#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rkd n GLY 5 N 0.00 -1.85 3.90 0.00 0.00 -1.15 -4.96 105.19 101.14 1rkd n GLY 5 Ca 0.00 -1.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 1rkd n GLY 5 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rkd s SER 6 N -5.09 6.41 -0.01 1.61 1.04 -1.26 -4.45 113.70 111.94 1rkd s SER 6 Ca 0.68 0.40 0.07 0.00 0.48 0.00 0.00 55.95 57.58 1rkd s SER 6 Cb -0.03 -2.02 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1rkd s SER 6 CO 0.49 0.23 -0.21 -0.22 0.98 0.00 0.00 173.24 174.52 1rkd s LEU 7 N -2.01 2.40 -0.13 2.42 2.96 0.47 -0.44 118.68 124.35 1rkd s LEU 7 Ca 0.29 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.83 1rkd s LEU 7 Cb -0.13 -1.44 0.01 0.00 0.50 0.00 0.00 46.19 45.13 1rkd s LEU 7 CO 0.20 0.31 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.63 1rkd s VAL 8 N -0.74 1.96 -0.13 1.68 1.01 -0.41 -1.52 120.40 122.25 1rkd s VAL 8 Ca 0.12 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 1rkd s VAL 8 Cb -0.10 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1rkd s VAL 8 CO 0.01 0.53 0.05 -0.69 0.00 0.00 0.00 175.10 175.00 1rkd s VAL 9 N 0.75 4.70 -0.13 2.92 1.01 -0.24 -0.27 120.40 129.14 1rkd s VAL 9 Ca -0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1rkd s VAL 9 Cb -0.16 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.21 1rkd s VAL 9 CO 0.00 0.56 -0.09 -0.22 0.00 0.00 0.00 175.10 175.35 1rkd s LEU 10 N -0.44 1.35 0.00 3.92 0.20 -0.61 -0.60 118.68 122.50 1rkd s LEU 10 Ca 0.09 -0.39 0.00 0.00 0.69 0.00 0.00 54.13 54.52 1rkd s LEU 10 Cb -0.12 -0.93 0.00 0.00 -0.43 0.00 0.00 46.19 44.71 1rkd s LEU 10 CO 0.02 -0.11 0.00 0.61 -0.29 0.00 0.00 176.35 176.58 1rkd n GLY 11 N 4.90 -1.07 3.85 7.98 0.00 -0.91 -4.01 105.19 115.92 1rkd n GLY 11 Ca -0.13 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 1rkd n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rkd s SER 12 N -4.00 6.11 -0.09 1.61 1.04 -1.26 -4.47 113.70 112.64 1rkd s SER 12 Ca 0.00 1.54 0.01 0.00 0.48 0.00 0.00 55.95 57.98 1rkd s SER 12 Cb 0.00 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.65 1rkd s SER 12 CO 0.00 -0.95 -0.09 -0.63 0.98 0.00 0.00 173.24 172.55 1rkd s ILE 13 N -2.93 1.03 0.16 -1.02 1.01 -1.26 -0.65 121.20 117.53 1rkd s ILE 13 Ca 0.58 -0.35 0.07 0.00 0.00 0.00 0.00 60.65 60.95 1rkd s ILE 13 Cb -0.12 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1rkd s ILE 13 CO 0.47 0.35 -0.16 0.20 0.00 0.00 0.00 174.94 175.80 1rkd s ASN 14 N 1.23 2.38 -0.46 3.58 0.01 -0.38 -3.55 114.94 117.76 1rkd s ASN 14 Ca -0.04 -0.89 -0.19 0.00 -0.71 0.00 0.00 52.86 51.03 1rkd s ASN 14 Cb -0.14 -0.12 0.03 0.00 0.41 0.00 0.00 41.25 41.44 1rkd s ASN 14 CO -0.03 -0.12 0.58 0.00 -1.51 0.00 0.00 177.10 176.03 1rkd s ALA 15 N -2.35 3.38 -0.07 0.60 0.00 -0.18 -0.37 121.76 122.77 1rkd s ALA 15 Ca 0.15 -1.46 -0.24 0.00 0.00 0.00 0.00 51.96 50.41 1rkd s ALA 15 Cb -0.04 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1rkd s ALA 15 CO 0.05 -1.81 0.73 -0.51 0.00 0.00 0.00 175.76 174.22 1rkd s ASP 16 N 2.16 7.00 -0.28 0.00 1.01 0.28 -1.59 116.67 125.25 1rkd s ASP 16 Ca 0.17 1.21 -0.03 0.00 0.71 0.00 0.00 52.55 54.61 1rkd s ASP 16 Cb -0.16 -2.42 0.03 0.00 1.01 0.00 0.00 42.92 41.37 1rkd s ASP 16 CO 0.15 -0.15 0.00 -1.00 0.21 0.00 0.00 175.17 174.38 1rkd s HIS 17 N 0.95 3.14 -0.14 4.23 3.76 0.92 -1.05 115.29 127.11 1rkd s HIS 17 Ca 0.38 -1.47 0.02 0.00 -0.15 0.00 0.00 55.06 53.85 1rkd s HIS 17 Cb -0.18 -2.14 0.01 0.00 1.11 0.00 0.00 32.58 31.39 1rkd s HIS 17 CO 0.18 -0.71 -0.20 0.42 -0.85 0.00 0.00 174.74 173.58 1rkd s ILE 18 N 1.36 1.95 -0.16 0.60 1.01 -0.23 -0.55 121.20 125.18 1rkd s ILE 18 Ca -0.01 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.74 1rkd s ILE 18 Cb -0.18 -1.74 -0.00 0.00 0.01 0.00 0.00 42.46 40.55 1rkd s ILE 18 CO -0.01 0.53 -0.14 -0.22 0.00 0.00 0.00 174.94 175.09 1rkd s LEU 19 N 0.94 2.53 0.03 2.97 2.96 -0.25 -1.38 118.68 126.48 1rkd s LEU 19 Ca -0.05 -0.45 -0.23 0.00 -0.22 0.00 0.00 54.13 53.19 1rkd s LEU 19 Cb -0.15 -1.58 -0.06 0.00 0.50 0.00 0.00 46.19 44.90 1rkd s LEU 19 CO -0.04 0.08 0.68 0.20 -1.32 0.00 0.00 176.35 175.96 1rkd s ASN 20 N 0.82 7.10 0.29 3.68 -0.87 -0.51 -1.19 114.94 124.26 1rkd s ASN 20 Ca -0.05 1.31 -0.02 0.00 -1.57 0.00 0.00 52.86 52.54 1rkd s ASN 20 Cb -0.15 -2.42 -0.02 0.00 -0.02 0.00 0.00 41.25 38.64 1rkd s ASN 20 CO 0.00 0.07 0.35 -1.48 -2.57 0.00 0.00 177.10 173.47 1rkd s LEU 21 N -0.18 1.07 -0.09 0.60 0.05 -0.37 0.22 118.68 119.97 1rkd s LEU 21 Ca 0.35 -1.41 -0.12 0.00 0.05 0.00 0.00 54.13 52.99 1rkd s LEU 21 Cb -0.19 1.05 -0.10 0.00 -2.05 0.00 0.00 46.19 44.90 1rkd s LEU 21 CO 0.20 -1.10 0.42 -0.61 -0.55 0.00 0.00 176.35 174.71 1rkd h GLN 22 N 2.28 -0.11 -5.85 1.48 5.75 -1.85 -2.31 115.11 114.49 1rkd h GLN 22 Ca -0.29 0.01 -0.53 0.00 -0.15 0.00 0.00 58.65 57.68 1rkd h GLN 22 Cb 1.24 0.02 -0.25 0.00 1.07 0.00 0.00 27.48 29.57 1rkd h GLN 22 CO 0.41 0.22 -0.82 -1.12 -2.65 0.00 0.00 178.83 174.87 1rkd s SER 23 N -5.60 2.23 0.40 -0.69 0.01 -1.26 -1.11 113.70 107.68 1rkd s SER 23 Ca -0.08 -0.53 -0.27 0.00 1.31 0.00 0.00 55.95 56.39 1rkd s SER 23 Cb -0.00 -0.16 -0.09 0.00 0.21 0.00 0.00 66.02 65.97 1rkd s SER 23 CO 0.27 0.10 1.39 -0.36 0.41 0.00 0.00 173.24 175.06 1rkd s PHE 24 N -0.88 2.67 0.32 2.43 0.08 -1.26 -4.94 117.98 116.40 1rkd s PHE 24 Ca 0.05 1.30 -0.29 0.00 0.12 0.00 0.00 56.93 58.12 1rkd s PHE 24 Cb -0.09 -3.84 -0.10 0.00 -0.57 0.00 0.00 43.02 38.42 1rkd s PHE 24 CO 0.02 -2.56 1.29 -1.25 -0.10 0.00 0.00 175.22 172.62 1rkd s PRO 25 N -2.21 4.38 0.47 0.24 0.04 -1.26 -5.04 135.00 131.62 1rkd s PRO 25 Ca 0.56 2.17 -0.00 0.00 0.04 0.00 0.00 61.00 63.77 1rkd s PRO 25 Cb -0.42 -3.09 -0.00 0.00 0.04 0.00 0.00 34.50 31.03 1rkd s PRO 25 CO 0.55 -0.16 0.71 0.95 0.04 0.00 0.00 177.00 179.09 1rkd s THR 26 N -1.05 3.91 0.04 1.26 -4.23 -1.26 -4.97 115.64 109.35 1rkd s THR 26 Ca 0.49 -0.43 -0.37 0.00 -1.18 0.00 0.00 61.69 60.20 1rkd s THR 26 Cb -0.39 -3.46 -0.16 0.00 1.34 0.00 0.00 72.50 69.83 1rkd s THR 26 CO 0.51 -0.34 1.43 -2.65 -0.54 0.00 0.00 174.62 173.02 1rkd n PRO 27 N -2.16 1.27 -0.97 3.99 -0.02 -1.26 -1.29 135.00 134.57 1rkd n PRO 27 Ca 0.02 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1rkd n PRO 27 Cb 0.58 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1rkd n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rkd n GLY 28 N 2.87 0.77 3.93 -1.23 0.00 -1.26 -5.02 105.19 105.25 1rkd n GLY 28 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1rkd n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rkd s GLU 29 N -0.11 3.45 -0.12 1.61 2.12 -0.41 -5.10 118.70 120.13 1rkd s GLU 29 Ca 0.00 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 54.87 1rkd s GLU 29 Cb 0.00 -3.01 -0.02 0.00 0.26 0.00 0.00 34.13 31.37 1rkd s GLU 29 CO 0.00 0.58 -0.13 0.99 -0.54 0.00 0.00 175.26 176.15 1rkd s THR 30 N -1.59 3.05 -0.05 -1.70 2.01 -1.26 -4.70 115.64 111.40 1rkd s THR 30 Ca 0.35 -0.67 0.06 0.00 0.31 0.00 0.00 61.69 61.75 1rkd s THR 30 Cb -0.12 -2.27 -0.01 0.00 0.01 0.00 0.00 72.50 70.10 1rkd s THR 30 CO 0.28 0.53 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.81 1rkd s VAL 31 N 0.25 1.96 -0.29 3.82 1.01 -1.26 -5.09 120.40 120.79 1rkd s VAL 31 Ca -0.09 -1.02 -0.22 0.00 0.00 0.00 0.00 61.98 60.65 1rkd s VAL 31 Cb -0.15 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 1rkd s VAL 31 CO 0.05 0.55 0.71 -0.89 0.00 0.00 0.00 175.10 175.52 1rkd s THR 32 N -0.24 4.89 0.49 3.92 2.01 -1.26 -5.06 115.64 120.40 1rkd s THR 32 Ca -0.01 1.12 0.00 0.00 0.31 0.00 0.00 61.69 63.12 1rkd s THR 32 Cb -0.12 -4.05 0.10 0.00 0.01 0.00 0.00 72.50 68.43 1rkd s THR 32 CO 0.02 -0.13 0.68 0.61 -0.69 0.00 0.00 174.62 175.11 1rkd n GLY 33 N 4.20 0.77 0.00 4.40 0.00 -1.26 -4.74 105.19 108.56 1rkd n GLY 33 Ca 0.02 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1rkd n GLY 33 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rkd n ASN 34 N -2.91 0.00 -4.77 1.61 0.23 0.13 -4.98 115.26 104.57 1rkd n ASN 34 Ca 0.11 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.75 1rkd n ASN 34 Cb 0.41 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1rkd n ASN 34 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 1rkd n HIS 35 N 0.00 2.99 -4.28 -2.53 -0.00 -1.26 -4.77 115.22 