#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 -2.27 3.15 2.61 0.00 -1.25 -4.32 105.19 103.11 2klj n GLY 2 Ca 0.00 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.24 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 -3.63 0.17 0.29 1.61 2.20 -1.26 -4.53 119.74 114.59 2klj s LYS 3 Ca 0.00 0.17 0.08 0.00 -0.36 0.00 0.00 55.97 55.86 2klj s LYS 3 Cb 0.00 0.08 -0.06 0.00 -1.51 0.00 0.00 37.83 36.34 2klj s LYS 3 CO 0.00 -0.31 -0.10 0.96 -0.36 0.00 0.00 175.35 175.54 2klj s ILE 4 N 2.95 1.94 -0.45 5.43 -0.00 -0.99 -0.56 121.20 129.50 2klj s ILE 4 Ca 0.26 -2.19 0.03 0.00 -0.00 0.00 0.00 60.65 58.75 2klj s ILE 4 Cb -0.03 -2.44 0.12 0.00 -0.00 0.00 0.00 42.46 40.11 2klj s ILE 4 CO -0.23 -0.32 0.21 -0.89 -0.00 0.00 0.00 174.94 173.71 2klj s THR 5 N -2.83 2.14 0.14 8.37 2.01 0.20 -1.49 115.64 124.18 2klj s THR 5 Ca 0.30 -2.84 -0.30 0.00 0.31 0.00 0.00 61.69 59.15 2klj s THR 5 Cb 0.02 -2.51 -0.07 0.00 0.01 0.00 0.00 72.50 69.94 2klj s THR 5 CO 0.13 -0.78 1.27 -0.76 -0.69 0.00 0.00 174.62 173.80 2klj s LEU 6 N 0.20 4.40 -0.15 4.42 1.43 0.96 -2.43 118.68 127.50 2klj s LEU 6 Ca 0.16 2.24 -0.01 0.00 -1.03 0.00 0.00 54.13 55.48 2klj s LEU 6 Cb -0.24 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.38 2klj s LEU 6 CO -0.03 -0.51 -0.12 -0.31 0.23 0.00 0.00 176.35 175.62 2klj s TYR 7 N 0.59 2.84 0.25 0.29 1.51 0.34 0.22 117.35 123.39 2klj s TYR 7 Ca 0.58 -0.79 -0.04 0.00 -1.01 0.00 0.00 57.07 55.81 2klj s TYR 7 Cb -0.34 -1.90 0.38 0.00 -0.11 0.00 0.00 41.96 39.99 2klj s TYR 7 CO 0.33 -0.33 1.85 1.49 -1.11 0.00 0.00 175.55 177.78 2klj h GLU 8 N 7.10 0.96 -6.29 -0.62 4.22 0.34 -1.29 114.58 119.00 2klj h GLU 8 Ca -0.31 -0.06 -0.58 0.00 0.08 0.00 0.00 59.36 58.49 2klj h GLU 8 Cb 1.20 -0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.13 2klj h GLU 8 CO 0.57 0.64 -0.64 -0.51 -2.18 0.00 0.00 179.01 176.89 2klj s ASP 9 N -5.77 4.84 0.91 1.04 1.11 -1.19 -2.55 116.67 115.07 2klj s ASP 9 Ca -0.12 -0.42 -0.12 0.00 0.18 0.00 0.00 52.55 52.07 2klj s ASP 9 Cb 0.19 -1.04 0.14 0.00 1.07 0.00 0.00 42.92 43.28 2klj s ASP 9 CO 0.80 0.06 1.09 0.00 1.18 0.00 0.00 175.17 178.30 2klj s ARG 10 N -3.20 1.11 -1.33 8.23 1.70 -1.26 -2.88 118.95 121.32 2klj s ARG 10 Ca 0.29 0.76 0.00 0.00 -0.47 0.00 0.00 55.73 56.31 2klj s ARG 10 Cb -0.09 -1.80 0.00 0.00 -0.57 0.00 0.00 34.95 32.50 2klj s ARG 10 CO 0.20 -2.33 0.00 0.41 -1.08 0.00 0.00 175.30 172.50 2klj n GLY 11 N -1.14 1.11 3.38 3.88 0.00 0.13 -2.45 105.19 110.10 2klj n GLY 11 Ca 0.07 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.87 -2.56 -2.71 1.61 3.72 -1.23 -4.99 117.46 108.43 2klj n PHE 12 Ca -0.13 0.84 0.00 0.00 -0.05 0.00 0.00 57.45 58.10 2klj n PHE 12 Cb 0.46 -4.84 0.00 0.00 -0.94 0.00 0.00 39.48 34.16 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 -4.65 2.59 0.00 -1.08 6.02 -1.03 -5.02 117.38 114.22 2klj n GLN 13 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2klj n GLN 13 Cb 0.58 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.84 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 0.75 3.78 1.08 0.00 -1.26 -3.18 105.19 111.36 2klj n GLY 14 Ca 0.00 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 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 3.90 0.15 1.61 1.81 -1.26 -4.78 118.95 120.38 2klj s ARG 15 Ca 0.00 1.62 0.05 0.00 -1.72 0.00 0.00 55.73 55.68 2klj s ARG 15 Cb 0.00 -2.41 -0.04 0.00 -0.45 0.00 0.00 34.95 32.05 2klj s ARG 15 CO 0.00 -0.39 -0.11 -3.38 -0.68 0.00 0.00 175.30 170.74 2klj s HIS 16 N -1.65 1.31 -0.11 -0.53 -3.43 -1.26 0.89 115.29 110.51 2klj s HIS 16 Ca 0.62 -0.73 -0.07 0.00 -0.80 0.00 0.00 55.06 54.09 2klj s HIS 16 Cb -0.24 -0.66 0.04 0.00 -1.43 0.00 0.00 32.58 30.29 2klj s HIS 16 CO 0.30 0.11 0.27 -0.47 -2.00 0.00 0.00 174.74 172.95 2klj s TYR 17 N -3.19 -0.35 -0.24 0.38 5.04 0.13 -4.97 117.35 114.15 2klj s TYR 17 Ca 0.16 0.82 -0.09 0.00 -2.44 0.00 0.00 57.07 55.52 2klj s TYR 17 Cb 0.02 0.09 -0.04 0.00 0.35 0.00 0.00 41.96 42.37 2klj s TYR 17 CO 0.01 -0.22 0.12 -2.00 -1.34 0.00 0.00 175.55 172.12 2klj s GLU 18 N 0.92 3.86 -0.16 4.97 2.12 -1.26 -0.03 118.70 129.13 2klj s GLU 18 Ca -0.06 -0.38 0.01 0.00 0.36 0.00 0.00 54.97 54.90 2klj s GLU 18 Cb -0.07 -3.43 0.01 0.00 0.26 0.00 0.00 34.13 30.89 2klj s GLU 18 CO -0.06 -0.05 -0.18 0.00 -0.54 0.00 0.00 175.26 174.42 2klj n SER 20 N 4.19 1.95 -3.60 0.00 3.41 -1.26 -2.35 113.62 115.96 2klj n SER 20 Ca -0.20 -1.92 -0.10 0.00 -0.26 0.00 0.00 58.87 56.40 2klj n SER 20 Cb 0.51 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 2klj n SER 20 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2klj s SER 21 N -0.92 0.09 0.20 4.04 0.01 -1.26 -4.63 113.70 111.23 2klj s SER 21 Ca 0.01 -1.02 -0.32 0.00 1.31 0.00 0.00 55.95 55.93 2klj s SER 21 Cb 0.00 0.69 -0.13 0.00 0.21 0.00 0.00 66.02 66.79 2klj s SER 21 CO 0.01 -1.33 1.57 -0.90 0.41 0.00 0.00 173.24 172.99 2klj n ASP 22 N -0.81 3.27 -4.04 2.44 5.75 -1.26 -4.35 116.55 117.55 2klj n ASP 22 Ca -0.03 1.10 -0.17 0.00 -0.01 0.00 0.00 54.79 55.68 2klj n ASP 22 Cb 0.61 -1.47 -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 0.62 0.80 -0.21 2.11 2.46 0.12 -4.96 115.29 116.23 2klj s HIS 23 Ca 0.74 -0.23 0.08 0.00 0.47 0.00 0.00 55.06 56.12 2klj s HIS 23 Cb -0.62 -0.50 -0.11 0.00 -0.13 0.00 0.00 32.58 31.23 2klj s HIS 23 CO 0.41 -0.01 0.27 0.25 -2.47 0.00 0.00 174.74 173.18 2klj n THR 24 N 2.49 0.00 -3.71 0.89 -2.24 -1.26 -2.20 114.28 108.25 2klj n THR 24 Ca -0.16 -0.25 -0.26 0.00 -2.27 0.00 0.00 64.05 61.12 2klj n THR 24 Cb 