#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kqy s GLY 2 N 0.00 1.96 -0.14 -0.02 0.00 -0.89 -4.88 107.32 103.35 1kqy s GLY 2 Ca 0.00 -1.80 -0.03 0.00 0.00 0.00 0.00 44.72 42.88 1kqy s GLY 2 CO 0.00 -1.65 -0.03 -0.42 0.00 0.00 0.00 173.10 171.00 1kqy s ILE 3 N -3.59 4.00 -0.14 0.90 1.01 -1.26 -1.70 121.20 120.43 1kqy s ILE 3 Ca 0.36 -0.33 -0.06 0.00 0.00 0.00 0.00 60.65 60.61 1kqy s ILE 3 Cb 0.07 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 1kqy s ILE 3 CO 0.15 0.51 0.09 0.00 0.00 0.00 0.00 174.94 175.69 1kqy s ALA 4 N 0.11 3.60 0.04 9.38 0.00 0.68 -0.56 121.76 135.00 1kqy s ALA 4 Ca -0.00 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.30 1kqy s ALA 4 Cb -0.13 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 1kqy s ALA 4 CO 0.03 0.44 -0.16 -1.50 0.00 0.00 0.00 175.76 174.56 1kqy s ILE 5 N -0.45 1.28 -0.23 0.00 1.10 -0.19 -0.63 121.20 122.08 1kqy s ILE 5 Ca 0.10 -1.07 -0.10 0.00 -0.51 0.00 0.00 60.65 59.07 1kqy s ILE 5 Cb -0.12 -1.14 -0.05 0.00 0.15 0.00 0.00 42.46 41.30 1kqy s ILE 5 CO 0.02 0.05 0.15 -0.31 -2.11 0.00 0.00 174.94 172.74 1kqy s TYR 6 N -0.85 3.34 0.03 3.50 1.51 -1.14 -0.88 117.35 122.85 1kqy s TYR 6 Ca 0.03 0.25 0.07 0.00 -1.01 0.00 0.00 57.07 56.40 1kqy s TYR 6 Cb -0.08 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 1kqy s TYR 6 CO 0.01 0.12 -0.19 -0.46 -1.11 0.00 0.00 175.55 173.92 1kqy s TRP 7 N 0.89 1.69 0.00 2.71 -0.00 -0.51 -1.84 118.94 121.88 1kqy s TRP 7 Ca 0.08 -0.36 0.00 0.00 -0.00 0.00 0.00 56.10 55.82 1kqy s TRP 7 Cb -0.13 -1.03 0.00 0.00 -0.00 0.00 0.00 33.47 32.32 1kqy s TRP 7 CO 0.03 0.05 0.00 0.41 -0.00 0.00 0.00 176.95 177.44 1kqy n GLY 8 N 2.05 1.34 1.47 5.86 0.00 -1.26 -0.98 105.19 113.66 1kqy n GLY 8 Ca -0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.95 1kqy n GLY 8 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1kqy n GLN 9 N 0.00 3.42 -3.22 1.61 1.13 -1.25 -2.69 117.38 116.37 1kqy n GLN 9 Ca 0.00 -2.80 -0.01 0.00 -1.94 0.00 0.00 57.00 52.26 1kqy n GLN 9 Cb 0.00 -1.78 -0.03 0.00 0.11 0.00 0.00 30.24 28.54 1kqy n GLN 9 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1kqy s ASN 10 N -0.97 -0.83 0.33 1.08 3.84 -1.26 -4.78 114.94 112.35 1kqy s ASN 10 Ca 0.49 0.52 0.16 0.00 0.21 0.00 0.00 52.86 54.24 1kqy s ASN 10 Cb 0.30 1.78 0.87 0.00 -0.55 0.00 0.00 41.25 43.65 1kqy s ASN 10 CO 0.26 -0.28 1.42 0.61 -2.79 0.00 0.00 177.10 176.32 1kqy n GLY 11 N 5.40 -0.70 0.80 1.21 0.00 -1.26 -1.19 105.19 109.46 1kqy n GLY 11 Ca -0.01 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1kqy n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1kqy n ASN 12 N -2.13 2.44 -0.30 1.61 3.02 -1.26 -4.29 115.26 114.36 1kqy n ASN 12 Ca -0.01 -1.82 0.09 0.00 -0.03 0.00 0.00 54.58 52.82 1kqy n ASN 12 Cb 0.23 -0.11 0.43 0.00 -0.61 0.00 0.00 39.78 39.72 1kqy n ASN 12 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1kqy n GLU 13 N 0.85 1.39 0.00 3.52 0.28 -0.33 -5.02 120.64 121.33 1kqy n GLU 13 Ca 0.17 -0.59 0.00 0.00 -0.16 0.00 0.00 57.16 56.58 1kqy n GLU 13 Cb 0.47 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 32.01 1kqy n GLU 13 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1kqy n GLY 14 N 0.96 0.61 3.75 -1.84 0.00 -1.26 -4.72 105.19 102.68 1kqy n GLY 14 Ca 0.14 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 1kqy n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kqy s THR 15 N -2.75 2.70 0.23 2.61 -4.23 -1.26 -4.83 115.64 108.11 1kqy s THR 15 Ca 0.00 0.23 -0.04 0.00 -1.18 0.00 0.00 61.69 60.70 1kqy s THR 15 Cb 0.00 -2.81 0.10 0.00 1.34 0.00 0.00 72.50 71.12 1kqy s THR 15 CO 0.00 -0.30 1.72 0.25 -0.54 0.00 0.00 174.62 175.75 1kqy h LEU 16 N -1.42 0.86 -0.27 4.79 5.85 -1.95 -0.20 115.31 122.96 1kqy h LEU 16 Ca -0.49 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.00 1kqy h LEU 16 Cb 1.29 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1kqy h LEU 16 CO 0.57 0.92 0.16 0.74 -0.34 0.00 0.00 178.44 180.49 1kqy h THR 17 N 0.82 1.11 -0.75 1.05 2.02 -1.91 -1.63 112.91 113.62 1kqy h THR 17 Ca 0.15 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 67.01 1kqy h THR 17 Cb 0.49 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 1kqy h THR 17 CO 0.02 0.11 0.25 -0.61 0.37 0.00 0.00 175.52 175.66 1kqy h GLN 18 N 0.34 1.15 -0.33 6.66 -0.00 -1.86 -1.04 115.11 120.03 1kqy h GLN 18 Ca 0.10 -0.24 0.03 0.00 -0.00 0.00 0.00 58.65 58.54 1kqy h GLN 18 Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 27.48 27.31 1kqy h GLN 18 CO -0.02 0.97 0.12 1.15 0.00 0.00 0.00 178.83 181.05 1kqy h THR 19 N 1.10 0.92 0.00 2.39 2.02 -0.66 -2.41 112.91 116.28 1kqy h THR 19 Ca 0.24 -0.09 -0.10 0.00 0.77 0.00 0.00 66.41 67.23 1kqy h THR 19 Cb 0.29 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1kqy h THR 19 CO -0.01 0.05 -0.47 0.00 0.37 0.00 0.00 175.52 175.46 1kqy n SER 21 N -3.49 0.22 0.29 0.00 3.41 -0.41 -2.54 113.62 111.11 1kqy n SER 21 Ca 0.00 0.55 0.17 0.00 -0.26 0.00 0.00 58.87 59.33 1kqy n SER 21 Cb 0.59 -0.60 0.83 0.00 -0.26 0.00 0.00 64.21 64.77 1kqy n SER 21 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1kqy h THR 22 N 0.00 0.19 -0.53 6.66 1.35 -1.40 -3.46 112.91 115.72 1kqy h THR 22 Ca 0.00 -0.42 -0.23 0.00 -0.55 0.00 0.00 66.41 65.21 1kqy h THR 22 Cb 0.32 1.35 -0.09 0.00 -1.73 0.00 0.00 68.15 67.99 1kqy h THR 22 CO 0.00 0.05 -0.21 0.54 -0.25 0.00 0.00 175.52 175.65 1kqy n ARG 23 N -3.25 -1.00 -0.01 4.72 1.74 -1.05 -4.86 116.66 112.95 1kqy n ARG 23 Ca -0.01 0.86 0.09 0.00 -0.77 0.00 0.00 57.85 58.01 1kqy n ARG 23 Cb 0.23 -4.91 -0.13 0.00 -1.02 0.00 0.00 32.46 26.63 1kqy n ARG 23 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1kqy n LYS 24 N -2.21 0.59 -4.39 5.56 5.02 -1.26 -4.98 118.16 116.49 1kqy n LYS 24 Ca -0.11 -0.15 -0.34 0.00 -2.02 0.00 0.00 58.31 55.69 1kqy n LYS 24 Cb 0.42 -1.40 -0.10 0.00 -0.02 0.00 0.00 35.03 33.93 1kqy n LYS 24 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1kqy s TYR 25 N -3.16 3.10 -0.04 2.13 2.02 -1.26 -4.31 117.35 115.83 1kqy s TYR 25 Ca -0.05 0.04 0.21 0.00 -0.37 0.00 0.00 57.07 56.90 1kqy s TYR 25 Cb 0.11 -1.84 -0.33 0.00 -0.40 0.00 0.00 41.96 39.50 1kqy s TYR 25 CO 0.72 0.30 0.44 0.43 -1.57 0.00 0.00 175.55 175.86 1kqy n SER 26 N 2.61 0.11 -3.90 2.29 7.64 0.27 -4.90 113.62 117.75 1kqy n SER 26 Ca -0.18 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.58 1kqy n SER 26 Cb 0.53 1.91 -0.14 0.00 -1.01 0.00 0.00 64.21 65.50 1kqy n SER 26 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1kqy s TYR 27 N -3.42 0.11 -0.10 1.43 1.51 -1.12 -2.81 117.35 112.97 1kqy s TYR 27 Ca -0.08 -0.10 0.01 0.00 -1.01 0.00 0.00 57.07 55.89 1kqy s TYR 27 Cb 0.13 -0.08 0.02 0.00 -0.11 0.00 0.00 41.96 41.93 1kqy s TYR 27 CO 0.88 -0.03 -0.10 0.08 -1.11 0.00 0.00 175.55 175.27 1kqy s VAL 28 N -0.25 1.12 -0.27 0.71 1.01 -0.39 -1.03 120.40 121.31 1kqy s VAL 28 Ca -0.02 -0.40 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 1kqy s VAL 28 Cb -0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.26 1kqy s VAL 28 CO -0.00 0.37 0.08 0.20 0.00 0.00 0.00 175.10 175.75 1kqy s ASN 29 N 1.26 5.14 -0.38 3.32 0.01 -0.06 -1.03 114.94 123.21 1kqy s ASN 29 Ca -0.03 -0.39 -0.28 0.00 -0.71 0.00 0.00 52.86 51.45 1kqy s ASN 29 Cb -0.14 -1.91 0.02 0.00 0.41 0.00 0.00 41.25 39.63 1kqy s ASN 29 CO -0.04 -0.10 1.03 -0.63 -1.51 0.00 0.00 177.10 175.85 1kqy s ILE 30 N 1.58 4.47 -0.16 0.60 1.01 0.41 -1.42 121.20 127.68 1kqy s ILE 30 Ca 0.05 1.38 -0.04 0.00 0.00 0.00 0.00 60.65 62.04 1kqy s ILE 30 Cb -0.16 -4.43 -0.03 0.00 0.01 0.00 0.00 42.46 37.85 1kqy s ILE 30 CO 0.03 -0.64 -0.03 0.00 0.00 0.00 0.00 174.94 174.31 1kqy s ALA 31 N 3.77 3.02 0.10 9.38 0.00 -0.15 -0.61 121.76 137.27 1kqy s ALA 31 Ca 0.43 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.48 1kqy s ALA 31 Cb -0.11 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 1kqy s ALA 31 CO 0.21 0.18 0.19 -0.06 0.00 0.00 0.00 175.76 176.28 1kqy s PHE 32 N 0.41 0.25 -0.93 0.00 0.08 -0.32 -3.90 117.98 113.57 1kqy s PHE 32 Ca -0.03 -0.67 -0.12 0.00 0.12 0.00 0.00 56.93 56.23 1kqy s PHE 32 Cb -0.14 -0.10 0.24 0.00 -0.57 0.00 0.00 43.02 42.45 1kqy s PHE 32 CO 0.03 -0.57 0.89 -1.17 -0.10 0.00 0.00 175.22 174.30 1kqy s LEU 33 N -2.89 6.54 0.00 -0.37 2.96 -0.18 -0.42 118.68 124.32 1kqy s LEU 33 Ca 0.08 -3.07 0.15 0.00 -0.22 0.00 0.00 54.13 51.07 1kqy s LEU 33 Cb 0.05 -2.19 0.46 0.00 0.50 0.00 0.00 46.19 45.01 1kqy s LEU 33 CO -0.08 -0.45 1.37 -0.46 -1.32 0.00 0.00 176.35 175.41 1kqy n ASN 34 N 3.43 2.23 -3.69 3.68 6.94 -1.17 -2.01 115.26 124.66 1kqy n ASN 34 Ca 0.18 -1.94 -0.17 0.00 -0.02 0.00 0.00 54.58 52.63 1kqy n ASN 34 Cb 0.44 -0.25 -0.16 0.00 -2.36 0.00 0.00 39.78 37.45 1kqy n ASN 34 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1kqy s LYS 35 N -1.51 0.02 0.00 -3.83 2.20 -1.19 -2.46 119.74 112.98 1kqy s LYS 35 Ca 0.30 0.48 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 1kqy s LYS 35 Cb 0.16 -0.29 0.00 0.00 -1.51 0.00 0.00 37.83 36.19 1kqy s LYS 35 CO 0.22 -0.28 0.00 1.97 -0.36 0.00 0.00 175.35 176.90 1kqy n PHE 36 N 5.06 0.00 0.00 4.03 1.16 -1.26 -1.07 117.46 125.38 1kqy n PHE 36 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.49 1kqy n PHE 