105.37 1rkd n HIS 35 Ca 0.00 0.43 -0.19 0.00 -0.00 0.00 0.00 57.72 57.96 1rkd n HIS 35 Cb 0.00 -2.54 -0.16 0.00 -0.00 0.00 0.00 29.99 27.30 1rkd n HIS 35 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1rkd s TYR 36 N -1.02 0.80 -0.01 1.57 5.04 -1.26 -1.42 117.35 121.04 1rkd s TYR 36 Ca 0.54 -0.20 -0.02 0.00 -2.44 0.00 0.00 57.07 54.95 1rkd s TYR 36 Cb -0.48 -0.60 0.00 0.00 0.35 0.00 0.00 41.96 41.23 1rkd s TYR 36 CO 0.63 -0.11 0.06 -1.14 -1.34 0.00 0.00 175.55 173.64 1rkd s GLN 37 N 0.35 0.17 -0.19 4.97 0.74 -0.48 -5.00 119.66 120.22 1rkd s GLN 37 Ca -0.05 -0.10 -0.06 0.00 0.05 0.00 0.00 55.36 55.21 1rkd s GLN 37 Cb -0.09 0.07 -0.03 0.00 1.10 0.00 0.00 33.01 34.06 1rkd s GLN 37 CO 0.00 -0.03 0.01 0.08 -0.55 0.00 0.00 175.29 174.81 1rkd s VAL 38 N -0.41 4.18 0.10 1.34 1.01 -1.26 -1.07 120.40 124.29 1rkd s VAL 38 Ca -0.05 -0.24 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 1rkd s VAL 38 Cb -0.03 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 1rkd s VAL 38 CO 0.00 0.44 0.14 0.00 0.00 0.00 0.00 175.10 175.68 1rkd s ALA 39 N 0.74 0.14 0.40 5.51 0.00 -0.21 -4.98 121.76 123.35 1rkd s ALA 39 Ca 0.01 -0.93 -0.25 0.00 0.00 0.00 0.00 51.96 50.80 1rkd s ALA 39 Cb -0.14 0.56 -0.09 0.00 0.00 0.00 0.00 23.12 23.45 1rkd s ALA 39 CO 0.02 -0.50 1.09 -0.06 0.00 0.00 0.00 175.76 176.31 1rkd s PHE 40 N -3.92 3.21 0.00 0.00 0.08 -1.26 -0.56 117.98 115.53 1rkd s PHE 40 Ca 0.10 1.62 0.00 0.00 0.12 0.00 0.00 56.93 58.77 1rkd s PHE 40 Cb 0.06 -3.23 0.00 0.00 -0.57 0.00 0.00 43.02 39.28 1rkd s PHE 40 CO -0.07 -0.87 0.00 0.41 -0.10 0.00 0.00 175.22 174.59 1rkd n GLY 41 N 0.50 3.71 0.00 4.36 0.00 0.50 -4.35 105.19 109.91 1rkd n GLY 41 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1rkd n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rkd n GLY 42 N 0.00 2.26 0.31 -0.02 0.00 -1.26 -1.25 105.19 105.23 1rkd n GLY 42 Ca 0.00 -1.52 0.01 0.00 0.00 0.00 0.00 46.02 44.51 1rkd n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rkd h LYS 43 N 0.00 0.69 0.87 1.61 1.57 -1.98 0.08 116.57 119.42 1rkd h LYS 43 Ca 0.00 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1rkd h LYS 43 Cb 0.00 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.18 1rkd h LYS 43 CO 0.00 0.56 -0.44 0.78 -0.57 0.00 0.00 179.45 179.77 1rkd h GLY 44 N 0.82 -1.28 1.45 3.86 0.00 -1.79 -1.74 103.07 104.39 1rkd h GLY 44 Ca 0.17 0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.94 1rkd h GLY 44 CO -0.02 -0.46 0.10 0.00 0.00 0.00 0.00 176.54 176.17 1rkd h ALA 45 N -1.09 1.31 -0.34 3.60 0.00 -0.58 0.12 119.26 122.28 1rkd h ALA 45 Ca -0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1rkd h ALA 45 Cb 0.93 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1rkd h ALA 45 CO 0.18 0.48 0.05 -0.91 0.00 0.00 0.00 179.25 179.05 1rkd h ASN 46 N 0.68 0.55 -0.48 0.00 2.35 -0.96 0.29 115.58 118.00 1rkd h ASN 46 Ca 0.15 -0.27 -0.10 0.00 -0.55 0.00 0.00 56.30 55.53 1rkd h ASN 46 Cb 0.27 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1rkd h ASN 46 CO -0.00 0.68 -0.07 1.56 -1.65 0.00 0.00 177.43 177.95 1rkd h GLN 47 N 0.40 0.95 -0.80 0.81 4.20 -1.06 0.10 115.11 119.70 1rkd h GLN 47 Ca 0.10 -0.32 -0.02 0.00 0.06 0.00 0.00 58.65 58.47 1rkd h GLN 47 Cb 0.37 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.04 1rkd h GLN 47 CO 0.01 0.98 0.43 0.00 -0.67 0.00 0.00 178.83 179.58 1rkd h ALA 48 N 1.05 1.25 -0.22 3.87 0.00 -0.30 -0.78 119.26 124.13 1rkd h ALA 48 Ca 0.14 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1rkd h ALA 48 Cb 0.60 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.08 1rkd h ALA 48 CO 0.04 0.60 -0.64 0.28 0.00 0.00 0.00 179.25 179.53 1rkd h VAL 49 N 1.12 1.28 -0.95 0.00 2.07 -0.22 0.32 116.25 119.87 1rkd h VAL 49 Ca 0.28 -1.83 0.01 0.00 0.82 0.00 0.00 66.70 65.98 1rkd h VAL 49 Cb 0.04 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 1rkd h VAL 49 CO -0.04 0.59 0.63 0.00 0.02 0.00 0.00 177.57 178.77 1rkd h ALA 50 N 0.61 1.21 -0.03 1.67 0.00 -0.54 0.13 119.26 122.31 1rkd h ALA 50 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1rkd h ALA 50 Cb 1.26 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1rkd h ALA 50 CO 0.14 0.60 -0.01 0.00 0.00 0.00 0.00 179.25 179.98 1rkd h ALA 51 N 1.35 0.05 -0.68 0.00 0.00 -0.99 -1.88 119.26 117.10 1rkd h ALA 51 Ca 0.35 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1rkd h ALA 51 Cb -0.15 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1rkd h ALA 51 CO -0.08 -0.25 0.17 0.78 0.00 0.00 0.00 179.25 179.87 1rkd h GLY 52 N -0.30 1.17 1.75 0.00 0.00 -0.77 0.67 103.07 105.61 1rkd h GLY 52 Ca 0.01 -0.73 -0.17 0.00 0.00 0.00 0.00 47.33 46.44 1rkd h GLY 52 CO 0.00 0.68 -0.72 3.21 0.00 0.00 0.00 176.54 179.72 1rkd h ARG 53 N 1.02 0.24 0.00 4.80 3.08 -0.78 -2.79 114.38 119.95 1rkd h ARG 53 Ca 0.22 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1rkd h ARG 53 Cb 0.36 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1rkd h ARG 53 CO 0.00 0.86 0.00 -1.13 -1.07 0.00 0.00 179.97 178.63 1rkd n SER 54 N -3.79 0.00 0.00 7.04 3.41 -0.71 -0.79 113.62 118.78 1rkd n SER 54 Ca -0.03 -0.72 0.00 0.00 -0.26 0.00 0.00 58.87 57.86 1rkd n SER 54 Cb 0.70 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1rkd n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rkd n GLY 55 N 1.09 1.08 3.73 5.00 0.00 -0.96 -4.64 105.19 110.48 1rkd n GLY 55 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1rkd n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rkd s ALA 56 N -2.00 1.82 -0.83 4.61 0.00 0.19 -4.97 121.76 120.58 1rkd s ALA 56 Ca 0.00 0.20 -0.14 0.00 0.00 0.00 0.00 51.96 52.02 1rkd s ALA 56 Cb 0.00 -3.27 0.22 0.00 0.00 0.00 0.00 23.12 20.06 1rkd s ALA 56 CO 0.00 -2.17 0.77 1.21 0.00 0.00 0.00 175.76 175.57 1rkd s ASN 57 N -3.27 6.75 0.03 0.00 2.47 -1.26 -4.67 114.94 115.00 1rkd s ASN 57 Ca 0.63 -2.67 0.07 0.00 0.42 0.00 0.00 52.86 51.31 1rkd s ASN 57 Cb -0.18 -2.21 -0.02 0.00 -1.45 0.00 0.00 41.25 37.38 1rkd s ASN 57 CO 0.57 -0.59 -0.20 -0.51 -3.72 0.00 0.00 177.10 172.65 1rkd s ILE 58 N 0.23 1.59 0.08 -5.21 -1.16 -1.26 -0.39 121.20 115.08 1rkd s ILE 58 Ca 0.18 -1.10 0.08 0.00 -0.51 0.00 0.00 60.65 59.31 1rkd s ILE 58 Cb -0.10 -1.37 -0.03 0.00 0.61 0.00 0.00 42.46 41.56 1rkd s ILE 58 CO -0.09 0.24 -0.22 0.00 -2.81 0.00 0.00 174.94 172.06 1rkd s ALA 59 N -0.72 1.93 -0.10 1.50 0.00 -0.57 -1.28 121.76 122.50 1rkd s ALA 59 Ca 0.07 -1.23 0.02 0.00 0.00 0.00 0.00 51.96 50.82 1rkd s ALA 59 Cb -0.08 -0.32 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1rkd s ALA 59 CO 0.01 0.42 -0.14 0.12 0.00 0.00 0.00 175.76 176.17 1rkd s PHE 60 N -1.00 1.85 -0.31 0.00 5.36 -0.84 -1.08 117.98 121.96 1rkd s PHE 60 Ca 0.08 -0.85 -0.13 0.00 -0.96 0.00 0.00 56.93 55.07 1rkd s PHE 60 Cb -0.10 -1.36 -0.03 0.00 -0.34 0.00 0.00 43.02 41.20 1rkd s PHE 60 CO 0.04 -0.45 0.28 0.42 -1.46 0.00 0.00 175.22 174.04 1rkd s ILE 61 N 1.01 5.24 0.24 3.12 1.01 0.23 -3.19 121.20 128.86 1rkd s ILE 61 Ca -0.07 0.10 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 1rkd s ILE 61 Cb -0.15 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.67 1rkd s ILE 61 CO -0.01 0.08 0.75 0.00 0.00 0.00 0.00 174.94 175.75 1rkd s ALA 62 N 1.87 -1.35 -0.05 9.38 0.00 -1.07 -2.14 121.76 128.40 1rkd s ALA 62 Ca 0.09 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.95 1rkd s ALA 62 Cb -0.16 0.81 0.01 0.00 0.00 0.00 0.00 23.12 23.78 1rkd s ALA 62 CO 0.11 -1.01 -0.10 0.00 0.00 0.00 0.00 175.76 174.77 1rkd s THR 64 N 0.53 2.44 0.31 0.00 -1.32 -0.04 -3.98 115.64 113.58 1rkd s THR 64 Ca -0.10 -1.85 -0.02 0.00 -1.21 0.00 0.00 61.69 58.51 1rkd s THR 64 Cb -0.13 -2.92 0.07 0.00 -1.51 0.00 0.00 72.50 68.01 1rkd s THR 64 CO 0.02 -0.09 0.43 0.61 -2.21 0.00 0.00 174.62 173.37 1rkd n GLY 65 N -1.08 0.16 1.30 6.08 0.00 -1.26 -0.92 105.19 109.47 1rkd n GLY 65 Ca -0.03 -1.90 -0.05 0.00 0.00 0.00 0.00 46.02 44.04 1rkd n GLY 65 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rkd n ASP 66 N -3.07 2.97 -3.77 1.61 5.75 -0.32 -4.22 116.55 115.51 1rkd n ASP 66 Ca 0.06 -3.61 -0.30 0.00 -0.01 0.00 0.00 54.79 50.94 1rkd n ASP 66 Cb 0.23 -0.65 0.25 0.00 -1.03 0.00 0.00 41.12 39.92 1rkd n ASP 66 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 1rkd s ASP 67 N -2.21 0.57 0.17 -1.12 1.47 -1.26 -4.75 116.67 109.54 1rkd s ASP 67 Ca 0.46 0.69 -0.12 0.00 1.18 0.00 0.00 52.55 54.77 1rkd s ASP 67 Cb 0.41 -0.97 0.06 0.00 -0.34 0.00 0.00 42.92 42.07 1rkd s ASP 67 CO 0.03 -4.34 1.67 0.28 0.68 0.00 0.00 175.17 173.50 1rkd h SER 68 N -2.73 0.87 -0.09 2.11 0.02 -1.97 -2.06 113.55 109.70 1rkd h SER 68 Ca -0.45 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.18 1rkd h SER 68 Cb 1.30 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 1rkd h SER 68 CO 0.34 0.88 -0.18 -0.29 -1.14 0.00 0.00 176.83 176.43 1rkd h ILE 69 N 0.82 1.24 -0.56 3.27 2.10 -1.94 -2.27 117.51 120.17 1rkd h ILE 69 Ca 0.18 -1.11 -0.05 0.00 1.08 0.00 0.00 64.86 64.96 1rkd h ILE 69 Cb 0.35 1.24 -0.03 0.00 -1.09 0.00 0.00 36.82 37.29 1rkd h ILE 69 CO 0.00 0.36 0.15 1.23 -1.08 0.00 0.00 178.15 178.81 1rkd h GLY 70 N 0.96 0.92 1.38 8.18 0.00 -1.67 -1.06 103.07 111.79 1rkd h GLY 70 Ca 0.07 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1rkd h GLY 70 CO 0.04 0.49 -0.07 1.18 0.00 0.00 0.00 176.54 178.18 1rkd n GLU 71 N -4.28 0.41 -0.02 4.80 -0.58 -0.81 -3.44 120.64 116.73 1rkd n GLU 71 Ca 0.04 -0.08 0.04 0.00 -0.42 0.00 0.00 57.16 56.74 1rkd n GLU 71 Cb 0.22 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.49 1rkd n GLU 71 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1rkd n SER 72 N -1.23 2.05 0.03 1.62 7.64 -0.80 -4.78 113.62 118.15 1rkd n SER 72 Ca 0.13 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.92 1rkd n SER 72 Cb 0.28 1.40 0.06 0.00 -1.01 0.00 0.00 64.21 64.94 1rkd n SER 72 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1rkd h VAL 73 N 0.00 1.34 -0.62 0.44 3.04 -1.24 -2.88 116.25 116.33 1rkd h VAL 73 Ca -0.08 -1.88 -0.05 0.00 -1.01 0.00 0.00 66.70 63.68 1rkd h VAL 73 Cb 0.86 1.87 -0.03 0.00 -2.01 0.00 0.00 31.29 31.98 1rkd h VAL 73 CO 0.00 0.58 0.17 0.03 -1.01 0.00 0.00 177.57 177.34 1rkd h ARG 74 N 0.36 0.95 -0.63 4.17 3.08 -1.86 0.96 114.38 121.40 1rkd h ARG 74 Ca -0.00 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 1rkd h ARG 74 Cb 1.13 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.01 1rkd h ARG 74 CO 0.11 0.83 0.16 1.96 -1.07 0.00 0.00 179.97 181.96 1rkd h GLN 75 N 0.91 0.99 -0.10 0.04 7.50 -1.88 0.31 115.11 122.88 1rkd h GLN 75 Ca 0.20 -0.22 -0.03 0.00 0.50 0.00 0.00 58.65 59.10 1rkd h GLN 75 Cb 0.30 -0.14 -0.00 0.00 0.05 0.00 0.00 27.48 27.69 1rkd h GLN 75 CO -0.00 0.88 -0.07 0.37 -1.50 0.00 0.00 178.83 178.51 1rkd h GLN 76 N 0.95 0.22 -0.90 1.46 5.75 -1.04 -3.26 115.11 118.29 1rkd h GLN 76 Ca 0.20 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 1rkd h GLN 76 Cb 0.33 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.84 1rkd h GLN 76 CO -0.00 0.60 0.52 -0.07 -2.65 0.00 0.00 178.83 177.23 1rkd h LEU 77 N -0.16 1.09 -1.69 -2.39 3.38 -0.58 -2.40 115.31 112.56 1rkd h LEU 77 Ca 0.02 -0.08 0.21 0.00 0.09 0.00 0.00 57.88 58.12 1rkd h LEU 77 Cb 0.54 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1rkd h LEU 77 CO 0.02 0.85 0.58 0.00 0.09 0.00 0.00 178.44 179.98 1rkd h ALA 78 N 1.33 2.39 0.00 1.53 0.00 -0.98 -0.03 119.26 123.51 1rkd h ALA 78 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1rkd h ALA 78 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1rkd h ALA 78 CO -0.06 -0.65 0.00 0.25 0.00 0.00 0.00 179.25 178.79 1rkd n THR 79 N -4.43 0.60 -0.55 0.00 -2.24 -0.90 -2.47 114.28 104.29 1rkd n THR 79 Ca 0.18 0.15 -0.07 0.00 -2.27 0.00 0.00 64.05 62.04 1rkd n THR 79 Cb 0.74 -0.81 0.22 0.00 -2.10 0.00 0.00 70.33 68.38 1rkd n THR 79 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1rkd n ASP 80 N -1.46 4.05 -3.39 3.42 8.00 -0.02 -4.88 116.55 122.26 1rkd n ASP 80 Ca 0.06 -2.96 -0.22 0.00 0.71 0.00 0.00 54.79 52.37 1rkd n ASP 80 Cb 0.22 -0.70 0.07 0.00 -0.02 0.00 0.00 41.12 40.69 1rkd n ASP 80 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1rkd n ASN 81 N -0.16 -6.02 -4.36 -2.24 3.02 -1.03 -3.59 115.26 100.88 1rkd n ASN 81 Ca 0.33 -0.51 -0.33 0.00 -0.03 0.00 0.00 54.58 54.05 1rkd n ASN 81 Cb 1.18 -4.74 -0.15 0.00 -0.61 0.00 0.00 39.78 35.46 1rkd n ASN 81 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1rkd s ILE 82 N -3.30 2.83 -0.47 2.41 1.01 -1.23 -4.42 121.20 118.03 1rkd s ILE 82 Ca 0.54 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 60.14 1rkd s ILE 82 Cb -0.24 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 40.11 1rkd s ILE 82 CO 0.68 0.55 1.13 -0.62 0.00 0.00 0.00 174.94 176.68 1rkd s ASP 83 N 0.08 6.63 -0.14 3.58 -1.08 -0.40 -4.27 116.67 121.06 1rkd s ASP 83 Ca -0.07 0.46 0.15 0.00 -0.52 0.00 0.00 52.55 52.58 1rkd s ASP 83 Cb -0.15 -2.55 0.70 0.00 -1.46 0.00 0.00 42.92 39.46 1rkd s ASP 83 CO 0.05 -1.24 1.59 2.30 0.52 0.00 0.00 175.17 178.39 1rkd n ILE 84 N 6.81 1.97 -0.27 4.11 -6.64 -1.26 -1.99 119.36 122.09 1rkd n ILE 84 Ca 0.12 -1.15 0.05 0.00 -1.77 0.00 0.00 62.75 60.00 1rkd n ILE 84 Cb 0.49 -0.05 0.19 0.00 -1.44 0.00 0.00 39.64 38.83 1rkd n ILE 84 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 1rkd h THR 85 N 3.73 0.74 -0.28 7.28 2.02 -1.89 -0.63 112.91 123.89 1rkd h THR 85 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1rkd h THR 85 Cb 1.53 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1rkd h THR 85 CO 0.30 0.10 0.00 -0.81 0.37 0.00 0.00 175.52 175.48 1rkd n PRO 86 N -4.90 2.62 -3.07 6.66 -0.05 -1.25 -4.71 135.00 130.29 1rkd n PRO 86 Ca 0.15 -1.42 -0.42 0.00 -0.05 0.00 0.00 63.50 61.76 1rkd n PRO 86 Cb 0.38 -1.74 -0.06 0.00 -0.05 0.00 0.00 33.50 32.03 1rkd n PRO 86 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 175.50 175.53 1rkd s VAL 87 N -1.76 4.81 0.21 0.52 1.01 -0.24 -2.61 120.40 122.32 1rkd s VAL 87 Ca 0.25 0.40 -0.09 0.00 0.00 0.00 0.00 61.98 62.54 1rkd s VAL 87 Cb 0.18 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.31 1rkd s VAL 87 CO 0.09 -0.50 0.52 -0.44 0.00 0.00 0.00 175.10 174.76 1rkd s SER 88 N 1.94 6.62 -0.23 3.32 0.01 0.34 -4.94 113.70 120.75 1rkd s SER 88 Ca 0.25 0.87 -0.06 0.00 1.31 0.00 0.00 55.95 58.32 1rkd s SER 88 Cb -0.14 -2.21 -0.03 0.00 0.21 0.00 0.00 66.02 63.86 1rkd s SER 88 CO 0.18 -0.03 0.04 -0.69 0.41 0.00 0.00 173.24 173.15 1rkd s VAL 89 N -1.75 4.12 -0.41 3.43 1.01 -1.26 -0.86 120.40 124.68 1rkd s VAL 89 Ca 0.45 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 62.02 1rkd s VAL 89 Cb -0.12 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.37 1rkd s VAL 89 CO 0.21 0.37 0.47 -0.63 0.00 0.00 0.00 175.10 175.53 1rkd s ILE 90 N 1.45 5.04 0.39 2.22 -1.09 -0.10 -4.94 121.20 124.17 1rkd s ILE 90 Ca 0.05 -0.16 -0.25 0.00 -2.23 0.00 0.00 60.65 58.07 1rkd s ILE 90 Cb -0.15 -4.04 -0.09 0.00 -1.58 0.00 0.00 42.46 36.61 1rkd s ILE 90 CO 0.02 -0.40 1.11 -0.54 -1.23 0.00 0.00 174.94 173.90 1rkd s LYS 91 N 2.27 4.13 0.00 2.79 1.02 -1.26 -3.00 119.74 125.69 1rkd s LYS 91 Ca 0.15 1.69 0.00 0.00 0.02 0.00 0.00 55.97 57.83 1rkd s LYS 91 Cb -0.16 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.50 1rkd s LYS 91 CO 0.14 -0.21 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 1rkd n GLY 92 N 0.55 0.62 3.15 -3.33 0.00 -1.26 -4.96 105.19 99.97 1rkd n GLY 92 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1rkd n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rkd s GLU 93 N -0.22 0.78 0.10 1.61 2.02 -1.20 -5.04 118.70 116.76 1rkd s GLU 93 Ca 0.00 -1.20 0.04 0.00 0.02 0.00 0.00 54.97 53.82 1rkd s GLU 93 Cb 0.00 -0.27 -0.04 0.00 0.10 0.00 0.00 34.13 33.92 1rkd s GLU 93 CO 0.00 0.01 0.08 -1.12 0.02 0.00 0.00 175.26 174.25 1rkd s SER 94 N -2.69 5.46 0.55 -0.19 0.01 -1.26 -1.17 113.70 114.41 1rkd s SER 94 Ca 0.07 -0.06 -0.21 0.00 1.31 0.00 0.00 55.95 57.06 1rkd s SER 94 Cb 0.01 -1.44 -0.05 0.00 0.21 0.00 0.00 66.02 64.76 1rkd s SER 94 CO -0.03 0.15 1.31 -0.89 0.41 0.00 0.00 173.24 174.19 1rkd s THR 95 N -1.48 2.24 0.75 1.44 2.01 -1.26 -0.91 115.64 118.43 1rkd s THR 95 Ca 0.29 0.17 -0.16 0.00 0.31 0.00 0.00 61.69 62.31 1rkd s THR 95 Cb -0.12 -3.08 -0.01 0.00 0.01 0.00 0.00 72.50 69.30 1rkd s THR 95 CO 0.22 -0.01 0.68 0.61 -0.69 0.00 0.00 174.62 175.43 1rkd n GLY 96 N 0.70 -1.19 3.20 4.40 0.00 -1.22 -4.66 105.19 106.41 1rkd n GLY 96 Ca 0.11 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 1rkd n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rkd s VAL 97 N -1.95 1.35 -0.03 1.61 1.01 -0.54 -1.01 120.40 120.84 1rkd s