR 46 Ca 0.18 -0.81 0.25 0.00 -1.01 0.00 0.00 57.07 55.68 2klj s TYR 46 Cb -0.11 -1.72 1.45 0.00 -0.11 0.00 0.00 41.96 41.47 2klj s TYR 46 CO 0.09 -0.28 2.03 1.05 -1.11 0.00 0.00 175.55 177.32 2klj h GLU 47 N 6.48 0.00 -6.83 -0.62 4.11 -1.11 -1.95 114.58 114.66 2klj h GLU 47 Ca -0.25 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.50 2klj h GLU 47 Cb 1.21 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.26 2klj h GLU 47 CO 0.50 0.00 -0.85 -0.65 0.07 0.00 0.00 179.01 178.08 2klj s GLN 48 N -4.90 1.48 1.04 1.06 -0.21 -0.23 -3.47 119.66 114.42 2klj s GLN 48 Ca -0.05 -1.35 -0.11 0.00 0.02 0.00 0.00 55.36 53.86 2klj s GLN 48 Cb 0.18 -1.92 0.21 0.00 1.00 0.00 0.00 33.01 32.48 2klj s GLN 48 CO 0.67 0.45 1.08 -1.25 -2.12 0.00 0.00 175.29 174.12 2klj s PRO 49 N -2.19 0.07 -1.58 2.91 0.04 -1.26 -2.41 135.00 130.58 2klj s PRO 49 Ca 0.16 1.16 -0.01 0.00 0.04 0.00 0.00 61.00 62.35 2klj s PRO 49 Cb -0.10 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.80 2klj s PRO 49 CO 0.07 -3.15 0.11 0.09 0.04 0.00 0.00 177.00 174.16 2klj n ASN 50 N -4.56 -5.45 -3.13 6.66 5.03 0.10 -3.33 115.26 110.59 2klj n ASN 50 Ca 0.07 -0.02 -0.09 0.00 0.87 0.00 0.00 54.58 55.41 2klj n ASN 50 Cb 0.53 -4.53 0.01 0.00 -1.02 0.00 0.00 39.78 34.77 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 -3.95 -3.00 -3.96 3.10 4.01 -1.23 -5.04 117.16 107.09 2klj n TYR 51 Ca -0.20 1.18 -0.11 0.00 -0.16 0.00 0.00 57.90 58.62 2klj n TYR 51 Cb 0.66 -3.74 -0.12 0.00 -0.31 0.00 0.00 39.34 35.83 2klj n TYR 51 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2klj s SER 52 N -2.74 0.22 0.00 7.72 0.01 -1.01 -5.04 113.70 112.86 2klj s SER 52 Ca 0.11 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.08 2klj s SER 52 Cb -0.03 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2klj s SER 52 CO 0.79 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.89 2klj n GLY 53 N 2.21 -1.60 3.74 3.44 0.00 -1.26 -1.07 105.19 110.65 2klj n GLY 53 Ca -0.19 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 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 4.49 0.00 0.99 2.96 -1.26 -4.77 118.68 121.10 2klj s LEU 54 Ca 0.00 2.02 0.02 0.00 -0.22 0.00 0.00 54.13 55.94 2klj s LEU 54 Cb 0.00 -3.60 0.02 0.00 0.50 0.00 0.00 46.19 43.11 2klj s LEU 54 CO 0.00 -0.18 0.13 0.00 -1.32 0.00 0.00 176.35 174.98 2klj n GLN 55 N 2.49 1.02 -3.72 1.98 0.00 -1.26 -0.92 117.38 116.97 2klj n GLN 55 Ca 0.03 -2.60 -0.14 0.00 0.00 0.00 0.00 57.00 54.29 2klj n GLN 55 Cb 0.47 0.52 -0.14 0.00 0.00 0.00 0.00 30.24 31.08 2klj n GLN 55 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 2klj s TYR 56 N -2.17 -0.22 -0.19 2.61 1.51 -0.49 -4.93 117.35 113.46 2klj s TYR 56 Ca 0.10 0.61 -0.27 0.00 -1.01 0.00 0.00 57.07 56.50 2klj s TYR 56 Cb -0.01 -0.09 -0.00 0.00 -0.11 0.00 0.00 41.96 41.75 2klj s TYR 56 CO 0.06 -0.22 0.92 0.12 -1.11 0.00 0.00 175.55 175.33 2klj s PHE 57 N 1.52 3.39 -0.12 2.71 5.36 -1.26 -2.57 117.98 127.01 2klj s PHE 57 Ca -0.06 1.35 0.03 0.00 -0.96 0.00 0.00 56.93 57.29 2klj s PHE 57 Cb -0.11 -3.13 0.00 0.00 -0.34 0.00 0.00 43.02 39.44 2klj s PHE 57 CO -0.07 -0.34 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.62 2klj s LEU 58 N 2.59 2.17 0.18 6.12 1.02 -0.61 -4.93 118.68 125.22 2klj s LEU 58 Ca 0.41 -0.56 0.10 0.00 0.02 0.00 0.00 54.13 54.10 2klj s LEU 58 Cb -0.16 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.56 2klj s LEU 58 CO 0.10 0.12 -0.14 -0.60 0.02 0.00 0.00 176.35 175.85 2klj s ARG 59 N 0.58 1.90 -0.26 1.70 6.06 -1.26 -1.32 118.95 126.35 2klj s ARG 59 Ca -0.12 -1.33 -0.26 0.00 -2.50 0.00 0.00 55.73 51.52 2klj s ARG 59 Cb -0.17 -2.07 -0.11 0.00 0.06 0.00 0.00 34.95 32.66 2klj s ARG 59 CO 0.03 0.43 0.87 -2.13 -2.50 0.00 0.00 175.30 172.00 2klj n ARG 60 N 0.15 0.00 0.00 5.12 0.63 -1.24 -4.79 116.66 116.53 2klj n ARG 60 Ca -0.11 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.82 2klj n ARG 60 Cb 0.55 -0.83 0.00 0.00 0.45 0.00 0.00 32.46 32.64 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 2.15 -0.06 3.60 5.14 0.00 -1.22 -5.00 105.19 109.80 2klj n GLY 61 Ca 0.17 -1.29 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 