36 Cb 0.50 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.37 1kqy n PHE 36 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1kqy n GLY 37 N -0.00 -1.35 2.81 4.97 0.00 -1.25 -1.63 105.19 108.75 1kqy n GLY 37 Ca 0.00 -1.55 -0.21 0.00 0.00 0.00 0.00 46.02 44.25 1kqy n GLY 37 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1kqy n ASN 38 N -1.43 -5.77 0.00 1.61 5.15 -1.26 -1.91 115.26 111.65 1kqy n ASN 38 Ca 0.00 -0.18 0.00 0.00 -0.60 0.00 0.00 54.58 53.80 1kqy n ASN 38 Cb 0.00 -4.72 0.00 0.00 -0.53 0.00 0.00 39.78 34.53 1kqy n ASN 38 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1kqy n GLY 39 N -1.30 1.33 3.78 8.20 0.00 -1.26 -5.03 105.19 110.92 1kqy n GLY 39 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1kqy n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1kqy s GLN 40 N -0.21 3.81 -0.14 1.61 -0.21 -0.80 -4.98 119.66 118.74 1kqy s GLN 40 Ca 0.00 1.55 -0.29 0.00 0.02 0.00 0.00 55.36 56.64 1kqy s GLN 40 Cb 0.00 -2.28 -0.01 0.00 1.00 0.00 0.00 33.01 31.72 1kqy s GLN 40 CO 0.00 -0.45 1.14 0.99 -2.12 0.00 0.00 175.29 174.85 1kqy s THR 41 N -1.75 4.47 0.26 -0.19 2.01 -1.26 -4.22 115.64 114.96 1kqy s THR 41 Ca 0.65 1.77 -0.31 0.00 0.31 0.00 0.00 61.69 64.11 1kqy s THR 41 Cb -0.22 -4.14 -0.13 0.00 0.01 0.00 0.00 72.50 68.02 1kqy s THR 41 CO 0.27 -0.08 1.41 -2.65 -0.69 0.00 0.00 174.62 172.88 1kqy n PRO 42 N 5.82 2.14 -4.08 4.92 -0.02 -1.26 -4.67 135.00 137.85 1kqy n PRO 42 Ca 0.12 0.76 -0.16 0.00 -2.02 0.00 0.00 63.50 62.19 1kqy n PRO 42 Cb 0.46 -2.42 -0.15 0.00 -0.02 0.00 0.00 33.50 31.37 1kqy n PRO 42 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1kqy s GLN 43 N -0.66 0.38 0.00 -0.52 0.74 -0.24 -4.99 119.66 114.38 1kqy s GLN 43 Ca 0.66 -0.10 -0.01 0.00 0.05 0.00 0.00 55.36 55.95 1kqy s GLN 43 Cb -0.62 -0.41 -0.04 0.00 1.10 0.00 0.00 33.01 33.04 1kqy s GLN 43 CO 0.51 0.03 0.12 -1.50 -0.55 0.00 0.00 175.29 173.91 1kqy s ILE 44 N 0.21 4.99 -0.15 -2.34 2.07 -1.26 -3.07 121.20 121.65 1kqy s ILE 44 Ca -0.02 -0.34 0.00 0.00 -1.41 0.00 0.00 60.65 58.88 1kqy s ILE 44 Cb -0.05 -3.31 0.03 0.00 0.13 0.00 0.00 42.46 39.25 1kqy s ILE 44 CO -0.00 0.32 -0.11 0.21 -1.91 0.00 0.00 174.94 173.45 1kqy s ASN 45 N -1.87 2.75 -0.30 4.50 3.84 0.44 -4.76 114.94 119.55 1kqy s ASN 45 Ca 0.25 -0.56 0.08 0.00 0.21 0.00 0.00 52.86 52.84 1kqy s ASN 45 Cb -0.12 -1.08 0.46 0.00 -0.55 0.00 0.00 41.25 39.96 1kqy s ASN 45 CO 0.16 -0.11 1.18 0.18 -2.79 0.00 0.00 177.10 175.73 1kqy n LEU 46 N 4.81 4.71 0.00 3.21 4.77 -1.26 -1.17 117.00 132.07 1kqy n LEU 46 Ca -0.15 -4.67 0.00 0.00 -0.03 0.00 0.00 56.01 51.16 1kqy n LEU 46 Cb 0.49 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1kqy n LEU 46 CO 0.19 2.05 0.00 0.00 -1.33 0.00 0.00 177.39 178.31 1kqy n ALA 47 N -0.69 0.00 1.39 -1.18 0.00 -1.10 -1.13 120.51 117.80 1kqy n ALA 47 Ca 0.41 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.93 1kqy n ALA 47 Cb 0.94 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.72 1kqy n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kqy n GLY 48 N 0.00 -0.04 0.21 0.00 0.00 -1.26 -4.27 105.19 99.83 1kqy n GLY 48 Ca 0.00 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 1kqy n GLY 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1kqy h HIS 49 N 1.48 -0.42 -2.70 1.61 -0.00 -1.41 -3.44 115.15 110.27 1kqy h HIS 49 Ca 0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.37 1kqy h HIS 49 Cb 0.33 0.14 -0.14 0.00 -0.00 0.00 0.00 27.41 27.74 1kqy h HIS 49 CO 0.10 -0.19 0.28 0.00 -0.00 0.00 0.00 177.93 178.13 1kqy s ASN 51 N -2.49 5.91 0.61 0.00 3.84 -1.26 -4.56 114.94 116.98 1kqy s ASN 51 Ca 0.01 -0.31 0.41 0.00 0.21 0.00 0.00 52.86 53.18 1kqy s ASN 51 Cb -0.01 -2.10 2.21 0.00 -0.55 0.00 0.00 41.25 40.80 1kqy s ASN 51 CO -0.09 -0.16 2.24 1.55 -2.79 0.00 0.00 177.10 177.85 1kqy h PRO 52 N 8.42 0.00 -6.93 0.43 0.13 -1.85 -3.02 132.00 129.17 1kqy h PRO 52 Ca -0.33 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.25 1kqy h PRO 52 Cb 1.17 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.42 1kqy h PRO 52 CO 0.60 0.00 0.63 0.00 -0.23 0.00 0.00 178.00 179.01 1kqy n ALA 53 N -2.02 1.80 -4.09 -0.56 0.00 -1.26 -2.76 120.51 111.62 1kqy n ALA 53 Ca -0.03 0.26 -0.34 0.00 0.00 0.00 0.00 53.44 53.34 1kqy n ALA 53 Cb 0.07 -2.35 -0.00 0.00 0.00 0.00 0.00 19.45 17.16 1kqy n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kqy n ALA 54 N -0.16 -1.27 -2.20 0.00 0.00 -1.26 -0.75 120.51 114.87 1kqy n ALA 54 Ca 0.05 0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.40 1kqy n ALA 54 Cb 0.41 -3.93 -0.02 0.00 0.00 0.00 0.00 19.45 15.91 1kqy n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kqy n GLY 55 N -1.52 -0.04 0.07 0.00 0.00 -1.11 -4.88 105.19 97.70 1kqy n GLY 55 Ca 0.06 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.00 1kqy n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kqy n GLY 56 N -1.00 -1.15 0.36 -0.02 0.00 0.07 -2.55 105.19 100.91 1kqy n GLY 56 Ca -0.20 0.02 0.03 0.00 0.00 0.00 0.00 46.02 45.87 1kqy n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kqy h THR 58 N 1.26 0.00 0.00 0.00 1.35 -1.49 -1.61 112.91 112.42 1kqy h THR 58 Ca 0.00 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.63 1kqy h THR 58 Cb 0.56 1.18 -0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1kqy h THR 58 CO 0.00 0.00 -0.02 -0.29 -0.25 0.00 0.00 175.52 174.96 1kqy h ILE 59 N 0.00 0.25 0.00 6.82 6.09 -1.81 -1.89 117.51 126.97 1kqy h ILE 59 Ca 0.00 -0.16 -0.00 0.00 -1.37 0.00 0.00 64.86 63.33 1kqy h ILE 59 Cb 0.23 1.13 -0.00 0.00 0.47 0.00 0.00 36.82 38.65 1kqy h ILE 59 CO 0.00 0.02 -0.00 0.58 -3.07 0.00 0.00 178.15 175.68 1kqy h VAL 60 N 0.00 0.46 -0.23 2.19 2.07 -1.48 -1.65 116.25 117.60 1kqy h VAL 60 Ca -0.00 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.58 1kqy h VAL 60 Cb 0.12 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1kqy h VAL 60 CO 0.00 0.00 0.20 0.28 0.02 0.00 0.00 177.57 178.07 1kqy h SER 61 N 0.00 0.00 -0.41 0.57 0.02 -0.86 0.26 113.55 113.13 1kqy h SER 61 Ca -0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 1kqy h SER 61 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1kqy h SER 61 CO 0.00 0.00 -0.27 0.78 -1.14 0.00 0.00 176.83 176.20 1kqy h ASN 62 N 0.00 0.98 -0.34 3.07 2.35 -1.52 -1.35 115.58 118.76 1kqy h ASN 62 Ca 0.11 -0.39 -0.14 0.00 -0.55 0.00 0.00 56.30 55.32 1kqy h ASN 62 Cb 0.51 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1kqy h ASN 62 CO -0.00 1.18 -0.35 1.23 -1.65 0.00 0.00 177.43 177.84 1kqy h GLY 63 N 0.87 0.92 0.88 2.83 0.00 -1.15 -1.24 103.07 106.17 1kqy h GLY 63 Ca 0.09 -0.94 0.01 0.00 0.00 0.00 0.00 47.33 46.49 1kqy h GLY 63 CO 0.07 0.85 -0.01 -2.22 0.00 0.00 0.00 176.54 175.23 1kqy h ILE 64 N 0.63 0.94 -0.69 2.60 2.04 -1.04 -0.47 117.51 121.52 1kqy h ILE 64 Ca 0.05 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.85 1kqy h ILE 64 Cb 0.94 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1kqy h ILE 64 CO 0.09 0.00 0.19 0.03 0.00 0.00 0.00 178.15 178.45 1kqy h ARG 65 N 0.00 1.08 -0.87 2.37 3.08 -1.23 -1.31 114.38 117.51 1kqy h ARG 65 Ca 0.03 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 1kqy h ARG 65 Cb 0.04 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 1kqy h ARG 65 CO -0.06 0.94 0.53 1.03 -1.07 0.00 0.00 179.97 181.34 1kqy h SER 66 N 1.03 1.03 -0.15 7.04 0.87 -0.87 -1.70 113.55 120.81 1kqy h SER 66 Ca 0.22 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.69 1kqy h SER 66 Cb 0.33 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1kqy h SER 66 CO -0.00 0.79 -0.03 0.00 -0.53 0.00 0.00 176.83 177.06 1kqy h GLN 68 N -0.00 1.14 0.00 0.00 4.20 -0.96 -1.08 115.11 118.41 1kqy h GLN 68 Ca 0.04 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1kqy h GLN 68 Cb 0.44 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1kqy h GLN 68 CO 0.01 0.82 0.00 -0.84 -0.67 0.00 0.00 178.83 178.15 1kqy h ILE 69 N 1.15 0.00 -0.48 2.54 3.07 -1.37 -0.75 117.51 121.67 1kqy h ILE 69 Ca 0.29 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 66.33 1kqy h ILE 69 Cb 0.00 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 37.85 1kqy h ILE 69 CO -0.05 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.05 1kqy n GLN 70 N -2.89 2.61 -1.00 0.16 6.02 -0.49 -4.91 117.38 116.89 1kqy n GLN 70 Ca 0.00 -1.92 0.00 0.00 -0.01 0.00 0.00 57.00 55.07 1kqy n GLN 70 Cb 0.25 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 29.93 1kqy n GLN 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1kqy n GLY 71 N 1.05 0.45 3.70 1.08 0.00 -0.29 -5.02 105.19 106.17 1kqy n GLY 71 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1kqy n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kqy s ILE 72 N -1.94 5.17 0.00 -0.61 1.01 -0.72 -4.99 121.20 119.11 1kqy s ILE 72 Ca 0.00 0.95 -0.28 0.00 0.00 0.00 0.00 60.65 61.32 1kqy s ILE 72 Cb 0.00 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1kqy s ILE 72 CO 0.00 0.28 0.90 -0.54 0.00 0.00 0.00 174.94 175.58 1kqy s LYS 73 N 0.93 4.54 -0.16 2.79 1.02 -1.12 -3.53 119.74 124.20 1kqy s LYS 73 Ca 0.25 1.27 -0.00 0.00 0.02 0.00 0.00 55.97 57.51 1kqy s LYS 73 Cb -0.15 -3.44 -0.00 0.00 -0.52 0.00 0.00 37.83 33.72 1kqy s LYS 73 CO 0.10 0.04 -0.15 0.08 -0.92 0.00 0.00 175.35 174.50 1kqy s VAL 74 N 0.75 2.68 0.17 3.17 1.01 -1.26 -1.26 120.40 125.65 1kqy s VAL 74 Ca 0.47 -0.76 0.10 0.00 0.00 0.00 0.00 61.98 61.78 1kqy s VAL 74 Cb -0.20 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1kqy s VAL 74 CO 0.26 0.51 -0.15 -0.04 0.00 0.00 0.00 175.10 175.67 1kqy s MET 75 N 0.89 1.85 -0.20 2.72 -1.94 -0.19 -1.16 119.30 121.26 1kqy s MET 75 Ca -0.04 -1.31 -0.17 0.00 -1.71 0.00 0.00 55.69 52.46 1kqy s MET 75 Cb -0.15 -2.07 -0.04 0.00 2.01 0.00 0.00 34.83 34.59 1kqy s MET 75 CO -0.01 0.44 0.44 -1.17 -0.01 0.00 0.00 175.02 174.71 1kqy s LEU 76 N -2.61 4.15 -0.21 -0.03 2.96 -0.94 -0.45 118.68 121.55 1kqy s LEU 76 Ca 0.22 0.58 -0.17 0.00 -0.22 0.00 0.00 54.13 54.54 1kqy s LEU 76 Cb -0.09 -2.