VAL 97 Ca 0.67 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 61.49 1rkd s VAL 97 Cb -0.33 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 1rkd s VAL 97 CO 0.56 -0.02 -0.20 0.00 0.00 0.00 0.00 175.10 175.45 1rkd s ALA 98 N -1.00 1.70 -0.22 5.51 0.00 -0.62 -0.79 121.76 126.34 1rkd s ALA 98 Ca 0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 51.11 1rkd s ALA 98 Cb -0.09 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 1rkd s ALA 98 CO 0.02 0.37 -0.04 -0.51 0.00 0.00 0.00 175.76 175.60 1rkd s LEU 99 N -0.29 2.91 -0.04 0.00 1.43 -0.27 -0.05 118.68 122.36 1rkd s LEU 99 Ca 0.03 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1rkd s LEU 99 Cb -0.10 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.39 1rkd s LEU 99 CO 0.01 -0.01 -0.13 -0.63 0.23 0.00 0.00 176.35 175.82 1rkd s ILE 100 N 1.41 1.15 -0.10 -0.59 1.01 0.28 -1.43 121.20 122.93 1rkd s ILE 100 Ca 0.05 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 1rkd s ILE 100 Cb -0.14 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 1rkd s ILE 100 CO -0.03 0.34 -0.06 -0.36 0.00 0.00 0.00 174.94 174.84 1rkd s PHE 101 N 0.25 2.97 -0.19 3.97 0.08 -0.89 -1.09 117.98 123.08 1rkd s PHE 101 Ca -0.06 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 56.88 1rkd s PHE 101 Cb -0.12 -1.80 0.02 0.00 -0.57 0.00 0.00 43.02 40.55 1rkd s PHE 101 CO 0.02 0.18 -0.19 0.08 -0.10 0.00 0.00 175.22 175.21 1rkd s VAL 102 N -0.35 2.06 0.88 -0.44 1.01 -0.33 -1.58 120.40 121.64 1rkd s VAL 102 Ca 0.05 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1rkd s VAL 102 Cb -0.12 -1.88 0.19 0.00 0.00 0.00 0.00 36.38 34.57 1rkd s VAL 102 CO 0.02 0.50 1.20 -0.46 0.00 0.00 0.00 175.10 176.36 1rkd n ASN 103 N 4.61 0.52 0.20 3.32 0.23 0.49 -1.24 115.26 123.39 1rkd n ASN 103 Ca -0.20 -1.70 0.06 0.00 -0.53 0.00 0.00 54.58 52.21 1rkd n ASN 103 Cb 0.49 -0.88 0.53 0.00 -2.08 0.00 0.00 39.78 37.84 1rkd n ASN 103 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1rkd h GLY 104 N -1.34 0.10 1.25 4.83 0.00 -0.52 -0.18 103.07 107.22 1rkd h GLY 104 Ca -0.39 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1rkd h GLY 104 CO 0.32 0.05 -0.08 1.18 0.00 0.00 0.00 176.54 178.00 1rkd n GLU 105 N -4.42 0.49 -0.27 4.80 1.02 -1.26 -4.91 120.64 116.08 1rkd n GLU 105 Ca -0.02 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1rkd n GLU 105 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1rkd n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rkd n GLY 106 N 1.31 0.82 3.90 0.62 0.00 -0.08 -4.79 105.19 106.98 1rkd n GLY 106 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1rkd n GLY 106 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rkd s GLU 107 N -0.73 3.44 0.13 1.61 2.56 -1.26 -1.52 118.70 122.94 1rkd s GLU 107 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 54.97 55.33 1rkd s GLU 107 Cb 0.00 -2.25 -0.04 0.00 2.00 0.00 0.00 34.13 33.83 1rkd s GLU 107 CO 0.00 -0.43 -0.01 0.54 -0.56 0.00 0.00 175.26 174.81 1rkd s ASN 108 N -4.17 0.94 -0.02 -1.70 4.22 -1.26 -0.38 114.94 112.57 1rkd s ASN 108 Ca 0.51 -1.13 0.03 0.00 -2.14 0.00 0.00 52.86 50.13 1rkd s ASN 108 Cb -0.11 0.16 -0.00 0.00 1.28 0.00 0.00 41.25 42.58 1rkd s ASN 108 CO 0.48 -0.58 -0.10 0.68 -2.04 0.00 0.00 177.10 175.54 1rkd s VAL 109 N -3.76 0.86 -0.02 3.54 -7.23 -0.61 -4.99 120.40 108.18 1rkd s VAL 109 Ca 0.20 -0.42 0.03 0.00 -1.81 0.00 0.00 61.98 59.97 1rkd s VAL 109 Cb 0.06 -0.74 -0.00 0.00 0.56 0.00 0.00 36.38 36.26 1rkd s VAL 109 CO 0.00 0.26 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.31 1rkd s ILE 110 N 0.03 0.89 -0.11 -0.62 1.01 -1.26 -2.09 121.20 119.06 1rkd s ILE 110 Ca -0.01 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1rkd s ILE 110 Cb -0.07 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.64 1rkd s ILE 110 CO 0.00 0.27 -0.18 -0.83 0.00 0.00 0.00 174.94 174.20 1rkd s GLY 111 N -0.01 1.13 0.22 6.18 0.00 -0.52 -5.00 107.32 109.32 1rkd s GLY 111 Ca -0.00 -0.81 0.10 0.00 0.00 0.00 0.00 44.72 44.01 1rkd s GLY 111 CO 0.00 0.06 -0.10 -0.26 0.00 0.00 0.00 173.10 172.80 1rkd s ILE 112 N 0.79 3.06 -0.13 0.90 -4.36 -1.26 -1.12 121.20 119.08 1rkd s ILE 112 Ca -0.10 -1.89 0.01 0.00 -0.26 0.00 0.00 60.65 58.41 1rkd s ILE 112 Cb -0.16 -2.56 0.02 0.00 1.25 0.00 0.00 42.46 41.01 1rkd s ILE 112 CO 0.01 -0.23 -0.14 -2.28 0.24 0.00 0.00 174.94 172.54 1rkd s HIS 113 N -2.00 2.03 0.15 1.37 5.65 0.03 -5.00 115.29 117.52 1rkd s HIS 113 Ca 0.27 -1.05 -0.17 0.00 0.25 0.00 0.00 55.06 54.35 1rkd s HIS 113 Cb -0.07 -1.49 0.03 0.00 -1.18 0.00 0.00 32.58 29.87 1rkd s HIS 113 CO 0.16 -0.57 1.73 0.00 -0.65 0.00 0.00 174.74 175.41 1rkd h ALA 114 N 7.77 0.32 -0.73 1.58 0.00 -1.96 -1.44 119.26 124.79 1rkd h ALA 114 Ca -0.34 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1rkd h ALA 114 Cb 1.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1rkd h ALA 114 CO 0.50 -0.35 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1rkd n GLY 115 N -1.21 2.69 0.09 0.00 0.00 -1.26 -1.70 105.19 103.81 1rkd n GLY 115 Ca 0.00 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1rkd n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rkd n ALA 116 N 8.47 1.39 0.13 4.61 0.00 -0.09 -1.59 120.51 133.44 1rkd n ALA 116 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.55 1rkd n ALA 116 Cb 0.00 -1.28 0.42 0.00 0.00 0.00 0.00 19.45 18.59 1rkd n ALA 116 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1rkd h ASN 117 N 0.00 0.21 0.20 0.00 2.35 -1.46 -1.32 115.58 115.56 1rkd h ASN 117 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1rkd h ASN 117 Cb 0.19 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1rkd h ASN 117 CO 0.00 0.34 0.00 0.00 -1.65 0.00 0.00 177.43 176.12 1rkd n ALA 118 N -2.49 1.49 1.14 -0.83 0.00 -0.62 -2.34 120.51 116.86 1rkd n ALA 118 Ca -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.52 1rkd n ALA 118 Cb 0.24 -1.13 0.30 0.00 0.00 0.00 0.00 19.45 18.85 1rkd n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rkd n ALA 119 N -1.36 3.33 -2.42 0.00 0.00 -0.50 -4.66 120.51 114.91 1rkd n ALA 119 Ca 0.03 -0.41 -0.39 0.00 0.00 0.00 0.00 53.44 52.67 1rkd n ALA 119 Cb 0.08 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 1rkd n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1rkd s LEU 120 N -2.69 3.26 0.49 0.00 0.20 -0.99 -4.90 118.68 114.05 1rkd s LEU 120 Ca 0.19 -0.54 0.08 0.00 0.69 0.00 0.00 54.13 54.55 1rkd s LEU 120 Cb 0.18 -2.56 0.03 0.00 -0.43 0.00 0.00 46.19 43.42 1rkd s LEU 120 CO 0.60 -1.94 0.54 -0.94 -0.29 0.00 0.00 176.35 174.31 1rkd s SER 121 N 5.19 5.06 0.40 3.68 1.04 -1.26 -4.47 113.70 123.34 1rkd s SER 121 Ca 0.46 -0.84 0.09 0.00 0.48 0.00 0.00 55.95 56.14 1rkd s SER 121 Cb -0.07 -0.09 0.88 0.00 0.10 0.00 0.00 66.02 66.84 1rkd s SER 121 CO 0.09 -0.98 2.01 -0.65 0.98 0.00 0.00 173.24 174.69 1rkd h PRO 122 N 0.65 0.55 -0.29 4.02 0.11 -1.91 -0.33 132.00 134.80 1rkd h PRO 122 Ca -0.37 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.59 1rkd h PRO 122 Cb 1.28 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1rkd h PRO 122 CO 0.50 0.36 -0.31 0.00 -0.21 0.00 0.00 178.00 178.35 1rkd h ALA 123 N 1.69 0.92 -0.02 -0.75 0.00 -1.97 0.27 119.26 119.41 1rkd h ALA 123 Ca 0.23 -0.39 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1rkd h ALA 123 Cb 0.21 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1rkd h ALA 123 CO -0.06 0.62 -0.72 -0.07 0.00 0.00 0.00 179.25 179.02 1rkd h LEU 124 N 0.52 0.13 -0.40 0.00 3.38 -1.56 -1.67 115.31 115.71 1rkd h LEU 124 Ca 0.06 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1rkd h LEU 124 Cb 0.79 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1rkd h LEU 124 CO 0.06 0.80 0.09 0.58 0.09 0.00 0.00 178.44 180.07 1rkd h VAL 125 N 0.07 1.23 -0.29 1.22 2.07 -0.72 -3.07 116.25 116.78 1rkd h VAL 125 Ca -0.02 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 1rkd h VAL 125 Cb 1.27 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1rkd h VAL 125 CO 0.10 0.28 -0.05 -0.08 0.02 0.00 0.00 177.57 177.85 1rkd h GLU 126 N 0.51 0.45 0.00 1.57 4.57 -0.67 0.48 114.58 121.48 1rkd h GLU 126 Ca 0.13 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1rkd h GLU 126 Cb 0.33 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1rkd h GLU 126 CO 0.00 0.51 0.00 0.00 -1.18 