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 5.02 -0.25 1.61 -4.77 -1.26 -1.01 116.67 116.00 2klj s ASP 62 Ca 0.00 0.02 -0.01 0.00 -3.30 0.00 0.00 52.55 49.27 2klj s ASP 62 Cb 0.00 -1.54 0.07 0.00 -1.09 0.00 0.00 42.92 40.36 2klj s ASP 62 CO 0.00 0.30 0.02 -0.31 0.70 0.00 0.00 175.17 175.87 2klj s TYR 63 N -0.40 1.89 -1.68 2.11 2.02 0.39 -4.97 117.35 116.70 2klj s TYR 63 Ca 0.07 -1.55 0.26 0.00 -0.37 0.00 0.00 57.07 55.49 2klj s TYR 63 Cb -0.12 -1.52 0.77 0.00 -0.40 0.00 0.00 41.96 40.68 2klj s TYR 63 CO 0.02 -0.76 1.57 0.00 -1.57 0.00 0.00 175.55 174.82 2klj n ALA 64 N 4.81 3.10 -3.24 3.71 0.00 -1.26 0.11 120.51 127.73 2klj n ALA 64 Ca -0.08 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 52.84 2klj n ALA 64 Cb 0.44 -1.15 -0.10 0.00 0.00 0.00 0.00 19.45 18.65 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 -2.54 -0.32 0.27 0.00 1.01 -1.22 0.80 116.67 114.67 2klj s ASP 65 Ca 0.23 0.55 -0.00 0.00 0.71 0.00 0.00 52.55 54.05 2klj s ASP 65 Cb 0.19 0.61 0.51 0.00 1.01 0.00 0.00 42.92 45.25 2klj s ASP 65 CO 0.53 -0.20 1.84 1.12 0.21 0.00 0.00 175.17 178.67 2klj h HIS 66 N 5.18 1.10 -0.09 4.23 2.07 -1.81 0.22 115.15 126.05 2klj h HIS 66 Ca -0.27 0.03 0.03 0.00 -2.85 0.00 0.00 60.37 57.31 2klj h HIS 66 Cb 1.18 -0.35 -0.00 0.00 2.57 0.00 0.00 27.41 30.81 2klj h HIS 66 CO 0.43 0.45 0.27 1.96 -3.07 0.00 0.00 177.93 177.97 2klj h GLN 67 N 0.98 0.00 -0.61 5.12 7.50 -1.91 0.12 115.11 126.30 2klj h GLN 67 Ca 0.48 0.00 -0.09 0.00 0.50 0.00 0.00 58.65 59.54 2klj h GLN 67 Cb 0.44 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.95 2klj h GLN 67 CO -0.26 0.00 0.05 1.96 -1.50 0.00 0.00 178.83 179.09 2klj h GLN 68 N 0.00 1.05 -0.78 1.46 1.08 -0.89 -2.51 115.11 114.52 2klj h GLN 68 Ca 0.04 -0.31 -0.02 0.00 -1.45 0.00 0.00 58.65 56.91 2klj h GLN 68 Cb 0.58 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 2klj h GLN 68 CO -0.00 1.00 0.03 -2.67 -0.95 0.00 0.00 178.83 176.24 2klj n TRP 69 N -4.23 1.25 -1.00 2.96 2.14 -0.24 -4.81 117.44 113.51 2klj n TRP 69 Ca 0.03 -0.49 0.00 0.00 2.07 0.00 0.00 57.50 59.11 2klj n TRP 69 Cb 0.32 -0.37 0.00 0.00 -0.81 0.00 0.00 31.31 30.45 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 0.29 -0.20 -1.38 -2.67 2.81 -0.94 -4.61 117.12 110.42 2klj n MET 70 Ca 0.17 0.05 -0.53 0.00 -1.81 0.00 0.00 57.70 55.58 2klj n MET 70 Cb 0.83 -3.20 -0.09 0.00 -0.71 0.00 0.00 33.22 30.05 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 -2.59 0.20 0.16 3.03 0.00 0.24 -4.77 105.19 101.47 2klj n GLY 71 Ca 0.00 1.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.79 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 11.35 0.86 -7.64 0.99 4.07 -1.91 -3.36 115.31 119.67 2klj h LEU 72 Ca -0.20 -0.87 -0.40 0.00 0.08 0.00 0.00 57.88 56.49 2klj h LEU 72 Cb 1.35 -0.28 -0.35 0.00 1.08 0.00 0.00 40.66 42.47 2klj h LEU 72 CO 1.07 1.66 -0.76 -0.94 -1.08 0.00 0.00 178.44 178.39 2klj s SER 73 N -7.50 0.99 0.00 -0.43 1.04 -1.26 -5.00 113.70 101.53 2klj s SER 73 Ca -0.09 -0.09 0.19 0.00 0.48 0.00 0.00 55.95 56.44 2klj s SER 73 Cb 0.05 -0.39 1.15 0.00 0.10 0.00 0.00 66.02 66.93 2klj s SER 73 CO 0.94 -0.10 1.55 -0.67 0.98 0.00 0.00 173.24 175.94 2klj n ASP 74 N 4.35 0.00 -3.53 7.02 2.03 -1.26 -4.32 116.55 120.84 2klj n ASP 74 Ca -0.21 -0.66 -0.39 0.00 0.52 0.00 0.00 54.79 54.06 2klj n ASP 74 Cb 0.50 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.88 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 -0.98 4.29 -4.58 1.67 2.88 -1.26 -4.36 113.62 111.28 2klj n SER 75 Ca 0.15 -2.65 -0.39 0.00 -1.33 0.00 0.00 58.87 54.64 2klj n SER 75 Cb 0.07 -1.35 -0.10 0.00 -0.75 0.00 0.00 64.21 62.07 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 3.72 5.24 0.00 2.46 1.01 -1.26 -4.00 120.40 127.57 2klj s VAL 76 Ca 0.53 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.70 2klj s VAL 76 Cb 0.14 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2klj s VAL 76 CO -0.00 0.11 0.73 0.54 0.00 0.00 0.00 175.10 176.48 2klj n ARG 77 N 5.21 1.26 -3.46 2.72 1.74 -0.76 -4.68 116.66 118.69 2klj n ARG 77 Ca -0.11 -0.98 -0.12 0.00 -0.77 0.00 0.00 57.85 55.86 2klj n ARG 77 Cb 0.51 -0.91 -0.03 0.00 -1.02 0.00 0.00 32.46 31.01 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 -0.52 -0.54 -0.05 0.55 1.04 -1.04 0.16 113.70 113.29 2klj s SER 78 Ca 0.00 0.13 -0.29 0.00 0.48 0.00 0.00 55.95 56.27 2klj s SER 78 Cb 0.00 0.54 0.10 0.00 0.10 0.00 0.00 66.02 66.77 2klj s SER 78 CO 0.00 -0.83 0.86 0.00 0.98 0.00 0.00 173.24 174.25 2klj s ARG 80 N -2.18 1.29 -0.16 0.00 1.70 0.18 0.32 118.95 120.09 2klj s ARG 80 Ca -0.00 -1.62 -0.05 0.00 -0.47 0.00 0.00 55.73 53.59 2klj s ARG 80 Cb -0.01 0.30 -0.03 0.00 -0.57 0.00 0.00 34.95 34.64 2klj s ARG 80 CO -0.03 -0.44 0.01 -1.17 -1.08 0.00 0.00 175.30 172.59 2klj s LEU 81 N -3.16 3.54 -0.39 -1.89 2.96 -1.26 -2.05 118.68 116.42 2klj s LEU 81 Ca 0.37 -0.00 -0.16 0.00 -0.22 0.00 0.00 54.13 54.12 2klj s LEU 81 Cb 0.06 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.89 2klj s LEU 81 CO 0.13 0.19 0.36 -0.63 -1.32 0.00 0.00 176.35 175.08 2klj s ILE 82 N 0.23 5.17 0.84 6.68 1.01 -1.08 -4.89 121.20 129.16 2klj s ILE 82 Ca 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 2klj s ILE 82 Cb -0.13 -3.92 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 2klj s ILE 82 CO 0.02 -0.26 0.38 -2.65 0.00 0.00 0.00 174.94 172.43 2klj n PRO 83 N 5.38 0.02 -4.24 2.79 -0.02 -1.26 -4.17 135.00 133.49 2klj n PRO 83 Ca -0.09 0.05 -0.24 0.00 -2.02 0.00 0.00 63.50 61.20 2klj n PRO 83 Cb 0.48 -1.78 -0.07 0.00 -0.02 0.00 0.00 33.50 32.11 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 -2.91 0.14 -3.49 6.00 -0.00 -1.26 -4.26 115.22 109.43 2klj n HIS 84 Ca 0.08 -2.44 -0.11 0.00 -0.00 0.00 0.00 57.72 55.25 2klj n HIS 84 Cb 0.52 -0.01 -0.03 0.00 -0.00 0.00 0.00 29.99 30.47 2klj n HIS 84 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2klj s SER 85 N -3.34 -0.46 0.18 0.41 0.15 -1.26 -4.78 113.70 104.59 2klj s SER 85 Ca 0.19 0.11 -0.10 0.00 0.70 0.00 0.00 55.95 56.85 2klj s SER 85 Cb 0.01 0.46 0.08 0.00 -1.71 0.00 0.00 66.02 64.86 2klj s SER 85 CO 0.14 -0.70 1.69 1.23 1.20 0.00 0.00 173.24 176.80 2klj h GLY 86 N 2.16 1.07 -2.30 9.45 0.00 -2.02 -3.44 103.07 108.00 2klj h GLY 86 Ca -0.26 -0.67 -0.58 0.00 0.00 0.00 0.00 47.33 45.82 2klj h GLY 86 CO 0.34 0.63 -0.65 -0.56 0.00 0.00 0.00 176.54 176.29 2klj s SER 87 N -6.32 4.20 -0.07 0.19 0.01 -1.26 -4.73 113.70 105.72 2klj s SER 87 Ca -0.12 -0.87 -0.06 0.00 1.31 0.00 0.00 55.95 56.20 2klj s SER 87 Cb 0.13 -0.60 0.02 0.00 0.21 0.00 0.00 66.02 65.79 2klj s SER 87 CO 0.82 -0.10 0.19 -2.28 0.41 0.00 0.00 173.24 172.29 2klj s HIS 88 N -2.45 -0.22 -0.16 2.43 2.46 -1.26 -4.52 115.29 111.58 2klj s HIS 88 Ca 0.33 0.54 -0.08 0.00 0.47 0.00 0.00 55.06 56.32 2klj s HIS 88 Cb -0.03 0.06 0.06 0.00 -0.13 0.00 0.00 32.58 32.54 2klj s HIS 88 CO 0.19 -0.12 0.37 -0.98 -2.47 0.00 0.00 174.74 171.73 2klj s ARG 89 N 0.29 0.34 0.01 2.88 1.70 -1.26 -4.41 118.95 118.50 2klj s ARG 89 Ca -0.02 0.77 0.01 0.00 -0.47 0.00 0.00 55.73 56.02 2klj s ARG 89 Cb -0.03 -0.01 -0.01 0.00 -0.57 0.00 0.00 34.95 34.33 2klj s ARG 89 CO -0.01 -0.17 -0.03 -1.50 -1.08 0.00 0.00 175.30 172.51 2klj s ILE 90 N 1.54 0.17 -0.38 4.99 2.07 -0.73 -2.18 121.20 126.68 2klj s ILE 90 Ca -0.08 -0.39 0.03 0.00 -1.41 0.00 0.00 60.65 58.81 2klj s ILE 90 Cb -0.09 -0.20 0.11 0.00 0.13 0.00 0.00 42.46 42.40 2klj s ILE 90 CO -0.12 -0.14 0.10 -0.13 -1.91 0.00 0.00 174.94 172.75 2klj s ARG 91 N -0.55 1.50 0.36 3.50 0.52 -0.74 -0.92 118.95 122.61 2klj s ARG 91 Ca -0.05 -1.96 -0.25 0.00 -0.52 0.00 0.00 55.73 52.96 2klj s ARG 91 Cb -0.04 -3.08 -0.10 0.00 0.52 0.00 0.00 34.95 32.26 2klj s ARG 91 CO -0.00 -0.99 0.99 -0.51 0.02 0.00 0.00 175.30 174.81 2klj s LEU 92 N 0.71 4.24 -0.03 2.53 1.43 -0.74 -0.34 118.68 126.48 2klj s LEU 92 Ca 0.12 1.91 0.06 0.00 -1.03 0.00 0.00 54.13 55.19 2klj s LEU 92 Cb -0.20 -4.11 -0.01 0.00 0.03 0.00 0.00 46.19 41.89 2klj s LEU 92 CO -0.08 -0.25 -0.23 -0.31 0.23 0.00 0.00 176.35 175.72 2klj s TYR 93 N -1.67 2.12 0.00 0.29 1.51 0.31 -1.81 117.35 118.10 2klj s TYR 93 Ca 0.54 -0.51 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 2klj s TYR 93 Cb -0.19 -1.38 0.00 0.00 -0.11 0.00 0.00 41.96 40.28 2klj s TYR 93 CO 0.25 -0.12 0.90 -1.91 -1.11 0.00 0.00 