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.98 1kqy s LEU 76 CO 0.12 -0.11 0.46 -0.55 -1.32 0.00 0.00 176.35 174.95 1kqy s SER 77 N 1.08 6.47 -0.04 3.68 0.15 0.22 -0.25 113.70 125.00 1kqy s SER 77 Ca 0.21 0.56 -0.16 0.00 0.70 0.00 0.00 55.95 57.25 1kqy s SER 77 Cb -0.15 -2.26 -0.05 0.00 -1.71 0.00 0.00 66.02 61.85 1kqy s SER 77 CO 0.09 -0.15 0.43 -0.76 1.20 0.00 0.00 173.24 174.05 1kqy s LEU 78 N 1.62 4.40 0.00 3.45 1.43 0.96 -1.01 118.68 129.53 1kqy s LEU 78 Ca 0.21 0.91 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 1kqy s LEU 78 Cb -0.15 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1kqy s LEU 78 CO 0.09 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.49 1kqy n GLY 79 N 2.35 1.00 0.00 -3.19 0.00 -0.85 -0.65 105.19 103.84 1kqy n GLY 79 Ca -0.12 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1kqy n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kqy n GLY 80 N 0.00 -3.58 0.26 -0.02 0.00 -0.02 -4.14 105.19 97.68 1kqy n GLY 80 Ca 0.00 -2.15 0.16 0.00 0.00 0.00 0.00 46.02 44.04 1kqy n GLY 80 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1kqy h GLY 81 N 0.00 0.00 -6.19 -0.02 0.00 -1.98 -3.41 103.07 91.47 1kqy h GLY 81 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.89 1kqy h GLY 81 CO 0.00 0.00 -0.78 -0.42 0.00 0.00 0.00 176.54 175.34 1kqy s ILE 82 N -3.59 0.70 0.00 2.60 1.01 -1.26 -5.04 121.20 115.62 1kqy s ILE 82 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1kqy s ILE 82 Cb 0.09 -0.70 0.00 0.00 0.01 0.00 0.00 42.46 41.85 1kqy s ILE 82 CO 0.54 0.27 0.00 0.61 0.00 0.00 0.00 174.94 176.36 1kqy n GLY 83 N 4.08 3.45 1.69 6.18 0.00 -1.26 -4.79 105.19 114.55 1kqy n GLY 83 Ca -0.23 -1.06 0.08 0.00 0.00 0.00 0.00 46.02 44.81 1kqy n GLY 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1kqy n SER 84 N 0.00 5.25 -4.67 1.61 3.41 -1.03 -5.00 113.62 113.18 1kqy n SER 84 Ca 0.00 -2.78 -0.39 0.00 -0.26 0.00 0.00 58.87 55.44 1kqy n SER 84 Cb 0.00 -0.63 0.03 0.00 -0.26 0.00 0.00 64.21 63.35 1kqy n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kqy n TYR 85 N 0.68 1.65 -3.88 7.33 0.18 -1.09 -4.58 117.16 117.44 1kqy n TYR 85 Ca 0.26 0.47 0.01 0.00 1.88 0.00 0.00 57.90 60.53 1kqy n TYR 85 Cb 1.07 -2.28 0.01 0.00 -0.38 0.00 0.00 39.34 37.76 1kqy n TYR 85 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 1kqy s THR 86 N -1.33 0.00 -0.11 -3.48 -1.32 -0.65 -4.66 115.64 104.09 1kqy s THR 86 Ca 0.69 -0.27 -0.03 0.00 -1.21 0.00 0.00 61.69 60.86 1kqy s THR 86 Cb -0.46 -2.72 0.05 0.00 -1.51 0.00 0.00 72.50 67.86 1kqy s THR 86 CO 0.52 0.00 0.07 -0.76 -2.21 0.00 0.00 174.62 172.24 1kqy s LEU 87 N -3.54 0.28 0.38 9.08 1.43 -1.26 -3.77 118.68 121.27 1kqy s LEU 87 Ca 0.24 -0.28 0.21 0.00 -1.03 0.00 0.00 54.13 53.26 1kqy s LEU 87 Cb 0.00 -0.21 0.24 0.00 0.03 0.00 0.00 46.19 46.26 1kqy s LEU 87 CO -0.00 -0.30 1.53 0.00 0.23 0.00 0.00 176.35 177.81 1kqy h ALA 88 N 8.42 0.88 -2.40 4.21 0.00 -1.93 -3.46 119.26 124.99 1kqy h ALA 88 Ca -0.14 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.72 1kqy h ALA 88 Cb 1.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1kqy h ALA 88 CO 0.23 0.19 0.39 -1.13 0.00 0.00 0.00 179.25 178.93 1kqy n SER 89 N -3.12 -1.39 0.09 0.00 3.41 -1.26 -4.98 113.62 106.37 1kqy n SER 89 Ca 0.03 -1.79 -0.04 0.00 -0.26 0.00 0.00 58.87 56.81 1kqy n SER 89 Cb 0.59 2.27 0.14 0.00 -0.26 0.00 0.00 64.21 66.96 1kqy n SER 89 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1kqy h GLN 90 N 0.00 0.21 -0.45 4.33 4.15 -1.94 -2.46 115.11 118.95 1kqy h GLN 90 Ca -0.21 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.02 1kqy h GLN 90 Cb 0.90 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.59 1kqy h GLN 90 CO 0.28 0.73 0.07 0.00 -1.93 0.00 0.00 178.83 177.98 1kqy h ALA 91 N 1.24 1.29 -0.59 3.38 0.00 -2.00 -1.83 119.26 120.75 1kqy h ALA 91 Ca -0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1kqy h ALA 91 Cb 1.07 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1kqy h ALA 91 CO 0.09 0.49 0.09 0.22 0.00 0.00 0.00 179.25 180.14 1kqy h ASP 92 N 0.66 0.94 -0.64 0.00 1.82 -1.85 -1.33 116.42 116.02 1kqy h ASP 92 Ca 0.15 -0.26 -0.00 0.00 -0.39 0.00 0.00 57.03 56.52 1kqy h ASP 92 Cb 0.31 -0.25 -0.03 0.00 0.68 0.00 0.00 39.33 40.04 1kqy h ASP 92 CO 0.00 0.97 0.39 0.00 -1.61 0.00 0.00 179.24 178.99 1kqy h ALA 93 N 1.01 1.46 -0.14 -0.78 0.00 -0.94 -0.34 119.26 119.53 1kqy h ALA 93 Ca 0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1kqy h ALA 93 Cb 0.43 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1kqy h ALA 93 CO 0.01 0.47 -0.04 -0.22 0.00 0.00 0.00 179.25 179.47 1kqy h LYS 94 N 0.90 0.27 -0.53 0.00 3.64 -0.85 -1.67 116.57 118.33 1kqy h LYS 94 Ca 0.24 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1kqy h LYS 94 Cb -0.03 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1kqy h LYS 94 CO -0.04 0.57 0.33 -0.91 -2.27 0.00 0.00 179.45 177.13 1kqy h ASN 95 N -0.04 0.63 -0.65 4.20 -0.26 -0.86 -0.03 115.58 118.56 1kqy h ASN 95 Ca 0.03 -0.05 -0.08 0.00 -0.56 0.00 0.00 56.30 55.65 1kqy h ASN 95 Cb 0.48 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.55 1kqy h ASN 95 CO 0.02 0.49 0.11 0.58 -1.06 0.00 0.00 177.43 177.57 1kqy h VAL 96 N 0.71 1.26 -0.42 2.81 2.07 -1.07 0.68 116.25 122.29 1kqy h VAL 96 Ca 0.19 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 1kqy h VAL 96 Cb -0.03 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1kqy h VAL 96 CO -0.04 0.38 0.14 0.00 0.02 0.00 0.00 177.57 178.07 1kqy h ALA 97 N 1.04 0.55 -0.61 1.67 0.00 -0.97 0.13 119.26 121.08 1kqy h ALA 97 Ca 0.20 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1kqy h ALA 97 Cb 0.43 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1kqy h ALA 97 CO 0.01 0.19 0.08 -0.44 0.00 0.00 0.00 179.25 179.09 1kqy h ASP 98 N 0.54 0.96 0.11 0.00 3.32 -0.80 -0.58 116.42 119.97 1kqy h ASP 98 Ca 0.14 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1kqy h ASP 98 Cb 0.25 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1kqy h ASP 98 CO -0.01 0.97 -0.06 0.22 -1.72 0.00 0.00 179.24 178.65 1kqy h TYR 99 N 0.94 -0.14 -0.98 4.55 3.20 -0.52 -2.01 116.97 122.00 1kqy h TYR 99 Ca 0.19 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.11 1kqy h TYR 99 Cb 0.44 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 1kqy h TYR 99 CO 0.03 -0.04 0.63 -0.07 -1.64 0.00 0.00 178.16 177.08 1kqy h LEU 100 N -0.21 1.03 -0.08 2.82 3.38 -0.51 0.51 115.31 122.25 1kqy h LEU 100 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1kqy h LEU 100 Cb 0.17 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1kqy h LEU 100 CO 0.03 0.68 0.04 -0.25 0.09 0.00 0.00 178.44 179.03 1kqy h TRP 101 N 1.18 0.12 0.00 1.13 2.91 -0.90 0.11 115.95 120.49 1kqy h TRP 101 Ca 0.41 -0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.32 1kqy h TRP 101 Cb 0.10 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 28.70 1kqy h TRP 101 CO -0.01 0.16 -0.51 -0.91 -1.03 0.00 0.00 178.44 176.14 1kqy h ASN 102 N 0.04 0.00 0.00 2.65 2.35 -0.99 0.31 115.58 119.94 1kqy h ASN 102 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1kqy h ASN 102 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1kqy h ASN 102 CO -0.00 0.51 -1.31 0.59 -1.65 0.00 0.00 177.43 175.56 1kqy n ASN 103 N -3.61 0.79 0.00 5.81 3.02 0.14 -3.02 115.26 118.39 1kqy n ASN 103 Ca -0.00 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 54.04 1kqy n ASN 103 Cb 0.59 1.39 0.00 0.00 -0.61 0.00 0.00 39.78 41.15 1kqy n ASN 103 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1kqy n PHE 104 N -1.76 0.00 -1.24 3.10 3.72 0.34 -4.27 117.46 117.34 1kqy n PHE 104 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1kqy n PHE 104 Cb 0.38 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.92 1kqy n PHE 104 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1kqy n LEU 105 N -0.36 0.00 0.00 4.37 4.77 -0.83 -1.44 117.00 123.51 1kqy n LEU 105 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 1kqy n LEU 105 Cb 0.01 0.00 0.44 0.00 -2.33 0.00 0.00 43.42 41.54 1kqy n LEU 105 CO 0.00 0.00 0.65 0.61 -1.33 0.00 0.00 177.39 177.32 1kqy n GLY 106 N 5.00 -0.51 0.00 -0.72 0.00 -1.21 -4.78 105.19 102.97 1kqy n GLY 106 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1kqy n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kqy n GLY 107 N 0.02 -1.38 3.10 -0.02 0.00 0.10 -4.97 105.19 102.05 1kqy n GLY 107 