0.00 0.00 179.01 178.35 1rkd h ALA 127 N 1.53 1.00 -0.36 2.92 0.00 -1.22 -1.95 119.26 121.18 1rkd h ALA 127 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rkd h ALA 127 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rkd h ALA 127 CO 0.02 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.31 1rkd n GLN 128 N -2.38 3.29 -0.17 0.00 1.13 0.16 -4.77 117.38 114.66 1rkd n GLN 128 Ca -0.00 -2.76 -0.02 0.00 -1.94 0.00 0.00 57.00 52.28 1rkd n GLN 128 Cb 0.13 -1.81 0.07 0.00 0.11 0.00 0.00 30.24 28.74 1rkd n GLN 128 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1rkd h ARG 129 N 2.41 0.15 -0.68 -1.09 2.43 -1.11 -1.05 114.38 115.44 1rkd h ARG 129 Ca 0.00 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1rkd h ARG 129 Cb 1.40 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.89 1rkd h ARG 129 CO 0.23 0.10 0.23 1.49 -1.51 0.00 0.00 179.97 180.51 1rkd h GLU 130 N 0.16 1.04 -0.56 0.20 4.81 -1.86 0.82 114.58 119.20 1rkd h GLU 130 Ca 0.27 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1rkd h GLU 130 Cb 0.39 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1rkd h GLU 130 CO -0.40 0.89 0.34 -0.09 -0.73 0.00 0.00 179.01 179.02 1rkd h ARG 131 N 0.98 0.75 -0.28 1.92 2.43 -1.72 -0.65 114.38 117.81 1rkd h ARG 131 Ca 0.22 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 1rkd h ARG 131 Cb 0.27 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1rkd h ARG 131 CO -0.01 0.54 -0.29 0.82 -1.51 0.00 0.00 179.97 179.52 1rkd h ILE 132 N 0.75 1.30 -0.70 1.20 2.04 -0.91 -2.53 117.51 118.66 1rkd h ILE 132 Ca 0.20 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.59 1rkd h ILE 132 Cb -0.02 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1rkd h ILE 132 CO -0.04 0.47 0.37 0.00 0.00 0.00 0.00 178.15 178.94 1rkd h ALA 133 N 0.70 1.33 0.00 1.87 0.00 -0.64 -2.53 119.26 119.99 1rkd h ALA 133 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rkd h ALA 133 Cb 0.86 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1rkd h ALA 133 CO 0.07 0.54 -0.03 -0.91 0.00 0.00 0.00 179.25 178.92 1rkd h ASN 134 N 0.98 0.00 -4.29 0.00 2.35 -1.10 -3.45 115.58 110.07 1rkd h ASN 134 Ca 0.25 -0.01 -0.50 0.00 -0.55 0.00 0.00 56.30 55.49 1rkd h ASN 134 Cb 0.05 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.49 1rkd h ASN 134 CO -0.04 0.00 0.38 0.00 -1.65 0.00 0.00 177.43 176.13 1rkd s ALA 135 N -3.12 2.79 -0.01 -0.83 0.00 -0.96 -4.85 121.76 114.78 1rkd s ALA 135 Ca 0.10 0.14 0.12 0.00 0.00 0.00 0.00 51.96 52.32 1rkd s ALA 135 Cb 0.11 -3.17 -0.18 0.00 0.00 0.00 0.00 23.12 19.88 1rkd s ALA 135 CO 0.61 -0.95 0.98 0.77 0.00 0.00 0.00 175.76 177.17 1rkd h SER 136 N -0.22 0.00 -5.04 0.00 0.02 -1.06 -3.41 113.55 103.83 1rkd h SER 136 Ca -0.45 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.40 1rkd h SER 136 Cb 1.21 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.57 1rkd h SER 136 CO 0.58 0.88 -0.25 0.00 -1.14 0.00 0.00 176.83 176.91 1rkd s ALA 137 N -2.72 -0.72 -0.12 3.77 0.00 -1.01 -1.71 121.76 119.25 1rkd s ALA 137 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1rkd s ALA 137 Cb 0.09 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.50 1rkd s ALA 137 CO 0.81 -0.38 -0.11 -1.17 0.00 0.00 0.00 175.76 174.91 1rkd s LEU 138 N -1.91 1.48 -0.16 0.00 2.96 0.77 -1.29 118.68 120.54 1rkd s LEU 138 Ca -0.07 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1rkd s LEU 138 Cb -0.02 -1.00 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 1rkd s LEU 138 CO -0.02 -0.07 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.62 1rkd s LEU 139 N 1.45 2.75 0.10 -0.68 2.96 0.63 -0.73 118.68 125.17 1rkd s LEU 139 Ca 0.02 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1rkd s LEU 139 Cb -0.13 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 1rkd s LEU 139 CO -0.07 0.11 -0.04 -0.04 -1.32 0.00 0.00 176.35 174.98 1rkd s MET 140 N 0.70 0.85 0.00 1.98 -1.94 -0.46 -1.57 119.30 118.86 1rkd s MET 140 Ca -0.05 -1.35 0.00 0.00 -1.71 0.00 0.00 55.69 52.57 1rkd s MET 140 Cb -0.15 -0.12 0.00 0.00 2.01 0.00 0.00 34.83 36.56 1rkd s MET 140 CO 0.02 -0.06 0.00 1.04 -0.01 0.00 0.00 175.02 176.01 1rkd n GLN 141 N -0.05 1.32 -1.11 2.03 3.00 -1.26 -0.50 117.38 120.82 1rkd n GLN 141 Ca -0.11 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.81 1rkd n GLN 141 Cb 0.61 0.00 0.14 0.00 0.00 0.00 0.00 30.24 31.00 1rkd n GLN 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1rkd n LEU 142 N 0.00 3.82 -1.20 1.08 4.77 0.23 -4.48 117.00 121.22 1rkd n LEU 142 Ca 0.00 -4.17 0.09 0.00 -0.03 0.00 0.00 56.01 51.91 1rkd n LEU 142 Cb 0.00 -0.50 0.28 0.00 -2.33 0.00 0.00 43.42 40.87 1rkd n LEU 142 CO 0.00 1.61 0.74 -0.62 -1.33 0.00 0.00 177.39 177.79 1rkd n GLU 143 N -0.99 3.06 -4.37 3.23 1.02 -1.25 -4.42 120.64 116.91 1rkd n GLU 143 Ca 0.31 -2.58 -0.26 0.00 -0.02 0.00 0.00 57.16 54.61 1rkd n GLU 143 Cb 0.84 -1.59 -0.12 0.00 -0.02 0.00 0.00 31.44 30.54 1rkd n GLU 143 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1rkd s SER 144 N -1.03 3.07 0.23 1.62 0.01 -1.26 -4.49 113.70 111.84 1rkd s SER 144 Ca 0.42 -0.80 -0.31 0.00 1.31 0.00 0.00 55.95 56.58 1rkd s SER 144 Cb 0.24 -0.20 -0.15 0.00 0.21 0.00 0.00 66.02 66.13 1rkd s SER 144 CO 0.25 0.09 1.19 -2.65 0.41 0.00 0.00 173.24 172.53 1rkd n PRO 145 N 0.61 1.46 -0.33 12.44 -0.02 -1.26 -4.83 135.00 143.07 1rkd n PRO 145 Ca -0.15 0.52 0.09 0.00 -2.02 0.00 0.00 63.50 61.93 1rkd n PRO 145 Cb 0.55 -2.02 0.29 0.00 -0.02 0.00 0.00 33.50 32.30 1rkd n PRO 145 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1rkd h LEU 146 N 3.17 0.83 -1.19 2.45 5.85 -1.96 -0.18 115.31 124.29 1rkd h LEU 146 Ca -0.43 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.29 1rkd h LEU 146 Cb 1.32 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1rkd h LEU 146 CO 0.69 0.43 0.07 -0.33 -0.34 0.00 0.00 178.44 178.96 1rkd h GLU 147 N 0.88 0.63 -0.12 1.25 3.07 -1.96 0.03 114.58 118.36 1rkd h GLU 147 Ca 0.48 -0.12 -0.23 0.00 -0.50 0.00 0.00 59.36 58.99 1rkd h GLU 147 Cb 0.58 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1rkd h GLU 147 CO -0.25 0.60 -0.82 0.77 -1.40 0.00 0.00 179.01 177.92 1rkd h SER 148 N 0.62 0.91 -0.38 1.42 0.02 -1.33 0.29 113.55 115.09 1rkd h SER 148 Ca 0.14 -0.61 0.04 0.00 -0.84 0.00 0.00 61.79 60.52 1rkd h SER 148 Cb 0.28 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 1rkd h SER 148 CO 0.00 1.41 0.14 0.58 -1.14 0.00 0.00 176.83 177.82 1rkd h VAL 149 N 0.50 0.89 -0.55 2.27 2.07 -0.92 -0.53 116.25 119.99 1rkd h VAL 149 Ca -0.06 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1rkd h VAL 149 Cb 1.45 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1rkd h VAL 149 CO 0.17 0.05 0.28 0.24 0.02 0.00 0.00 177.57 178.32 1rkd h MET 150 N 0.29 0.78 -0.95 1.57 2.86 -0.93 0.20 114.93 118.74 1rkd h MET 150 Ca 0.17 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1rkd h MET 150 Cb 0.15 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.62 1rkd h MET 150 CO -0.17 0.62 0.58 0.00 1.06 0.00 0.00 176.91 179.00 1rkd h ALA 151 N 1.11 1.22 -0.03 6.32 0.00 -0.67 -1.81 119.26 125.39 1rkd h ALA 151 Ca 0.19 -0.10 -0.24 0.00 0.00 0.00 0.00 54.91 54.76 1rkd h ALA 151 Cb 0.09 -0.38 0.01 0.00 0.00 0.00 0.00 17.79 17.51 1rkd h ALA 151 CO -0.03 0.67 -0.93 0.00 0.00 0.00 0.00 179.25 178.96 1rkd h ALA 152 N 1.32 0.29 -0.95 0.00 0.00 -0.68 -2.64 119.26 116.60 1rkd h ALA 152 Ca 0.34 -0.68 0.01 0.00 0.00 0.00 0.00 54.91 54.59 1rkd h ALA 152 Cb -0.06 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1rkd h ALA 152 CO -0.06 0.74 0.63 0.00 0.00 0.00 0.00 179.25 180.56 1rkd h ALA 153 N 0.60 1.21 -0.31 0.00 0.00 -0.83 -0.77 119.26 119.16 1rkd h ALA 153 Ca -0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1rkd h ALA 153 Cb 1.57 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1rkd h ALA 153 CO 0.18 0.59 0.15 -0.22 0.00 0.00 0.00 179.25 179.95 1rkd h LYS 154 N 1.28 0.44 -0.57 0.00 3.64 -1.18 0.23 116.57 120.41 1rkd h LYS 154 Ca 0.35 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1rkd h LYS 154 Cb -0.14 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 1rkd h LYS 154 CO -0.08 0.41 0.37 0.82 -2.27 0.00 0.00 179.45 178.70 1rkd h ILE 155 N 0.36 1.15 -0.07 2.00 2.04 -1.16 -1.49 117.51 120.33 1rkd h ILE 155 Ca 0.11 