0.56 0.68 -0.17 0.00 -2.10 0.00 0.00 70.33 69.30 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 -2.33 2.33 -0.01 3.42 3.04 -1.22 -0.90 114.94 119.28 2klj s ASN 25 Ca 0.00 -0.53 0.15 0.00 0.04 0.00 0.00 52.86 52.52 2klj s ASN 25 Cb 0.06 -0.45 -0.19 0.00 -1.54 0.00 0.00 41.25 39.13 2klj s ASN 25 CO 0.34 -0.28 0.54 0.18 -3.04 0.00 0.00 177.10 174.84 2klj n LEU 26 N 5.14 0.47 0.11 3.21 4.32 0.26 -4.54 117.00 125.97 2klj n LEU 26 Ca -0.08 -0.34 -0.13 0.00 -0.02 0.00 0.00 56.01 55.45 2klj n LEU 26 Cb 0.48 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.21 2klj n LEU 26 CO 0.11 0.12 0.81 1.56 -1.22 0.00 0.00 177.39 178.78 2klj h GLN 27 N 0.00 -0.21 0.00 3.23 4.20 -1.72 1.32 115.11 121.93 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 0.47 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.30 2klj h GLN 27 CO 0.00 -0.14 0.00 -0.35 -0.67 0.00 0.00 178.83 177.67 2klj n PRO 28 N -5.19 0.00 0.00 1.46 -0.04 -1.26 -2.46 135.00 127.51 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 0.12 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 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 -0.78 0.00 -4.47 0.54 4.01 -0.73 -5.08 117.16 110.65 2klj n TYR 29 Ca 0.00 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.47 2klj n TYR 29 Cb 0.00 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 38.86 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 -2.61 1.63 0.16 7.72 1.43 0.44 -4.66 118.68 122.80 2klj s LEU 30 Ca 0.00 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2klj s LEU 30 Cb 0.00 -0.95 0.01 0.00 0.03 0.00 0.00 46.19 45.27 2klj s LEU 30 CO 0.00 0.01 1.39 -1.28 0.23 0.00 0.00 176.35 176.70 2klj h SER 31 N 7.29 0.42 0.00 2.29 0.87 -1.82 -3.33 113.55 119.27 2klj h SER 31 Ca -0.30 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 2klj h SER 31 Cb 1.18 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2klj h SER 31 CO 0.47 1.07 -0.17 0.54 -0.53 0.00 0.00 176.83 178.21 2klj n ARG 32 N -3.76 0.11 -3.12 2.24 1.74 -1.26 -4.88 116.66 107.73 2klj n ARG 32 Ca -0.05 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.97 2klj n ARG 32 Cb 0.76 -0.59 0.03 0.00 -1.02 0.00 0.00 32.46 31.65 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 -2.38 2.27 -3.91 0.00 6.94 -0.53 -4.67 115.26 112.98 2klj n ASN 34 Ca -0.03 -1.66 -0.11 0.00 -0.02 0.00 0.00 54.58 52.77 2klj n ASN 34 Cb 0.55 0.17 -0.11 0.00 -2.36 0.00 0.00 39.78 38.03 2klj n ASN 34 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2klj s SER 35 N -2.21 0.08 0.02 0.53 0.15 -0.96 0.29 113.70 111.60 2klj s SER 35 Ca 0.26 -0.24 -0.19 0.00 0.70 0.00 0.00 55.95 56.48 2klj s SER 35 Cb 0.19 0.16 0.04 0.00 -1.71 0.00 0.00 66.02 64.70 2klj s SER 35 CO 0.42 -0.28 0.42 0.00 1.20 0.00 0.00 173.24 174.99 2klj s ALA 36 N -1.15 -1.04 -0.07 5.45 0.00 0.33 0.13 121.76 125.41 2klj s ALA 36 Ca -0.13 0.43 -0.00 0.00 0.00 0.00 0.00 51.96 52.26 2klj s ALA 36 Cb -0.07 0.24 0.02 0.00 0.00 0.00 0.00 23.12 23.31 2klj s ALA 36 CO 0.00 -0.40 -0.04 1.03 0.00 0.00 0.00 175.76 176.36 2klj s ARG 37 N -2.03 0.95 -0.14 0.00 0.52 -1.02 0.12 118.95 117.34 2klj s ARG 37 Ca -0.08 -0.07 -0.04 0.00 -0.52 0.00 0.00 55.73 55.01 2klj s ARG 37 Cb -0.02 -1.08 -0.03 0.00 0.52 0.00 0.00 34.95 34.34 2klj s ARG 37 CO 0.01 -0.20 0.00 0.08 0.02 0.00 0.00 175.30 175.21 2klj s VAL 38 N 1.46 4.27 -0.16 3.52 1.01 -1.09 0.62 120.40 130.03 2klj s VAL 38 Ca -0.02 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 61.48 2klj s VAL 38 Cb -0.13 -2.86 -0.22 0.00 0.00 0.00 0.00 36.38 33.16 2klj s VAL 38 CO -0.03 0.52 0.53 -0.78 0.00 0.00 0.00 175.10 175.33 2klj h ASP 39 N 6.25 0.00 -0.25 3.32 3.58 -1.17 -3.21 116.42 124.94 2klj h ASP 39 Ca -0.38 -0.77 0.26 0.00 0.42 0.00 0.00 57.03 56.55 2klj h ASP 39 Cb 1.18 0.00 -0.22 0.00 1.72 0.00 0.00 39.33 42.02 2klj h ASP 39 CO 0.63 1.14 0.24 -0.44 -2.88 0.00 0.00 179.24 177.93 2klj s SER 40 N -6.40 -0.29 0.00 2.28 0.01 -1.26 -4.84 113.70 103.20 2klj s SER 40 Ca -0.22 0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2klj s SER 40 Cb 0.00 1.25 0.00 0.00 0.21 0.00 0.00 66.02 67.49 2klj s SER 40 CO 0.62 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.83 2klj n GLY 41 N 5.36 0.30 3.42 3.44 0.00 -1.26 -3.92 105.19 112.52 2klj n GLY 41 Ca -0.08 -1.80 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 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 -0.11 0.98 -0.08 0.00 0.52 0.79 -2.28 118.94 118.76 2klj s TRP 43 Ca -0.01 -0.27 0.04 0.00 0.02 0.00 0.00 56.10 55.88 2klj s TRP 43 Cb -0.14 -0.60 -0.00 0.00 -1.15 0.00 0.00 33.47 31.58 2klj s TRP 43 CO 0.03 -0.00 -0.22 1.41 0.02 0.00 0.00 176.95 178.19 2klj s MET 44 N -0.73 2.71 0.17 4.98 1.75 -0.99 0.64 119.30 127.84 2klj s MET 44 Ca 0.01 -0.82 0.10 0.00 -1.25 0.00 0.00 55.69 53.73 2klj s MET 44 Cb -0.06 -2.12 -0.04 0.00 2.84 0.00 0.00 34.83 35.45 2klj s MET 44 CO 0.00 0.21 -0.15 -0.51 -0.65 0.00 0.00 175.02 173.92 2klj s LEU 45 N 0.25 2.78 -0.03 4.11 1.43 -1.01 -1.21 118.68 125.00 2klj s LEU 45 Ca -0.14 -0.65 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 2klj s LEU 45 Cb -0.16 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.55 2klj s LEU 45 CO 0.07 0.12 -0.11 -0.31 0.23 0.00 0.00 176.35 176.36 2klj s TYR 46 N -1.58 1.08 0.48 0.29 1.51 0.22 -1.62 117.35 117.73 2klj s TYR 46 Ca 0.22 -0.27 0.13 0.00 -1.01 0.00 0.00 57.07 56.14 2klj s TYR 46 Cb -0.09 -0.75 1.11 0.00 -0.11 0.00 0.00 41.96 42.13 2klj s TYR 46 CO 0.13 -0.10 2.11 1.05 -1.11 0.00 0.00 175.55 177.63 2klj h GLU 47 