Ca 0.11 -1.61 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 1kqy n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kqy s LYS 108 N -2.48 1.24 -0.10 1.61 -0.14 -1.21 -4.74 119.74 113.92 1kqy s LYS 108 Ca 0.00 -0.50 -0.26 0.00 -1.36 0.00 0.00 55.97 53.85 1kqy s LYS 108 Cb 0.00 -1.17 0.06 0.00 -1.68 0.00 0.00 37.83 35.04 1kqy s LYS 108 CO 0.00 0.27 0.61 0.45 -0.76 0.00 0.00 175.35 175.93 1kqy s SER 109 N -0.21 -0.59 0.00 2.83 0.15 -1.17 -4.73 113.70 109.98 1kqy s SER 109 Ca 0.03 0.79 0.28 0.00 0.70 0.00 0.00 55.95 57.75 1kqy s SER 109 Cb -0.07 0.73 1.08 0.00 -1.71 0.00 0.00 66.02 66.05 1kqy s SER 109 CO -0.00 -0.47 1.76 -1.20 1.20 0.00 0.00 173.24 174.53 1kqy n SER 110 N 1.50 1.31 -2.67 5.45 7.64 -1.26 -4.22 113.62 121.37 1kqy n SER 110 Ca -0.18 -1.36 -0.09 0.00 1.01 0.00 0.00 58.87 58.25 1kqy n SER 110 Cb 0.56 0.01 0.03 0.00 -1.01 0.00 0.00 64.21 63.81 1kqy n SER 110 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1kqy n SER 111 N -0.04 1.49 -4.64 6.43 3.41 -1.26 -5.08 113.62 113.93 1kqy n SER 111 Ca 0.18 -2.68 -0.43 0.00 -0.26 0.00 0.00 58.87 55.69 1kqy n SER 111 Cb 0.33 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 1kqy n SER 111 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1kqy s ARG 112 N -3.17 3.88 0.29 4.33 0.52 -1.26 -4.90 118.95 118.64 1kqy s ARG 112 Ca 0.27 1.96 0.03 0.00 -0.52 0.00 0.00 55.73 57.48 1kqy s ARG 112 Cb 0.45 -4.07 0.71 0.00 0.52 0.00 0.00 34.95 32.56 1kqy s ARG 112 CO 0.03 -1.21 1.70 -1.35 0.02 0.00 0.00 175.30 174.50 1kqy h PRO 113 N 10.80 0.41 -0.45 3.54 0.11 -1.94 -2.22 132.00 142.26 1kqy h PRO 113 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1kqy h PRO 113 Cb 1.18 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1kqy h PRO 113 CO 0.98 0.27 0.00 1.28 -0.21 0.00 0.00 178.00 180.32 1kqy n LEU 114 N -5.03 4.14 0.00 2.35 4.77 -1.26 -3.35 117.00 118.62 1kqy n LEU 114 Ca 0.22 -2.57 0.00 0.00 -0.03 0.00 0.00 56.01 53.63 1kqy n LEU 114 Cb 0.63 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1kqy n LEU 114 CO 0.14 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1kqy n GLY 115 N 0.41 -1.90 0.01 -0.72 0.00 -0.84 -2.22 105.19 99.94 1kqy n GLY 115 Ca 0.21 -2.03 0.14 0.00 0.00 0.00 0.00 46.02 44.34 1kqy n GLY 115 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kqy n ASP 116 N 0.05 0.09 -4.74 1.61 5.75 -1.26 -4.76 116.55 113.28 1kqy n ASP 116 Ca 0.00 0.51 -0.38 0.00 -0.01 0.00 0.00 54.79 54.91 1kqy n ASP 116 Cb 0.00 -0.53 0.05 0.00 -1.03 0.00 0.00 41.12 39.61 1kqy n ASP 116 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1kqy s ALA 117 N -3.01 2.70 -0.34 2.12 0.00 -1.26 -4.97 121.76 117.00 1kqy s ALA 117 Ca 0.14 1.30 -0.10 0.00 0.00 0.00 0.00 51.96 53.30 1kqy s ALA 117 Cb 0.18 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1kqy s ALA 117 CO 0.53 -1.43 0.16 0.08 0.00 0.00 0.00 175.76 175.10 1kqy s VAL 118 N -1.33 4.45 0.65 0.00 1.01 -1.26 -4.82 120.40 119.10 1kqy s VAL 118 Ca 0.75 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 1kqy s VAL 118 Cb -0.40 -3.37 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 1kqy s VAL 118 CO 0.45 -0.07 1.22 -0.76 0.00 0.00 0.00 175.10 175.95 1kqy s LEU 119 N 1.56 3.51 0.25 3.92 2.01 -0.52 -4.94 118.68 124.47 1kqy s LEU 119 Ca 0.03 2.40 0.07 0.00 0.01 0.00 0.00 54.13 56.64 1kqy s LEU 119 Cb -0.18 -4.60 0.27 0.00 0.01 0.00 0.00 46.19 41.69 1kqy s LEU 119 CO 0.06 -1.90 1.57 0.44 1.01 0.00 0.00 176.35 177.52 1kqy h ASP 120 N 0.38 0.16 -0.28 2.29 3.32 -1.48 -3.45 116.42 117.35 1kqy h ASP 120 Ca -0.49 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.46 1kqy h ASP 120 Cb 1.30 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1kqy h ASP 120 CO 0.53 0.75 0.00 0.61 -1.72 0.00 0.00 179.24 179.41 1kqy n GLY 121 N 0.31 1.11 3.22 2.75 0.00 -1.21 -0.97 105.19 110.40 1kqy n GLY 121 Ca -0.02 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 1kqy n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kqy s ILE 122 N -2.37 1.85 -0.16 -0.61 -1.09 0.21 -2.20 121.20 116.83 1kqy s ILE 122 Ca 0.00 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.43 1kqy s ILE 122 Cb 0.00 -1.57 -0.03 0.00 -1.58 0.00 0.00 42.46 39.27 1kqy s ILE 122 CO 0.00 0.52 0.00 -0.62 -1.23 0.00 0.00 174.94 173.61 1kqy s ASP 123 N -0.03 5.13 -0.50 3.58 2.15 0.65 -1.29 116.67 126.36 1kqy s ASP 123 Ca -0.05 -0.03 -0.18 0.00 0.43 0.00 0.00 52.55 52.72 1kqy s ASP 123 Cb -0.14 -1.82 0.07 0.00 -0.30 0.00 0.00 42.92 40.73 1kqy s ASP 123 CO 0.04 0.19 0.54 -0.36 -0.17 0.00 0.00 175.17 175.41 1kqy s PHE 124 N 0.24 3.13 -0.56 -5.34 0.40 0.79 -0.03 117.98 116.60 1kqy s PHE 124 Ca -0.00 -0.72 0.03 0.00 -0.60 0.00 0.00 56.93 55.64 1kqy s PHE 124 Cb -0.13 -3.42 0.39 0.00 0.51 0.00 0.00 43.02 40.37 1kqy s PHE 124 CO 0.02 -0.95 1.29 0.00 0.70 0.00 0.00 175.22 176.28 1kqy n ALA 125 N 5.79 5.34 -2.61 5.36 0.00 0.17 -0.59 120.51 133.96 1kqy n ALA 125 Ca -0.09 -4.35 -0.43 0.00 0.00 0.00 0.00 53.44 48.57 1kqy n ALA 125 Cb 0.44 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 18.96 1kqy n ALA 125 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1kqy s ILE 126 N -5.27 4.41 -0.02 0.00 -1.09 -1.25 -0.84 121.20 117.14 1kqy s ILE 126 Ca 0.49 1.40 0.06 0.00 -2.23 0.00 0.00 60.65 60.37 1kqy s ILE 126 Cb 0.38 -4.47 -0.09 0.00 -1.58 0.00 0.00 42.46 36.70 1kqy s ILE 126 CO -0.23 -0.71 0.11 0.00 -1.23 0.00 0.00 174.94 172.89 1kqy n ALA 127 N 7.23 2.15 -3.18 9.38 0.00 -1.26 -4.72 120.51 130.11 1kqy n ALA 127 Ca 0.11 -0.20 -0.12 0.00 0.00 0.00 0.00 53.44 53.22 1kqy n ALA 127 Cb 0.48 -0.14 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 1kqy n ALA 127 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1kqy s HIS 128 N -2.38 0.70 0.00 0.00 -3.43 -1.26 -4.99 115.29 103.93 1kqy s HIS 128 Ca -0.02 -1.07 0.00 0.00 -0.80 0.00 0.00 55.06 53.16 1kqy s HIS 128 Cb 0.04 0.20 0.00 0.00 -1.43 0.00 0.00 32.58 31.39 1kqy s HIS 128 CO 0.26 -1.23 0.00 0.41 -2.00 0.00 0.00 174.74 172.18 1kqy n GLY 129 N -0.53 0.88 3.73 -1.38 0.00 -1.26 -4.90 105.19 101.73 1kqy n GLY 129 Ca -0.02 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 1kqy n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1kqy s SER 130 N -4.00 7.52 0.00 1.61 0.15 -1.26 -4.94 113.70 112.78 1kqy s SER 130 Ca 0.00 1.81 0.24 0.00 0.70 0.00 0.00 55.95 58.70 1kqy s SER 130 Cb 0.00 -2.59 0.21 0.00 -1.71 0.00 0.00 66.02 61.94 1kqy s SER 130 CO 0.00 -0.01 1.27 0.35 1.20 0.00 0.00 173.24 176.05 1kqy n THR 131 N 2.48 0.00 -4.19 6.45 -2.24 -1.26 -4.88 114.28 110.64 1kqy n THR 131 Ca 0.01 -0.48 -0.23 0.00 -2.27 0.00 0.00 64.05 61.08 1kqy n THR 131 Cb 0.49 1.45 -0.06 0.00 -2.10 0.00 0.00 70.33 70.11 1kqy n THR 131 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1kqy s LEU 132 N -2.02 3.53 0.00 3.22 1.43 -1.26 -4.70 118.68 118.88 1kqy s LEU 132 Ca 0.28 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1kqy s LEU 132 Cb 0.20 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1kqy s LEU 132 CO 0.31 0.01 0.00 -1.22 0.23 0.00 0.00 176.35 175.68 1kqy n TYR 133 N -0.83 0.00 0.21 0.29 4.01 -1.26 -4.73 117.16 114.85 1kqy n TYR 133 Ca -0.08 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.75 1kqy n TYR 133 Cb 0.57 -0.64 0.42 0.00 -0.31 0.00 0.00 39.34 39.39 1kqy n TYR 133 CO 0.00 0.00 0.00 -1.49 -0.46 0.00 0.00 176.86 174.91 1kqy h TRP 134 N 0.00 0.00 -0.03 -0.72 4.06 -1.87 -1.75 115.95 115.63 1kqy h TRP 134 Ca 0.00 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.78 1kqy h TRP 134 Cb 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1kqy h TRP 134 CO 0.06 0.27 -0.73 0.38 -3.56 0.00 0.00 178.44 174.85 1kqy h ASP 135 N 0.00 0.26 -0.28 -3.49 2.03 -1.89 -2.14 116.42 110.92 1kqy h ASP 135 Ca -0.00 -0.18 -0.07 0.00 -0.73 0.00 0.00 57.03 56.05 1kqy h ASP 135 Cb 0.79 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 39.20 1kqy h ASP 135 CO 0.03 0.90 -0.10 0.44 -1.03 0.00 0.00 179.24 179.48 1kqy h ASP 136 N 0.14 0.57 -0.48 4.15 3.32 -1.84 -1.57 116.42 120.72 1kqy h ASP 136 Ca -0.02 -0.39 0.03 0.00 0.02 0.00 0.00 57.03 56.67 1kqy h ASP 136 Cb 1.30 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.66 1kqy h ASP 136 CO 0.11 0.83 0.26 0.25 -1.72 0.00 0.00 179.24 178.97 1kqy h LEU 137 N 0.30 0.40 -0.24 1.55 5.85 -1.26 0.06 115.31 121.96 1kqy h LEU 137 Ca 0.07 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.81 1kqy h LEU 137 Cb 0.60 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1kqy h LEU 137 CO 0.03 0.28 0.13 0.00 -0.34 0.00 0.00 178.44 178.55 1kqy h ALA 138 N 1.23 0.30 -0.49 1.25 0.00 -1.29 -0.96 119.26 119.30 1kqy h ALA 138 Ca 0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1kqy h ALA 138 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1kqy h ALA 138 CO -0.12 -0.26 0.31 0.00 0.00 0.00 0.00 179.25 179.18 1kqy h ARG 139 N 0.28 0.66 -0.52 0.00 3.08 -0.76 -0.54 114.38 116.58 1kqy h ARG 139 Ca 0.10 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1kqy h ARG 139 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1kqy h ARG 139 CO -0.05 0.47 0.14 1.88 -1.07 0.00 0.00 179.97 181.34 1kqy h TYR 140 N 0.66 0.86 -0.52 3.04 0.05 -0.79 -2.15 116.97 118.11 1kqy h TYR 140 Ca 0.18 