#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 -1.19 0.00 2.61 0.00 -1.15 -4.61 105.19 100.85 2klj n GLY 2 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2klj n GLY 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2klj n LYS 3 N -3.48 0.00 -4.45 1.61 5.02 -1.24 -4.55 118.16 111.07 2klj n LYS 3 Ca -0.03 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 55.99 2klj n LYS 3 Cb 0.25 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.17 2klj n LYS 3 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2klj s ILE 4 N 0.00 2.23 -0.40 -0.18 -0.00 -1.01 -0.55 121.20 121.28 2klj s ILE 4 Ca 0.00 -1.97 0.02 0.00 -0.00 0.00 0.00 60.65 58.70 2klj s ILE 4 Cb 0.00 -2.89 0.12 0.00 -0.00 0.00 0.00 42.46 39.69 2klj s ILE 4 CO 0.00 -0.08 0.18 -0.89 -0.00 0.00 0.00 174.94 174.15 2klj s THR 5 N -2.63 1.52 0.06 8.37 2.01 0.26 -1.80 115.64 123.43 2klj s THR 5 Ca 0.36 -2.30 -0.30 0.00 0.31 0.00 0.00 61.69 59.75 2klj s THR 5 Cb 0.05 -2.09 -0.05 0.00 0.01 0.00 0.00 72.50 70.42 2klj s THR 5 CO 0.19 -0.78 1.06 -0.76 -0.69 0.00 0.00 174.62 173.64 2klj s LEU 6 N 0.70 4.40 -0.14 4.42 1.43 0.60 -2.41 118.68 127.68 2klj s LEU 6 Ca 0.14 1.85 -0.00 0.00 -1.03 0.00 0.00 54.13 55.09 2klj s LEU 6 Cb -0.22 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2klj s LEU 6 CO -0.08 -0.30 -0.13 -0.31 0.23 0.00 0.00 176.35 175.77 2klj s TYR 7 N 0.72 2.82 0.26 0.29 1.51 0.19 -0.32 117.35 122.81 2klj s TYR 7 Ca 0.53 -0.70 -0.04 0.00 -1.01 0.00 0.00 57.07 55.84 2klj s TYR 7 Cb -0.25 -1.86 0.33 0.00 -0.11 0.00 0.00 41.96 40.07 2klj s TYR 7 CO 0.30 -0.26 1.90 1.49 -1.11 0.00 0.00 175.55 177.86 2klj h GLU 8 N 6.85 1.19 -6.63 -0.62 4.22 0.12 0.74 114.58 120.45 2klj h GLU 8 Ca -0.27 -0.07 -0.46 0.00 0.08 0.00 0.00 59.36 58.64 2klj h GLU 8 Cb 1.21 -0.27 0.03 0.00 0.50 0.00 0.00 28.75 30.22 2klj h GLU 8 CO 0.56 0.79 -0.13 0.34 -2.18 0.00 0.00 179.01 178.39 2klj s ASP 9 N -5.97 5.24 0.02 1.04 2.15 -1.25 -3.11 116.67 114.79 2klj s ASP 9 Ca -0.13 -0.59 -0.06 0.00 0.43 0.00 0.00 52.55 52.21 2klj s ASP 9 Cb 0.19 -0.16 -0.05 0.00 -0.30 0.00 0.00 42.92 42.60 2klj s ASP 9 CO 0.81 -1.17 0.27 0.00 -0.17 0.00 0.00 175.17 174.92 2klj s ARG 10 N -4.61 3.58 0.00 4.34 1.04 -1.26 -4.09 118.95 117.95 2klj s ARG 10 Ca 0.59 -0.09 0.00 0.00 -1.04 0.00 0.00 55.73 55.19 2klj s ARG 10 Cb -0.08 -3.06 0.00 0.00 -2.04 0.00 0.00 34.95 29.77 2klj s ARG 10 CO 0.37 0.63 0.00 0.41 -0.04 0.00 0.00 175.30 176.68 2klj n GLY 11 N 1.00 0.68 3.29 3.88 0.00 -0.53 -4.08 105.19 109.43 2klj n GLY 11 Ca -0.10 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.90 -2.35 -2.40 1.61 3.72 -1.26 -5.02 117.46 108.86 2klj n PHE 12 Ca 0.00 0.88 0.00 0.00 -0.05 0.00 0.00 57.45 58.28 2klj n PHE 12 Cb 0.15 -4.43 0.00 0.00 -0.94 0.00 0.00 39.48 34.26 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 -3.51 2.11 0.00 -1.08 6.02 -1.26 -5.07 117.38 114.60 2klj n GLN 13 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 2klj n GLN 13 Cb 0.64 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.90 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 2.64 0.80 3.79 1.08 0.00 -1.26 -3.79 105.19 108.46 2klj n GLY 14 Ca 0.00 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 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 4.03 0.10 1.61 3.00 -1.26 -4.81 118.95 121.62 2klj s ARG 15 Ca 0.00 1.49 0.03 0.00 0.00 0.00 0.00 55.73 57.25 2klj s ARG 15 Cb 0.00 -2.40 -0.04 0.00 0.00 0.00 0.00 34.95 32.51 2klj s ARG 15 CO 0.00 -0.26 -0.09 -3.38 0.00 0.00 0.00 175.30 171.57 2klj s HIS 16 N -1.74 1.01 -0.11 -0.53 -3.43 -1.26 0.74 115.29 109.97 2klj s HIS 16 Ca 0.61 -0.75 -0.09 0.00 -0.80 0.00 0.00 55.06 54.02 2klj s HIS 16 Cb -0.21 -0.56 0.03 0.00 -1.43 0.00 0.00 32.58 30.42 2klj s HIS 16 CO 0.26 -0.04 0.29 -0.47 -2.00 0.00 0.00 174.74 172.78 2klj s TYR 17 N -2.95 -0.35 -0.18 0.38 5.04 0.56 -4.98 117.35 114.88 2klj s TYR 17 Ca 0.09 0.82 -0.06 0.00 -2.44 0.00 0.00 57.07 55.48 2klj s TYR 17 Cb 0.01 0.11 -0.03 0.00 0.35 0.00 0.00 41.96 42.39 2klj s TYR 17 CO -0.02 -0.18 0.03 -2.00 -1.34 0.00 0.00 175.55 172.04 2klj s GLU 18 N 0.47 3.84 -0.18 4.97 2.12 -1.26 -0.29 118.70 128.37 2klj s GLU 18 Ca -0.03 -0.42 -0.00 0.00 0.36 0.00 0.00 54.97 54.89 2klj s GLU 18 Cb -0.04 -3.13 0.01 0.00 0.26 0.00 0.00 34.13 31.23 2klj s GLU 18 CO -0.02 0.21 -0.16 0.00 -0.54 0.00 0.00 175.26 174.75 2klj n SER 20 N 4.41 1.99 -3.49 0.00 3.41 -1.26 -2.41 113.62 116.26 2klj n SER 20 Ca -0.20 -2.25 -0.08 0.00 -0.26 0.00 0.00 58.87 56.08 2klj n SER 20 Cb 0.51 -0.12 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 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 -1.46 -0.12 0.22 4.04 0.15 -1.26 -4.74 113.70 110.52 2klj s SER 21 Ca 0.09 -0.86 -0.32 0.00 0.70 0.00 0.00 55.95 55.56 2klj s SER 21 Cb 0.07 0.77 -0.13 0.00 -1.71 0.00 0.00 66.02 65.03 2klj s SER 21 CO 0.01 -1.47 1.61 -0.90 1.20 0.00 0.00 173.24 173.69 2klj n ASP 22 N -0.85 3.55 -4.02 5.45 5.75 -1.26 -4.37 116.55 120.79 2klj n ASP 22 Ca -0.05 1.10 -0.21 0.00 -0.01 0.00 0.00 54.79 55.61 2klj n ASP 22 Cb 0.60 -1.52 -0.15 0.00 -1.03 0.00 0.00 41.12 39.01 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 0.69 1.02 -0.02 2.11 2.46 0.16 -4.98 115.29 116.73 2klj s HIS 23 Ca 0.73 -0.25 0.12 0.00 0.47 0.00 0.00 55.06 56.13 2klj s HIS 23 Cb -0.57 -0.71 -0.18 0.00 -0.13 0.00 0.00 32.58 30.99 2klj s HIS 23 CO 0.39 -0.09 0.26 0.25 -2.47 0.00 0.00 174.74 173.08 2klj n THR 24 N 3.18 0.00 -3.63 0.89 -2.24 -1.26 -1.68 114.28 109.55 2klj n THR 24 Ca -0.17 -0.27 -0.29 0.00 -2.27 0.00 0.00 