N 6.28 0.21 -6.37 -0.62 4.11 -0.73 -0.80 114.58 116.65 2klj h GLU 47 Ca -0.33 -0.01 -0.65 0.00 0.07 0.00 0.00 59.36 58.44 2klj h GLU 47 Cb 1.17 -0.05 -0.12 0.00 0.50 0.00 0.00 28.75 30.25 2klj h GLU 47 CO 0.49 0.14 -0.67 -0.65 0.07 0.00 0.00 179.01 178.38 2klj s GLN 48 N -5.23 2.48 0.97 1.06 -0.21 -0.35 -3.17 119.66 115.20 2klj s GLN 48 Ca -0.06 -0.89 -0.11 0.00 0.02 0.00 0.00 55.36 54.31 2klj s GLN 48 Cb 0.17 -2.49 0.17 0.00 1.00 0.00 0.00 33.01 31.87 2klj s GLN 48 CO 0.69 0.52 1.10 -1.25 -2.12 0.00 0.00 175.29 174.24 2klj s PRO 49 N -2.38 0.61 -1.59 2.91 0.04 -1.26 -2.58 135.00 130.74 2klj s PRO 49 Ca 0.25 1.16 -0.03 0.00 0.04 0.00 0.00 61.00 62.42 2klj s PRO 49 Cb -0.11 -1.71 0.01 0.00 0.04 0.00 0.00 34.50 32.73 2klj s PRO 49 CO 0.18 -2.78 0.36 0.09 0.04 0.00 0.00 177.00 174.88 2klj n ASN 50 N -4.30 -5.77 -3.06 6.66 5.03 -0.08 -3.55 115.26 110.19 2klj n ASN 50 Ca 0.08 -0.17 -0.12 0.00 0.87 0.00 0.00 54.58 55.24 2klj n ASN 50 Cb 0.53 -4.73 0.01 0.00 -1.02 0.00 0.00 39.78 34.58 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 -4.24 -3.17 -3.87 3.10 4.01 -1.24 -5.05 117.16 106.71 2klj n TYR 51 Ca -0.16 1.27 -0.09 0.00 -0.16 0.00 0.00 57.90 58.77 2klj n TYR 51 Cb 0.64 -3.67 -0.08 0.00 -0.31 0.00 0.00 39.34 35.92 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 -2.54 0.11 0.01 7.72 0.01 -1.07 -5.04 113.70 112.90 2klj s SER 52 Ca 0.20 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.88 2klj s SER 52 Cb -0.05 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.50 2klj s SER 52 CO 0.79 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 174.38 2klj n GLY 53 N 0.19 -0.85 3.73 3.44 0.00 -1.26 -1.21 105.19 109.22 2klj n GLY 53 Ca -0.16 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 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 4.38 0.26 0.99 1.98 -1.26 -4.76 118.68 120.27 2klj s LEU 54 Ca 0.00 2.58 0.12 0.00 -2.89 0.00 0.00 54.13 53.94 2klj s LEU 54 Cb 0.00 -3.61 -0.05 0.00 0.66 0.00 0.00 46.19 43.20 2klj s LEU 54 CO 0.00 -0.73 -0.20 0.00 -1.89 0.00 0.00 176.35 173.53 2klj s GLN 55 N 0.46 1.67 -0.06 1.98 0.00 -1.26 -0.34 119.66 122.12 2klj s GLN 55 Ca 0.64 -1.70 -0.02 0.00 -0.00 0.00 0.00 55.36 54.28 2klj s GLN 55 Cb -0.41 -1.81 0.04 0.00 0.00 0.00 0.00 33.01 30.83 2klj s GLN 55 CO 0.36 0.35 0.11 0.71 0.00 0.00 0.00 175.29 176.82 2klj s TYR 56 N -2.32 -0.10 -0.04 9.60 1.51 -0.64 -4.97 117.35 120.40 2klj s TYR 56 Ca 0.28 0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 56.46 2klj s TYR 56 Cb -0.06 -0.20 -0.03 0.00 -0.11 0.00 0.00 41.96 41.57 2klj s TYR 56 CO 0.14 -0.18 0.94 0.12 -1.11 0.00 0.00 175.55 175.46 2klj s PHE 57 N 1.50 3.61 -0.01 2.71 5.36 -1.26 -2.40 117.98 127.49 2klj s PHE 57 Ca -0.05 1.60 0.08 0.00 -0.96 0.00 0.00 56.93 57.60 2klj s PHE 57 Cb -0.12 -3.08 -0.02 0.00 -0.34 0.00 0.00 43.02 39.46 2klj s PHE 57 CO -0.05 -0.04 -0.26 -0.51 -1.46 0.00 0.00 175.22 172.90 2klj s LEU 58 N 1.20 2.06 0.13 6.12 1.02 0.21 -4.92 118.68 124.50 2klj s LEU 58 Ca 0.49 -0.48 0.02 0.00 0.02 0.00 0.00 54.13 54.18 2klj s LEU 58 Cb -0.20 -1.32 -0.04 0.00 0.02 0.00 0.00 46.19 44.64 2klj s LEU 58 CO 0.24 0.31 -0.06 -0.60 0.02 0.00 0.00 176.35 176.27 2klj s ARG 59 N -0.68 0.96 -0.31 1.70 3.52 -1.26 -0.15 118.95 122.73 2klj s ARG 59 Ca 0.10 -1.41 -0.29 0.00 -0.13 0.00 0.00 55.73 54.00 2klj s ARG 59 Cb -0.10 -0.31 -0.12 0.00 -1.56 0.00 0.00 34.95 32.85 2klj s ARG 59 CO -0.01 -0.03 1.09 -2.13 -0.81 0.00 0.00 175.30 173.41 2klj n ARG 60 N -0.13 0.00 0.00 5.12 0.63 -1.08 -4.81 116.66 116.40 2klj n ARG 60 Ca -0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.83 2klj n ARG 60 Cb 0.61 -0.93 0.00 0.00 0.45 0.00 0.00 32.46 32.59 2klj n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2klj n GLY 61 N 3.08 3.93 3.79 5.14 0.00 -1.21 -5.01 105.19 114.91 2klj n GLY 61 Ca 0.23 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 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 7.23 -0.21 1.61 -4.77 -1.26 -2.67 116.67 116.60 2klj s ASP 62 Ca 0.00 1.75 -0.04 0.00 -3.30 0.00 0.00 52.55 50.96 2klj s ASP 62 Cb 0.00 -2.55 0.07 0.00 -1.09 0.00 0.00 42.92 39.35 2klj s ASP 62 CO 0.00 -0.10 0.08 -0.31 0.70 0.00 0.00 175.17 175.53 2klj s TYR 63 N -1.70 0.61 -1.90 2.11 2.02 0.33 -4.98 117.35 113.83 2klj s TYR 63 Ca 0.51 -0.69 0.25 0.00 -0.37 0.00 0.00 57.07 56.78 2klj s TYR 63 Cb -0.17 -0.91 0.51 0.00 -0.40 0.00 0.00 41.96 41.00 2klj s TYR 63 CO 0.22 -0.62 1.41 0.00 -1.57 0.00 0.00 175.55 174.99 2klj n ALA 64 N 5.16 3.21 -3.11 3.71 0.00 -1.26 0.12 120.51 128.34 2klj n ALA 64 Ca -0.07 -0.49 -0.12 0.00 0.00 0.00 0.00 53.44 52.76 2klj n ALA 64 Cb 0.47 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 18.81 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 -2.46 -0.04 0.49 0.00 1.01 -1.15 0.20 116.67 114.71 2klj s ASP 65 Ca 0.23 -0.14 0.17 0.00 0.71 0.00 0.00 52.55 53.52 2klj s ASP 65 Cb 0.19 0.25 1.18 0.00 1.01 0.00 0.00 42.92 45.55 2klj s ASP 65 CO 0.53 -0.43 2.07 1.12 0.21 0.00 0.00 175.17 178.67 2klj h HIS 66 N 4.00 0.00 0.00 4.23 2.07 0.41 -1.43 115.15 124.42 2klj h HIS 66 Ca -0.31 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.21 2klj h HIS 66 Cb 1.19 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.17 2klj h HIS 66 CO 0.56 0.10 -0.03 1.96 -3.07 0.00 0.00 177.93 177.44 2klj h GLN 67 N 0.00 0.00 -0.59 5.12 4.20 -1.83 1.13 115.11 123.14 2klj h GLN 67 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2klj h GLN 67 Cb 0.18 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2klj h