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 1kqy h TYR 140 Cb -0.03 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.45 1kqy h TYR 140 CO -0.03 0.75 0.18 -0.07 -1.05 0.00 0.00 178.16 177.93 1kqy h LEU 141 N 0.71 0.74 -1.23 3.88 3.38 -0.99 -2.97 115.31 118.83 1kqy h LEU 141 Ca 0.16 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1kqy h LEU 141 Cb 0.32 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1kqy h LEU 141 CO -0.00 0.74 0.28 -1.28 0.09 0.00 0.00 178.44 178.27 1kqy h SER 142 N 0.70 0.74 0.11 -0.43 0.87 -0.92 -2.52 113.55 112.10 1kqy h SER 142 Ca 0.17 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1kqy h SER 142 Cb 0.25 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 1kqy h SER 142 CO -0.01 0.62 -0.09 0.00 -0.53 0.00 0.00 176.83 176.83 1kqy h ALA 143 N 1.49 1.75 0.00 6.23 0.00 -1.22 -1.80 119.26 125.71 1kqy h ALA 143 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1kqy h ALA 143 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1kqy h ALA 143 CO -0.03 0.11 0.00 1.88 0.00 0.00 0.00 179.25 181.22 1kqy h TYR 144 N 0.00 0.00 0.00 0.00 0.05 -1.47 -1.66 116.97 113.88 1kqy h TYR 144 Ca -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1kqy h TYR 144 Cb 0.17 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.91 1kqy h TYR 144 CO 0.00 0.00 -0.04 0.77 -1.05 0.00 0.00 178.16 177.84 1kqy h SER 145 N 0.00 0.00 0.24 3.88 0.02 -1.46 -2.08 113.55 114.15 1kqy h SER 145 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1kqy h SER 145 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1kqy h SER 145 CO 0.00 0.04 0.00 0.29 -1.14 0.00 0.00 176.83 176.02 1kqy n LYS 146 N -3.80 0.11 0.00 3.45 5.02 -0.63 -2.16 118.16 120.15 1kqy n LYS 146 Ca -0.03 0.22 0.15 0.00 -2.02 0.00 0.00 58.31 56.63 1kqy n LYS 146 Cb 0.13 -1.50 0.64 0.00 -0.02 0.00 0.00 35.03 34.28 1kqy n LYS 146 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1kqy n GLN 147 N -1.34 1.41 0.00 1.97 6.02 -0.78 -4.95 117.38 119.71 1kqy n GLN 147 Ca 0.04 -0.65 0.00 0.00 -0.01 0.00 0.00 57.00 56.38 1kqy n GLN 147 Cb 0.09 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.87 1kqy n GLN 147 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1kqy n GLY 148 N 1.14 3.48 3.57 1.08 0.00 -0.92 -5.09 105.19 108.45 1kqy n GLY 148 Ca 0.20 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 1kqy n GLY 148 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1kqy s LYS 149 N 0.00 3.88 0.27 1.61 2.20 -1.25 -5.07 119.74 121.38 1kqy s LYS 149 Ca 0.00 -0.38 -0.30 0.00 -0.36 0.00 0.00 55.97 54.93 1kqy s LYS 149 Cb 0.00 -3.33 -0.11 0.00 -1.51 0.00 0.00 37.83 32.89 1kqy s LYS 149 CO 0.00 0.06 1.51 0.21 -0.36 0.00 0.00 175.35 176.76 1kqy s LYS 150 N 0.98 4.20 -0.49 4.03 2.20 -1.26 -4.35 119.74 125.05 1kqy s LYS 150 Ca 0.05 2.43 -0.15 0.00 -0.36 0.00 0.00 55.97 57.93 1kqy s LYS 150 Cb -0.14 -3.07 0.09 0.00 -1.51 0.00 0.00 37.83 33.21 1kqy s LYS 150 CO 0.03 -0.51 0.42 0.08 -0.36 0.00 0.00 175.35 175.01 1kqy s VAL 151 N -0.07 5.15 0.50 4.02 1.01 -1.26 -4.83 120.40 124.92 1kqy s VAL 151 Ca 0.61 -1.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.15 1kqy s VAL 151 Cb -0.45 -4.15 -0.06 0.00 0.00 0.00 0.00 36.38 31.72 1kqy s VAL 151 CO 0.46 -0.66 1.20 -0.31 0.00 0.00 0.00 175.10 175.79 1kqy s TYR 152 N 1.61 2.70 -0.13 5.22 1.51 -0.14 -4.75 117.35 123.37 1kqy s TYR 152 Ca 0.04 1.51 0.01 0.00 -1.01 0.00 0.00 57.07 57.62 1kqy s TYR 152 Cb -0.26 -3.45 0.02 0.00 -0.11 0.00 0.00 41.96 38.16 1kqy s TYR 152 CO 0.05 -1.83 -0.16 -0.51 -1.11 0.00 0.00 175.55 172.00 1kqy s LEU 153 N -3.31 1.75 0.17 -1.29 1.43 -1.26 -0.62 118.68 115.55 1kqy s LEU 153 Ca 0.67 -0.47 0.06 0.00 -1.03 0.00 0.00 54.13 53.37 1kqy s LEU 153 Cb -0.30 -1.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 1kqy s LEU 153 CO 0.36 -0.00 -0.12 0.42 0.23 0.00 0.00 176.35 177.23 1kqy s THR 154 N 1.14 1.44 -0.01 5.49 -4.23 -0.41 -0.30 115.64 118.76 1kqy s THR 154 Ca -0.03 -2.10 -0.05 0.00 -1.18 0.00 0.00 61.69 58.33 1kqy s THR 154 Cb -0.14 -1.91 0.00 0.00 1.34 0.00 0.00 72.50 71.79 1kqy s THR 154 CO -0.05 -0.65 0.10 0.00 -0.54 0.00 0.00 174.62 173.48 1kqy s ALA 155 N -3.07 -0.23 -0.57 3.99 0.00 -0.57 -0.15 121.76 121.17 1kqy s ALA 155 Ca 0.19 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.13 1kqy s ALA 155 Cb 0.00 0.02 0.33 0.00 0.00 0.00 0.00 23.12 23.47 1kqy s ALA 155 CO 0.04 -0.15 0.90 0.00 0.00 0.00 0.00 175.76 176.54 1kqy n ALA 156 N 1.98 4.34 -1.64 0.00 0.00 0.24 -0.88 120.51 124.56 1kqy n ALA 156 Ca -0.20 -4.59 -0.34 0.00 0.00 0.00 0.00 53.44 48.32 1kqy n ALA 156 Cb 0.57 -0.77 0.02 0.00 0.00 0.00 0.00 19.45 19.27 1kqy n ALA 156 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kqy s PRO 157 N -3.22 3.12 0.67 0.00 0.04 -1.26 -4.67 135.00 129.68 1kqy s PRO 157 Ca 0.47 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.82 1kqy s PRO 157 Cb 0.27 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.81 1kqy s PRO 157 CO -0.12 -1.00 1.05 -0.65 0.04 0.00 0.00 177.00 176.32 1kqy s GLN 158 N -3.80 3.14 0.62 4.56 -0.21 -1.26 -0.31 119.66 122.40 1kqy s GLN 158 Ca 0.68 0.92 0.39 0.00 0.02 0.00 0.00 55.36 57.37 1kqy s GLN 158 Cb -0.20 -2.02 2.09 0.00 1.00 0.00 0.00 33.01 33.88 1kqy s GLN 158 CO 0.35 -0.94 2.28 0.00 -2.12 0.00 0.00 175.29 174.86 1kqy s PRO 160 N -4.21 4.18 -0.11 0.00 0.02 -1.26 -4.96 135.00 128.64 1kqy s PRO 160 Ca -0.04 2.40 -0.02 0.00 0.02 0.00 0.00 61.00 63.36 1kqy s PRO 160 Cb 0.13 -3.73 -0.03 0.00 0.02 0.00 0.00 34.50 30.89 1kqy s PRO 160 CO 0.47 -0.80 -0.05 0.12 -0.33 0.00 0.00 177.00 176.41 1kqy s PHE 161 N 3.11 2.99 0.52 6.54 2.19 -1.26 -2.89 117.98 129.17 1kqy s PHE 161 Ca 0.77 -0.16 -0.17 0.00 0.33 0.00 0.00 56.93 57.70 1kqy s PHE 161 Cb -0.40 -1.84 -0.08 0.00 -1.31 0.00 0.00 43.02 39.39 1kqy s PHE 161 CO 0.34 0.13 0.99 -1.25 1.83 0.00 0.00 175.22 177.26 1kqy s PRO 162 N -0.19 3.92 0.13 10.12 0.04 -1.26 -5.10 135.00 142.66 1kqy s PRO 162 Ca 0.03 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 61.74 1kqy s PRO 162 Cb -0.13 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 32.20 1kqy s PRO 162 CO 0.03 -0.29 1.39 0.34 0.04 0.00 0.00 177.00 178.50 1kqy s ASP 163 N -3.02 6.82 0.51 6.66 -1.08 -1.14 -4.91 116.67 120.52 1kqy s ASP 163 Ca 0.59 2.35 0.18 0.00 -0.52 0.00 0.00 52.55 55.15 1kqy s ASP 163 Cb -0.10 -2.59 1.28 0.00 -1.46 0.00 0.00 42.92 40.05 1kqy s ASP 163 CO 0.31 -0.65 2.12 -0.09 0.52 0.00 0.00 175.17 177.38 1kqy h ARG 164 N 6.62 0.00 0.00 4.34 2.43 -1.95 -0.36 114.38 125.46 1kqy h ARG 164 Ca -0.42 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.39 1kqy h ARG 164 Cb 1.21 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 1kqy h ARG 164 CO 0.85 0.06 -2.35 0.66 -1.51 0.00 0.00 179.97 177.68 1kqy n TYR 165 N -4.34 0.00 0.67 2.20 4.02 -1.26 -4.63 117.16 113.82 1kqy n TYR 165 Ca -0.03 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.96 1kqy n TYR 165 Cb 0.14 -0.93 0.10 0.00 -0.02 0.00 0.00 39.34 38.63 1kqy n TYR 165 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1kqy n LEU 166 N -3.07 2.72 -0.07 7.72 4.77 -1.23 -4.65 117.00 123.18 1kqy n LEU 166 Ca -0.40 -1.12 -0.07 0.00 -0.03 0.00 0.00 56.01 54.40 1kqy n LEU 166 Cb 0.99 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 42.03 1kqy n LEU 166 CO 0.28 0.50 0.75 1.23 -1.33 0.00 0.00 177.39 178.83 1kqy h GLY 167 N 3.73 0.07 1.10 -0.72 0.00 -1.31 -0.28 103.07 105.66 1kqy h GLY 167 Ca 0.00 0.20 -0.14 0.00 0.00 0.00 0.00 47.33 47.39 1kqy h GLY 167 CO 0.00 -0.17 -0.29 -0.84 0.00 0.00 0.00 176.54 175.24 1kqy h THR 168 N -0.12 1.27 -0.77 4.70 2.02 -1.82 -2.39 112.91 115.81 1kqy h THR 168 Ca 0.15 -1.46 0.01 0.00 0.77 0.00 0.00 66.41 65.89 1kqy h THR 168 Cb 0.35 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 1kqy h THR 168 CO -0.37 0.49 0.51 0.00 0.37 0.00 0.00 175.52 176.52 1kqy h ALA 169 N 0.81 0.98 0.00 6.16 0.00 -1.78 -1.70 119.26 123.74 1kqy h ALA 169 Ca 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1kqy h ALA 169 Cb 0.88 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1kqy h ALA 169 CO 0.08 0.38 -0.26 -0.07 0.00 0.00 0.00 179.25 179.37 1kqy h LEU 170 N 1.03 0.00 -0.34 0.00 3.38 -0.95 -2.66 115.31 115.77 1kqy h LEU 170 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1kqy h LEU 170 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1kqy h LEU 170 CO -0.07 0.26 0.00 0.59 0.09 0.00 0.00 178.44 179.31 1kqy n ASN 171 N -3.60 0.40 0.23 -0.43 5.03 -0.65 -2.50 115.26 113.75 1kqy n ASN 171 Ca -0.01 0.59 0.12 0.00 0.87 0.00 0.00 54.58 56.15 1kqy n ASN 171 Cb 0.40 -0.68 0.47 0.00 -1.02 0.00 0.00 39.78 38.95 1kqy n ASN 171 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1kqy h THR 172 N 0.00 0.34 -0.08 3.41 1.35 -1.40 -3.47 112.91 113.06 1kqy h THR 172 Ca 0.00 -0.99 -0.03 0.00 -0.55 0.00 0.00 66.41 64.84 1kqy h THR 172 Cb 0.37 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1kqy h THR 172 CO 0.00 0.14 -0.03 0.61 -0.25 0.00 0.00 175.52 175.99 1kqy n GLY 173 N 0.29 0.52 0.12 5.82 0.00 -1.04 -4.91 105.19 105.98 1kqy n GLY 173 Ca 0.01 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 45.83 1kqy n GLY 173 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1kqy n