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1rkd h ILE 155 Cb 0.11 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1rkd h ILE 155 CO -0.01 0.15 0.03 0.00 0.00 0.00 0.00 178.15 178.31 1rkd h ALA 156 N 1.20 0.10 -0.55 1.87 0.00 -0.74 -2.49 119.26 118.66 1rkd h ALA 156 Ca 0.21 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.13 1rkd h ALA 156 Cb -0.07 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 1rkd h ALA 156 CO -0.04 -0.32 0.06 1.25 0.00 0.00 0.00 179.25 180.20 1rkd h HIS 157 N -0.03 0.08 -0.50 0.00 -0.00 -0.30 -0.98 115.15 113.42 1rkd h HIS 157 Ca 0.02 0.04 0.02 0.00 -0.00 0.00 0.00 60.37 60.45 1rkd h HIS 157 Cb 0.16 0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.59 1rkd h HIS 157 CO -0.02 -0.07 0.33 1.96 -0.00 0.00 0.00 177.93 180.13 1rkd h GLN 158 N 0.18 0.59 -0.60 5.26 4.20 -1.08 -3.04 115.11 120.62 1rkd h GLN 158 Ca 0.28 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1rkd h GLN 158 Cb 0.42 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1rkd h GLN 158 CO -0.41 0.39 0.00 0.09 -0.67 0.00 0.00 178.83 178.23 1rkd n ASN 159 N -4.47 4.05 -1.79 1.46 3.02 -0.50 -4.96 115.26 112.07 1rkd n ASN 159 Ca 0.05 -2.21 -0.16 0.00 -0.03 0.00 0.00 54.58 52.23 1rkd n ASN 159 Cb 0.11 -0.47 -0.01 0.00 -0.61 0.00 0.00 39.78 38.79 1rkd n ASN 159 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rkd n LYS 160 N 1.13 -1.27 -3.08 3.52 5.02 -0.71 -4.95 118.16 117.82 1rkd n LYS 160 Ca 0.22 0.79 -0.40 0.00 -2.02 0.00 0.00 58.31 56.91 1rkd n LYS 160 Cb 0.70 -5.17 -0.05 0.00 -0.02 0.00 0.00 35.03 30.49 1rkd n LYS 160 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rkd s THR 161 N -2.79 5.04 0.22 -0.18 2.01 -0.49 -4.96 115.64 114.49 1rkd s THR 161 Ca 0.00 1.34 -0.31 0.00 0.31 0.00 0.00 61.69 63.03 1rkd s THR 161 Cb 0.00 -4.00 -0.11 0.00 0.01 0.00 0.00 72.50 68.40 1rkd s THR 161 CO 0.00 0.20 1.60 -0.63 -0.69 0.00 0.00 174.62 175.10 1rkd s ILE 162 N 1.21 2.32 -0.30 1.82 1.01 -0.69 -4.24 121.20 122.32 1rkd s ILE 162 Ca 0.34 0.25 -0.09 0.00 0.00 0.00 0.00 60.65 61.15 1rkd s ILE 162 Cb -0.17 -3.16 -0.00 0.00 0.01 0.00 0.00 42.46 39.14 1rkd s ILE 162 CO 0.15 0.03 0.13 -0.69 0.00 0.00 0.00 174.94 174.56 1rkd s VAL 163 N 0.67 4.45 -0.22 2.92 1.01 -1.26 -0.16 120.40 127.81 1rkd s VAL 163 Ca 0.68 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 1rkd s VAL 163 Cb -0.46 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1rkd s VAL 163 CO 0.38 0.08 0.00 0.00 0.00 0.00 0.00 175.10 175.56 1rkd s ALA 164 N 1.59 2.99 -0.14 5.51 0.00 0.09 -0.36 121.76 131.44 1rkd s ALA 164 Ca 0.04 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.93 1rkd s ALA 164 Cb -0.17 -1.83 0.01 0.00 0.00 0.00 0.00 23.12 21.14 1rkd s ALA 164 CO 0.05 -0.33 -0.20 -1.17 0.00 0.00 0.00 175.76 174.11 1rkd s LEU 165 N 1.33 2.00 -0.49 0.00 2.96 0.30 -1.35 118.68 123.42 1rkd s LEU 165 Ca 0.04 -0.57 -0.16 0.00 -0.22 0.00 0.00 54.13 53.22 1rkd s LEU 165 Cb -0.15 -1.36 0.07 0.00 0.50 0.00 0.00 46.19 45.26 1rkd s LEU 165 CO 0.01 0.04 0.46 0.21 -1.32 0.00 0.00 176.35 175.75 1rkd s ASN 166 N 0.97 6.17 -1.32 3.68 3.04 0.35 -1.69 114.94 126.13 1rkd s ASN 166 Ca -0.04 -1.28 -0.09 0.00 0.04 0.00 0.00 52.86 51.49 1rkd s ASN 166 Cb -0.15 -2.21 -0.10 0.00 -1.54 0.00 0.00 41.25 37.25 1rkd s ASN 166 CO -0.04 -0.73 3.03 -0.81 -3.04 0.00 0.00 177.10 175.51 1rkd n PRO 167 N 5.45 3.48 -4.70 0.43 -0.04 -1.26 -3.86 135.00 134.49 1rkd n PRO 167 Ca -0.11 -2.10 -0.23 0.00 -0.04 0.00 0.00 63.50 61.01 1rkd n PRO 167 Cb 0.44 -2.65 -0.15 0.00 -0.04 0.00 0.00 33.50 31.10 1rkd n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rkd s ALA 168 N 1.67 1.32 0.84 0.55 0.00 -1.26 -3.76 121.76 121.13 1rkd s ALA 168 Ca 0.68 -0.71 -0.11 0.00 0.00 0.00 0.00 51.96 51.82 1rkd s ALA 168 Cb 0.21 -0.32 0.10 0.00 0.00 0.00 0.00 23.12 23.10 1rkd s ALA 168 CO -0.06 0.32 1.09 -2.14 0.00 0.00 0.00 175.76 174.97 1rkd s PRO 169 N -0.49 1.70 0.29 0.00 0.02 -1.26 -0.60 135.00 134.65 1rkd s PRO 169 Ca 0.06 1.03 -0.30 0.00 0.02 0.00 0.00 61.00 61.80 1rkd s PRO 169 Cb -0.06 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.49 1rkd s PRO 169 CO -0.00 -1.99 1.40 0.00 -0.33 0.00 0.00 177.00 176.07 1rkd n ALA 170 N -3.74 1.41 -3.54 -1.55 0.00 -1.25 -4.80 120.51 107.04 1rkd n ALA 170 Ca 0.08 0.39 -0.07 0.00 0.00 0.00 0.00 53.44 53.84 1rkd n ALA 170 Cb 0.54 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 1rkd n ALA 170 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1rkd s ARG 171 N -0.96 0.61 0.47 0.00 1.70 -1.26 -5.10 118.95 114.42 1rkd s ARG 171 Ca 0.63 -0.19 -0.20 0.00 -0.47 0.00 0.00 55.73 55.50 1rkd s ARG 171 Cb -0.60 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 33.98 1rkd s ARG 171 CO 0.54 -0.26 1.00 -1.21 -1.08 0.00 0.00 175.30 174.29 1rkd s GLU 172 N -2.65 3.94 0.07 3.89 2.02 -1.26 -4.64 118.70 120.07 1rkd s GLU 172 Ca 0.06 1.23 0.07 0.00 0.02 0.00 0.00 54.97 56.34 1rkd s GLU 172 Cb -0.01 -2.13 -0.03 0.00 0.10 0.00 0.00 34.13 32.07 1rkd s GLU 172 CO -0.06 -0.30 -0.18 -0.51 0.02 0.00 0.00 175.26 174.23 1rkd s LEU 173 N -3.48 2.24 0.51 1.80 1.43 -1.26 -5.10 118.68 114.82 1rkd s LEU 173 Ca 0.64 -0.59 -0.22 0.00 -1.03 0.00 0.00 54.13 52.93 1rkd s LEU 173 Cb -0.13 -0.75 -0.06 0.00 0.03 0.00 0.00 46.19 45.28 1rkd s LEU 173 CO 0.19 0.04 1.26 -2.16 0.23 0.00 0.00 176.35 175.91 1rkd s PRO 174 N -1.57 3.39 0.51 1.29 0.04 -1.26 -4.87 135.00 132.53 1rkd s PRO 174 Ca 0.04 1.99 0.17 0.00 0.04 0.00 0.00 61.00 63.24 1rkd s PRO 174 Cb -0.09 -2.29 1.24 0.00 0.04 0.00 0.00 34.50 33.40 1rkd s PRO 174 CO 0.03 -0.92 2.09 -0.44 0.04 0.00 0.00 177.00 177.80 1rkd h ASP 175 N 1.66 0.07 -0.92 6.66 3.32 -1.99 0.58 116.42 125.80 1rkd h ASP 175 Ca -0.50 -0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.58 1rkd h ASP 175 Cb 1.28 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.76 1rkd h ASP 175 CO 0.58 0.05 0.60 -0.33 -1.72 0.00 0.00 179.24 178.42 1rkd h GLU 176 N 0.09 1.15 -0.01 3.56 3.07 -1.97 -1.55 114.58 118.91 1rkd h GLU 176 Ca 0.10 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 58.81 1rkd h GLU 176 Cb 0.29 -0.26 0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1rkd h GLU 176 CO -0.01 0.76 -0.33 1.25 -1.40 0.00 0.00 179.01 179.28 1rkd h LEU 177 N 1.18 0.30 -1.93 1.33 5.85 -1.27 -3.37 115.31 117.40 1rkd h LEU 177 Ca 0.36 -0.76 0.07 0.00 0.84 0.00 0.00 57.88 58.40 1rkd h LEU 177 Cb -0.02 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1rkd h LEU 177 CO -0.11 1.02 0.21 -0.07 -0.34 0.00 0.00 178.44 179.15 1rkd h LEU 178 N -0.39 0.08 -1.68 2.25 3.38 -1.18 -0.75 115.31 117.02 1rkd h LEU 178 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1rkd h LEU 178 Cb 1.06 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1rkd h LEU 178 CO 0.06 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.64 1rkd h ALA 179 N 1.85 1.00 -0.01 1.53 0.00 -1.32 -1.58 119.26 120.73 1rkd h ALA 179 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1rkd h ALA 179 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1rkd h ALA 179 CO -0.01 0.00 -0.38 1.28 0.00 0.00 0.00 179.25 180.14 1rkd n LEU 180 N -2.98 1.33 -4.78 0.00 4.77 -0.29 -4.85 117.00 110.21 1rkd n LEU 180 Ca -0.00 -0.42 -0.38 0.00 -0.03 0.00 0.00 56.01 55.17 1rkd n LEU 180 Cb 0.24 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1rkd n LEU 180 CO 0.24 0.25 0.21 -0.69 -1.33 0.00 0.00 177.39 176.08 1rkd s VAL 181 N -2.54 4.98 -0.17 4.08 1.01 -0.59 -4.68 120.40 122.49 1rkd s VAL 181 Ca 0.21 1.07 -0.00 0.00 0.00 0.00 0.00 61.98 63.25 1rkd s VAL 181 Cb 0.19 -3.84 -0.22 0.00 0.00 0.00 0.00 36.38 32.50 1rkd s VAL 181 CO 0.56 0.45 0.15 0.47 0.00 0.00 0.00 175.10 176.73 1rkd n ASP 182 N 2.61 1.83 -4.00 3.32 8.00 0.52 -4.34 116.55 124.50 1rkd n ASP 182 Ca -0.09 0.08 -0.27 0.00 0.71 0.00 0.00 54.79 55.22 1rkd n ASP 182 Cb 0.51 -0.51 -0.17 0.00 -0.02 0.00 0.00 41.12 40.94 1rkd n ASP 182 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rkd s ILE 183 N -2.54 1.28 -0.04 0.53 1.01 -0.36 -1.60 121.20 119.49 1rkd s ILE 183 Ca -0.25 -0.50 0.06 0.00 0.00 0.00 0.00 60.65 59.96 1rkd s ILE 183 Cb 0.08 -1.21 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 1rkd s ILE 183 CO 0.71 0.40 -0.22 -0.51 0.00 0.00 0.00 174.94 175.33 1rkd s ILE 184 N 1.17 1.79 -0.54 2.92 2.07 -0.47 -0.54 121.20 127.59 