64.05 61.05 2klj n THR 24 Cb 0.55 0.24 -0.15 0.00 -2.10 0.00 0.00 70.33 68.87 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 -3.33 3.62 0.00 3.42 2.47 -1.21 -0.26 114.94 119.65 2klj s ASN 25 Ca -0.04 -1.35 0.27 0.00 0.42 0.00 0.00 52.86 52.15 2klj s ASN 25 Cb 0.07 -0.54 0.79 0.00 -1.45 0.00 0.00 41.25 40.12 2klj s ASN 25 CO 0.48 -0.42 1.59 0.18 -3.72 0.00 0.00 177.10 175.21 2klj n LEU 26 N 5.09 0.99 0.01 3.21 4.77 0.47 -4.20 117.00 127.35 2klj n LEU 26 Ca -0.05 -0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 55.58 2klj n LEU 26 Cb 0.43 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.34 2klj n LEU 26 CO 0.07 0.19 0.87 1.56 -1.33 0.00 0.00 177.39 178.75 2klj h GLN 27 N 1.18 0.03 -0.15 3.23 4.20 -1.74 0.30 115.11 122.16 2klj h GLN 27 Ca 0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2klj h GLN 27 Cb 0.50 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2klj h GLN 27 CO 0.00 0.02 0.00 -0.35 -0.67 0.00 0.00 178.83 177.83 2klj n PRO 28 N -5.11 0.31 0.00 1.46 -0.04 -1.26 -3.04 135.00 127.33 2klj n PRO 28 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2klj n PRO 28 Cb 0.06 -1.08 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 -0.09 0.00 -4.77 0.54 4.01 -0.70 -5.10 117.16 111.05 2klj n TYR 29 Ca 0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.49 2klj n TYR 29 Cb 0.04 0.31 -0.16 0.00 -0.31 0.00 0.00 39.34 39.21 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 -4.77 1.89 0.07 7.72 1.43 0.96 -4.78 118.68 121.20 2klj s LEU 30 Ca 0.00 -0.33 -0.03 0.00 -1.03 0.00 0.00 54.13 52.74 2klj s LEU 30 Cb 0.00 -0.91 -0.28 0.00 0.03 0.00 0.00 46.19 45.03 2klj s LEU 30 CO 0.00 0.14 1.14 -1.28 0.23 0.00 0.00 176.35 176.57 2klj h SER 31 N 6.30 0.39 0.00 2.29 0.87 -1.84 -3.38 113.55 118.18 2klj h SER 31 Ca -0.32 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 59.81 2klj h SER 31 Cb 1.17 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2klj h SER 31 CO 0.48 1.33 -0.47 0.54 -0.53 0.00 0.00 176.83 178.19 2klj n ARG 32 N -3.51 0.46 -3.25 2.24 1.74 -1.26 -4.93 116.66 108.15 2klj n ARG 32 Ca -0.08 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.91 2klj n ARG 32 Cb 1.02 -0.73 0.02 0.00 -1.02 0.00 0.00 32.46 31.74 2klj n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2klj n ASN 34 N -2.21 6.03 0.00 0.00 6.94 0.25 -4.71 115.26 121.56 2klj n ASN 34 Ca -0.07 -3.76 0.00 0.00 -0.02 0.00 0.00 54.58 50.73 2klj n ASN 34 Cb 0.56 -0.78 0.00 0.00 -2.36 0.00 0.00 39.78 37.20 2klj n ASN 34 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2klj n SER 35 N -0.92 0.00 -3.71 0.53 3.41 -1.20 -3.06 113.62 108.67 2klj n SER 35 Ca 0.55 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 59.02 2klj n SER 35 Cb 0.89 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.76 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 -1.33 -1.02 -0.04 7.33 0.00 0.31 0.53 121.76 127.53 2klj s ALA 36 Ca 0.00 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.60 2klj s ALA 36 Cb 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.12 2klj s ALA 36 CO 0.00 -0.28 -0.04 1.03 0.00 0.00 0.00 175.76 176.48 2klj s ARG 37 N -1.13 0.75 -0.12 0.00 0.52 -1.01 0.45 118.95 118.41 2klj s ARG 37 Ca -0.12 -0.07 -0.03 0.00 -0.52 0.00 0.00 55.73 54.99 2klj s ARG 37 Cb -0.04 -0.80 -0.03 0.00 0.52 0.00 0.00 34.95 34.60 2klj s ARG 37 CO 0.05 -0.10 -0.00 0.08 0.02 0.00 0.00 175.30 175.35 2klj s VAL 38 N 0.98 4.26 -0.20 3.52 1.01 -0.98 0.91 120.40 129.89 2klj s VAL 38 Ca -0.10 -0.25 -0.20 0.00 0.00 0.00 0.00 61.98 61.43 2klj s VAL 38 Cb -0.14 -2.83 -0.17 0.00 0.00 0.00 0.00 36.38 33.23 2klj s VAL 38 CO -0.00 0.55 0.15 -0.67 0.00 0.00 0.00 175.10 175.13 2klj n ASP 39 N 2.75 1.86 -3.15 3.32 2.03 0.28 -3.98 116.55 119.66 2klj n ASP 39 Ca -0.18 0.44 0.06 0.00 0.52 0.00 0.00 54.79 55.63 2klj n ASP 39 Cb 0.53 -0.95 -0.00 0.00 -0.72 0.00 0.00 41.12 39.98 2klj n ASP 39 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2klj s SER 40 N -6.77 -0.37 0.00 1.67 0.15 -1.26 -4.93 113.70 102.18 2klj s SER 40 Ca -0.28 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2klj s SER 40 Cb 0.06 1.25 0.00 0.00 -1.71 0.00 0.00 66.02 65.62 2klj s SER 40 CO 0.55 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.53 2klj n GLY 41 N 5.15 -0.55 3.65 9.45 0.00 -1.26 -2.94 105.19 118.69 2klj n GLY 41 Ca 0.07 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.19 2klj n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klj s TRP 43 N -1.27 -0.28 -0.08 0.00 0.52 0.23 -2.53 118.94 115.53 2klj s TRP 43 Ca 0.24 0.69 0.04 0.00 0.02 0.00 0.00 56.10 57.09 2klj s TRP 43 Cb -0.11 0.10 0.00 0.00 -1.15 0.00 0.00 33.47 32.30 2klj s TRP 43 CO 0.16 -0.15 -0.21 1.41 0.02 0.00 0.00 176.95 178.18 2klj s MET 44 N 0.07 2.60 0.09 4.98 1.75 -0.62 0.83 119.30 128.99 2klj s MET 44 Ca -0.01 -0.77 0.07 0.00 -1.25 0.00 0.00 55.69 53.73 2klj s MET 44 Cb -0.02 -2.04 -0.04 0.00 2.84 0.00 0.00 34.83 35.57 2klj s MET 44 CO 0.01 0.19 -0.12 -0.51 -0.65 0.00 0.00 175.02 173.93 2klj s LEU 45 N 0.29 2.92 -0.05 4.11 1.43 -0.97 -0.96 118.68 125.45 2klj s LEU 45 Ca -0.14 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.60 2klj s LEU 45 Cb -0.16 -1.73 -0.00 0.00 0.03 0.00 0.00 46.19 44.33 2klj s LEU 45 CO 0.07 0.20 -0.16 -0.31 0.23 0.00 0.00 176.35 176.38 2klj s TYR 46 N -1.13 1.63 0.41 0.29 1.51 0.20 -1.48 117.35 118.77 2klj s TYR 46 Ca 0.19 -0.49 0.08 0.00 -1.01 0.00 0.00 57.07 55.84 2klj s TYR 46 Cb -0.11 -1.11 0.85 0.00 -0.11 0.00 0.00 41.96 41.48 2klj s TYR 46 CO 0.11 -0.18 2.03 1.05 -1.11 0.00 0.00 175.55 177.45 2klj h GLU 47 N 6.37 0.47 -6.20 -0.62 4.11 -1.28 -1.48 114.58 115.96 2klj h GLU 47 Ca -0.32 -0.04 -0.66 0.00 0.07 0.00 0.00 59.36 58.41 2klj h GLU 47 Cb 1.18 -0.10 -0.12 0.00 0.50 0.00 0.00 28.75 30.21 2klj h GLU 47 CO 0.48 0.36 -0.63 -0.65 0.07 0.00 0.00 179.01 178.63 2klj s GLN 48 N -5.32 2.77 1.00 1.06 -0.21 -0.35 -3.12 119.66 115.50 2klj s GLN 48 Ca -0.08 -0.67 -0.11 0.00 0.02 0.00 0.00 55.36 54.52 2klj s GLN 48 Cb 0.17 -2.67 0.19 0.00 1.00 0.00 0.00 33.01 31.71 2klj s GLN 48 CO 0.73 0.59 1.09 -1.25 -2.12 0.00 0.00 175.29 174.34 2klj s PRO 49 N -1.94 0.36 -1.53 2.91 0.04 -1.26 -2.34 135.00 131.23 2klj s PRO 49 Ca 0.23 1.17 -0.04 0.00 0.04 0.00 0.00 61.00 62.41 2klj s PRO 49 Cb -0.12 -1.68 0.01 0.00 0.04 0.00 0.00 34.50 32.76 2klj s PRO 49 CO 0.15 -2.96 0.46 0.09 0.04 0.00 0.00 177.00 174.77 2klj n ASN 50 N -4.43 -5.62 -3.09 6.66 5.03 0.64 -3.53 115.26 110.92 2klj n ASN 50 Ca 0.08 -0.23 -0.19 0.00 0.87 0.00 0.00 54.58 55.11 2klj n ASN 50 Cb 0.53 -4.59 0.02 0.00 -1.02 0.00 0.00 39.78 34.72 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 -4.29 -3.20 -3.86 3.10 4.01 -1.23 -5.04 117.16 106.66 2klj n TYR 51 Ca -0.12 1.30 -0.11 0.00 -0.16 0.00 0.00 57.90 58.81 2klj n TYR 51 Cb 0.62 -3.30 -0.09 0.00 -0.31 0.00 0.00 39.34 36.26 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 -2.24 0.05 0.00 7.72 0.15 -0.99 -5.04 113.70 113.35 2klj s SER 52 Ca 0.29 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.61 2klj s SER 52 Cb -0.06 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2klj s SER 52 CO 0.81 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 175.37 2klj n GLY 53 N 0.97 -0.11 3.74 9.45 0.00 -1.26 -1.21 105.19 116.78 2klj n GLY 53 Ca -0.20 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.09 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 4.52 0.39 0.99 2.96 -1.26 -4.86 118.68 121.42 2klj s LEU 54 Ca 0.00 1.71 0.05 0.00 -0.22 0.00 0.00 54.13 55.67 2klj s LEU 54 Cb 0.00 -3.47 -0.06 0.00 0.50 0.00 0.00 46.19 43.16 2klj s LEU 54 CO 0.00 0.02 0.03 0.00 -1.32 0.00 0.00 176.35 175.09 2klj s GLN 55 N -0.34 1.88 -0.08 1.98 0.00 -1.26 -1.29 119.66 120.55 2klj s GLN 55 Ca 0.42 -2.08 -0.04 0.00 -0.00 0.00 0.00 55.36 53.66 2klj s GLN 55 Cb -0.23 -1.32 0.04 0.00 0.00 0.00 0.00 33.01 31.51 2klj s GLN 55 CO 0.28 -0.15 0.19 0.71 0.00 0.00 0.00 175.29 176.31 2klj s TYR 56 N -2.95 -0.23 -0.01 9.60 1.51 -0.55 -4.92 117.35 119.79 2klj s TYR 56 Ca 0.32 0.61 -0.28 0.00 -1.01 0.00 0.00 57.07 56.71 2klj s TYR 56 Cb 0.08 -0.04 -0.03 0.00 -0.11 0.00 0.00 41.96 41.86 2klj s TYR 56 CO 0.15 -0.20 0.88 0.12 -1.11 0.00 0.00 175.55 175.39 2klj s PHE 57 N 1.27 3.64 0.00 2.71 5.36 -1.26 -2.30 117.98 127.40 2klj s PHE 57 Ca -0.09 1.55 0.07 0.00 -0.96 0.00 0.00 56.93 57.50 2klj s PHE 57 Cb -0.11 -3.00 -0.02 0.00 -0.34 0.00 0.00 43.02 39.55 2klj s PHE 57 CO -0.07 0.05 -0.22 -0.51 -1.46 0.00 0.00 175.22 173.01 2klj s LEU 58 N 0.84 2.08 0.14 6.12 1.02 0.24 -4.90 118.68 124.23 2klj s LEU 58 Ca 0.46 -0.44 -0.03 0.00 0.02 0.00 0.00 54.13 54.14 2klj s LEU 58 Cb -0.20 -1.08 -0.03 0.00 0.02 0.00 0.00 46.19 44.89 2klj s LEU 58 CO 0.25 0.24 0.12 -0.13 0.02 0.00 0.00 176.35 176.84 2klj s ARG 59 N -0.74 1.00 -0.29 1.70 0.52 -1.26 -0.60 118.95 119.28 2klj s ARG 59 Ca 0.08 -1.38 -0.20 0.00 -0.52 0.00 0.00 55.73 53.72 2klj s ARG 59 Cb -0.09 0.28 -0.09 0.00 0.52 0.00 0.00 34.95 35.57 2klj s ARG 59 CO 0.00 -0.31 1.08 -2.13 0.02 0.00 0.00 175.30 173.96 2klj n ARG 60 N -0.13 0.00 0.00 3.54 3.00 -1.24 -4.79 116.66 117.03 2klj n ARG 60 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 2klj n ARG 60 Cb 0.64 -0.72 0.00 0.00 0.00 0.00 0.00 32.46 32.38 2klj n ARG 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2klj n GLY 61 N 3.50 1.37 3.63 5.14 0.00 -1.26 -5.01 105.19 112.56 2klj n GLY 61 Ca 0.27 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 2klj n GLY 61 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2klj s ASP 62 N 0.00 5.98 -0.29 1.61 -1.08 -1.26 -2.33 116.67 119.29 2klj s ASP 62 Ca 0.00 0.07 0.03 0.00 -0.52 0.00 0.00 52.55 52.12 2klj s ASP 62 Cb 0.00 -2.08 0.08 0.00 -1.46 0.00 0.00 42.92 39.46 2klj s ASP 62 CO 0.00 0.05 -0.01 -0.31 0.52 0.00 0.00 175.17 175.42 2klj s TYR 63 N 1.13 3.18 -2.15 -5.34 2.02 0.17 -4.95 117.35 111.40 2klj s TYR 63 Ca 0.07 -2.46 0.28 0.00 -0.37 0.00 0.00 57.07 54.59 2klj s TYR 63 Cb -0.14 -2.27 0.99 0.00 -0.40 0.00 0.00 41.96 40.14 2klj s TYR 63 CO 0.05 -0.89 1.71 0.00 -1.57 0.00 0.00 175.55 174.85 2klj n ALA 64 N 4.44 2.77 -2.85 3.71 0.00 -1.26 0.11 120.51 127.43 2klj n ALA 64 Ca -0.05 -0.41 -0.09 0.00 0.00 0.00 0.00 53.44 52.89 2klj n ALA 64 Cb 0.42 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 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 -2.21 -0.03 0.18 0.00 1.01 -1.17 -1.45 116.67 112.99 2klj s ASP 65 Ca 0.33 -0.74 -0.01 0.00 0.71 0.00 0.00 52.55 52.84 2klj s ASP 65 Cb 0.20 0.46 0.08 0.00 1.01 0.00 0.00 42.92 44.68 2klj s ASP 65 CO 0.41 -0.91 1.45 1.12 0.21 0.00 0.00 175.17 177.45 2klj h HIS 66 N 2.48 0.51 -0.19 4.23 2.07 -1.85 -3.02 115.15 119.38 2klj h HIS 66 Ca -0.31 -0.22 0.05 0.00 -2.85 0.00 0.00 60.37 57.04 2klj h HIS 66 Cb 1.23 -0.08 -0.01 0.00 2.57 0.00 0.00 27.41 31.13 2klj h HIS 66 CO 0.39 0.97 0.18 -0.56 -3.07 0.00 0.00 177.93 175.83 2klj h GLN 67 N 0.26 0.00 -0.72 5.12 3.07 -1.88 0.60 115.11 121.56 2klj h GLN 67 Ca -0.03 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.65 2klj h GLN 67 Cb 1.28 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.81 