175.55 173.56 2klj n GLU 94 N 2.76 0.00 -2.83 -0.62 2.13 0.20 -2.02 120.64 120.26 2klj n GLU 94 Ca -0.17 0.50 -0.20 0.00 0.66 0.00 0.00 57.16 57.95 2klj n GLU 94 Cb 0.52 -1.40 0.05 0.00 0.27 0.00 0.00 31.44 30.89 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 -2.59 2.33 0.87 5.31 1.70 -1.26 -1.11 118.95 124.20 2klj s ARG 95 Ca 0.00 -1.23 -0.12 0.00 -0.47 0.00 0.00 55.73 53.91 2klj s ARG 95 Cb 0.00 -2.56 0.08 0.00 -0.57 0.00 0.00 34.95 31.90 2klj s ARG 95 CO 0.00 -0.83 0.95 0.39 -1.08 0.00 0.00 175.30 174.73 2klj n GLU 96 N -2.31 -0.12 0.00 3.89 1.02 -1.19 -4.38 120.64 117.54 2klj n GLU 96 Ca 0.12 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 2klj n GLU 96 Cb 0.60 -2.24 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 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 -2.90 0.00 -2.69 1.62 8.00 -0.70 -3.66 116.55 116.22 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 0.52 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.73 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 9.54 -2.07 -0.02 1.24 4.01 -1.26 -4.85 117.16 123.76 2klj n TYR 98 Ca 0.00 -1.92 0.07 0.00 -0.16 0.00 0.00 57.90 55.88 2klj n TYR 98 Cb 0.00 1.44 -0.14 0.00 -0.31 0.00 0.00 39.34 40.33 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 0.64 -0.99 -0.72 3.00 -1.24 -5.00 116.66 111.52 2klj n ARG 99 Ca -0.06 -0.14 -0.06 0.00 -0.01 0.00 0.00 57.85 57.58 2klj n ARG 99 Cb 0.86 -1.42 0.03 0.00 0.00 0.00 0.00 32.46 31.93 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 1.57 0.38 3.77 -0.13 0.00 -1.26 -5.00 105.19 104.52 2klj n GLY 100 Ca -0.06 -1.92 -0.38 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.18 3.69 0.10 1.61 2.00 -1.26 -4.65 119.66 117.97 2klj s GLN 101 Ca 0.17 1.88 0.07 0.00 -2.00 0.00 0.00 55.36 55.48 2klj s GLN 101 Cb -0.01 -2.42 -0.03 0.00 0.80 0.00 0.00 33.01 31.34 2klj s GLN 101 CO 0.11 -0.64 -0.17 1.41 -0.50 0.00 0.00 175.29 175.51 2klj s MET 102 N -2.67 1.00 -0.11 1.67 -2.45 -1.26 0.59 119.30 116.07 2klj s MET 102 Ca 0.64 -1.13 -0.10 0.00 -1.25 0.00 0.00 55.69 53.85 2klj s MET 102 Cb -0.31 -1.06 0.03 0.00 1.25 0.00 0.00 34.83 34.73 2klj s MET 102 CO 0.38 0.23 0.29 -1.50 1.05 0.00 0.00 175.02 175.48 2klj s ILE 103 N -1.52 0.00 0.08 10.11 2.07 -0.75 -5.02 121.20 126.17 2klj s ILE 103 Ca 0.05 -0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.30 2klj s ILE 103 Cb -0.08 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.05 2klj s ILE 103 CO 0.03 -0.01 0.13 -0.70 -1.91 0.00 0.00 174.94 172.49 2klj s GLU 104 N 0.13 3.06 -0.02 3.50 2.12 -1.26 -1.79 118.70 124.43 2klj s GLU 104 Ca -0.00 -0.63 0.02 0.00 0.36 0.00 0.00 54.97 54.72 2klj s GLU 104 Cb -0.02 -2.82 0.01 0.00 0.26 0.00 0.00 34.13 31.56 2klj s GLU 104 CO 0.00 0.57 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.16 2klj s PHE 105 N -1.46 0.79 -0.03 5.30 0.08 -0.10 -4.99 117.98 117.57 2klj s PHE 105 Ca 0.31 -0.19 0.04 0.00 0.12 0.00 0.00 56.93 57.21 2klj s PHE 105 Cb -0.12 -0.58 0.06 0.00 -0.57 0.00 0.00 43.02 41.81 2klj s PHE 105 CO 0.24 -0.10 0.90 0.25 -0.10 0.00 0.00 175.22 176.42 2klj n THR 106 N 3.37 0.77 -3.64 0.64 -2.24 -1.26 -1.77 114.28 110.15 2klj n THR 106 Ca -0.19 -0.86 -0.06 0.00 -2.27 0.00 0.00 64.05 60.67 2klj n THR 106 Cb 0.54 0.47 -0.00 0.00 -2.10 0.00 0.00 70.33 69.24 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 -0.49 0.49 -2.30 -0.78 0.28 -1.26 -4.75 120.64 111.83 2klj n GLU 107 Ca 0.03 -1.37 -0.41 0.00 -0.16 0.00 0.00 57.16 55.26 2klj n GLU 107 Cb 0.47 1.49 -0.03 0.00 1.43 0.00 0.00 31.44 34.80 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 -2.15 7.03 -0.51 -1.84 -4.77 -1.26 -4.64 116.67 108.52 2klj s ASP 108 Ca 0.12 2.46 0.03 0.00 -3.30 0.00 0.00 52.55 51.86 2klj s ASP 108 Cb -0.02 -2.63 0.14 0.00 -1.09 0.00 0.00 42.92 39.32 2klj s ASP 108 CO 0.09 -0.34 0.28 0.00 0.70 0.00 0.00 175.17 175.90 2klj h SER 110 N 6.43 0.47 -2.72 0.00 0.87 -1.92 -0.21 113.55 116.47 2klj h SER 110 Ca -0.02 -0.17 -0.59 0.00 -1.23 0.00 0.00 61.79 59.78 2klj h SER 110 Cb 0.89 -0.13 -0.39 0.00 -0.44 0.00 0.00 62.40 62.33 2klj h SER 110 CO 0.61 0.74 -0.85 0.00 -0.53 0.00 0.00 176.83 176.80 