1rkd s ILE 184 Ca -0.04 -0.93 0.07 0.00 -1.41 0.00 0.00 60.65 58.34 1rkd s ILE 184 Cb -0.14 -1.51 0.28 0.00 0.13 0.00 0.00 42.46 41.21 1rkd s ILE 184 CO -0.03 0.50 0.73 0.35 -1.91 0.00 0.00 174.94 174.58 1rkd n THR 185 N 2.92 1.55 -1.91 4.00 -2.24 -0.68 -1.08 114.28 116.84 1rkd n THR 185 Ca -0.17 -4.95 -0.33 0.00 -2.27 0.00 0.00 64.05 56.33 1rkd n THR 185 Cb 0.52 -1.76 0.03 0.00 -2.10 0.00 0.00 70.33 67.03 1rkd n THR 185 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1rkd s PRO 186 N -2.37 3.06 0.46 -0.78 0.04 -1.16 -4.51 135.00 129.74 1rkd s PRO 186 Ca 0.41 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.74 1rkd s PRO 186 Cb 0.20 -1.99 0.09 0.00 0.04 0.00 0.00 34.50 32.84 1rkd s PRO 186 CO -0.07 -1.03 0.62 0.27 0.04 0.00 0.00 177.00 176.84 1rkd n ASN 187 N -2.20 0.64 -0.24 6.66 0.23 -1.26 -0.56 115.26 118.53 1rkd n ASN 187 Ca 0.10 -1.58 -0.08 0.00 -0.53 0.00 0.00 54.58 52.48 1rkd n ASN 187 Cb 0.52 -0.42 0.04 0.00 -2.08 0.00 0.00 39.78 37.84 1rkd n ASN 187 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1rkd h GLU 188 N 0.00 1.11 -0.54 -3.83 5.08 -1.90 -1.59 114.58 112.92 1rkd h GLU 188 Ca -0.21 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1rkd h GLU 188 Cb 0.71 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1rkd h GLU 188 CO 0.20 1.01 0.31 1.15 -1.00 0.00 0.00 179.01 180.69 1rkd h THR 189 N 1.03 1.17 -0.58 1.13 2.02 -1.92 -2.36 112.91 113.40 1rkd h THR 189 Ca 0.20 -0.40 -0.10 0.00 0.77 0.00 0.00 66.41 66.88 1rkd h THR 189 Cb 0.44 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1rkd h THR 189 CO 0.01 0.18 -0.04 -0.33 0.37 0.00 0.00 175.52 175.70 1rkd h GLU 190 N 0.72 1.04 -0.88 6.66 5.08 -1.86 -0.97 114.58 124.38 1rkd h GLU 190 Ca 0.19 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1rkd h GLU 190 Cb 0.01 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 1rkd h GLU 190 CO -0.03 1.04 0.53 0.00 -1.00 0.00 0.00 179.01 179.55 1rkd h ALA 191 N 0.99 1.12 -0.34 3.43 0.00 -1.12 0.02 119.26 123.36 1rkd h ALA 191 Ca 0.16 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1rkd h ALA 191 Cb 0.60 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1rkd h ALA 191 CO 0.04 0.57 0.01 1.49 0.00 0.00 0.00 179.25 181.36 1rkd h GLU 192 N 1.20 0.59 -0.42 0.00 4.81 -1.25 -1.22 114.58 118.30 1rkd h GLU 192 Ca 0.31 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1rkd h GLU 192 Cb -0.06 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1rkd h GLU 192 CO -0.06 0.71 0.13 -0.22 -0.73 0.00 0.00 179.01 178.84 1rkd h LYS 193 N 0.40 0.60 0.00 1.92 1.63 -0.65 0.75 116.57 121.23 1rkd h LYS 193 Ca 0.10 -0.09 -0.18 0.00 -0.85 0.00 0.00 60.65 59.63 1rkd h LYS 193 Cb 0.44 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.94 1rkd h LYS 193 CO 0.02 0.53 -0.90 -0.07 -3.45 0.00 0.00 179.45 175.58 1rkd h LEU 194 N 0.60 0.00 0.00 5.20 3.38 -0.70 -3.39 115.31 120.39 1rkd h LEU 194 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1rkd h LEU 194 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1rkd h LEU 194 CO -0.01 0.80 -1.13 0.35 0.09 0.00 0.00 178.44 178.55 1rkd n THR 195 N -3.26 0.08 -0.50 0.22 -2.24 -0.49 -4.92 114.28 103.18 1rkd n THR 195 Ca -0.01 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1rkd n THR 195 Cb 0.87 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1rkd n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rkd n GLY 196 N 2.64 0.75 3.43 3.38 0.00 0.26 -5.03 105.19 110.61 1rkd n GLY 196 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1rkd n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rkd s ILE 197 N -2.67 4.49 0.25 -0.61 1.01 -1.25 -5.01 121.20 117.41 1rkd s ILE 197 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 60.65 59.93 1rkd s ILE 197 Cb 0.00 -3.27 -0.10 0.00 0.01 0.00 0.00 42.46 39.10 1rkd s ILE 197 CO 0.00 0.10 1.45 -0.60 0.00 0.00 0.00 174.94 175.89 1rkd s ARG 198 N 1.60 4.26 -0.33 2.79 3.52 -1.26 -3.73 118.95 125.79 1rkd s ARG 198 Ca 0.05 2.32 -0.03 0.00 -0.13 0.00 0.00 55.73 57.93 1rkd s ARG 198 Cb -0.17 -3.10 0.06 0.00 -1.56 0.00 0.00 34.95 30.18 1rkd s ARG 198 CO 0.05 -0.43 0.07 0.08 -0.81 0.00 0.00 175.30 174.27 1rkd s VAL 199 N -0.00 3.30 0.00 7.11 1.01 -1.26 -4.83 120.40 125.73 1rkd s VAL 199 Ca 0.60 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1rkd s VAL 199 Cb -0.42 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1rkd s VAL 199 CO 0.44 -0.25 0.16 -0.62 0.00 0.00 0.00 175.10 174.82 1rkd n GLU 200 N 4.68 2.86 -3.74 2.72 -0.58 -1.26 -4.90 120.64 120.41 1rkd n GLU 200 Ca -0.11 -0.16 -0.12 0.00 -0.42 0.00 0.00 57.16 56.36 1rkd n GLU 200 Cb 0.43 -0.59 -0.01 0.00 -0.57 0.00 0.00 31.44 30.71 1rkd n GLU 200 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1rkd n ASN 201 N -0.45 -1.54 0.23 1.62 0.23 -1.26 -5.03 115.26 109.05 1rkd n ASN 201 Ca 0.00 -2.68 0.10 0.00 -0.53 0.00 0.00 54.58 51.46 1rkd n ASN 201 Cb 0.02 2.74 0.50 0.00 -2.08 0.00 0.00 39.78 40.97 1rkd n ASN 201 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1rkd h ASP 202 N 1.84 0.00 -0.08 0.53 3.32 -1.98 -0.30 116.42 119.75 1rkd h ASP 202 Ca -0.27 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 1rkd h ASP 202 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1rkd h ASP 202 CO 0.36 0.23 -0.33 -0.08 -1.72 0.00 0.00 179.24 177.70 1rkd h GLU 203 N 0.00 0.36 -0.63 3.56 4.81 -1.99 -2.07 114.58 118.61 1rkd h GLU 203 Ca -0.00 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1rkd h GLU 203 Cb 0.67 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.08 1rkd h GLU 203 CO 0.03 0.92 0.11 -0.44 -0.73 0.00 0.00 179.01 178.89 1rkd h ASP 204 N -0.12 0.98 -0.82 1.04 3.32 -1.80 -2.35 116.42 116.67 1rkd h ASP 204 Ca -0.02 -0.22 0.03 0.00 0.02 0.00 0.00 57.03 56.84 1rkd h ASP 204 Cb 0.97 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.21 1rkd h ASP 204 CO 0.07 0.98 0.53 0.00 -1.72 0.00 0.00 179.24 179.09 1rkd h ALA 205 N 1.14 1.08 -0.45 3.45 0.00 -1.05 -0.17 119.26 123.26 1rkd h ALA 205 Ca 0.20 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1rkd h ALA 205 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1rkd h ALA 205 CO 0.01 0.36 -0.07 0.00 0.00 0.00 0.00 179.25 179.55 1rkd h ALA 206 N 1.34 1.03 0.20 0.00 0.00 -1.07 -0.62 119.26 120.14 1rkd h ALA 206 Ca 0.33 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1rkd h ALA 206 Cb -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1rkd h ALA 206 CO -0.11 0.59 -0.10 -0.22 0.00 0.00 0.00 179.25 179.41 1rkd h LYS 207 N 0.72 -0.27 -0.72 0.00 3.64 -0.66 -1.31 116.57 117.98 1rkd h LYS 207 Ca 0.13 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1rkd h LYS 207 Cb 0.54 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1rkd h LYS 207 CO 0.03 -0.18 0.29 0.00 -2.27 0.00 0.00 179.45 177.33 1rkd h ALA 208 N 0.52 0.94 -0.91 5.00 0.00 -0.99 -2.36 119.26 121.46 1rkd h ALA 208 Ca -0.03 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.78 1rkd h ALA 208 Cb 0.21 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1rkd h ALA 208 CO 0.04 0.56 0.56 0.00 0.00 0.00 0.00 179.25 180.41 1rkd h ALA 209 N 1.14 1.28 -0.56 0.00 0.00 -0.98 -2.19 119.26 117.95 1rkd h ALA 209 Ca 0.24 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1rkd h ALA 209 Cb 0.20 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1rkd h ALA 209 CO -0.02 0.27 0.06 0.37 0.00 0.00 0.00 179.25 179.93 1rkd h GLN 210 N 0.98 0.93 -0.24 0.00 5.75 -0.70 0.47 115.11 122.30 1rkd h GLN 210 Ca 0.41 -0.24 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1rkd h GLN 210 Cb 0.26 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1rkd h GLN 210 CO -0.20 0.88 0.14 0.28 -2.65 0.00 0.00 178.83 177.28 1rkd h VAL 211 N 0.87 1.03 -0.62 2.39 2.07 -1.19 0.16 116.25 120.96 1rkd h VAL 211 Ca 0.17 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 1rkd h VAL 211 Cb 0.43 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1rkd h VAL 211 CO 0.01 0.05 0.25 -0.07 0.02 0.00 0.00 177.57 177.83 1rkd h LEU 212 N 0.29 0.83 -0.91 2.57 3.38 -1.20 -1.39 115.31 118.88 1rkd h LEU 212 Ca 0.09 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1rkd h LEU 212 Cb -0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1rkd h LEU 212 CO -0.04 0.75 0.08 0.45 0.09 0.00 0.00 178.44 179.77 1rkd h HIS 213 N 0.90 