2klj h GLN 67 CO 0.12 0.00 0.22 1.96 0.09 0.00 0.00 178.83 181.22 2klj h GLN 68 N 0.00 1.12 -0.81 0.06 4.20 -1.83 -2.57 115.11 115.28 2klj h GLN 68 Ca 0.09 -0.24 -0.12 0.00 0.06 0.00 0.00 58.65 58.44 2klj h GLN 68 Cb 0.44 -0.16 -0.07 0.00 0.30 0.00 0.00 27.48 27.98 2klj h GLN 68 CO -0.00 0.96 0.16 -2.67 -0.67 0.00 0.00 178.83 176.60 2klj n TRP 69 N -4.25 1.68 -1.00 2.96 2.14 -0.76 -4.81 117.44 113.40 2klj n TRP 69 Ca 0.06 -0.82 0.00 0.00 2.07 0.00 0.00 57.50 58.81 2klj n TRP 69 Cb 0.23 -0.51 0.00 0.00 -0.81 0.00 0.00 31.31 30.22 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 0.06 -0.01 -1.54 -2.67 2.81 -0.97 -4.45 117.12 110.35 2klj n MET 70 Ca 0.27 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.73 2klj n MET 70 Cb 1.05 -2.83 -0.05 0.00 -0.71 0.00 0.00 33.22 30.68 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 -2.60 0.62 0.14 3.03 0.00 0.20 -4.74 105.19 101.84 2klj n GLY 71 Ca 0.00 0.81 0.01 0.00 0.00 0.00 0.00 46.02 46.84 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 15.26 0.00 -8.80 0.99 3.38 -1.92 -3.18 115.31 121.04 2klj h LEU 72 Ca -0.32 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.27 2klj h LEU 72 Cb 1.27 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.88 2klj h LEU 72 CO 1.04 0.57 -0.70 -0.44 0.09 0.00 0.00 178.44 179.00 2klj s SER 73 N -6.63 2.05 -0.37 -0.43 0.01 -1.26 -5.01 113.70 102.05 2klj s SER 73 Ca 0.00 -1.08 0.02 0.00 1.31 0.00 0.00 55.95 56.20 2klj s SER 73 Cb 0.11 -0.05 0.45 0.00 0.21 0.00 0.00 66.02 66.75 2klj s SER 73 CO 0.74 -0.34 1.77 -0.67 0.41 0.00 0.00 173.24 175.14 2klj n ASP 74 N -0.32 4.44 -4.32 2.44 2.03 -1.26 -4.86 116.55 114.69 2klj n ASP 74 Ca -0.08 -3.25 -0.33 0.00 0.52 0.00 0.00 54.79 51.65 2klj n ASP 74 Cb 0.62 -0.82 -0.15 0.00 -0.72 0.00 0.00 41.12 40.05 2klj n ASP 74 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2klj s SER 75 N -0.73 3.87 -0.33 1.67 0.15 -1.26 -4.46 113.70 112.61 2klj s SER 75 Ca 0.44 -0.39 0.02 0.00 0.70 0.00 0.00 55.95 56.71 2klj s SER 75 Cb 0.36 -1.60 0.15 0.00 -1.71 0.00 0.00 66.02 63.23 2klj s SER 75 CO 0.06 0.12 0.37 -0.69 1.20 0.00 0.00 173.24 174.30 2klj s VAL 76 N 0.60 -0.43 -2.43 4.45 1.01 -1.26 -4.02 120.40 118.31 2klj s VAL 76 Ca -0.08 -0.67 0.20 0.00 0.00 0.00 0.00 61.98 61.43 2klj s VAL 76 Cb -0.16 -0.81 0.20 0.00 0.00 0.00 0.00 36.38 35.62 2klj s VAL 76 CO 0.03 -0.47 1.17 0.54 0.00 0.00 0.00 175.10 176.37 2klj n ARG 77 N 4.79 1.90 -3.68 2.72 1.74 -0.61 -4.52 116.66 119.00 2klj n ARG 77 Ca 0.05 -1.79 -0.15 0.00 -0.77 0.00 0.00 57.85 55.20 2klj n ARG 77 Cb 0.47 -1.40 -0.08 0.00 -1.02 0.00 0.00 32.46 30.43 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 -1.61 -0.43 -0.06 0.55 1.04 -0.87 0.18 113.70 112.49 2klj s SER 78 Ca 0.26 0.59 -0.31 0.00 0.48 0.00 0.00 55.95 56.97 2klj s SER 78 Cb 0.17 0.63 0.07 0.00 0.10 0.00 0.00 66.02 67.00 2klj s SER 78 CO 0.26 -0.39 0.68 0.00 0.98 0.00 0.00 173.24 174.77 2klj s ARG 80 N -1.10 1.32 -0.24 0.00 1.70 -0.14 0.39 118.95 120.88 2klj s ARG 80 Ca -0.10 -1.35 -0.10 0.00 -0.47 0.00 0.00 55.73 53.71 2klj s ARG 80 Cb -0.00 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 34.71 2klj s ARG 80 CO 0.09 -0.50 0.14 -1.17 -1.08 0.00 0.00 175.30 172.78 2klj s LEU 81 N -3.05 3.92 -0.36 -1.89 0.20 -1.26 -1.59 118.68 114.65 2klj s LEU 81 Ca 0.26 0.02 -0.28 0.00 0.69 0.00 0.00 54.13 54.81 2klj s LEU 81 Cb 0.03 -2.06 0.02 0.00 -0.43 0.00 0.00 46.19 43.75 2klj s LEU 81 CO 0.07 0.03 1.04 -0.63 -0.29 0.00 0.00 176.35 176.58 2klj s ILE 82 N 1.25 4.47 0.37 6.68 1.01 -1.05 -4.86 121.20 129.07 2klj s ILE 82 Ca 0.06 1.49 -0.25 0.00 0.00 0.00 0.00 60.65 61.95 2klj s ILE 82 Cb -0.14 -4.43 -0.12 0.00 0.01 0.00 0.00 42.46 37.78 2klj s ILE 82 CO 0.06 -0.60 0.96 -2.65 0.00 0.00 0.00 174.94 172.71 2klj n PRO 83 N 7.03 1.28 -0.18 2.79 -0.02 -1.26 -4.41 135.00 140.23 2klj n PRO 83 Ca 0.11 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2klj n PRO 83 Cb 0.48 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 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 -0.27 -3.13 -3.65 6.00 8.25 -1.26 -4.33 115.22 116.84 2klj n HIS 84 Ca 0.10 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.54 2klj n HIS 84 Cb 0.37 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.41 2klj n HIS 84 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2klj s SER 85 N -1.00 -0.03 0.01 0.41 0.15 -1.26 -4.49 113.70 107.48 2klj s SER 85 Ca 0.00 0.07 -0.05 0.00 0.70 0.00 0.00 55.95 56.66 2klj s SER 85 Cb 0.00 0.16 -0.03 0.00 -1.71 0.00 0.00 66.02 64.44 2klj s SER 85 CO 0.00 -0.01 1.01 1.23 1.20 0.00 0.00 173.24 176.67 2klj h GLY 86 N 3.29 -0.19 -2.33 9.45 0.00 -1.97 -3.35 103.07 107.96 2klj h GLY 86 Ca -0.27 0.07 -0.46 0.00 0.00 0.00 0.00 47.33 46.67 2klj h GLY 86 CO 0.19 -0.07 -0.13 -0.56 0.00 0.00 0.00 176.54 175.97 2klj s SER 87 N -2.36 5.89 -0.05 0.19 0.01 -1.26 -4.76 113.70 111.37 2klj s SER 87 Ca -0.03 0.26 -0.01 0.00 1.31 0.00 0.00 55.95 57.49 2klj s SER 87 Cb 0.00 -1.56 0.03 0.00 0.21 0.00 0.00 66.02 64.70 2klj s SER 87 CO 0.08 -0.63 0.02 -1.00 0.41 0.00 0.00 173.24 172.12 2klj s HIS 88 N -2.50 0.35 -0.19 2.43 0.09 -1.26 -4.21 115.29 110.00 2klj s HIS 88 Ca 0.47 0.03 -0.12 0.00 -0.00 0.00 0.00 55.06 55.44 2klj s HIS 88 Cb -0.10 -0.56 0.06 0.00 -0.00 0.00 0.00 32.58 31.98 2klj s HIS 88 CO 0.37 -0.21 0.48 -0.98 -0.00 0.00 0.00 174.74 174.40 2klj s ARG 89 N 1.70 0.49 -0.02 1.40 1.70 -1.26 -4.58 118.95 118.38 2klj s ARG 89 Ca -0.00 0.86 -0.02 0.00 -0.47 0.00 0.00 55.73 56.10 2klj s ARG 89 Cb -0.13 