2klj h LEU 112 N 6.33 0.90 -0.22 0.00 6.46 -1.09 -0.92 115.31 126.78 2klj h LEU 112 Ca 0.13 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.94 2klj h LEU 112 Cb 0.92 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.72 2klj h LEU 112 CO 0.38 0.47 0.34 0.00 -0.62 0.00 0.00 178.44 179.01 2klj n GLN 113 N -4.62 0.02 0.02 1.25 3.00 -1.25 0.25 117.38 116.07 2klj n GLN 113 Ca 0.19 0.33 0.04 0.00 -0.01 0.00 0.00 57.00 57.55 2klj n GLN 113 Cb 0.37 -1.92 -0.09 0.00 0.00 0.00 0.00 30.24 28.60 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 -1.48 0.55 -0.13 1.08 8.00 -0.35 -4.52 116.55 119.71 2klj n ASP 114 Ca -0.00 0.23 -0.21 0.00 0.71 0.00 0.00 54.79 55.52 2klj n ASP 114 Cb 0.34 0.77 -0.11 0.00 -0.02 0.00 0.00 41.12 42.11 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 -2.67 0.60 -4.84 -1.24 5.12 0.71 -5.01 116.66 109.33 2klj n ARG 115 Ca -0.09 0.17 -0.25 0.00 -1.93 0.00 0.00 57.85 55.75 2klj n ARG 115 Cb 0.74 -1.48 -0.15 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 -2.49 1.68 0.00 -1.55 -0.71 0.11 -5.10 117.98 109.91 2klj s PHE 116 Ca -0.34 -0.33 0.00 0.00 -1.04 0.00 0.00 56.93 55.22 2klj s PHE 116 Cb 0.10 -1.06 0.00 0.00 -1.21 0.00 0.00 43.02 40.85 2klj s PHE 116 CO 0.54 -0.01 0.12 0.54 -1.34 0.00 0.00 175.22 175.07 2klj n ARG 117 N 2.46 0.00 -1.17 1.99 5.12 -1.26 -4.29 116.66 119.50 2klj n ARG 117 Ca -0.15 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.35 2klj n ARG 117 Cb 0.54 -0.52 -0.04 0.00 -1.16 0.00 0.00 32.46 31.28 2klj n ARG 117 CO 0.00 0.00 0.00 1.97 -1.93 0.00 0.00 177.63 177.67 2klj n PHE 118 N -0.16 -0.14 0.44 -1.55 -1.74 -1.26 -4.83 117.46 108.23 2klj n PHE 118 Ca 0.00 0.82 0.09 0.00 -0.56 0.00 0.00 57.45 57.80 2klj n PHE 118 Cb 0.00 -1.64 0.25 0.00 1.52 0.00 0.00 39.48 39.61 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 1.52 2.76 -4.09 5.98 3.02 -1.26 -4.86 115.26 118.34 2klj n ASN 119 Ca 0.15 -1.96 -0.29 0.00 -0.03 0.00 0.00 54.58 52.46 2klj n ASN 119 Cb 0.17 -0.30 -0.17 0.00 -0.61 0.00 0.00 39.78 38.86 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 -1.39 2.33 -0.28 3.52 2.02 -1.26 -1.56 118.70 122.07 2klj s GLU 120 Ca 0.36 -0.61 -0.05 0.00 0.02 0.00 0.00 54.97 54.68 2klj s GLU 120 Cb 0.19 -1.90 0.01 0.00 0.10 0.00 0.00 34.13 32.53 2klj s GLU 120 CO 0.26 0.01 0.04 0.42 0.02 0.00 0.00 175.26 176.01 2klj s ILE 121 N 0.77 3.66 -0.43 -1.63 -1.09 -1.11 -4.62 121.20 116.75 2klj s ILE 121 Ca -0.11 -0.80 0.04 0.00 -2.23 0.00 0.00 60.65 57.55 2klj s ILE 121 Cb -0.16 -2.89 0.46 0.00 -1.58 0.00 0.00 42.46 38.29 2klj s ILE 121 CO 0.02 0.10 1.51 1.41 -1.23 0.00 0.00 174.94 176.75 2klj n HIS 122 N 4.81 2.92 0.00 3.97 8.25 -0.27 -4.45 115.22 130.45 2klj n HIS 122 Ca -0.15 -2.52 0.00 0.00 -0.26 0.00 0.00 57.72 54.79 2klj n HIS 122 Cb 0.48 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.82 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 -0.79 0.00 -3.51 0.41 7.64 -1.21 -3.15 113.62 113.01 2klj n SER 123 Ca 0.51 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 60.24 2klj n SER 123 Cb 0.85 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.01 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 -0.49 -0.38 -3.43 0.05 -1.04 0.12 118.68 113.50 2klj s LEU 124 Ca 0.00 0.41 0.02 0.00 0.05 0.00 0.00 54.13 54.61 2klj s LEU 124 Cb 0.00 2.45 0.11 0.00 -2.05 0.00 0.00 46.19 46.71 2klj s LEU 124 CO 0.00 -0.73 0.14 0.21 -0.55 0.00 0.00 176.35 175.42 2klj s ASN 125 N -1.77 4.30 -0.51 1.48 2.47 0.54 -0.21 114.94 121.24 2klj s ASN 125 Ca -0.07 -2.27 -0.28 0.00 0.42 0.00 0.00 52.86 50.66 2klj s ASN 125 Cb -0.01 -1.33 0.03 0.00 -1.45 0.00 0.00 41.25 38.49 2klj s ASN 125 CO 0.01 -0.34 1.10 -0.69 -3.72 0.00 0.00 177.10 173.46 2klj s VAL 126 N 0.76 4.21 -0.12 -5.21 1.01 -0.41 -1.80 120.40 118.84 2klj s VAL 126 Ca 0.13 0.97 -0.25 0.00 0.00 0.00 0.00 61.98 62.82 2klj s VAL 126 Cb -0.21 -4.61 -0.27 0.00 0.00 0.00 0.00 36.38 31.30 2klj s VAL 126 CO -0.09 -1.09 0.73 -0.07 0.00 0.00 0.00 175.10 174.58 2klj h LEU 127 N 11.29 0.15 -8.86 3.92 -0.00 -1.72 -1.26 115.31 118.83 2klj h LEU 127 Ca -0.24 -0.93 -0.54 0.00 -0.00 0.00 0.00 57.88 56.18 2klj h LEU 