LEU 174 N -0.19 0.69 -4.74 0.99 4.77 -1.26 -4.79 117.00 112.46 1kqy n LEU 174 Ca -0.02 -0.08 -0.40 0.00 -0.03 0.00 0.00 56.01 55.49 1kqy n LEU 174 Cb 0.12 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 1kqy n LEU 174 CO 0.03 0.14 0.44 -0.36 -1.33 0.00 0.00 177.39 176.30 1kqy s PHE 175 N -2.72 3.71 -0.13 -1.77 0.40 -1.26 -4.61 117.98 111.59 1kqy s PHE 175 Ca 0.19 1.41 -0.24 0.00 -0.60 0.00 0.00 56.93 57.69 1kqy s PHE 175 Cb 0.19 -2.80 -0.26 0.00 0.51 0.00 0.00 43.02 40.67 1kqy s PHE 175 CO 0.59 0.25 0.62 -0.44 0.70 0.00 0.00 175.22 176.94 1kqy h ASP 176 N 5.83 0.15 -3.43 1.36 3.32 -1.01 -2.20 116.42 120.44 1kqy h ASP 176 Ca -0.44 -0.85 -0.51 0.00 0.02 0.00 0.00 57.03 55.25 1kqy h ASP 176 Cb 1.20 -0.05 -0.33 0.00 0.22 0.00 0.00 39.33 40.37 1kqy h ASP 176 CO 0.71 1.29 -0.81 -0.31 -1.72 0.00 0.00 179.24 178.40 1kqy s TYR 177 N -2.33 1.46 -0.26 4.55 2.02 -1.17 -0.47 117.35 121.14 1kqy s TYR 177 Ca -0.21 -0.53 0.01 0.00 -0.37 0.00 0.00 57.07 55.97 1kqy s TYR 177 Cb 0.01 -1.07 0.07 0.00 -0.40 0.00 0.00 41.96 40.57 1kqy s TYR 177 CO 0.70 -0.27 -0.03 0.08 -1.57 0.00 0.00 175.55 174.47 1kqy s VAL 178 N 0.65 1.65 -0.65 0.71 1.01 -0.29 -1.51 120.40 121.97 1kqy s VAL 178 Ca -0.14 -1.48 -0.14 0.00 0.00 0.00 0.00 61.98 60.22 1kqy s VAL 178 Cb -0.16 -1.98 0.16 0.00 0.00 0.00 0.00 36.38 34.40 1kqy s VAL 178 CO 0.04 -0.24 0.59 -1.66 0.00 0.00 0.00 175.10 173.82 1kqy s TRP 179 N 1.30 3.47 0.18 5.22 -2.14 -0.06 -0.52 118.94 126.40 1kqy s TRP 179 Ca -0.02 -1.66 -0.31 0.00 2.66 0.00 0.00 56.10 56.78 1kqy s TRP 179 Cb -0.19 -3.76 -0.09 0.00 -3.10 0.00 0.00 33.47 26.33 1kqy s TRP 179 CO -0.08 -1.00 1.38 0.08 -2.66 0.00 0.00 176.95 174.66 1kqy s VAL 180 N 0.97 3.10 -0.63 -0.66 1.01 -1.03 -4.06 120.40 119.10 1kqy s VAL 180 Ca 0.09 0.86 -0.23 0.00 0.00 0.00 0.00 61.98 62.71 1kqy s VAL 180 Cb -0.22 -3.55 0.06 0.00 0.00 0.00 0.00 36.38 32.68 1kqy s VAL 180 CO -0.02 0.10 0.94 -1.10 0.00 0.00 0.00 175.10 175.02 1kqy s GLN 181 N 0.34 3.15 -0.93 2.72 -0.21 0.57 -0.14 119.66 125.17 1kqy s GLN 181 Ca 0.61 -0.73 -0.04 0.00 0.02 0.00 0.00 55.36 55.22 1kqy s GLN 181 Cb -0.38 -4.19 0.11 0.00 1.00 0.00 0.00 33.01 29.56 1kqy s GLN 181 CO 0.36 -1.72 2.51 1.19 -2.12 0.00 0.00 175.29 175.51 1kqy n PHE 182 N 7.57 2.20 -3.63 0.91 3.72 -0.32 -1.16 117.46 126.74 1kqy n PHE 182 Ca -0.03 -2.42 -0.10 0.00 -0.05 0.00 0.00 57.45 54.85 1kqy n PHE 182 Cb 0.46 -1.59 -0.03 0.00 -0.94 0.00 0.00 39.48 37.38 1kqy n PHE 182 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 1kqy s PHE 183 N -1.66 -0.29 -1.83 1.38 -0.71 -1.26 -4.43 117.98 109.18 1kqy s PHE 183 Ca 0.55 -0.03 0.00 0.00 -1.04 0.00 0.00 56.93 56.42 1kqy s PHE 183 Cb 0.28 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.57 1kqy s PHE 183 CO -0.16 -0.92 0.00 0.09 -1.34 0.00 0.00 175.22 172.89 1kqy n ASN 184 N -0.36 -5.68 -3.10 1.98 3.02 -0.54 -4.85 115.26 105.73 1kqy n ASN 184 Ca -0.12 0.11 -0.08 0.00 -0.03 0.00 0.00 54.58 54.46 1kqy n ASN 184 Cb 0.63 -4.76 -0.03 0.00 -0.61 0.00 0.00 39.78 35.01 1kqy n ASN 184 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1kqy s ASN 185 N -2.26 -0.61 0.29 6.41 0.01 -1.26 -5.02 114.94 112.50 1kqy s ASN 185 Ca 0.00 -1.57 0.02 0.00 -0.71 0.00 0.00 52.86 50.60 1kqy s ASN 185 Cb 0.00 1.37 0.73 0.00 0.41 0.00 0.00 41.25 43.76 1kqy s ASN 185 CO 0.00 -0.14 1.62 -0.65 -1.51 0.00 0.00 177.10 176.42 1kqy h PRO 186 N 6.10 0.13 0.00 -0.60 0.11 -1.93 -2.10 132.00 133.71 1kqy h PRO 186 Ca 0.08 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 1kqy h PRO 186 Cb 1.10 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1kqy h PRO 186 CO 0.12 0.08 -0.02 -1.00 -0.21 0.00 0.00 178.00 176.97 1kqy h PRO 187 N 0.13 0.00 0.00 1.05 0.13 -1.97 -3.22 132.00 128.12 1kqy h PRO 187 Ca 0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.70 1kqy h PRO 187 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1kqy h PRO 187 CO -0.73 0.02 -0.21 0.00 -0.23 0.00 0.00 178.00 176.85 1kqy s GLN 189 N -1.08 2.23 0.24 0.00 -2.07 -0.94 -3.92 119.66 114.13 1kqy s GLN 189 Ca 0.11 -2.11 -0.30 0.00 -1.82 0.00 0.00 55.36 51.24 1kqy s GLN 189 Cb 0.09 -1.89 -0.09 0.00 -1.09 0.00 0.00 33.01 30.04 1kqy s GLN 189 CO 0.01 -0.44 1.04 -0.47 -1.32 0.00 0.00 175.29 174.12 1kqy s TYR 190 N -2.77 3.72 0.05 9.60 5.04 -1.26 -3.97 117.35 127.76 1kqy s TYR 190 Ca 0.26 1.75 0.06 0.00 -2.44 0.00 0.00 57.07 56.70 1kqy s TYR 190 Cb 0.00 -3.18 -0.02 0.00 0.35 0.00 0.00 41.96 39.11 1kqy s TYR 190 CO 0.15 -0.20 -0.16 -1.12 -1.34 0.00 0.00 175.55 172.88 1kqy s SER 191 N -0.76 1.84 -0.44 4.32 0.01 -1.03 -4.43 113.70 113.21 1kqy s SER 191 Ca 0.45 -0.52 -0.40 0.00 1.31 0.00 0.00 55.95 56.78 1kqy s SER 191 Cb -0.29 -0.11 -0.17 0.00 0.21 0.00 0.00 66.02 65.66 1kqy s SER 191 CO 0.36 0.03 1.67 -0.24 0.41 0.00 0.00 173.24 175.47 1kqy n SER 192 N 1.68 0.84 0.00 2.44 2.88 -1.26 0.57 113.62 120.77 1kqy n SER 192 Ca -0.19 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1kqy n SER 192 Cb 0.54 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 1kqy n SER 192 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1kqy n GLY 193 N 5.24 0.55 2.95 0.46 0.00 -1.26 -4.98 105.19 108.15 1kqy n GLY 193 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 1kqy n GLY 193 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1kqy s ASN 194 N -2.48 3.28 0.00 1.61 2.47 0.19 -4.95 114.94 115.05 1kqy s ASN 194 Ca 0.00 -0.86 0.15 0.00 0.42 0.00 0.00 52.86 52.57 1kqy s ASN 194 Cb 0.00 -1.11 0.13 0.00 -1.45 0.00 0.00 41.25 38.82 1kqy s ASN 194 CO 0.00 -0.17 0.99 2.30 -3.72 0.00 0.00 177.10 176.49 1kqy n ILE 195 N 4.75 0.05 -0.26 -5.21 -5.35 -1.26 -2.47 119.36 109.60 1kqy n ILE 195 Ca -0.13 -0.53 -0.04 0.00 -0.27 0.00 0.00 62.75 61.79 1kqy n ILE 195 Cb 0.47 1.27 0.08 0.00 -1.74 0.00 0.00 39.64 39.71 1kqy n ILE 195 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 1kqy h ASN 196 N 2.89 0.79 -0.48 7.28 2.35 -1.93 -1.18 115.58 125.31 1kqy h ASN 196 Ca 0.00 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 1kqy h ASN 196 Cb 0.62 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1kqy h ASN 196 CO 0.00 0.56 -0.07 0.78 -1.65 0.00 0.00 177.43 177.04 1kqy h ASN 197 N 0.94 0.93 0.00 5.81 2.35 -1.82 -0.62 115.58 123.17 1kqy h ASN 197 Ca 0.29 -0.28 -0.24 0.00 -0.55 0.00 0.00 56.30 55.51 1kqy h ASN 197 Cb -0.03 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.10 1kqy h ASN 197 CO -0.09 1.03 -0.91 -0.29 -1.65 0.00 0.00 177.43 175.51 1kqy h ILE 198 N 0.85 1.30 -0.38 2.81 2.10 -1.63 -1.94 117.51 120.62 1kqy h ILE 198 Ca 0.14 -2.16 -0.11 0.00 1.08 0.00 0.00 64.86 63.81 1kqy h ILE 198 Cb 0.60 2.22 -0.01 0.00 -1.09 0.00 0.00 36.82 38.54 1kqy h ILE 198 CO 0.04 0.67 -0.20 0.40 -1.08 0.00 0.00 178.15 177.98 1kqy h ILE 199 N 0.42 1.28 -0.84 2.19 1.08 -1.19 0.82 117.51 121.27 1kqy h ILE 199 Ca -0.09 -1.34 -0.01 0.00 -0.39 0.00 0.00 64.86 63.03 1kqy h ILE 199 Cb 1.55 1.32 -0.04 0.00 -3.07 0.00 0.00 36.82 36.58 1kqy h ILE 199 CO 0.18 0.44 0.49 -1.13 -0.69 0.00 0.00 178.15 177.44 1kqy h ASN 200 N 0.61 1.02 -0.31 1.72 -1.24 -1.14 -0.92 115.58 115.33 1kqy h ASN 200 Ca 0.08 -0.08 -0.09 0.00 0.71 0.00 0.00 56.30 56.92 1kqy h ASN 200 Cb 0.76 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 39.54 1kqy h ASN 200 CO 0.06 0.80 -0.17 -1.28 -1.29 0.00 0.00 177.43 175.55 1kqy h SER 201 N 1.15 0.68 -0.99 1.15 0.87 -1.17 -2.83 113.55 112.42 1kqy h SER 201 Ca 0.30 -0.42 0.09 0.00 -1.23 0.00 0.00 61.79 60.53 1kqy h SER 201 Cb -0.02 -0.19 -0.08 0.00 -0.44 0.00 0.00 62.40 61.68 1kqy h SER 201 CO -0.05 0.95 0.63 -0.25 -0.53 0.00 0.00 176.83 177.58 1kqy h TRP 202 N 0.41 1.15 -0.28 2.24 2.91 -0.38 -1.41 115.95 120.61 1kqy h TRP 202 Ca 0.07 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 60.04 1kqy h TRP 202 Cb 0.71 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.97 1kqy h TRP 202 CO 0.06 0.53 -0.18 -0.91 -1.03 0.00 0.00 178.44 176.91 1kqy h ASN 203 N 1.07 0.48 -0.54 2.65 2.35 -1.01 -1.41 115.58 119.17 1kqy h ASN 203 Ca 0.46 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.99 1kqy h ASN 203 Cb 0.33 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1kqy h ASN 203 CO -0.22 0.68 0.03 0.03 -1.65 0.00 0.00 177.43 176.30 1kqy h ARG 204 N 0.45 0.93 0.00 0.81 3.08 -1.04 -2.48 114.38 116.13 1kqy h ARG 204 Ca 0.08 -0.28 -0.12 0.00 0.07 0.00 0.00 59.98 59.72 1kqy h ARG 204 Cb 0.57 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1kqy h ARG 204 CO 0.04 0.93 -0.58 -1.49 -1.07 0.00 0.00 179.97 177.79 1kqy h TRP 205 N 0.81 0.00 -0.02 3.04 4.06 -1.12 -3.22 115.95 119.49 1kqy h TRP 205 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 1kqy h TRP 205 Cb 0.49 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.65 1kqy h TRP 205 CO 0.04 0.58 -0.00 0.25 -3.56 0.00 0.00 178.44 175.75 1kqy n THR 206 N -3.68 0.00 -1.82 1.49 -2.24 -0.56 -4.08 114.28 103.39 1kqy n THR 206 Ca -0.01 -0.38 0.06 0.00 -2.27 0.00 0.00 64.05 61.45 1kqy n THR 206 Cb 0.62 1.03 0.16 0.00 -2.10 0.00 0.00 70.33 70.05 1kqy n THR 206 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1kqy n THR 207 N 0.80 1.67 0.00 4.28 -2.24 -0.94 -4.94 114.28 112.91 1kqy n THR 207 Ca 0.16 -2.70 0.00 0.00 -2.27 0.00 0.00 