0.06 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 2klj s ARG 89 CO -0.03 -0.14 0.06 -1.50 -1.08 0.00 0.00 175.30 172.60 2klj s ILE 90 N 1.26 0.02 -0.26 4.99 2.07 -0.92 -2.38 121.20 125.98 2klj s ILE 90 Ca -0.08 -0.16 0.02 0.00 -1.41 0.00 0.00 60.65 59.01 2klj s ILE 90 Cb -0.07 -0.14 0.07 0.00 0.13 0.00 0.00 42.46 42.45 2klj s ILE 90 CO -0.12 -0.09 -0.05 0.00 -1.91 0.00 0.00 174.94 172.77 2klj s ARG 91 N -0.26 1.72 0.13 3.50 1.70 -0.79 -1.14 118.95 123.81 2klj s ARG 91 Ca -0.03 -1.18 -0.07 0.00 -0.47 0.00 0.00 55.73 53.98 2klj s ARG 91 Cb -0.02 -2.70 -0.06 0.00 -0.57 0.00 0.00 34.95 31.60 2klj s ARG 91 CO 0.00 -0.65 0.40 -0.51 -1.08 0.00 0.00 175.30 173.46 2klj s LEU 92 N 1.28 4.28 -0.02 -1.89 1.02 -0.97 -0.36 118.68 122.02 2klj s LEU 92 Ca -0.04 0.68 0.05 0.00 0.02 0.00 0.00 54.13 54.85 2klj s LEU 92 Cb -0.19 -3.24 -0.01 0.00 0.02 0.00 0.00 46.19 42.77 2klj s LEU 92 CO -0.07 0.08 -0.17 -0.31 0.02 0.00 0.00 176.35 175.89 2klj s TYR 93 N -1.59 1.61 -1.08 0.29 1.51 0.22 -2.44 117.35 115.87 2klj s TYR 93 Ca 0.39 -0.34 0.26 0.00 -1.01 0.00 0.00 57.07 56.37 2klj s TYR 93 Cb -0.13 -1.05 1.16 0.00 -0.11 0.00 0.00 41.96 41.84 2klj s TYR 93 CO 0.22 -0.06 1.85 -0.85 -1.11 0.00 0.00 175.55 175.60 2klj n GLU 94 N 2.77 0.07 -4.25 -0.62 0.00 -1.02 -1.74 120.64 115.86 2klj n GLU 94 Ca -0.16 0.05 -0.21 0.00 0.00 0.00 0.00 57.16 56.85 2klj n GLU 94 Cb 0.54 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.35 2klj n GLU 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2klj s ARG 95 N -2.92 0.95 0.82 3.44 3.52 -1.26 -3.94 118.95 119.57 2klj s ARG 95 Ca 0.15 -1.00 -0.15 0.00 -0.13 0.00 0.00 55.73 54.61 2klj s ARG 95 Cb 0.17 -1.04 -0.01 0.00 -1.56 0.00 0.00 34.95 32.51 2klj s ARG 95 CO 0.46 0.24 0.46 0.39 -0.81 0.00 0.00 175.30 176.04 2klj n GLU 96 N 1.32 0.06 0.00 5.12 1.02 -1.07 -4.27 120.64 122.81 2klj n GLU 96 Ca -0.20 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2klj n GLU 96 Cb 0.54 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 2klj n GLU 96 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2klj n ASP 97 N -0.65 0.00 -2.65 1.62 9.92 0.52 -3.57 116.55 121.74 2klj n ASP 97 Ca 0.08 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.29 2klj n ASP 97 Cb 0.51 0.00 0.10 0.00 -0.64 0.00 0.00 41.12 41.10 2klj n ASP 97 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2klj n TYR 98 N 4.37 -2.09 -2.03 1.24 4.01 -1.26 -4.71 117.16 116.69 2klj n TYR 98 Ca 0.00 -1.69 -0.19 0.00 -0.16 0.00 0.00 57.90 55.86 2klj n TYR 98 Cb 0.00 1.52 0.04 0.00 -0.31 0.00 0.00 39.34 40.60 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 -0.78 3.22 -1.98 -0.72 1.74 -1.23 -5.03 116.66 111.87 2klj n ARG 99 Ca -0.09 -4.00 -0.02 0.00 -0.77 0.00 0.00 57.85 52.97 2klj n ARG 99 Cb 0.82 -2.14 -0.01 0.00 -1.02 0.00 0.00 32.46 30.12 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 -0.74 3.32 3.74 -0.13 0.00 -1.26 -4.95 105.19 105.17 2klj n GLY 100 Ca 0.38 -1.50 -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 -2.11 2.81 -0.01 1.61 2.00 -1.26 -4.82 119.66 117.89 2klj s GLN 101 Ca 0.04 2.13 0.02 0.00 -2.00 0.00 0.00 55.36 55.54 2klj s GLN 101 Cb -0.00 -2.02 -0.00 0.00 0.80 0.00 0.00 33.01 31.79 2klj s GLN 101 CO 0.03 -1.41 -0.05 1.41 -0.50 0.00 0.00 175.29 174.76 2klj s MET 102 N -3.18 0.44 -0.03 1.67 -2.45 -1.26 -2.42 119.30 112.07 2klj s MET 102 Ca 0.78 -0.18 -0.02 0.00 -1.25 0.00 0.00 55.69 55.02 2klj s MET 102 Cb -0.39 -0.44 0.02 0.00 1.25 0.00 0.00 34.83 35.28 2klj s MET 102 CO 0.43 0.10 0.08 -1.50 1.05 0.00 0.00 175.02 175.17 2klj s ILE 103 N -0.04 -0.02 0.10 10.11 2.07 -1.02 -5.02 121.20 127.38 2klj s ILE 103 Ca 0.01 0.09 0.02 0.00 -1.41 0.00 0.00 60.65 59.36 2klj s ILE 103 Cb -0.03 -0.13 -0.04 0.00 0.13 0.00 0.00 42.46 42.39 2klj s ILE 103 CO -0.00 0.04 0.17 -0.70 -1.91 0.00 0.00 174.94 172.54 2klj s GLU 104 N 0.51 3.18 -0.01 3.50 2.12 -1.26 -2.29 118.70 124.44 2klj s GLU 104 Ca -0.04 -0.62 0.02 0.00 0.36 0.00 0.00 54.97 54.69 2klj s GLU 104 Cb -0.06 -2.86 -0.00 0.00 0.26 0.00 0.00 34.13 31.47 2klj s GLU 104 CO -0.02 0.56 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.12 2klj s PHE 105 N -1.57 0.72 -0.01 5.30 0.08 -0.29 -5.00 117.98 117.20 2klj s PHE 105 Ca 0.32 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 57.24 2klj s PHE 105 Cb -0.12 -0.49 0.03 0.00 -0.57 0.00 0.00 43.02 41.87 2klj s PHE 105 CO 0.26 -0.04 0.77 0.25 -0.10 0.00 0.00 175.22 176.35 2klj n THR 106 N 3.06 0.40 -3.88 0.64 -2.24 -1.26 -2.17 114.28 108.82 2klj n THR 106 Ca -0.15 -0.43 -0.11 0.00 -2.27 0.00 0.00 64.05 61.09 2klj n THR 106 Cb 0.56 0.68 -0.00 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 -0.24 0.87 -2.26 -0.78 0.28 -1.26 -4.92 120.64 112.32 2klj n GLU 107 Ca 0.01 -2.37 -0.41 0.00 -0.16 0.00 0.00 57.16 54.24 2klj n GLU 107 Cb 0.49 2.58 -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 -3.00 6.97 -0.45 -1.84 -4.77 -1.26 -4.62 116.67 107.69 2klj s ASP 108 Ca 0.21 2.52 0.04 0.00 -3.30 0.00 0.00 52.55 52.03 2klj s ASP 108 Cb -0.03 -2.64 0.17 0.00 -1.09 0.00 0.00 42.92 39.33 2klj s ASP 108 CO 0.15 -0.38 0.37 0.00 0.70 0.00 0.00 175.17 176.01 2klj h SER 110 N 5.55 0.00 -2.79 0.00 4.64 -1.93 -0.33 113.55 118.70 2klj h SER 110 Ca 0.25 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.97 2klj h SER 110 Cb 0.89 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.58 2klj h SER 110 CO 0.42 0.03 -0.80 0.00 -0.87 0.00 0.00 176.83 175.61 2klj h LEU 112 N 5.79 0.93 -0.02 0.00 6.46 -1.36 -2.03 115.31 125.09 2klj h LEU 112 Ca 0.18 