127 Cb 1.06 -0.05 -0.18 0.00 -0.00 0.00 0.00 40.66 41.50 2klj h LEU 127 CO 1.12 1.20 -0.78 -0.70 -0.00 0.00 0.00 178.44 179.28 2klj s GLU 128 N -2.31 1.31 0.00 1.13 2.12 -1.10 -4.84 118.70 115.02 2klj s GLU 128 Ca -0.19 -1.43 0.00 0.00 0.36 0.00 0.00 54.97 53.71 2klj s GLU 128 Cb -0.01 -1.39 0.00 0.00 0.26 0.00 0.00 34.13 32.99 2klj s GLU 128 CO 0.72 0.28 0.00 0.41 -0.54 0.00 0.00 175.26 176.13 2klj n GLY 129 N 0.26 0.25 3.44 -1.50 0.00 -1.26 -4.24 105.19 102.13 2klj n GLY 129 Ca -0.13 -0.45 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.86 3.34 0.36 1.61 0.01 -1.26 -3.52 113.70 110.38 2klj s SER 130 Ca 0.00 -1.01 0.04 0.00 1.31 0.00 0.00 55.95 56.29 2klj s SER 130 Cb 0.00 -0.26 -0.05 0.00 0.21 0.00 0.00 66.02 65.92 2klj s SER 130 CO 0.00 0.00 0.07 0.26 0.41 0.00 0.00 173.24 173.98 2klj s TRP 131 N -2.53 1.93 -0.03 2.43 0.52 -0.71 -0.14 118.94 120.41 2klj s TRP 131 Ca 0.27 -1.04 0.01 0.00 0.02 0.00 0.00 56.10 55.36 2klj s TRP 131 Cb -0.04 -1.29 0.02 0.00 -1.15 0.00 0.00 33.47 31.01 2klj s TRP 131 CO 0.13 -0.05 -0.03 0.08 0.02 0.00 0.00 176.95 177.10 2klj s VAL 132 N -3.23 0.37 -0.02 4.03 1.01 -0.24 -1.70 120.40 120.61 2klj s VAL 132 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2klj s VAL 132 Cb 0.07 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 2klj s VAL 132 CO 0.14 0.16 0.01 -0.76 0.00 0.00 0.00 175.10 174.66 2klj s LEU 133 N 0.66 3.57 0.53 3.92 1.43 -0.97 -1.77 118.68 126.05 2klj s LEU 133 Ca -0.08 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 2klj s LEU 133 Cb -0.11 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.13 2klj s LEU 133 CO -0.01 0.30 0.20 -0.31 0.23 0.00 0.00 176.35 176.77 2klj s TYR 134 N -1.05 1.74 -0.05 0.29 1.51 0.16 0.78 117.35 120.73 2klj s TYR 134 Ca 0.18 -0.90 0.09 0.00 -1.01 0.00 0.00 57.07 55.43 2klj s TYR 134 Cb -0.12 -1.76 -0.24 0.00 -0.11 0.00 0.00 41.96 39.74 2klj s TYR 134 CO 0.09 -0.13 0.62 1.49 -1.11 0.00 0.00 175.55 176.51 2klj h GLU 135 N 1.04 0.05 0.00 -0.62 4.22 -1.73 -1.98 114.58 115.56 2klj h GLU 135 Ca -0.40 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 58.95 2klj h GLU 135 Cb 1.31 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.59 2klj h GLU 135 CO 0.66 0.63 0.00 1.47 -2.18 0.00 0.00 179.01 179.58 2klj n LEU 136 N -3.13 0.00 0.00 1.64 -0.00 -1.26 -3.03 117.00 111.23 2klj n LEU 136 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.82 2klj n LEU 136 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.47 2klj n LEU 136 CO 0.45 0.00 0.00 -1.20 -0.00 0.00 0.00 177.39 176.64 2klj n SER 137 N -0.44 0.00 -1.70 1.45 7.64 -1.26 -2.12 113.62 117.19 2klj n SER 137 Ca 0.00 -0.64 -0.02 0.00 1.01 0.00 0.00 58.87 59.21 2klj n SER 137 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 2klj n SER 137 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2klj n ASN 138 N -1.93 -1.05 -3.83 6.43 0.23 0.06 -2.24 115.26 112.92 2klj n ASN 138 Ca 0.00 0.23 -0.29 0.00 -0.53 0.00 0.00 54.58 53.99 2klj n ASN 138 Cb 0.00 -1.21 0.00 0.00 -2.08 0.00 0.00 39.78 36.50 2klj n ASN 138 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2klj n TYR 139 N -1.84 -1.80 -2.75 -2.53 4.02 -1.26 -4.91 117.16 106.10 2klj n TYR 139 Ca -0.03 0.63 -0.04 0.00 -0.01 0.00 0.00 57.90 58.45 2klj n TYR 139 Cb 0.28 -2.63 0.04 0.00 -0.02 0.00 0.00 39.34 37.01 2klj n TYR 139 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2klj n ARG 140 N -3.09 1.53 0.00 -0.72 3.00 -0.95 -5.08 116.66 111.35 2klj n ARG 140 Ca -0.27 -3.42 0.00 0.00 -0.00 0.00 0.00 57.85 54.16 2klj n ARG 140 Cb 0.64 -1.47 0.00 0.00 0.00 0.00 0.00 32.46 31.63 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 -0.38 4.42 3.88 5.14 0.00 -1.26 -4.91 105.19 112.08 2klj n GLY 141 Ca 0.09 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 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 3.58 1.10 -0.07 1.61 1.81 -1.26 -4.81 118.95 120.91 2klj s ARG 142 Ca 0.00 -0.10 -0.13 0.00 -1.72 0.00 0.00 55.73 53.78 2klj s ARG 142 Cb 0.00 -1.87 0.03 0.00 -0.45 0.00 0.00 34.95 32.66 2klj s ARG 142 CO 0.00 -2.15 0.30 1.14 -0.68 0.00 0.00 175.30 173.91 2klj s GLN 143 N -5.67 0.51 0.31 3.54 