64.05 59.24 1kqy n THR 207 Cb 0.49 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1kqy n THR 207 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1kqy n SER 208 N -0.73 0.00 -4.72 3.42 3.41 -1.23 -5.01 113.62 108.77 1kqy n SER 208 Ca 0.16 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.41 1kqy n SER 208 Cb 0.80 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.84 1kqy n SER 208 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1kqy s ILE 209 N 0.00 2.10 -0.45 -1.33 -4.36 -1.26 -4.98 121.20 110.92 1kqy s ILE 209 Ca 0.00 0.05 -0.14 0.00 -0.26 0.00 0.00 60.65 60.30 1kqy s ILE 209 Cb 0.00 -2.80 0.06 0.00 1.25 0.00 0.00 42.46 40.97 1kqy s ILE 209 CO 0.00 -0.02 0.36 0.20 0.24 0.00 0.00 174.94 175.71 1kqy s ASN 210 N -1.72 6.06 0.18 4.36 0.01 -1.26 -4.95 114.94 117.61 1kqy s ASN 210 Ca 0.78 -1.27 0.01 0.00 -0.71 0.00 0.00 52.86 51.68 1kqy s ASN 210 Cb -0.33 -2.15 -0.05 0.00 0.41 0.00 0.00 41.25 39.13 1kqy s ASN 210 CO 0.43 -0.59 0.01 0.00 -1.51 0.00 0.00 177.10 175.45 1kqy s ALA 211 N 1.62 1.34 0.05 0.60 0.00 -1.26 -4.21 121.76 119.90 1kqy s ALA 211 Ca 0.04 -1.60 -0.33 0.00 0.00 0.00 0.00 51.96 50.07 1kqy s ALA 211 Cb -0.23 0.62 -0.19 0.00 0.00 0.00 0.00 23.12 23.32 1kqy s ALA 211 CO 0.07 -0.35 1.48 0.78 0.00 0.00 0.00 175.76 177.74 1kqy h GLY 212 N 2.68 -1.10 -4.85 0.00 0.00 -0.54 -3.46 103.07 95.80 1kqy h GLY 212 Ca -0.37 0.41 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 1kqy h GLY 212 CO 0.62 -0.40 -0.40 0.54 0.00 0.00 0.00 176.54 176.90 1kqy s LYS 213 N -5.66 0.49 -0.12 4.80 -0.14 0.37 -4.93 119.74 114.55 1kqy s LYS 213 Ca -0.18 -0.11 -0.00 0.00 -1.36 0.00 0.00 55.97 54.32 1kqy s LYS 213 Cb 0.02 0.22 -0.02 0.00 -1.68 0.00 0.00 37.83 36.37 1kqy s LYS 213 CO 0.57 -0.11 -0.11 0.42 -0.76 0.00 0.00 175.35 175.35 1kqy s ILE 214 N -0.91 3.24 0.17 2.17 1.01 0.48 -1.14 121.20 126.21 1kqy s ILE 214 Ca -0.10 -0.61 0.09 0.00 0.00 0.00 0.00 60.65 60.03 1kqy s ILE 214 Cb -0.05 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 1kqy s ILE 214 CO 0.02 0.53 -0.08 -0.36 0.00 0.00 0.00 174.94 175.05 1kqy s PHE 215 N 0.11 2.67 -0.54 3.97 0.40 0.32 -0.31 117.98 124.60 1kqy s PHE 215 Ca -0.05 -0.20 -0.21 0.00 -0.60 0.00 0.00 56.93 55.87 1kqy s PHE 215 Cb -0.15 -1.31 0.06 0.00 0.51 0.00 0.00 43.02 42.13 1kqy s PHE 215 CO 0.04 0.50 0.76 -1.17 0.70 0.00 0.00 175.22 176.06 1kqy s LEU 216 N -2.79 4.70 -0.08 -0.37 2.96 -0.34 -2.45 118.68 120.32 1kqy s LEU 216 Ca 0.25 -0.82 -0.25 0.00 -0.22 0.00 0.00 54.13 53.09 1kqy s LEU 216 Cb -0.09 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.03 1kqy s LEU 216 CO 0.15 -1.07 0.80 -0.83 -1.32 0.00 0.00 176.35 174.08 1kqy s GLY 217 N 2.94 2.56 0.09 7.98 0.00 0.81 -1.24 107.32 120.46 1kqy s GLY 217 Ca 0.20 0.21 -0.01 0.00 0.00 0.00 0.00 44.72 45.11 1kqy s GLY 217 CO 0.13 1.42 0.02 1.08 0.00 0.00 0.00 173.10 175.75 1kqy s LEU 218 N 1.18 2.11 0.12 0.66 1.43 0.34 -1.17 118.68 123.35 1kqy s LEU 218 Ca 0.41 -1.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 1kqy s LEU 218 Cb -0.18 0.27 -0.06 0.00 0.03 0.00 0.00 46.19 46.25 1kqy s LEU 218 CO 0.19 -0.67 0.96 -2.84 0.23 0.00 0.00 176.35 174.23 1kqy s PRO 219 N -3.98 4.71 0.20 1.29 0.02 -1.26 -1.78 135.00 134.20 1kqy s PRO 219 Ca 0.15 1.46 0.22 0.00 0.02 0.00 0.00 61.00 62.85 1kqy s PRO 219 Cb 0.08 -3.37 0.91 0.00 0.02 0.00 0.00 34.50 32.13 1kqy s PRO 219 CO -0.04 0.23 1.68 0.00 -0.33 0.00 0.00 177.00 178.54 1kqy n ALA 220 N 2.69 1.75 -3.56 -1.55 0.00 0.23 -4.68 120.51 115.39 1kqy n ALA 220 Ca 0.02 0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.42 1kqy n ALA 220 Cb 0.49 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 1kqy n ALA 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kqy s ALA 221 N -3.23 -1.69 0.45 0.00 0.00 -1.26 -4.53 121.76 111.51 1kqy s ALA 221 Ca 0.06 0.62 0.16 0.00 0.00 0.00 0.00 51.96 52.80 1kqy s ALA 221 Cb 0.10 0.61 1.11 0.00 0.00 0.00 0.00 23.12 24.94 1kqy s ALA 221 CO 0.40 -0.80 1.97 -1.35 0.00 0.00 0.00 175.76 175.97 1kqy h PRO 222 N 2.00 0.32 0.00 0.00 0.11 -1.92 -1.01 132.00 131.50 1kqy h PRO 222 Ca -0.25 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.79 1kqy h PRO 222 Cb 1.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1kqy h PRO 222 CO 0.31 0.21 -0.24 0.93 -0.21 0.00 0.00 178.00 179.00 1kqy h GLU 223 N 0.33 0.00 0.00 1.05 3.07 -1.98 -3.26 114.58 113.78 1kqy h GLU 223 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1kqy h GLU 223 Cb 0.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1kqy h GLU 223 CO -0.07 0.24 0.00 0.00 -1.40 0.00 0.00 179.01 177.77 1kqy h ALA 224 N 1.76 1.00 -2.80 3.43 0.00 -1.49 -3.45 119.26 117.70 1kqy h ALA 224 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1kqy h ALA 224 Cb 0.91 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.60 1kqy h ALA 224 CO 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 179.25 179.21 1kqy s ALA 225 N -3.46 -0.64 0.27 0.00 0.00 -1.23 -4.93 121.76 111.78 1kqy s ALA 225 Ca 0.02 -0.45 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1kqy s ALA 225 Cb 0.09 0.86 0.39 0.00 0.00 0.00 0.00 23.12 24.46 1kqy s ALA 225 CO 0.36 -0.77 1.72 0.78 0.00 0.00 0.00 175.76 177.86 1kqy h GLY 226 N 2.30 0.57 -2.83 0.00 0.00 -1.88 -3.47 103.07 97.77 1kqy h GLY 226 Ca -0.29 -0.46 0.17 0.00 0.00 0.00 0.00 47.33 46.75 1kqy h GLY 226 CO 0.40 0.42 0.53 -1.35 0.00 0.00 0.00 176.54 176.54 1kqy s SER 227 N -6.79 -0.24 0.00 0.19 1.04 -1.26 -5.02 113.70 101.62 1kqy s SER 227 Ca -0.07 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1kqy s SER 227 Cb 0.14 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1kqy s SER 227 CO 0.79 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.90 1kqy n GLY 228 N -0.37 0.71 3.76 7.32 0.00 -1.26 -1.47 105.19 113.88 1kqy n GLY 228 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1kqy n GLY 228 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1kqy s TYR 229 N -2.00 2.51 -0.14 1.61 5.04 -1.26 -4.44 117.35 118.68 1kqy s TYR 229 Ca 0.00 1.32 0.00 0.00 -2.44 0.00 0.00 57.07 55.96 1kqy s TYR 229 Cb 0.00 -3.83 0.03 0.00 0.35 0.00 0.00 41.96 38.51 1kqy s TYR 229 CO 0.00 -2.70 -0.12 0.08 -1.34 0.00 0.00 175.55 171.47 1kqy s VAL 230 N -1.25 1.39 0.36 3.14 1.01 -1.26 -4.90 120.40 118.89 1kqy s VAL 230 Ca 0.62 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 1kqy s VAL 230 Cb -0.41 -1.35 -0.12 0.00 0.00 0.00 0.00 36.38 34.50 1kqy s VAL 230 CO 0.52 0.40 1.36 -2.65 0.00 0.00 0.00 175.10 174.73 1kqy n PRO 231 N 4.82 2.30 -0.28 2.72 -0.02 -1.26 -4.77 135.00 138.51 1kqy n PRO 231 Ca -0.15 0.81 0.11 0.00 -2.02 0.00 0.00 63.50 62.24 1kqy n PRO 231 Cb 0.50 -2.46 0.26 0.00 -0.02 0.00 0.00 33.50 31.78 1kqy n PRO 231 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1kqy h PRO 232 N 2.64 0.24 -0.84 0.52 0.11 -1.99 -1.02 132.00 131.66 1kqy h PRO 232 Ca -0.48 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 1kqy h PRO 232 Cb 1.27 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1kqy h PRO 232 CO 0.63 0.16 0.40 0.38 -0.21 0.00 0.00 178.00 179.36 1kqy h ASP 233 N 0.25 1.09 -0.35 -2.05 2.03 -1.98 -1.07 116.42 114.35 1kqy h ASP 233 Ca 0.51 -0.14 -0.06 0.00 -0.73 0.00 0.00 57.03 56.62 1kqy h ASP 233 Cb 0.98 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 39.19 1kqy h ASP 233 CO -0.60 0.92 -0.00 0.58 -1.03 0.00 0.00 179.24 179.11 1kqy h VAL 234 N 1.19 1.26 -0.22 4.15 2.07 -1.57 -0.93 116.25 122.20 1kqy h VAL 234 Ca 0.29 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1kqy h VAL 234 Cb 0.12 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1kqy h VAL 234 CO -0.04 0.32 0.10 0.25 0.02 0.00 0.00 177.57 178.23 1kqy h LEU 235 N 0.43 0.14 -0.28 2.57 5.85 -1.09 0.17 115.31 123.09 1kqy h LEU 235 Ca 0.10 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1kqy h LEU 235 Cb 0.46 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1kqy h LEU 235 CO 0.02 0.11 -0.03 0.40 -0.34 0.00 0.00 178.44 178.60 1kqy h ILE 236 N 0.22 1.27 0.00 4.05 2.04 -1.13 0.19 117.51 124.14 1kqy h ILE 236 Ca 0.09 -1.00 -0.10 0.00 1.00 0.00 0.00 64.86 64.86 1kqy h ILE 236 Cb 0.04 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 1kqy h ILE 236 CO -0.08 0.32 -1.26 -1.54 0.00 0.00 0.00 178.15 175.59 1kqy n SER 237 N -4.55 0.84 -0.05 1.72 3.41 -0.36 -4.22 113.62 110.40 1kqy n SER 237 Ca -0.03 0.35 -0.08 0.00 -0.26 0.00 0.00 58.87 58.85 1kqy n SER 237 Cb 0.28 0.31 -0.05 0.00 -0.26 0.00 0.00 64.21 64.49 1kqy n SER 237 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1kqy n ARG 238 N -2.79 0.27 -0.09 4.33 1.74 0.57 -4.77 116.66 115.91 1kqy n ARG 238 Ca -0.06 0.07 -0.16 0.00 -0.77 0.00 0.00 57.85 56.93 1kqy n ARG 238 Cb 0.72 -1.17 -0.08 0.00 -1.02 0.00 0.00 32.46 30.91 1kqy n ARG 238 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1kqy n ILE 239 N -2.92 1.50 -0.32 0.55 5.41 -0.98 -4.41 119.36 118.19 1kqy n ILE 239 Ca -0.20 0.05 0.02 0.00 1.00 0.00 0.00 62.75 63.62 1kqy n ILE 239 Cb 0.70 -2.16 0.17 0.00 -0.71 0.00 0.00 39.64 37.64 1kqy n ILE 239 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1kqy h LEU 240 N -1.00 0.84 -2.61 1.39 3.38 -0.85 -1.53 115.31 114.93 1kqy h LEU 240 Ca -0.24 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1kqy h LEU 240 Cb 1.05 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1kqy h LEU 240 CO -0.15 0.51 0.11 -0.65 0.09 0.00 0.00 178.44 178.35 1kqy h PRO 241 N 0.96 0.00 0.00 1.13 0.11 -1.79 -1.78 132.00 130.63 1kqy h PRO 241 Ca 0.41 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.45 1kqy h PRO 241 Cb 0.