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.93 2klj h LEU 112 Cb 0.86 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.59 2klj h LEU 112 CO 0.49 0.64 0.32 0.00 -0.62 0.00 0.00 178.44 179.27 2klj n GLN 113 N -4.54 0.00 0.01 1.25 3.00 -1.26 0.26 117.38 116.10 2klj n GLN 113 Ca 0.11 0.19 0.05 0.00 -0.01 0.00 0.00 57.00 57.34 2klj n GLN 113 Cb 0.10 -1.83 -0.11 0.00 0.00 0.00 0.00 30.24 28.40 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 -1.21 0.41 -0.11 1.08 9.92 -0.76 -4.54 116.55 121.34 2klj n ASP 114 Ca -0.00 0.17 -0.17 0.00 -0.53 0.00 0.00 54.79 54.26 2klj n ASP 114 Cb 0.32 1.01 -0.10 0.00 -0.64 0.00 0.00 41.12 41.71 2klj n ASP 114 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2klj n ARG 115 N -2.60 0.56 -4.82 -1.24 5.12 0.73 -5.02 116.66 109.39 2klj n ARG 115 Ca -0.10 0.14 -0.25 0.00 -1.93 0.00 0.00 57.85 55.72 2klj n ARG 115 Cb 0.74 -1.44 -0.15 0.00 -1.16 0.00 0.00 32.46 30.44 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 -2.45 1.56 0.00 -1.55 -0.71 0.03 -5.08 117.98 109.78 2klj s PHE 116 Ca -0.31 -0.30 0.00 0.00 -1.04 0.00 0.00 56.93 55.28 2klj s PHE 116 Cb 0.08 -1.00 0.00 0.00 -1.21 0.00 0.00 43.02 40.89 2klj s PHE 116 CO 0.51 -0.02 0.35 0.54 -1.34 0.00 0.00 175.22 175.26 2klj n ARG 117 N 2.62 0.00 -1.46 1.99 5.12 -1.26 -4.30 116.66 119.37 2klj n ARG 117 Ca -0.15 0.00 -0.49 0.00 -1.93 0.00 0.00 57.85 55.29 2klj n ARG 117 Cb 0.54 -0.85 -0.03 0.00 -1.16 0.00 0.00 32.46 30.96 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 -0.50 0.11 0.48 -1.55 -1.74 -1.26 -4.83 117.46 108.17 2klj n PHE 118 Ca 0.00 0.91 0.07 0.00 -0.56 0.00 0.00 57.45 57.87 2klj n PHE 118 Cb 0.00 -2.06 0.21 0.00 1.52 0.00 0.00 39.48 39.15 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 1.80 2.59 -4.03 5.98 3.02 -1.26 -4.86 115.26 118.50 2klj n ASN 119 Ca 0.16 -2.04 -0.22 0.00 -0.03 0.00 0.00 54.58 52.45 2klj n ASN 119 Cb 0.24 -0.33 -0.16 0.00 -0.61 0.00 0.00 39.78 38.92 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 -1.44 1.24 -0.21 3.52 8.01 -1.26 -0.91 118.70 127.64 2klj s GLU 120 Ca 0.31 -0.38 -0.03 0.00 0.01 0.00 0.00 54.97 54.88 2klj s GLU 120 Cb 0.17 -1.11 -0.00 0.00 -4.31 0.00 0.00 34.13 28.88 2klj s GLU 120 CO 0.20 0.12 -0.07 0.42 0.01 0.00 0.00 175.26 175.94 2klj s ILE 121 N 0.25 3.09 -0.33 -1.63 -1.09 -1.09 -4.58 121.20 115.83 2klj s ILE 121 Ca -0.05 -0.60 0.07 0.00 -2.23 0.00 0.00 60.65 57.84 2klj s ILE 121 Cb -0.10 -2.40 0.47 0.00 -1.58 0.00 0.00 42.46 38.85 2klj s ILE 121 CO 0.01 0.44 1.42 1.41 -1.23 0.00 0.00 174.94 176.99 2klj n HIS 122 N 4.76 1.81 0.00 3.97 8.25 -0.71 -4.42 115.22 128.87 2klj n HIS 122 Ca -0.19 -1.99 0.00 0.00 -0.26 0.00 0.00 57.72 55.28 2klj n HIS 122 Cb 0.51 -0.54 0.00 0.00 1.12 0.00 0.00 29.99 31.07 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 -0.96 0.00 -3.46 0.41 7.64 -1.08 -2.61 113.62 113.55 2klj n SER 123 Ca 0.39 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 60.16 2klj n SER 123 Cb 0.93 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 64.10 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 -0.50 -0.24 -3.43 0.05 -0.94 0.69 118.68 114.31 2klj s LEU 124 Ca 0.00 0.07 -0.01 0.00 0.05 0.00 0.00 54.13 54.23 2klj s LEU 124 Cb 0.00 2.37 0.07 0.00 -2.05 0.00 0.00 46.19 46.59 2klj s LEU 124 CO 0.00 -0.80 0.03 0.21 -0.55 0.00 0.00 176.35 175.24 2klj s ASN 125 N -2.49 3.53 -0.45 1.48 2.47 0.52 -0.35 114.94 119.65 2klj s ASN 125 Ca 0.01 -1.19 -0.23 0.00 0.42 0.00 0.00 52.86 51.87 2klj s ASN 125 Cb -0.01 -0.85 0.02 0.00 -1.45 0.00 0.00 41.25 38.96 2klj s ASN 125 CO -0.10 -0.32 0.80 -0.69 -3.72 0.00 0.00 177.10 173.07 2klj s VAL 126 N 1.64 4.64 -0.12 -5.21 1.01 -0.68 -1.88 120.40 119.81 2klj s VAL 126 Ca 0.01 0.49 -0.28 0.00 0.00 0.00 0.00 61.98 62.21 2klj s VAL 126 Cb -0.18 -4.33 -0.27 0.00 0.00 0.00 0.00 36.38 31.61 2klj s VAL 126 CO -0.13 -0.71 0.81 -0.07 0.00 0.00 0.00 175.10 175.00 2klj h LEU 127 N 10.16 0.08 -9.19 3.92 -0.00 -1.72 -2.02 115.31 116.53 2klj h LEU 127 Ca -0.25 -0.97 -0.55 0.00 -0.00 0.00 0.00 57.88 56.11 2klj h LEU 127 Cb 1.08 -0.02 -0.14 0.00 -0.00 0.00 0.00 40.66 41.58 2klj h LEU 127 CO 0.96 1.04 -0.71 -1.61 -0.00 0.00 0.00 178.44 178.12 2klj s GLU 128 N -2.35 1.62 0.00 1.13 0.41 -1.18 -4.83 118.70 113.50 2klj s GLU 128 Ca -0.18 -1.79 0.00 0.00 -0.41 0.00 0.00 54.97 52.59 2klj s GLU 128 Cb -0.02 -1.46 0.00 0.00 -1.78 0.00 0.00 34.13 30.87 2klj s GLU 128 CO 0.71 0.17 0.00 0.41 -0.49 0.00 0.00 175.26 176.06 2klj n GLY 129 N -0.61 0.21 3.43 -1.39 0.00 -1.26 -4.40 105.19 101.16 2klj n GLY 129 Ca -0.06 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 2klj n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2klj s SER 130 N -3.28 3.11 0.35 1.61 0.15 -1.26 -3.61 113.70 110.78 2klj s SER 130 Ca 0.00 -1.08 0.03 0.00 0.70 0.00 0.00 55.95 55.61 2klj s SER 130 Cb 0.00 -0.23 -0.05 0.00 -1.71 0.00 0.00 66.02 64.04 2klj s SER 130 CO 0.00 -0.13 0.09 0.26 1.20 0.00 0.00 173.24 174.66 2klj s TRP 131 N -2.77 1.84 -0.06 3.44 0.52 -1.09 -2.08 118.94 118.74 2klj s TRP 131 Ca 0.28 -1.11 0.01 0.00 0.02 0.00 0.00 56.10 55.30 2klj s TRP 131 Cb -0.01 -1.19 0.02 0.00 -1.15 0.00 0.00 33.47 31.14 2klj s TRP 131 CO 0.12 -0.15 -0.08 0.08 0.02 0.00 0.00 176.95 176.94 2klj s VAL 132 N -3.32 0.83 -0.12 4.03 1.01 -0.42 -2.39 120.40 120.01 2klj s VAL 132 Ca 0.32 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 2klj s VAL 132 Cb 0.06 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 2klj s VAL 132 CO 0.15 0.30 0.08 -0.76 0.00 0.00 0.00 175.10 174.87 