0.00 -1.25 -2.61 119.66 114.50 2klj s GLN 143 Ca 0.68 0.11 0.03 0.00 -0.00 0.00 0.00 55.36 56.18 2klj s GLN 143 Cb -0.08 0.23 -0.06 0.00 0.00 0.00 0.00 33.01 33.10 2klj s GLN 143 CO 0.52 -0.11 0.08 0.71 0.00 0.00 0.00 175.29 176.48 2klj s TYR 144 N -0.59 1.81 -0.06 9.60 2.02 0.23 -4.92 117.35 125.45 2klj s TYR 144 Ca -0.07 -1.06 0.02 0.00 -0.37 0.00 0.00 57.07 55.59 2klj s TYR 144 Cb -0.04 -1.15 0.01 0.00 -0.40 0.00 0.00 41.96 40.39 2klj s TYR 144 CO 0.02 -0.13 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.58 2klj s LEU 145 N -3.44 1.63 -0.22 -1.29 2.96 -1.26 -2.30 118.68 114.75 2klj s LEU 145 Ca 0.36 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 2klj s LEU 145 Cb 0.08 -0.80 0.05 0.00 0.50 0.00 0.00 46.19 46.02 2klj s LEU 145 CO 0.15 0.03 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.33 2klj s LEU 146 N 0.67 2.72 0.79 -0.68 2.01 -0.69 -4.96 118.68 118.54 2klj s LEU 146 Ca -0.14 -1.07 -0.11 0.00 0.01 0.00 0.00 54.13 52.82 2klj s LEU 146 Cb -0.16 -1.38 0.08 0.00 0.01 0.00 0.00 46.19 44.74 2klj s LEU 146 CO 0.03 -0.15 1.15 -0.04 1.01 0.00 0.00 176.35 178.36 2klj s MET 147 N 1.27 1.99 -0.26 1.70 -1.94 -1.26 -1.73 119.30 119.06 2klj s MET 147 Ca -0.04 0.04 -0.28 0.00 -1.71 0.00 0.00 55.69 53.70 2klj s MET 147 Cb -0.17 -1.99 -0.05 0.00 2.01 0.00 0.00 34.83 34.63 2klj s MET 147 CO -0.08 -1.55 2.21 -2.14 -0.01 0.00 0.00 175.02 173.46 2klj s PRO 148 N -5.52 3.01 0.00 2.03 0.02 -1.23 -4.70 135.00 128.61 2klj s PRO 148 Ca 0.62 1.90 0.00 0.00 0.02 0.00 0.00 61.00 63.54 2klj s PRO 148 Cb -0.11 -4.39 0.00 0.00 0.02 0.00 0.00 34.50 30.02 2klj s PRO 148 CO 0.48 -2.24 0.00 0.41 -0.33 0.00 0.00 177.00 175.33 2klj n GLY 149 N 5.77 0.33 3.74 0.52 0.00 -0.47 -5.00 105.19 110.08 2klj n GLY 149 Ca 0.30 -0.95 -0.36 0.00 0.00 0.00 0.00 46.02 45.01 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 6.42 -0.08 1.61 2.15 -1.26 -1.29 116.67 124.22 2klj s ASP 150 Ca 0.00 0.49 0.05 0.00 0.43 0.00 0.00 52.55 53.52 2klj s ASP 150 Cb 0.00 -2.17 -0.01 0.00 -0.30 0.00 0.00 42.92 40.44 2klj s ASP 150 CO 0.00 0.13 -0.23 -0.31 -0.17 0.00 0.00 175.17 174.59 2klj s TYR 151 N 0.35 2.53 -1.62 -5.34 1.51 0.70 -5.01 117.35 110.47 2klj s TYR 151 Ca 0.16 -0.75 0.14 0.00 -1.01 0.00 0.00 57.07 55.61 2klj s TYR 151 Cb -0.13 -1.66 0.20 0.00 -0.11 0.00 0.00 41.96 40.26 2klj s TYR 151 CO 0.04 -0.23 1.07 0.54 -1.11 0.00 0.00 175.55 175.85 2klj n ARG 152 N 3.10 1.54 -3.81 -0.62 5.12 -1.26 -2.48 116.66 118.25 2klj n ARG 152 Ca -0.18 -1.61 -0.01 0.00 -1.93 0.00 0.00 57.85 54.12 2klj n ARG 152 Cb 0.52 -1.30 0.00 0.00 -1.16 0.00 0.00 32.46 30.53 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 -1.14 0.97 0.32 5.56 1.70 -1.22 -1.72 118.95 123.42 2klj s ARG 153 Ca 0.21 -0.59 0.17 0.00 -0.47 0.00 0.00 55.73 55.05 2klj s ARG 153 Cb 0.13 0.30 0.27 0.00 -0.57 0.00 0.00 34.95 35.08 2klj s ARG 153 CO 0.19 -0.45 1.54 0.10 -1.08 0.00 0.00 175.30 175.60 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.83 -3.15 116.97 119.88 2klj h TYR 154 Ca -0.27 0.00 -0.04 0.00 -0.00 0.00 0.00 58.73 58.43 2klj h TYR 154 Cb 1.21 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.94 2klj h TYR 154 CO 0.88 0.41 -0.19 1.96 -0.00 0.00 0.00 178.16 181.22 2klj h GLN 155 N 0.00 0.00 -0.73 0.10 4.20 -1.96 -2.80 115.11 113.93 2klj h GLN 155 Ca -0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.78 2klj h GLN 155 Cb 1.21 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.93 2klj h GLN 155 CO 0.05 0.19 0.40 -0.44 -0.67 0.00 0.00 178.83 178.36 2klj h ASP 156 N 0.00 0.57 -0.55 1.46 3.32 -1.93 0.77 116.42 120.06 2klj h ASP 156 Ca -0.00 0.04 -0.14 0.00 0.02 0.00 0.00 57.03 56.95 2klj h ASP 156 Cb 0.83 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 40.22 2klj h ASP 156 CO 0.02 0.35 0.18 -2.67 -1.72 0.00 0.00 179.24 175.41 2klj n TRP 157 N -4.79 1.85 -3.27 4.55 2.14 -1.21 -4.94 117.44 111.77 2klj n TRP 157 Ca 0.11 -0.90 -0.10 0.00 2.07 0.00 0.00 57.50 58.67 2klj n TRP 157 Cb 0.22 -0.55 0.00 0.00 -0.81 0.00 0.00 31.31 30.18 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 0.02 -1.18 3.02 -1.67 0.00 0.26 -4.86 105.19 100.79 2klj n GLY 