GLN 67 CO 0.01 0.03 0.00 1.96 -0.67 0.00 0.00 178.83 180.17 2klj h GLN 68 N 0.00 1.04 -0.63 1.46 1.08 -1.61 -2.82 115.11 113.62 2klj h GLN 68 Ca -0.00 -0.32 0.00 0.00 -1.45 0.00 0.00 58.65 56.88 2klj h GLN 68 Cb 0.29 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2klj h GLN 68 CO 0.00 1.01 0.00 -2.67 -0.95 0.00 0.00 178.83 176.23 2klj n TRP 69 N -4.18 1.67 -1.00 2.96 2.14 -1.03 -4.87 117.44 113.13 2klj n TRP 69 Ca 0.03 -0.62 0.00 0.00 2.07 0.00 0.00 57.50 58.98 2klj n TRP 69 Cb 0.34 -0.35 0.00 0.00 -0.81 0.00 0.00 31.31 30.49 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 0.85 -0.07 -1.44 -2.67 2.81 -1.07 -4.56 117.12 110.97 2klj n MET 70 Ca 0.25 0.02 -0.48 0.00 -1.81 0.00 0.00 57.70 55.68 2klj n MET 70 Cb 0.98 -3.04 -0.09 0.00 -0.71 0.00 0.00 33.22 30.36 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 -2.77 0.14 0.13 3.03 0.00 0.39 -4.75 105.19 101.36 2klj n GLY 71 Ca 0.00 0.97 -0.20 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 12.83 0.61 -7.93 0.99 3.38 -1.91 -3.36 115.31 119.90 2klj h LEU 72 Ca -0.19 -0.68 -0.67 0.00 0.09 0.00 0.00 57.88 56.43 2klj h LEU 72 Cb 1.33 -0.20 -0.36 0.00 0.09 0.00 0.00 40.66 41.52 2klj h LEU 72 CO 1.13 1.54 -0.82 -0.44 0.09 0.00 0.00 178.44 179.94 2klj s SER 73 N -7.32 4.06 0.00 -0.43 0.01 -1.26 -5.00 113.70 103.76 2klj s SER 73 Ca -0.07 -1.17 -0.01 0.00 1.31 0.00 0.00 55.95 56.01 2klj s SER 73 Cb 0.06 -1.53 -0.04 0.00 0.21 0.00 0.00 66.02 64.72 2klj s SER 73 CO 0.91 -0.13 1.20 -0.67 0.41 0.00 0.00 173.24 174.95 2klj n ASP 74 N 4.49 2.37 -3.30 2.44 2.03 -1.26 -4.22 116.55 119.10 2klj n ASP 74 Ca -0.16 -1.72 -0.25 0.00 0.52 0.00 0.00 54.79 53.18 2klj n ASP 74 Cb 0.44 -0.54 -0.08 0.00 -0.72 0.00 0.00 41.12 40.22 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 2.08 -0.63 -4.57 1.67 2.88 -1.18 -4.44 113.62 109.43 2klj n SER 75 Ca 0.06 -2.48 -0.42 0.00 -1.33 0.00 0.00 58.87 54.70 2klj n SER 75 Cb 0.28 -0.37 -0.06 0.00 -0.75 0.00 0.00 64.21 63.31 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 -0.08 4.88 -1.08 2.46 1.01 -1.16 -4.12 120.40 122.31 2klj s VAL 76 Ca 0.33 0.63 0.10 0.00 0.00 0.00 0.00 61.98 63.05 2klj s VAL 76 Cb 0.06 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.40 2klj s VAL 76 CO -0.18 -0.30 0.71 0.54 0.00 0.00 0.00 175.10 175.88 2klj n ARG 77 N 6.05 1.40 -3.70 2.72 1.74 -0.35 -4.34 116.66 120.18 2klj n ARG 77 Ca -0.01 -0.82 -0.14 0.00 -0.77 0.00 0.00 57.85 56.11 2klj n ARG 77 Cb 0.49 -1.13 -0.08 0.00 -1.02 0.00 0.00 32.46 30.71 2klj n ARG 77 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2klj s SER 78 N -1.15 -0.38 -0.08 0.55 0.01 -0.94 0.89 113.70 112.60 2klj s SER 78 Ca 0.10 0.49 -0.29 0.00 1.31 0.00 0.00 55.95 57.56 2klj s SER 78 Cb 0.08 0.56 0.07 0.00 0.21 0.00 0.00 66.02 66.94 2klj s SER 78 CO 0.20 -0.38 0.67 0.00 0.41 0.00 0.00 173.24 174.13 2klj s ARG 80 N -0.93 1.41 -0.23 0.00 1.70 -0.35 0.12 118.95 120.67 2klj s ARG 80 Ca -0.09 -1.62 -0.05 0.00 -0.47 0.00 0.00 55.73 53.50 2klj s ARG 80 Cb -0.01 0.33 -0.02 0.00 -0.57 0.00 0.00 34.95 34.69 2klj s ARG 80 CO 0.08 -0.51 -0.01 -1.17 -1.08 0.00 0.00 175.30 172.61 2klj s LEU 81 N -3.17 3.07 -0.28 -1.89 1.98 -1.26 -2.34 118.68 114.79 2klj s LEU 81 Ca 0.35 -0.32 -0.29 0.00 -2.89 0.00 0.00 54.13 50.98 2klj s LEU 81 Cb 0.04 -1.80 0.01 0.00 0.66 0.00 0.00 46.19 45.11 2klj s LEU 81 CO 0.14 -0.01 1.05 -0.63 -1.89 0.00 0.00 176.35 175.01 2klj s ILE 82 N 1.46 4.59 0.41 6.68 1.01 -0.96 -4.79 121.20 129.60 2klj s ILE 82 Ca 0.05 1.84 -0.24 0.00 0.00 0.00 0.00 60.65 62.30 2klj s ILE 82 Cb -0.14 -4.36 -0.11 0.00 0.01 0.00 0.00 42.46 37.85 2klj s ILE 82 CO -0.01 -0.34 0.88 -2.65 0.00 0.00 0.00 174.94 172.82 2klj n PRO 83 N 6.61 1.10 -0.20 2.79 -0.02 -1.26 -4.47 135.00 139.55 2klj n PRO 83 Ca 0.12 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2klj n PRO 83 Cb 0.47 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 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 -0.57 -0.82 0.00 6.00 8.25 -1.26 -4.28 115.22 122.54 2klj n HIS 84 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2klj n HIS 84 Cb 0.39 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.50 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 -0.77 0.00 0.08 0.41 7.64 -1.26 -4.53 113.62 115.19 2klj n SER 85 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 2klj n SER 85 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 2klj n SER 85 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2klj h GLY 86 N 0.00 -0.15 -2.35 0.23 0.00 -2.01 -3.42 103.07 95.37 2klj h GLY 86 Ca 0.00 0.08 -0.56 0.00 0.00 0.00 0.00 47.33 46.85 2klj h GLY 86 CO 0.00 -0.07 -0.59 -0.56 0.00 0.00 0.00 176.54 175.32 2klj s SER 87 N -5.05 4.53 -0.02 0.19 0.01 -1.26 -4.57 113.70 107.54 2klj s SER 87 Ca -0.14 -0.78 -0.00 0.00 1.31 0.00 0.00 55.95 56.34 2klj s SER 87 Cb 0.06 -0.73 0.02 0.00 0.21 0.00 0.00 66.02 65.59 2klj s SER 87 CO 0.66 -0.19 0.03 -1.00 0.41 0.00 0.00 173.24 173.15 2klj s HIS 88 N -2.41 0.01 -0.09 2.43 0.09 -1.26 -4.38 115.29 109.67 2klj s HIS 88 Ca 0.35 0.11 -0.04 0.00 -0.00 0.00 0.00 55.06 55.48 2klj s HIS 88 Cb -0.03 -0.16 0.04 0.00 -0.00 0.00 0.00 32.58 32.43 2klj s HIS 88 CO 0.21 -0.07 0.20 1.03 -0.00 0.00 0.00 174.74 176.12 2klj s ARG 89 N 0.75 0.15 -0.01 1.40 0.52 -1.23 -4.23 118.95 116.30 2klj s ARG 89 Ca -0.06 0.48 -0.02 0.00 -0.52 0.00 0.00 55.73 55.61 2klj s ARG 89 Cb -0.09 -0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.24 2klj s ARG 89 CO -0.02 -0.17 0.04 -1.50 0.02 0.00 0.00 175.30 173.67 