2klj s LEU 133 N 0.96 4.05 -0.12 3.92 1.43 -0.96 -1.87 118.68 126.10 2klj s LEU 133 Ca -0.10 0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 2klj s LEU 133 Cb -0.15 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 2klj s LEU 133 CO 0.00 0.36 -0.18 -0.31 0.23 0.00 0.00 176.35 176.46 2klj s TYR 134 N -0.77 2.71 0.28 0.29 1.51 0.17 -1.46 117.35 120.09 2klj s TYR 134 Ca 0.13 -0.80 0.27 0.00 -1.01 0.00 0.00 57.07 55.65 2klj s TYR 134 Cb -0.12 -1.79 1.45 0.00 -0.11 0.00 0.00 41.96 41.40 2klj s TYR 134 CO 0.03 -0.29 1.79 1.49 -1.11 0.00 0.00 175.55 177.46 2klj h GLU 135 N 6.69 0.00 0.00 -0.62 4.81 -1.69 0.54 114.58 124.31 2klj h GLU 135 Ca -0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2klj h GLU 135 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2klj h GLU 135 CO 0.52 0.00 0.00 1.47 -0.73 0.00 0.00 179.01 180.27 2klj n LEU 136 N -2.56 0.00 0.00 1.64 -0.00 -1.26 -3.55 117.00 111.27 2klj n LEU 136 Ca -0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.90 2klj n LEU 136 Cb 0.21 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.65 2klj n LEU 136 CO 0.12 0.00 0.08 -1.54 -0.00 0.00 0.00 177.39 176.04 2klj n SER 137 N -0.84 1.29 0.00 1.45 3.41 -1.26 -1.73 113.62 115.94 2klj n SER 137 Ca 0.00 -1.66 0.00 0.00 -0.26 0.00 0.00 58.87 56.95 2klj n SER 137 Cb 0.00 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2klj n SER 137 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2klj n ASN 138 N -2.29 -2.04 -3.12 4.04 4.13 -0.35 -2.90 115.26 112.73 2klj n ASN 138 Ca 0.02 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.24 2klj n ASN 138 Cb 0.23 -1.72 0.00 0.00 -1.54 0.00 0.00 39.78 36.75 2klj n ASN 138 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2klj n TYR 139 N -0.81 -2.94 -2.74 3.10 4.02 -1.26 -5.00 117.16 111.54 2klj n TYR 139 Ca 0.00 1.13 -0.04 0.00 -0.01 0.00 0.00 57.90 58.98 2klj n TYR 139 Cb 0.17 -3.94 0.05 0.00 -0.02 0.00 0.00 39.34 35.61 2klj n TYR 139 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2klj n ARG 140 N -1.69 1.41 0.00 -0.72 1.74 -1.14 -5.10 116.66 111.16 2klj n ARG 140 Ca -0.02 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 53.99 2klj n ARG 140 Cb 0.52 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 2klj n ARG 140 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2klj n GLY 141 N -0.46 3.98 3.91 -0.13 0.00 -1.26 -4.95 105.19 106.28 2klj n GLY 141 Ca 0.05 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 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 4.67 3.21 -0.01 1.61 1.81 -1.26 -4.91 118.95 124.08 2klj s ARG 142 Ca 0.00 0.12 0.01 0.00 -1.72 0.00 0.00 55.73 54.14 2klj s ARG 142 Cb 0.00 -2.30 0.00 0.00 -0.45 0.00 0.00 34.95 32.20 2klj s ARG 142 CO 0.00 -0.49 -0.03 -0.65 -0.68 0.00 0.00 175.30 173.45 2klj s GLN 143 N -4.90 0.32 0.26 3.54 1.11 -1.26 -2.36 119.66 116.39 2klj s GLN 143 Ca 0.51 -0.10 0.11 0.00 0.01 0.00 0.00 55.36 55.90 2klj s GLN 143 Cb -0.10 -0.35 -0.05 0.00 -1.01 0.00 0.00 33.01 31.50 2klj s GLN 143 CO 0.45 0.04 -0.15 0.71 0.01 0.00 0.00 175.29 176.35 2klj s TYR 144 N 0.14 2.40 -0.15 0.91 2.02 -0.53 -4.92 117.35 117.22 2klj s TYR 144 Ca -0.01 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 56.39 2klj s TYR 144 Cb -0.04 -1.06 -0.00 0.00 -0.40 0.00 0.00 41.96 40.45 2klj s TYR 144 CO -0.00 0.67 -0.15 -1.17 -1.57 0.00 0.00 175.55 173.32 2klj s LEU 145 N -3.44 2.49 -0.61 -1.29 0.20 -1.26 -2.25 118.68 112.51 2klj s LEU 145 Ca 0.29 -0.45 -0.03 0.00 0.69 0.00 0.00 54.13 54.63 2klj s LEU 145 Cb -0.06 -1.56 0.16 0.00 -0.43 0.00 0.00 46.19 44.30 2klj s LEU 145 CO 0.16 0.10 0.43 -0.76 -0.29 0.00 0.00 176.35 175.98 2klj s LEU 146 N 0.72 5.22 0.71 -0.68 2.01 -1.00 -4.90 118.68 120.75 2klj s LEU 146 Ca -0.07 -2.83 -0.14 0.00 0.01 0.00 0.00 54.13 51.10 2klj s LEU 146 Cb -0.16 -1.85 0.03 0.00 0.01 0.00 0.00 46.19 44.22 2klj s LEU 146 CO 0.01 -0.37 1.15 -0.04 1.01 0.00 0.00 176.35 178.11 2klj s MET 147 N -0.03 2.41 -0.40 1.70 -1.94 -1.26 -2.65 119.30 117.12 2klj s MET 147 Ca 0.17 1.53 -0.34 0.00 -1.71 0.00 0.00 55.69 55.34 2klj s MET 147 Cb -0.20 -1.89 -0.11 0.00 2.01 0.00 0.00 34.83 34.63 2klj s MET 147 CO -0.03 -1.58 2.25 -0.35 -0.01 0.00 0.00 175.02 175.30 2klj n PRO 148 N -2.70 1.04 -2.10 2.03 -0.04 -1.24 -4.72 135.00 127.28 2klj n PRO 148 Ca 0.12 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 2klj n PRO 148 Cb 0.51 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 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 6.45 -0.62 3.10 0.55 0.00 -0.76 -5.00 105.19 108.90 2klj n GLY 149 Ca 0.42 -0.55 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 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 2.27 -0.07 1.61 -1.08 -1.26 -1.68 116.67 112.46 2klj s ASP 150 Ca 0.00 -0.40 0.05 0.00 -0.52 0.00 0.00 52.55 51.69 2klj s ASP 150 Cb 0.00 -1.04 -0.01 0.00 -1.46 0.00 0.00 42.92 40.41 2klj s ASP 150 CO 0.00 0.08 -0.24 -0.31 0.52 0.00 0.00 175.17 175.21 2klj s TYR 151 N 0.56 2.45 -0.99 -5.34 1.51 0.53 -5.01 117.35 111.05 2klj s TYR 151 Ca -0.16 -0.82 0.09 0.00 -1.01 0.00 0.00 57.07 55.17 2klj s TYR 151 Cb -0.17 -1.62 0.12 0.00 -0.11 0.00 0.00 41.96 40.19 2klj s TYR 151 CO 0.05 -0.28 0.91 0.54 -1.11 0.00 0.00 175.55 175.66 2klj n ARG 152 N 3.14 1.05 -3.84 -0.62 1.74 -1.26 -2.20 116.66 114.65 2klj n ARG 152 Ca -0.18 -1.31 -0.04 0.00 -0.77 0.00 0.00 57.85 55.55 2klj n ARG 152 Cb 0.52 -1.18 0.01 0.00 -1.02 0.00 0.00 32.46 30.79 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 -0.82 1.50 0.39 5.56 3.03 -1.21 -0.35 118.95 