158 Ca 0.30 0.65 -0.22 0.00 0.00 0.00 0.00 46.02 46.75 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 1.02 0.44 4.61 0.00 -1.06 -5.02 121.76 118.90 2klj s ALA 159 Ca 0.05 -0.39 0.12 0.00 0.00 0.00 0.00 51.96 51.75 2klj s ALA 159 Cb -0.01 -0.40 0.96 0.00 0.00 0.00 0.00 23.12 23.67 2klj s ALA 159 CO 0.80 0.15 2.00 0.00 0.00 0.00 0.00 175.76 178.71 2klj h THR 160 N 5.51 1.12 -2.72 0.00 1.03 -1.95 -3.40 112.91 112.50 2klj h THR 160 Ca -0.33 -0.55 -0.07 0.00 -0.01 0.00 0.00 66.41 65.46 2klj h THR 160 Cb 1.17 1.18 -0.17 0.00 -1.07 0.00 0.00 68.15 69.26 2klj h THR 160 CO 0.48 0.17 0.02 0.20 -0.01 0.00 0.00 175.52 176.38 2klj s ASN 161 N -6.95 -0.44 0.47 0.00 0.02 -1.26 -5.03 114.94 101.75 2klj s ASN 161 Ca -0.05 0.22 0.26 0.00 -1.02 0.00 0.00 52.86 52.27 2klj s ASN 161 Cb 0.16 0.48 0.92 0.00 0.02 0.00 0.00 41.25 42.83 2klj s ASN 161 CO 0.71 -0.68 1.82 0.00 0.02 0.00 0.00 177.10 178.96 2klj h ALA 162 N 2.90 0.99 -0.45 0.60 0.00 -1.86 -3.46 119.26 117.97 2klj h ALA 162 Ca -0.30 -0.13 -0.65 0.00 0.00 0.00 0.00 54.91 53.84 2klj h ALA 162 Cb 1.20 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2klj h ALA 162 CO 0.41 0.17 0.74 0.54 0.00 0.00 0.00 179.25 181.11 2klj n ARG 163 N -3.24 0.00 -3.71 0.00 1.74 -1.26 -2.76 116.66 107.43 2klj n ARG 163 Ca 0.01 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.94 2klj n ARG 163 Cb 0.43 -1.16 -0.15 0.00 -1.02 0.00 0.00 32.46 30.56 2klj n ARG 163 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2klj s VAL 164 N 3.30 -0.14 -0.20 1.55 0.11 -0.60 -4.52 120.40 119.90 2klj s VAL 164 Ca 0.86 0.25 0.15 0.00 -2.93 0.00 0.00 61.98 60.32 2klj s VAL 164 Cb -1.16 -0.26 -0.22 0.00 -1.53 0.00 0.00 36.38 33.21 2klj s VAL 164 CO 0.58 0.10 0.41 0.61 -3.33 0.00 0.00 175.10 173.48 2klj n GLY 165 N 4.67 -0.62 3.67 6.54 0.00 -0.74 -4.61 105.19 114.10 2klj n GLY 165 Ca -0.18 -0.38 -0.07 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.40 -0.33 -0.05 1.61 1.04 -0.90 -0.70 113.70 110.96 2klj s SER 166 Ca -0.03 -0.32 -0.29 0.00 0.48 0.00 0.00 55.95 55.80 2klj s SER 166 Cb 0.10 0.58 0.10 0.00 0.10 0.00 0.00 66.02 66.90 2klj s SER 166 CO 0.63 -1.02 0.88 -1.48 0.98 0.00 0.00 173.24 173.23 2klj s LEU 167 N -2.82 -0.42 0.33 2.42 2.34 -0.09 0.37 118.68 120.82 2klj s LEU 167 Ca 0.08 0.24 0.05 0.00 0.06 0.00 0.00 54.13 54.56 2klj s LEU 167 Cb -0.03 2.07 -0.03 0.00 -0.56 0.00 0.00 46.19 47.64 2klj s LEU 167 CO -0.01 -0.54 0.22 0.00 -1.06 0.00 0.00 176.35 174.95 2klj s ARG 168 N -2.20 1.73 -0.16 1.48 1.70 -0.73 0.34 118.95 121.12 2klj s ARG 168 Ca 0.00 -2.01 -0.06 0.00 -0.47 0.00 0.00 55.73 53.19 2klj s ARG 168 Cb -0.01 0.09 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 2klj s ARG 168 CO -0.03 -0.58 0.06 -0.98 -1.08 0.00 0.00 175.30 172.70 2klj s ARG 169 N -3.60 3.74 -1.16 3.89 3.03 -1.26 -1.08 118.95 122.50 2klj s ARG 169 Ca 0.36 -0.32 -0.14 0.00 2.03 0.00 0.00 55.73 57.66 2klj s ARG 169 Cb 0.03 -3.14 -0.06 0.00 -1.03 0.00 0.00 34.95 30.75 2klj s ARG 169 CO 0.23 0.42 2.24 0.28 -1.13 0.00 0.00 175.30 177.34 2klj n VAL 170 N 3.07 2.89 -4.05 4.99 0.31 0.80 -4.85 118.33 121.49 2klj n VAL 170 Ca -0.17 -2.16 -0.33 0.00 -0.01 0.00 0.00 64.34 61.66 2klj n VAL 170 Cb 0.53 -2.42 -0.15 0.00 -0.91 0.00 0.00 33.84 30.89 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 3.61 2.40 -0.19 2.52 1.09 -1.26 -4.56 121.20 124.80 2klj s ILE 171 Ca 0.53 -1.08 0.16 0.00 -1.10 0.00 0.00 60.65 59.16 2klj s ILE 171 Cb 0.14 -2.16 0.11 0.00 -1.06 0.00 0.00 42.46 39.49 2klj s ILE 171 CO -0.01 0.32 1.48 -0.78 -0.10 0.00 0.00 174.94 175.85 2klj h ASP 172 N 7.94 0.00 0.00 3.58 3.58 -1.88 -3.44 116.42 126.19 2klj h ASP 172 Ca -0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2klj h ASP 172 Cb 1.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.16 2klj h ASP 172 CO 0.58 0.42 0.00 0.49 -2.88 0.00 0.00 179.24 177.85 2klj n PHE 173 N -3.21 0.00 -1.40 0.28 3.72 -1.26 -4.92 117.46 110.66 2klj n PHE 173 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2klj n PHE 173 Cb 0.70 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.24 2klj n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16