2klj s ILE 90 N 1.30 0.01 -0.39 1.52 2.07 -0.84 -1.39 121.20 123.49 2klj s ILE 90 Ca -0.09 -0.07 0.04 0.00 -1.41 0.00 0.00 60.65 59.12 2klj s ILE 90 Cb -0.11 -0.09 0.11 0.00 0.13 0.00 0.00 42.46 42.50 2klj s ILE 90 CO -0.07 -0.04 0.11 -0.13 -1.91 0.00 0.00 174.94 172.90 2klj s ARG 91 N -0.10 1.55 0.49 3.50 0.52 -0.14 -1.48 118.95 123.29 2klj s ARG 91 Ca -0.01 -2.02 -0.16 0.00 -0.52 0.00 0.00 55.73 53.01 2klj s ARG 91 Cb -0.01 -3.13 -0.08 0.00 0.52 0.00 0.00 34.95 32.25 2klj s ARG 91 CO 0.00 -0.99 0.95 -0.51 0.02 0.00 0.00 175.30 174.77 2klj s LEU 92 N 0.62 3.67 -0.01 2.53 1.02 -0.82 -0.39 118.68 125.30 2klj s LEU 92 Ca 0.13 1.51 0.03 0.00 0.02 0.00 0.00 54.13 55.82 2klj s LEU 92 Cb -0.21 -4.44 -0.01 0.00 0.02 0.00 0.00 46.19 41.56 2klj s LEU 92 CO -0.07 -0.55 -0.11 -0.31 0.02 0.00 0.00 176.35 175.33 2klj s TYR 93 N -2.56 1.04 -0.21 0.29 1.51 0.39 -1.81 117.35 116.01 2klj s TYR 93 Ca 0.58 -0.22 0.22 0.00 -1.01 0.00 0.00 57.07 56.64 2klj s TYR 93 Cb -0.10 -0.69 0.47 0.00 -0.11 0.00 0.00 41.96 41.53 2klj s TYR 93 CO 0.30 -0.05 1.64 1.05 -1.11 0.00 0.00 175.55 177.39 2klj h GLU 94 N 6.01 0.00 -6.04 -0.62 -0.00 -0.52 0.89 114.58 114.30 2klj h GLU 94 Ca -0.33 0.00 -0.54 0.00 -0.00 0.00 0.00 59.36 58.50 2klj h GLU 94 Cb 1.17 0.00 -0.20 0.00 -0.00 0.00 0.00 28.75 29.72 2klj h GLU 94 CO 0.49 0.18 -0.80 0.50 -0.00 0.00 0.00 179.01 179.37 2klj s ARG 95 N -3.26 1.19 0.57 1.06 3.52 -1.26 -3.51 118.95 117.26 2klj s ARG 95 Ca 0.04 -1.28 -0.18 0.00 -0.13 0.00 0.00 55.73 54.18 2klj s ARG 95 Cb 0.07 -1.35 -0.08 0.00 -1.56 0.00 0.00 34.95 32.03 2klj s ARG 95 CO 0.67 0.30 0.64 0.39 -0.81 0.00 0.00 175.30 176.48 2klj n GLU 96 N 0.69 0.61 0.00 5.12 1.02 -1.09 -4.29 120.64 122.71 2klj n GLU 96 Ca -0.16 0.24 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2klj n GLU 96 Cb 0.55 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 0.22 0.00 -2.69 1.62 9.92 0.10 -3.80 116.55 121.93 2klj n ASP 97 Ca 0.12 0.00 -0.06 0.00 -0.53 0.00 0.00 54.79 54.32 2klj n ASP 97 Cb 0.47 0.00 0.09 0.00 -0.64 0.00 0.00 41.12 41.04 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 12.83 -1.18 -0.06 1.24 4.02 -1.26 -4.76 117.16 127.99 2klj n TYR 98 Ca 0.00 -2.15 -0.09 0.00 -0.01 0.00 0.00 57.90 55.66 2klj n TYR 98 Cb 0.00 0.93 -0.03 0.00 -0.02 0.00 0.00 39.34 40.22 2klj n TYR 98 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2klj n ARG 99 N -0.58 0.38 0.00 -0.72 1.74 -1.25 -5.03 116.66 111.20 2klj n ARG 99 Ca -0.01 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 2klj n ARG 99 Cb 0.84 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 31.11 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 2.00 -2.54 3.79 -0.13 0.00 -1.26 -4.92 105.19 102.13 2klj n GLY 100 Ca -0.14 -0.84 -0.36 0.00 0.00 0.00 0.00 46.02 44.67 2klj n GLY 100 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2klj s GLN 101 N -1.78 4.38 0.18 1.61 2.00 -1.26 -4.77 119.66 120.02 2klj s GLN 101 Ca 0.00 1.37 0.05 0.00 -2.00 0.00 0.00 55.36 54.78 2klj s GLN 101 Cb 0.00 -2.61 -0.05 0.00 0.80 0.00 0.00 33.01 31.15 2klj s GLN 101 CO 0.00 0.08 -0.08 0.00 -0.50 0.00 0.00 175.29 174.79 2klj s MET 102 N -2.39 1.20 -0.09 1.67 0.23 -1.26 0.12 119.30 118.78 2klj s MET 102 Ca 0.55 -1.55 -0.09 0.00 -1.03 0.00 0.00 55.69 53.57 2klj s MET 102 Cb -0.18 -0.72 0.02 0.00 -1.53 0.00 0.00 34.83 32.42 2klj s MET 102 CO 0.24 0.04 0.26 -1.50 -2.03 0.00 0.00 175.02 172.03 2klj s ILE 103 N -3.29 0.01 0.11 3.16 2.07 -0.75 -5.00 121.20 117.51 2klj s ILE 103 Ca 0.21 -0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.45 2klj s ILE 103 Cb 0.03 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 42.20 2klj s ILE 103 CO 0.04 -0.02 0.09 -0.70 -1.91 0.00 0.00 174.94 172.44 2klj s GLU 104 N 0.03 2.86 -0.00 3.50 2.12 -1.26 -1.94 118.70 124.00 2klj s GLU 104 Ca -0.01 -0.77 0.01 0.00 0.36 0.00 0.00 54.97 54.56 2klj s GLU 104 Cb -0.02 -2.68 -0.00 0.00 0.26 0.00 0.00 34.13 31.69 2klj s GLU 104 CO 0.01 0.54 -0.03 -0.06 -0.54 0.00 0.00 175.26 175.17 2klj s PHE 105 N -1.51 0.26 -0.09 5.30 0.08 -0.55 -5.00 117.98 116.47 2klj s PHE 105 Ca 0.30 -0.05 0.15 0.00 0.12 0.00 0.00 56.93 57.45 2klj s PHE 105 Cb -0.11 -0.17 0.32 0.00 -0.57 0.00 0.00 43.02 42.48 2klj s PHE 105 CO 0.22 -0.01 1.15 0.25 -0.10 0.00 0.00 175.22 176.73 2klj n THR 106 N 3.06 1.07 -3.07 0.64 -2.24 -1.26 -1.99 114.28 110.49 2klj n THR 106 Ca -0.13 -1.79 0.00 0.00 -2.27 0.00 0.00 64.05 59.86 2klj n THR 106 Cb 0.59 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 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 -0.48 0.00 -2.54 -0.78 0.28 -1.26 -4.66 120.64 111.20 2klj n GLU 107 Ca 0.11 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 56.71 2klj n GLU 107 Cb 0.82 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.65 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 -0.14 7.25 -0.36 -1.84 -4.77 -1.26 -4.44 116.67 111.11 2klj s ASP 108 Ca 0.00 2.17 0.01 0.00 -3.30 0.00 0.00 52.55 51.43 2klj s ASP 108 Cb 0.00 -2.62 0.15 0.00 -1.09 0.00 0.00 42.92 39.36 2klj s ASP 108 CO 0.00 -0.15 0.26 0.00 0.70 0.00 0.00 175.17 175.98 2klj n SER 110 N 4.05 2.74 -2.77 0.00 3.41 -1.26 -0.36 113.62 119.43 2klj n SER 110 Ca 0.12 -2.30 -0.09 0.00 -0.26 0.00 0.00 58.87 56.35 2klj n SER 110 Cb 0.39 -0.49 0.04 0.00 -0.26 0.00 0.00 64.21 63.90 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 4.02 1.02 -0.74 0.00 3.38 -1.60 -2.00 115.31 119.40 2klj h LEU 112 Ca -0.14 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2klj h LEU 112 Cb 1.