127.05 2klj s ARG 153 Ca 0.13 -0.94 0.21 0.00 2.03 0.00 0.00 55.73 57.16 2klj s ARG 153 Cb 0.08 0.44 0.40 0.00 -1.03 0.00 0.00 34.95 34.84 2klj s ARG 153 CO 0.12 -0.70 1.61 0.10 -1.13 0.00 0.00 175.30 175.30 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.82 -3.07 116.97 119.97 2klj h TYR 154 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.45 2klj h TYR 154 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.96 2klj h TYR 154 CO 1.15 0.20 0.00 1.96 -0.00 0.00 0.00 178.16 181.47 2klj h GLN 155 N 0.00 0.00 -0.73 0.10 4.20 -1.96 -2.71 115.11 114.01 2klj h GLN 155 Ca -0.00 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 2klj h GLN 155 Cb 1.06 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.80 2klj h GLN 155 CO 0.03 0.00 0.46 -0.44 -0.67 0.00 0.00 178.83 178.21 2klj h ASP 156 N 0.00 0.77 -0.70 1.46 3.32 -1.91 -0.99 116.42 118.37 2klj h ASP 156 Ca 0.00 -0.01 -0.26 0.00 0.02 0.00 0.00 57.03 56.78 2klj h ASP 156 Cb 0.77 -0.17 -0.16 0.00 0.22 0.00 0.00 39.33 39.99 2klj h ASP 156 CO 0.00 0.54 0.33 -2.67 -1.72 0.00 0.00 179.24 175.72 2klj n TRP 157 N -4.63 2.28 -3.32 4.55 2.14 -1.22 -4.94 117.44 112.29 2klj n TRP 157 Ca 0.08 -1.23 -0.14 0.00 2.07 0.00 0.00 57.50 58.28 2klj n TRP 157 Cb 0.07 -0.69 0.01 0.00 -0.81 0.00 0.00 31.31 29.89 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 -0.32 -1.09 3.05 -1.67 0.00 -0.38 -4.72 105.19 100.06 2klj n GLY 158 Ca 0.40 0.73 -0.21 0.00 0.00 0.00 0.00 46.02 46.94 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 -2.74 0.99 0.42 4.61 0.00 -1.02 -5.00 121.76 119.02 2klj s ALA 159 Ca 0.09 -0.46 0.12 0.00 0.00 0.00 0.00 51.96 51.72 2klj s ALA 159 Cb -0.02 -0.31 0.90 0.00 0.00 0.00 0.00 23.12 23.70 2klj s ALA 159 CO 0.82 0.20 1.95 0.00 0.00 0.00 0.00 175.76 178.73 2klj h THR 160 N 5.11 1.16 -3.44 0.00 1.03 -1.95 -3.40 112.91 111.42 2klj h THR 160 Ca -0.33 -0.72 -0.05 0.00 -0.01 0.00 0.00 66.41 65.30 2klj h THR 160 Cb 1.17 1.30 -0.12 0.00 -1.07 0.00 0.00 68.15 69.43 2klj h THR 160 CO 0.49 0.21 -0.08 0.20 -0.01 0.00 0.00 175.52 176.33 2klj s ASN 161 N -6.95 -0.20 0.20 0.00 0.02 -1.26 -5.04 114.94 101.71 2klj s ASN 161 Ca -0.04 -0.42 0.09 0.00 -1.02 0.00 0.00 52.86 51.46 2klj s ASN 161 Cb 0.16 0.49 0.10 0.00 0.02 0.00 0.00 41.25 42.01 2klj s ASN 161 CO 0.71 -0.90 1.46 0.00 0.02 0.00 0.00 177.10 178.40 2klj h ALA 162 N 2.36 0.69 -0.19 0.60 0.00 -1.87 -3.47 119.26 117.38 2klj h ALA 162 Ca -0.33 -0.72 -0.16 0.00 0.00 0.00 0.00 54.91 53.70 2klj h ALA 162 Cb 1.25 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2klj h ALA 162 CO 0.45 0.99 0.12 0.54 0.00 0.00 0.00 179.25 181.35 2klj n ARG 163 N -3.60 0.00 -3.82 0.00 1.74 -1.26 -2.67 116.66 107.05 2klj n ARG 163 Ca -0.01 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.86 2klj n ARG 163 Cb 0.76 -0.28 -0.17 0.00 -1.02 0.00 0.00 32.46 31.75 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 0.50 0.27 -0.13 1.55 1.01 -0.09 -4.49 120.40 119.02 2klj s VAL 164 Ca 0.20 0.15 0.15 0.00 0.00 0.00 0.00 61.98 62.48 2klj s VAL 164 Cb -0.28 -0.42 -0.22 0.00 0.00 0.00 0.00 36.38 35.46 2klj s VAL 164 CO 0.15 0.22 0.14 0.61 0.00 0.00 0.00 175.10 176.22 2klj n GLY 165 N 4.90 -0.82 3.67 4.51 0.00 0.18 -4.56 105.19 113.08 2klj n GLY 165 Ca -0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.56 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 -4.79 -0.17 0.01 1.61 1.04 -0.70 -1.48 113.70 109.21 2klj s SER 166 Ca -0.08 -0.25 -0.28 0.00 0.48 0.00 0.00 55.95 55.82 2klj s SER 166 Cb 0.07 0.37 0.08 0.00 0.10 0.00 0.00 66.02 66.64 2klj s SER 166 CO 0.69 -0.67 0.74 -1.48 0.98 0.00 0.00 173.24 173.50 2klj s LEU 167 N -2.83 -0.53 0.25 2.42 2.34 -0.13 0.42 118.68 120.62 2klj s LEU 167 Ca 0.11 0.29 -0.03 0.00 0.06 0.00 0.00 54.13 54.57 2klj s LEU 167 Cb 0.00 2.36 -0.02 0.00 -0.56 0.00 0.00 46.19 47.97 2klj s LEU 167 CO -0.01 -0.69 0.29 0.00 -1.06 0.00 0.00 176.35 174.87 2klj s ARG 168 N -2.41 1.47 -0.09 1.48 1.70 -0.78 -0.34 118.95 119.98 2klj s ARG 168 Ca -0.03 -1.61 -0.28 0.00 -0.47 0.00 0.00 55.73 53.34 2klj s ARG 168 Cb -0.01 0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 34.71 2klj s ARG 168 CO -0.03 -0.55 0.91 1.03 -1.08 0.00 0.00 175.30 175.58 2klj s ARG 169 N -3.85 4.43 -0.13 3.89 0.52 -1.26 -1.30 118.95 121.24 2klj s ARG 169 Ca 0.34 1.23 -0.04 0.00 -0.52 0.00 0.00 55.73 56.74 2klj s ARG 169 Cb 0.03 -3.52 -0.11 0.00 0.52 0.00 0.00 34.95 31.87 2klj s ARG 169 CO 0.15 -0.19 3.06 1.55 0.02 0.00 0.00 175.30 179.88 2klj n VAL 170 N 4.32 2.90 -4.05 3.52 3.14 -0.88 -4.83 118.33 122.44 2klj n VAL 170 Ca 0.05 -1.70 -0.09 0.00 -2.96 0.00 0.00 64.34 59.65 2klj n VAL 170 Cb 0.50 -1.78 -0.09 0.00 -1.06 0.00 0.00 33.84 31.41 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 -0.15 0.15 -0.13 1.55 1.09 -1.26 -4.83 121.20 117.62 2klj s ILE 171 Ca 0.52 -1.67 0.05 0.00 -1.10 0.00 0.00 60.65 58.45 2klj s ILE 171 Cb 0.28 -1.70 0.15 0.00 -1.06 0.00 0.00 42.46 40.13 2klj s ILE 171 CO -0.05 -0.67 0.98 -0.67 -0.10 0.00 0.00 174.94 174.43 2klj n ASP 172 N -0.03 -0.86 0.04 3.58 2.03 -1.26 -5.02 116.55 115.03 2klj n ASP 172 Ca -0.11 -1.62 0.00 0.00 0.52 0.00 0.00 54.79 53.58 2klj n ASP 172 Cb 0.62 0.35 0.00 0.00 -0.72 0.00 0.00 41.12 41.37 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 -0.58 -0.62 -0.77 -0.67 3.72 -1.26 -4.98 117.46 112.29 2klj n PHE 173 Ca -0.15 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 2klj n PHE 173 Cb 0.67 0.47 0.00 0.00 -0.94 0.00 0.00 39.48 39.68 2klj n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16