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1kqy h PRO 241 CO -0.20 0.00 -0.88 0.39 -0.21 0.00 0.00 178.00 177.09 1kqy n GLU 242 N -3.19 0.50 0.24 1.05 -0.58 -0.63 -4.49 120.64 113.54 1kqy n GLU 242 Ca -0.02 0.44 0.09 0.00 -0.42 0.00 0.00 57.16 57.25 1kqy n GLU 242 Cb 0.18 -1.62 0.62 0.00 -0.57 0.00 0.00 31.44 30.05 1kqy n GLU 242 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 1kqy h ILE 243 N -1.00 0.82 0.00 -3.67 3.07 -1.38 -2.25 117.51 113.11 1kqy h ILE 243 Ca -0.10 -0.63 0.00 0.00 1.55 0.00 0.00 64.86 65.68 1kqy h ILE 243 Cb 0.82 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 38.74 1kqy h ILE 243 CO -0.06 0.16 0.00 0.29 -1.05 0.00 0.00 178.15 177.49 1kqy n LYS 244 N -3.91 0.08 0.13 0.16 5.02 -0.67 -2.10 118.16 116.87 1kqy n LYS 244 Ca -0.02 0.33 -0.02 0.00 -2.02 0.00 0.00 58.31 56.59 1kqy n LYS 244 Cb 0.26 -1.66 0.19 0.00 -0.02 0.00 0.00 35.03 33.80 1kqy n LYS 244 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1kqy h LYS 245 N 0.00 0.07 -6.68 1.97 1.57 -1.63 -3.44 116.57 108.43 1kqy h LYS 245 Ca 0.00 -0.04 -0.53 0.00 -1.87 0.00 0.00 60.65 58.21 1kqy h LYS 245 Cb 0.28 0.01 0.05 0.00 0.08 0.00 0.00 32.23 32.65 1kqy h LYS 245 CO 0.00 0.62 0.80 0.45 -0.57 0.00 0.00 179.45 180.75 1kqy s SER 246 N -6.87 6.65 0.01 0.86 0.15 -0.89 -4.89 113.70 108.71 1kqy s SER 246 Ca -0.02 2.62 0.15 0.00 0.70 0.00 0.00 55.95 59.39 1kqy s SER 246 Cb 0.13 -2.61 0.64 0.00 -1.71 0.00 0.00 66.02 62.47 1kqy s SER 246 CO 0.77 -0.74 1.48 -0.81 1.20 0.00 0.00 173.24 175.13 1kqy n PRO 247 N 3.06 0.01 0.00 5.44 -0.04 -1.26 -1.98 135.00 140.24 1kqy n PRO 247 Ca 0.10 0.26 0.11 0.00 -0.04 0.00 0.00 63.50 63.92 1kqy n PRO 247 Cb 0.40 -1.51 0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1kqy n PRO 247 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1kqy n LYS 248 N -1.53 0.04 -1.68 0.54 5.02 -1.26 -4.93 118.16 114.35 1kqy n LYS 248 Ca 0.03 0.00 -0.50 0.00 -2.02 0.00 0.00 58.31 55.82 1kqy n LYS 248 Cb 0.17 -1.51 -0.05 0.00 -0.02 0.00 0.00 35.03 33.62 1kqy n LYS 248 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1kqy n TYR 249 N -1.56 2.23 -0.01 2.13 9.36 -0.84 -0.39 117.16 128.08 1kqy n TYR 249 Ca 0.05 0.17 0.06 0.00 3.32 0.00 0.00 57.90 61.50 1kqy n TYR 249 Cb 0.35 -2.59 -0.10 0.00 -0.63 0.00 0.00 39.34 36.36 1kqy n TYR 249 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1kqy n GLY 250 N 4.20 -0.58 0.00 2.98 0.00 0.58 -4.78 105.19 107.59 1kqy n GLY 250 Ca 0.23 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1kqy n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kqy n GLY 251 N 1.79 0.69 3.24 -0.02 0.00 -1.25 -2.11 105.19 107.53 1kqy n GLY 251 Ca -0.03 -1.57 -0.25 0.00 0.00 0.00 0.00 46.02 44.17 1kqy n GLY 251 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kqy s VAL 252 N -3.90 1.62 -0.01 1.61 1.01 -0.69 -1.20 120.40 118.84 1kqy s VAL 252 Ca 0.00 -1.20 0.06 0.00 0.00 0.00 0.00 61.98 60.83 1kqy s VAL 252 Cb 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1kqy s VAL 252 CO 0.00 0.17 -0.19 -0.32 0.00 0.00 0.00 175.10 174.76 1kqy s MET 253 N -1.23 2.26 -0.02 2.72 0.00 -0.37 -0.23 119.30 122.43 1kqy s MET 253 Ca 0.07 -0.85 0.04 0.00 0.00 0.00 0.00 55.69 54.95 1kqy s MET 253 Cb -0.09 -2.22 -0.01 0.00 0.00 0.00 0.00 34.83 32.51 1kqy s MET 253 CO 0.02 0.58 -0.14 -0.51 0.00 0.00 0.00 175.02 174.97 1kqy s LEU 254 N -0.90 1.99 -0.27 4.11 1.43 0.20 -0.50 118.68 124.73 1kqy s LEU 254 Ca 0.12 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 1kqy s LEU 254 Cb -0.10 -0.76 0.06 0.00 0.03 0.00 0.00 46.19 45.41 1kqy s LEU 254 CO 0.01 0.16 -0.08 0.86 0.23 0.00 0.00 176.35 177.54 1kqy s TRP 255 N -0.23 3.26 0.00 0.29 -0.11 -0.73 -2.88 118.94 118.53 1kqy s TRP 255 Ca 0.03 -2.18 0.00 0.00 1.22 0.00 0.00 56.10 55.17 1kqy s TRP 255 Cb -0.07 -1.98 0.00 0.00 -1.50 0.00 0.00 33.47 29.92 1kqy s TRP 255 CO -0.00 -0.86 0.00 -1.13 -4.62 0.00 0.00 176.95 170.34 1kqy n SER 256 N 4.49 0.00 -0.15 5.86 3.41 -1.26 -0.60 113.62 125.37 1kqy n SER 256 Ca -0.14 -1.00 -0.03 0.00 -0.26 0.00 0.00 58.87 57.44 1kqy n SER 256 Cb 0.43 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.43 1kqy n SER 256 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1kqy h LYS 257 N 0.00 0.20 0.15 4.33 1.63 -1.62 0.13 116.57 121.39 1kqy h LYS 257 Ca 0.00 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.80 1kqy h LYS 257 Cb 0.00 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.55 1kqy h LYS 257 CO 0.00 0.13 -0.31 0.35 -3.45 0.00 0.00 179.45 176.17 1kqy h PHE 258 N 0.21 -0.84 0.00 1.91 3.57 -1.84 -2.18 116.94 117.77 1kqy h PHE 258 Ca 0.24 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1kqy h PHE 258 Cb 0.32 0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 1kqy h PHE 258 CO -0.23 -0.42 -0.08 1.88 -2.23 0.00 0.00 178.31 177.23 1kqy h TYR 259 N -0.55 0.00 -0.29 0.41 0.05 -1.84 -2.83 116.97 111.92 1kqy h TYR 259 Ca 0.02 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.72 1kqy h TYR 259 Cb 0.57 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.30 1kqy h TYR 259 CO -0.26 0.08 -0.16 0.22 -1.05 0.00 0.00 178.16 176.99 1kqy h ASP 260 N 0.00 0.65 -0.42 3.88 3.58 -0.22 -1.72 116.42 122.16 1kqy h ASP 260 Ca -0.00 -0.42 -0.08 0.00 0.42 0.00 0.00 57.03 56.95 1kqy h ASP 260 Cb 0.61 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 1kqy h ASP 260 CO 0.01 0.92 -0.05 0.44 -2.88 0.00 0.00 179.24 177.68 1kqy h ASP 261 N 0.37 0.78 -0.66 2.28 3.32 -1.27 0.60 116.42 121.84 1kqy h ASP 261 Ca 0.06 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 1kqy h ASP 261 Cb 0.69 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 1kqy h ASP 261 CO 0.05 0.93 0.37 0.50 -1.72 0.00 0.00 179.24 179.37 1kqy h LYS 262 N 0.61 0.94 -0.01 3.56 3.64 -1.45 -3.05 116.57 120.80 1kqy h LYS 262 Ca 0.11 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1kqy h LYS 262 Cb 0.57 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1kqy h LYS 262 CO 0.03 0.69 -0.47 -1.71 -2.27 0.00 0.00 179.45 175.71 1kqy n ASN 263 N -4.37 1.37 -3.81 4.20 5.15 -0.65 -5.00 115.26 112.15 1kqy n ASN 263 Ca 0.07 -1.18 -0.27 0.00 -0.60 0.00 0.00 54.58 52.59 1kqy n ASN 263 Cb 0.10 0.64 0.04 0.00 -0.53 0.00 0.00 39.78 40.03 1kqy n ASN 263 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1kqy n GLY 264 N 1.24 -0.48 0.30 8.20 0.00 0.21 -4.93 105.19 109.72 1kqy n GLY 264 Ca 0.06 0.20 -0.11 0.00 0.00 0.00 0.00 46.02 46.17 1kqy n GLY 264 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1kqy h TYR 265 N -2.21 -0.66 0.00 1.61 3.20 -1.73 -3.06 116.97 114.11 1kqy h TYR 265 Ca -0.58 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.27 1kqy h TYR 265 Cb 1.37 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 39.86 1kqy h TYR 265 CO 0.54 -0.41 -0.03 0.66 -1.64 0.00 0.00 178.16 177.28 1kqy h SER 266 N -1.12 0.00 0.24 -2.11 4.64 -1.92 -0.43 113.55 112.85 1kqy h SER 266 Ca -0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.21 1kqy h SER 266 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1kqy h SER 266 CO 0.12 0.03 -0.17 -1.28 -0.87 0.00 0.00 176.83 174.66 1kqy h SER 267 N 0.00 0.00 0.42 4.97 0.87 -1.90 -0.46 113.55 117.45 1kqy h SER 267 Ca -0.00 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.28 1kqy h SER 267 Cb 0.06 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 61.97 1kqy h SER 267 CO 0.00 0.17 -1.79 -1.20 -0.53 0.00 0.00 176.83 173.48 1kqy n SER 268 N -4.10 0.67 -0.00 6.23 7.64 -0.23 -4.55 113.62 119.28 1kqy n SER 268 Ca -0.02 0.31 0.08 0.00 1.01 0.00 0.00 58.87 60.25 1kqy n SER 268 Cb 0.25 0.25 -0.11 0.00 -1.01 0.00 0.00 64.21 63.59 1kqy n SER 268 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1kqy n ILE 269 N -2.93 0.00 -0.31 0.44 -5.35 -0.83 -4.73 119.36 105.64 1kqy n ILE 269 Ca -0.18 -0.26 0.05 0.00 -0.27 0.00 0.00 62.75 62.09 1kqy n ILE 269 Cb 1.02 0.54 0.14 0.00 -1.74 0.00 0.00 39.64 39.59 1kqy n ILE 269 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1kqy h LEU 270 N 0.00 -0.75 -1.55 7.28 5.85 -1.32 0.58 115.31 125.40 1kqy h LEU 270 Ca 0.00 0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 1kqy h LEU 270 Cb 0.56 0.52 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1kqy h LEU 270 CO 0.00 -0.29 -0.22 0.44 -0.34 0.00 0.00 178.44 178.03 1kqy h ASP 271 N 0.01 0.00 1.24 1.25 3.32 -1.85 -2.64 116.42 117.75 1kqy h ASP 271 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 1kqy h ASP 271 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1kqy h ASP 271 CO -0.89 0.22 -0.41 0.28 -1.72 0.00 0.00 179.24 176.72 1kqy h SER 272 N 0.00 0.00 0.00 6.45 0.02 -1.22 -3.50 113.55 115.30 1kqy h SER 272 Ca -0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1kqy h SER 272 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1kqy h SER 272 CO 0.03 0.04 0.00 0.52 -1.14 0.00 0.00 176.83 176.28