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2klj h LEU 112 CO 0.33 0.68 0.65 1.56 0.09 0.00 0.00 178.44 181.75 2klj h GLN 113 N 1.18 0.00 0.00 1.13 7.50 -1.71 2.87 115.11 126.07 2klj h GLN 113 Ca 0.39 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 59.49 2klj h GLN 113 Cb 0.05 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.57 2klj h GLN 113 CO -0.14 0.00 -1.33 -3.47 -1.50 0.00 0.00 178.83 172.39 2klj n ASP 114 N -2.42 0.65 -0.11 1.46 2.03 -0.75 -4.49 116.55 112.92 2klj n ASP 114 Ca -0.01 0.26 -0.18 0.00 0.52 0.00 0.00 54.79 55.38 2klj n ASP 114 Cb 0.67 0.72 -0.09 0.00 -0.72 0.00 0.00 41.12 41.70 2klj n ASP 114 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2klj n ARG 115 N -2.64 0.51 -4.56 -0.67 5.12 0.91 -5.03 116.66 110.30 2klj n ARG 115 Ca -0.04 0.16 -0.22 0.00 -1.93 0.00 0.00 57.85 55.82 2klj n ARG 115 Cb 0.63 -1.38 -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 -2.42 1.30 0.00 -1.55 -0.71 0.17 -5.09 117.98 109.69 2klj s PHE 116 Ca -0.30 -0.29 0.00 0.00 -1.04 0.00 0.00 56.93 55.31 2klj s PHE 116 Cb 0.09 -0.81 0.00 0.00 -1.21 0.00 0.00 43.02 41.09 2klj s PHE 116 CO 0.46 0.00 0.00 0.54 -1.34 0.00 0.00 175.22 174.88 2klj n ARG 117 N 2.40 0.00 -0.84 1.99 1.74 -1.26 -4.11 116.66 116.58 2klj n ARG 117 Ca -0.16 0.06 -0.23 0.00 -0.77 0.00 0.00 57.85 56.76 2klj n ARG 117 Cb 0.55 -0.50 -0.09 0.00 -1.02 0.00 0.00 32.46 31.40 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 -0.83 0.30 0.61 -1.55 -1.74 -1.26 -4.66 117.46 108.33 2klj n PHE 118 Ca 0.00 0.20 0.02 0.00 -0.56 0.00 0.00 57.45 57.11 2klj n PHE 118 Cb 0.00 -1.29 0.12 0.00 1.52 0.00 0.00 39.48 39.83 2klj n PHE 118 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 2klj n ASN 119 N 5.79 0.00 -4.02 5.98 0.23 -1.26 -4.49 115.26 117.49 2klj n ASN 119 Ca 0.37 -0.48 -0.31 0.00 -0.53 0.00 0.00 54.58 53.64 2klj n ASN 119 Cb 0.02 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.56 2klj n ASN 119 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2klj s GLU 120 N -2.00 2.24 -0.36 -3.83 2.02 -1.26 -0.76 118.70 114.75 2klj s GLU 120 Ca 0.06 -0.80 -0.13 0.00 0.02 0.00 0.00 54.97 54.12 2klj s GLU 120 Cb 0.03 -2.39 0.00 0.00 0.10 0.00 0.00 34.13 31.87 2klj s GLU 120 CO 0.05 -0.36 0.24 0.42 0.02 0.00 0.00 175.26 175.63 2klj s ILE 121 N 1.38 5.07 -0.45 -1.63 -1.09 -1.08 -4.36 121.20 119.05 2klj s ILE 121 Ca 0.01 -0.48 0.03 0.00 -2.23 0.00 0.00 60.65 57.98 2klj s ILE 121 Cb -0.15 -3.70 0.46 0.00 -1.58 0.00 0.00 42.46 37.48 2klj s ILE 121 CO -0.09 -0.12 1.54 1.41 -1.23 0.00 0.00 174.94 176.44 2klj n HIS 122 N 5.09 2.95 0.00 3.97 8.25 0.29 -4.54 115.22 131.24 2klj n HIS 122 Ca -0.12 -2.56 0.00 0.00 -0.26 0.00 0.00 57.72 54.78 2klj n HIS 122 Cb 0.48 -0.79 0.00 0.00 1.12 0.00 0.00 29.99 30.80 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 -3.49 0.41 7.64 -1.14 -2.65 113.62 113.60 2klj n SER 123 Ca 0.52 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 60.28 2klj n SER 123 Cb 0.84 0.00 -0.03 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 -0.48 -0.25 -3.43 0.05 -1.02 0.15 118.68 113.70 2klj s LEU 124 Ca 0.00 0.16 -0.01 0.00 0.05 0.00 0.00 54.13 54.33 2klj s LEU 124 Cb 0.00 2.28 0.07 0.00 -2.05 0.00 0.00 46.19 46.50 2klj s LEU 124 CO 0.00 -0.71 0.03 0.21 -0.55 0.00 0.00 176.35 175.33 2klj s ASN 125 N -2.22 3.60 -0.45 1.48 2.47 0.48 -0.38 114.94 119.92 2klj s ASN 125 Ca 0.00 -1.23 -0.23 0.00 0.42 0.00 0.00 52.86 51.82 2klj s ASN 125 Cb -0.01 -0.88 0.03 0.00 -1.45 0.00 0.00 41.25 38.94 2klj s ASN 125 CO -0.06 -0.32 0.78 -0.69 -3.72 0.00 0.00 177.10 173.08 2klj s VAL 126 N 1.62 4.66 -0.10 -5.21 1.01 -0.75 -0.97 120.40 120.66 2klj s VAL 126 Ca 0.02 0.39 -0.22 0.00 0.00 0.00 0.00 61.98 62.16 2klj s VAL 126 Cb -0.18 -4.32 -0.28 0.00 0.00 0.00 0.00 36.38 31.61 2klj s VAL 126 CO -0.13 -0.72 0.71 -0.07 0.00 0.00 0.00 175.10 174.89 2klj h LEU 127 N 10.12 0.28 -8.20 3.92 -0.00 -1.47 -2.30 115.31 117.66 2klj h LEU 127 Ca -0.25 -0.90 -0.39 0.00 -0.00 0.00 0.00 57.88 56.35 2klj h LEU 127 Cb 1.09 -0.09 -0.25 0.00 -0.00 0.00 0.00 40.66 41.40 2klj h LEU 127 CO 0.96 1.36 -0.78 -0.70 -0.00 0.00 0.00 178.44 179.28 2klj s GLU 128 N -2.38 0.77 1.27 1.13 2.12 -1.03 -4.88 118.70 115.71 2klj s GLU 128 Ca -0.18 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 54.53 2klj s GLU 128 Cb 0.01 -0.73 0.00 0.00 0.26 0.00 0.00 34.13 33.68 2klj s GLU 128 CO 0.75 0.18 0.00 0.41 -0.54 0.00 0.00 175.26 176.06 2klj n GLY 129 N 2.10 -0.86 3.72 -1.50 0.00 -1.26 -3.46 105.19 103.93 2klj n GLY 129 Ca -0.18 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 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 -4.36 4.11 0.17 1.61 0.15 -1.26 -3.99 113.70 110.12 2klj s SER 130 Ca 0.00 -1.45 -0.07 0.00 0.70 0.00 0.00 55.95 55.13 2klj s SER 130 Cb 0.00 0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.34 2klj s SER 130 CO 0.00 -0.68 0.26 0.26 1.20 0.00 0.00 173.24 174.28 2klj s TRP 131 N -2.77 0.52 -0.05 3.44 0.52 -0.66 -2.69 118.94 117.25 2klj s TRP 131 Ca 0.23 -0.88 0.03 0.00 0.02 0.00 0.00 56.10 55.50 2klj s TRP 131 Cb 0.05 -0.14 0.01 0.00 -1.15 0.00 0.00 33.47 32.24 2klj s TRP 131 CO 0.12 -0.71 -0.13 0.08 0.02 0.00 0.00 176.95 176.33 2klj s VAL 132 N -4.00 1.18 -0.00 4.03 1.01 -0.31 -0.77 120.40 121.53 2klj s VAL 132 Ca 0.20 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2klj s VAL 132 Cb 0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2klj s VAL 132 CO 0.02 0.36 0.06 -0.76 0.00 0.00 0.00 175.10 174.78 2klj s LEU 133 N 0.44 3.80 -0.01 3.92 1.43 -0.34 -1.83 118.68 126.08 2klj s LEU 133 Ca -0.10 0.10 0.07 0.00 -1.03 0.00 0.00 54.13 53.17 2klj s LEU 133 Cb -0.14 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 2klj s LEU 133 CO 0.03 0.27 -0.23 -0.31 0.23 0.00 0.00 176.35 176.35 2klj s TYR 134 N -1.17 2.03 0.09 0.29 1.51 0.15 -0.16 117.35 120.09 2klj s TYR 134 Ca 0.22 -0.38 0.30 0.00 -1.01 0.00 0.00 57.07 56.20 2klj s TYR 134 Cb -0.12 -1.30 1.60 0.00 -0.11 0.00 0.00 41.96 42.03 2klj s TYR 134 CO 0.13 -0.03 1.92 1.49 -1.11 0.00 0.00 175.55 177.96 2klj h GLU 135 N 5.54 0.00 0.00 -0.62 4.81 -1.64 0.49 114.58 123.17 2klj h GLU 135 Ca -0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2klj h GLU 135 Cb 1.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.51 2klj h GLU 135 CO 0.47 0.00 0.00 1.47 -0.73 0.00 0.00 179.01 180.22 2klj n LEU 136 N -2.58 0.00 -4.97 1.64 -0.00 -1.26 -3.77 117.00 106.07 2klj n LEU 136 Ca -0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.78 2klj n LEU 136 Cb 0.07 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.53 2klj n LEU 136 CO 0.15 0.00 0.36 -0.94 -0.00 0.00 0.00 177.39 176.96 2klj s SER 137 N -0.52 5.36 -0.57 1.45 1.04 -1.26 -2.09 113.70 117.12 2klj s SER 137 Ca 0.00 0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.45 2klj s SER 137 Cb 0.00 -1.01 0.04 0.00 0.10 0.00 0.00 66.02 65.15 2klj s SER 137 CO 0.00 -1.08 0.14 0.59 0.98 0.00 0.00 173.24 173.87 2klj n ASN 138 N -2.32 -1.79 -3.79 7.02 3.02 -0.15 -2.27 115.26 114.98 2klj n ASN 138 Ca 0.07 0.09 -0.26 0.00 -0.03 0.00 0.00 54.58 54.45 2klj n ASN 138 Cb 0.59 -1.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.15 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 -3.01 -2.07 -1.84 3.10 4.01 -1.26 -4.90 117.16 111.19 2klj n TYR 139 Ca -0.00 0.85 -0.09 0.00 -0.16 0.00 0.00 57.90 58.50 2klj n TYR 139 Cb 0.51 -2.67 0.11 0.00 -0.31 0.00 0.00 39.34 36.99 2klj n TYR 139 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2klj n ARG 140 N -2.47 2.55 0.00 -0.72 0.63 -0.96 -5.02 116.66 110.66 2klj n ARG 140 Ca -0.31 -3.71 0.00 0.00 -0.92 0.00 0.00 57.85 52.91 2klj n ARG 140 Cb 0.70 -1.91 0.00 0.00 0.45 0.00 0.00 32.46 31.70 2klj n ARG 140 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2klj n GLY 141 N -0.88 2.92 3.91 5.14 0.00 -1.26 -4.94 105.19 110.07 2klj n GLY 141 Ca 0.31 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 46.06 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 4.35 2.25 -0.03 1.61 1.81 -1.26 -4.91 118.95 122.77 2klj s ARG 142 Ca 0.00 -0.00 -0.08 0.00 -1.72 0.00 0.00 55.73 53.92 2klj s ARG 142 Cb 0.00 -2.08 0.01 0.00 -0.45 0.00 0.00 34.95 32.44 2klj s ARG 142 CO 0.00 -1.30 0.19 1.14 -0.68 0.00 0.00 175.30 174.64 2klj s GLN 143 N -5.37 0.40 0.05 3.54 0.00 -1.26 -2.44 119.66 114.59 2klj s GLN 143 Ca 0.60 -0.09 0.06 0.00 -0.00 0.00 0.00 55.36 55.94 2klj s GLN 143 Cb -0.11 0.18 -0.02 0.00 0.00 0.00 0.00 33.01 33.05 2klj s GLN 143 CO 0.47 -0.09 -0.18 0.71 0.00 0.00 0.00 175.29 176.20 2klj s TYR 144 N -0.75 1.59 -0.21 9.60 1.51 0.78 -4.94 117.35 124.92 2klj s TYR 144 Ca -0.08 -0.37 -0.09 0.00 -1.01 0.00 0.00 57.07 55.51 2klj s TYR 144 Cb -0.05 -0.94 -0.05 0.00 -0.11 0.00 0.00 41.96 40.82 2klj s TYR 144 CO 0.01 0.08 0.12 -1.17 -1.11 0.00 0.00 175.55 173.49 2klj s LEU 145 N -1.21 4.05 -0.33 -1.29 0.20 -1.26 -1.20 118.68 117.64 2klj s LEU 145 Ca 0.05 0.13 -0.05 0.00 0.69 0.00 0.00 54.13 54.95 2klj s LEU 145 Cb -0.09 -2.06 0.04 0.00 -0.43 0.00 0.00 46.19 43.66 2klj s LEU 145 CO 0.02 0.12 0.07 -0.76 -0.29 0.00 0.00 176.35 175.51 2klj s LEU 146 N 0.69 4.20 0.66 -0.68 2.01 0.05 -5.01 118.68 120.59 2klj s LEU 146 Ca 0.07 -1.20 -0.08 0.00 0.01 0.00 0.00 54.13 52.92 2klj s LEU 146 Cb -0.12 -1.82 0.02 0.00 0.01 0.00 0.00 46.19 44.28 2klj s LEU 146 CO 0.01 -0.31 1.00 -0.04 1.01 0.00 0.00 176.35 178.03 2klj s MET 147 N 1.35 2.79 -0.04 1.70 -1.94 -1.26 -1.65 119.30 120.25 2klj s MET 147 Ca -0.03 0.17 -0.30 0.00 -1.71 0.00 0.00 55.69 53.83 2klj s MET 147 Cb -0.20 -2.15 -0.07 0.00 2.01 0.00 0.00 34.83 34.43 2klj s MET 147 CO 0.01 -0.92 1.82 -2.14 -0.01 0.00 0.00 175.02 173.79 2klj s PRO 148 N -5.19 4.05 0.00 2.03 0.02 -1.26 -4.73 135.00 129.92 2klj s PRO 148 Ca 0.56 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.89 2klj s PRO 148 Cb -0.11 -4.09 0.00 0.00 0.02 0.00 0.00 34.50 30.32 2klj s PRO 148 CO 0.48 -1.03 0.00 0.41 -0.33 0.00 0.00 177.00 176.53 2klj n GLY 149 N 4.47 -0.63 3.02 0.52 0.00 -0.86 -5.01 105.19 106.69 2klj n GLY 149 Ca 0.19 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 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 1.44 -0.00 1.61 -1.08 -1.26 -1.81 116.67 111.57 2klj s ASP 150 Ca 0.00 -0.23 0.06 0.00 -0.52 0.00 0.00 52.55 51.86 2klj s ASP 150 Cb 0.00 -0.48 -0.02 0.00 -1.46 0.00 0.00 42.92 40.97 2klj s ASP 150 CO 0.00 0.06 -0.19 -0.31 0.52 0.00 0.00 175.17 175.25 2klj s TYR 151 N 0.33 1.72 -0.15 -5.34 1.51 0.49 -5.02 117.35 110.90 2klj s TYR 151 Ca -0.06 -0.33 0.01 0.00 -1.01 0.00 0.00 57.07 55.68 2klj s TYR 151 Cb -0.11 -1.09 0.01 0.00 -0.11 0.00 0.00 41.96 40.66 2klj s TYR 151 CO 0.01 -0.01 0.49 2.89 -1.11 0.00 0.00 175.55 177.82 2klj n ARG 152 N 2.47 -0.04 -3.75 -0.62 1.85 -1.26 -2.44 116.66 112.86 2klj n ARG 152 Ca -0.15 -0.52 -0.06 0.00 -1.00 0.00 0.00 57.85 56.12 2klj n ARG 152 Cb 0.53 -0.97 -0.02 0.00 -1.05 0.00 0.00 32.46 30.95 2klj n ARG 152 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 2klj s ARG 153 N -0.21 1.38 0.37 2.89 1.70 -1.22 0.03 118.95 123.90 2klj s ARG 153 Ca 0.01 -0.73 0.17 0.00 -0.47 0.00 0.00 55.73 54.71 2klj s ARG 153 Cb 0.01 0.49 0.73 0.00 -0.57 0.00 0.00 34.95 35.61 2klj s ARG 153 CO 0.02 -0.63 1.78 0.10 -1.08 0.00 0.00 175.30 175.49 2klj h TYR 154 N 2.00 0.00 0.00 5.89 -0.00 -1.80 -2.83 116.97 120.23 2klj h TYR 154 Ca -0.23 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 58.43 2klj h TYR 154 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.96 2klj h TYR 154 CO 0.38 0.38 -0.33 1.96 -0.00 0.00 0.00 178.16 180.56 2klj h GLN 155 N 0.00 0.00 -0.83 0.10 4.20 -1.90 -3.08 115.11 113.60 2klj h GLN 155 Ca -0.00 0.00 0.20 0.00 0.06 0.00 0.00 58.65 58.91 2klj h GLN 155 Cb 0.79 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.42 2klj h GLN 155 CO 0.05 0.33 0.01 -0.44 -0.67 0.00 0.00 178.83 178.10 2klj h ASP 156 N 0.00 -0.40 -0.61 1.46 3.32 -1.87 1.50 116.42 119.82 2klj h ASP 156 Ca -0.00 0.22 -0.27 0.00 0.02 0.00 0.00 57.03 57.00 2klj h ASP 156 Cb 0.68 0.39 -0.16 0.00 0.22 0.00 0.00 39.33 40.46 2klj h ASP 156 CO 0.04 -0.23 0.34 -2.67 -1.72 0.00 0.00 179.24 175.00 2klj n TRP 157 N -5.39 1.95 -3.30 4.55 2.14 -1.21 -4.92 117.44 111.27 2klj n TRP 157 Ca 0.16 -1.19 -0.11 0.00 2.07 0.00 0.00 57.50 58.43 2klj n TRP 157 Cb 0.55 -0.64 0.00 0.00 -0.81 0.00 0.00 31.31 30.41 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 -0.36 -1.17 3.02 -1.67 0.00 0.51 -4.96 105.19 100.55 2klj n GLY 158 Ca 0.36 0.66 -0.21 0.00 0.00 0.00 0.00 46.02 46.82 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 -2.84 0.94 0.42 4.61 0.00 -1.17 -5.01 121.76 118.71 2klj s ALA 159 Ca 0.06 -0.37 0.17 0.00 0.00 0.00 0.00 51.96 51.82 2klj s ALA 159 Cb -0.01 -0.35 1.03 0.00 0.00 0.00 0.00 23.12 23.80 2klj s ALA 159 CO 0.81 0.15 1.97 0.00 0.00 0.00 0.00 175.76 178.69 2klj h THR 160 N 5.39 1.03 -2.51 0.00 1.03 -1.95 -3.38 112.91 112.52 2klj h THR 160 Ca -0.33 -0.76 -0.08 0.00 -0.01 0.00 0.00 66.41 65.23 2klj h THR 160 Cb 1.17 1.43 -0.02 0.00 -1.07 0.00 0.00 68.15 69.66 2klj h THR 160 CO 0.49 0.21 -0.05 0.59 -0.01 0.00 0.00 175.52 176.74 2klj n ASN 161 N -4.11 -0.29 -0.00 0.00 4.13 -1.26 -5.06 115.26 108.67 2klj n ASN 161 Ca -0.02 -1.46 0.03 0.00 1.68 0.00 0.00 54.58 54.81 2klj n ASN 161 Cb 0.28 0.55 -0.04 0.00 -1.54 0.00 0.00 39.78 39.04 2klj n ASN 161 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2klj n ALA 162 N -2.46 2.74 -1.06 5.41 0.00 -1.26 -4.88 120.51 118.99 2klj n ALA 162 Ca -0.03 -0.17 -0.48 0.00 0.00 0.00 0.00 53.44 52.76 2klj n ALA 162 Cb 0.14 -0.22 -0.10 0.00 0.00 0.00 0.00 19.45 19.26 2klj n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2klj n ARG 163 N -1.20 0.00 -4.74 0.00 1.74 -1.25 -2.63 116.66 108.57 2klj n ARG 163 Ca 0.01 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.83 2klj n ARG 163 Cb 0.10 -1.25 -0.17 0.00 -1.02 0.00 0.00 32.46 30.13 2klj n ARG 163 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2klj s VAL 164 N 5.27 1.35 -0.03 1.55 1.01 0.06 -4.14 120.40 125.48 2klj s VAL 164 Ca 1.01 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 62.46 2klj s VAL 164 Cb -1.23 -1.21 -0.12 0.00 0.00 0.00 0.00 36.38 33.82 2klj s VAL 164 CO 0.53 0.40 0.14 0.61 0.00 0.00 0.00 175.10 176.79 2klj n GLY 165 N 3.65 -0.39 3.76 4.51 0.00 0.17 -4.67 105.19 112.23 2klj n GLY 165 Ca -0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.24 -0.07 -0.00 1.61 1.04 -0.89 -2.03 113.70 110.12 2klj s SER 166 Ca -0.03 -0.33 -0.28 0.00 0.48 0.00 0.00 55.95 55.79 2klj s SER 166 Cb 0.05 0.32 0.09 0.00 0.10 0.00 0.00 66.02 66.57 2klj s SER 166 CO 0.34 -0.61 0.77 -1.48 0.98 0.00 0.00 173.24 173.24 2klj s LEU 167 N -3.16 -0.51 0.31 2.42 2.34 0.51 -0.67 118.68 119.91 2klj s LEU 167 Ca 0.17 0.30 0.04 0.00 0.06 0.00 0.00 54.13 54.70 2klj s LEU 167 Cb 0.01 2.31 -0.03 0.00 -0.56 0.00 0.00 46.19 47.91 2klj s LEU 167 CO 0.00 -0.66 0.19 0.00 -1.06 0.00 0.00 176.35 174.82 2klj s ARG 168 N -2.30 1.63 -0.14 1.48 1.70 -0.76 -0.64 118.95 119.91 2klj s ARG 168 Ca -0.02 -1.93 -0.06 0.00 -0.47 0.00 0.00 55.73 53.24 2klj s ARG 168 Cb -0.01 0.02 -0.04 0.00 -0.57 0.00 0.00 34.95 34.35 2klj s ARG 168 CO -0.02 -0.50 0.09 -0.98 -1.08 0.00 0.00 175.30 172.81 2klj s ARG 169 N -3.74 3.56 -1.01 3.89 1.70 -1.26 -1.16 118.95 120.93 2klj s ARG 169 Ca 0.36 -0.24 -0.06 0.00 -0.47 0.00 0.00 55.73 55.32 2klj s ARG 169 Cb 0.04 -3.14 0.05 0.00 -0.57 0.00 0.00 34.95 31.33 2klj s ARG 169 CO 0.19 0.59 2.66 1.33 -1.08 0.00 0.00 175.30 179.00 2klj n VAL 170 N 2.55 4.42 -4.28 4.99 0.24 -1.10 -4.87 118.33 120.28 2klj n VAL 170 Ca -0.18 -3.53 -0.22 0.00 -2.04 0.00 0.00 64.34 58.37 2klj n VAL 170 Cb 0.54 -1.99 -0.16 0.00 -1.47 0.00 0.00 33.84 30.75 2klj n VAL 170 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2klj s ILE 171 N -0.93 0.78 0.12 1.34 1.09 -1.26 -4.59 121.20 117.74 2klj s ILE 171 Ca 0.58 -0.25 -0.10 0.00 -1.10 0.00 0.00 60.65 59.78 2klj s ILE 171 Cb 0.25 -0.76 -0.16 0.00 -1.06 0.00 0.00 42.46 40.73 2klj s ILE 171 CO -0.12 0.28 1.31 -2.24 -0.10 0.00 0.00 174.94 174.07 2klj h ASP 172 N 7.21 0.82 0.00 3.58 2.03 -1.89 -3.37 116.42 124.80 2klj h ASP 172 Ca -0.34 -0.56 0.00 0.00 -0.73 0.00 0.00 57.03 55.39 2klj h ASP 172 Cb 1.16 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 2klj h ASP 172 CO 0.46 1.35 0.00 0.49 -1.03 0.00 0.00 179.24 180.51 2klj n PHE 173 N -3.89 0.00 1.01 4.15 3.72 -1.26 -5.04 117.46 116.16 2klj n PHE 173 Ca -0.07 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.45 2klj n PHE 173 Cb 0.77 -0.13 0.11 0.00 -0.94 0.00 0.00 39.48 39.29 2klj n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16