0.92 0.00 1.13 3.86 -0.42 -1.51 115.15 120.03 1rkd h HIS 213 Ca 0.21 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1rkd h HIS 213 Cb 0.18 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1rkd h HIS 213 CO 0.01 0.80 0.00 0.93 0.86 0.00 0.00 177.93 180.53 1rkd h GLU 214 N 0.83 0.00 -0.01 2.45 5.08 0.05 -0.63 114.58 122.35 1rkd h GLU 214 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1rkd h GLU 214 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1rkd h GLU 214 CO 0.01 0.00 -0.25 1.63 -1.00 0.00 0.00 179.01 179.40 1rkd n LYS 215 N -2.32 1.03 0.00 2.33 4.76 -0.59 -4.92 118.16 118.45 1rkd n LYS 215 Ca -0.00 -0.66 0.00 0.00 -2.87 0.00 0.00 58.31 54.78 1rkd n LYS 215 Cb 0.10 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 1rkd n LYS 215 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1rkd n GLY 216 N 1.33 0.84 3.53 0.72 0.00 -0.25 -3.47 105.19 107.90 1rkd n GLY 216 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1rkd n GLY 216 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rkd s ILE 217 N -2.00 5.03 0.02 -0.61 1.01 -1.06 -4.84 121.20 118.75 1rkd s ILE 217 Ca 0.00 0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.49 1rkd s ILE 217 Cb 0.00 -4.00 -0.17 0.00 0.01 0.00 0.00 42.46 38.29 1rkd s ILE 217 CO 0.00 -0.31 1.42 -0.09 0.00 0.00 0.00 174.94 175.96 1rkd h ARG 218 N 8.60 0.06 -4.87 2.79 2.43 -1.78 -3.33 114.38 118.29 1rkd h ARG 218 Ca -0.27 -0.02 -0.67 0.00 -0.81 0.00 0.00 59.98 58.21 1rkd h ARG 218 Cb 1.12 -0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 30.41 1rkd h ARG 218 CO 0.79 0.38 -0.64 0.99 -1.51 0.00 0.00 179.97 179.98 1rkd s THR 219 N -4.85 3.94 -0.20 0.20 2.01 -0.62 -0.45 115.64 115.67 1rkd s THR 219 Ca -0.15 -0.55 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 1rkd s THR 219 Cb 0.04 -2.96 0.00 0.00 0.01 0.00 0.00 72.50 69.59 1rkd s THR 219 CO 0.68 0.19 -0.12 -0.69 -0.69 0.00 0.00 174.62 174.00 1rkd s VAL 220 N 1.52 2.75 -0.30 3.82 1.01 0.26 -1.37 120.40 128.10 1rkd s VAL 220 Ca 0.04 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1rkd s VAL 220 Cb -0.16 -2.22 0.07 0.00 0.00 0.00 0.00 36.38 34.08 1rkd s VAL 220 CO 0.02 0.48 -0.02 -0.76 0.00 0.00 0.00 175.10 174.82 1rkd s LEU 221 N 1.38 4.06 -0.38 3.92 1.43 -0.24 -0.35 118.68 128.50 1rkd s LEU 221 Ca 0.05 -1.65 -0.15 0.00 -1.03 0.00 0.00 54.13 51.35 1rkd s LEU 221 Cb -0.14 -1.63 0.01 0.00 0.03 0.00 0.00 46.19 44.46 1rkd s LEU 221 CO -0.08 -0.29 0.33 -0.63 0.23 0.00 0.00 176.35 175.91 1rkd s ILE 222 N 1.07 5.21 0.28 -0.59 1.01 -0.24 -2.98 121.20 124.96 1rkd s ILE 222 Ca -0.01 -0.37 -0.29 0.00 0.00 0.00 0.00 60.65 59.99 1rkd s ILE 222 Cb -0.20 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.29 1rkd s ILE 222 CO -0.05 -0.23 1.03 0.42 0.00 0.00 0.00 174.94 176.11 1rkd s THR 223 N 1.85 3.75 -0.22 2.92 -4.23 0.28 -0.61 115.64 119.39 1rkd s THR 223 Ca 0.08 1.70 0.12 0.00 -1.18 0.00 0.00 61.69 62.41 1rkd s THR 223 Cb -0.18 -4.06 0.44 0.00 1.34 0.00 0.00 72.50 70.04 1rkd s THR 223 CO 0.11 0.36 1.20 0.18 -0.54 0.00 0.00 174.62 175.93 1rkd n LEU 224 N 1.12 3.13 0.00 4.79 4.77 0.86 -3.22 117.00 128.45 1rkd n LEU 224 Ca -0.01 -3.94 0.00 0.00 -0.03 0.00 0.00 56.01 52.04 1rkd n LEU 224 Cb 0.46 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1rkd n LEU 224 CO 0.51 1.51 0.00 0.61 -1.33 0.00 0.00 177.39 178.69 1rkd n GLY 225 N -0.84 3.81 0.00 -0.72 0.00 -1.26 -1.76 105.19 104.43 1rkd n GLY 225 Ca 0.24 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1rkd n GLY 225 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rkd n SER 226 N 7.21 0.01 -0.31 1.61 3.41 -1.26 -2.57 113.62 121.72 1rkd n SER 226 Ca 0.00 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.23 1rkd n SER 226 Cb 0.00 -0.50 0.54 0.00 -0.26 0.00 0.00 64.21 63.98 1rkd n SER 226 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rkd n ARG 227 N -1.51 1.42 0.00 4.33 1.74 -0.73 -4.45 116.66 117.46 1rkd n ARG 227 Ca 0.06 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.51 1rkd n ARG 227 Cb 0.27 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1rkd n ARG 227 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rkd n GLY 228 N 1.03 0.65 3.05 -0.13 0.00 -1.06 -4.41 105.19 104.33 1rkd n GLY 228 Ca 0.17 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.94 1rkd n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rkd s VAL 229 N 0.00 0.01 -0.42 1.61 0.11 -0.36 -0.10 120.40 121.25 1rkd s VAL 229 Ca 0.00 -0.12 -0.23 0.00 -2.93 0.00 0.00 61.98 58.70 1rkd s VAL 229 Cb 0.00 -0.27 0.02 0.00 -1.53 0.00 0.00 36.38 34.60 1rkd s VAL 229 CO 0.00 -0.07 0.80 0.86 -3.33 0.00 0.00 175.10 173.37 1rkd s TRP 230 N -0.16 3.02 -0.25 1.54 -0.11 0.22 -0.69 118.94 122.52 1rkd s TRP 230 Ca -0.03 0.32 -0.11 0.00 1.22 0.00 0.00 56.10 57.51 1rkd s TRP 230 Cb -0.02 -3.61 -0.05 0.00 -1.50 0.00 0.00 33.47 28.28 1rkd s TRP 230 CO 0.00 -0.92 0.17 0.00 -4.62 0.00 0.00 176.95 171.59 1rkd s ALA 231 N 3.29 3.60 -0.07 5.86 0.00 0.11 -1.08 121.76 133.47 1rkd s ALA 231 Ca 0.31 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 1rkd s ALA 231 Cb -0.12 -2.35 0.03 0.00 0.00 0.00 0.00 23.12 20.67 1rkd s ALA 231 CO 0.21 -0.25 -0.02 0.45 0.00 0.00 0.00 175.76 176.15 1rkd s SER 232 N 1.17 1.50 -0.24 0.00 0.15 0.52 -0.65 113.70 116.15 1rkd s SER 232 Ca 0.08 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1rkd s SER 232 Cb -0.14 -0.49 0.03 0.00 -1.71 0.00 0.00 66.02 63.71 1rkd s SER 232 CO 0.06 -0.15 -0.10 -0.69 1.20 0.00 0.00 173.24 173.55 1rkd s VAL 233 N 1.67 2.50 -1.37 4.45 1.01 -0.66 -0.57 120.40 127.43 1rkd s VAL 233 Ca 0.01 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.67 1rkd s VAL 233 Cb -0.13 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 33.99 1rkd s VAL 233 CO -0.04 0.21 0.26 -0.46 0.00 0.00 0.00 175.10 175.06 1rkd n ASN 234 N 4.59 -1.00 0.00 3.32 6.94 0.40 -2.38 115.26 127.14 1rkd n ASN 234 Ca -0.17 -1.25 0.00 0.00 -0.02 0.00 0.00 54.58 53.14 1rkd n ASN 234 Cb 0.46 -1.53 0.00 0.00 -2.36 0.00 0.00 39.78 36.35 1rkd n ASN 234 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rkd n GLY 235 N -2.36 3.08 3.65 4.83 0.00 -1.26 -5.05 105.19 108.09 1rkd n GLY 235 Ca -0.23 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 1rkd n GLY 235 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rkd s GLU 236 N 0.00 4.22 0.17 1.61 2.12 -1.00 -5.04 118.70 120.79 1rkd s GLU 236 Ca 0.00 1.16 0.08 0.00 0.36 0.00 0.00 54.97 56.57 1rkd s GLU 236 Cb 0.00 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 1rkd s GLU 236 CO 0.00 -0.58 -0.16 0.20 -0.54 0.00 0.00 175.26 174.18 1rkd s GLY 237 N 1.27 1.36 0.04 -1.50 0.00 -1.26 -1.65 107.32 105.58 1rkd s GLY 237 Ca 0.40 -1.52 -0.18 0.00 0.00 0.00 0.00 44.72 43.41 1rkd s GLY 237 CO 0.07 -1.59 0.41 -0.86 0.00 0.00 0.00 173.10 171.12 1rkd s GLN 238 N -3.08 0.90 -0.11 2.90 0.00 0.17 -4.98 119.66 115.47 1rkd s GLN 238 Ca 0.17 -0.35 -0.18 0.00 -0.00 0.00 0.00 55.36 55.01 1rkd s GLN 238 Cb -0.04 0.40 -0.04 0.00 0.00 0.00 0.00 33.01 33.33 1rkd s GLN 238 CO 0.06 -0.31 0.46 0.50 0.00 0.00 0.00 175.29 176.01 1rkd s ARG 239 N -2.39 4.30 -0.33 9.60 3.52 -1.26 0.07 118.95 132.46 1rkd s ARG 239 Ca -0.06 0.42 -0.02 0.00 -0.13 0.00 0.00 55.73 55.95 1rkd s ARG 239 Cb -0.01 -3.42 0.07 0.00 -1.56 0.00 0.00 34.95 30.03 1rkd s ARG 239 CO -0.02 0.21 0.05 0.08 -0.81 0.00 0.00 175.30 174.81 1rkd s VAL 240 N 0.46 3.00 0.73 7.11 1.01 0.13 -4.97 120.40 127.89 1rkd s VAL 240 Ca 0.25 -1.61 -0.15 0.00 0.00 0.00 0.00 61.98 60.47 1rkd s VAL 240 Cb -0.15 -2.84 0.04 0.00 0.00 0.00 0.00 36.38 33.43 1rkd s VAL 240 CO 0.10 -0.28 1.21 -2.16 0.00 0.00 0.00 175.10 173.97 1rkd s PRO 241 N 1.20 2.10 0.00 2.72 0.04 -1.26 -1.23 135.00 138.57 1rkd s PRO 241 Ca -0.01 1.77 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1rkd s PRO 241 Cb -0.20 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1rkd s PRO 241 CO -0.02 -1.86 0.00 0.41 0.04 0.00 0.00 177.00 175.56 1rkd n GLY 242 N 0.41 0.73 3.88 0.56 0.00 -1.26 -4.84 105.19 104.66 1rkd n GLY 242 Ca 0.13 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 1rkd n GLY 242 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rkd s PHE 243 N 0.46 3.58 -0.46 1.61 0.08 -1.26 -4.93 117.98 117.07 1rkd s PHE 243 Ca 0.00 0.68 -0.28 0.00 0.12 0.00 0.00 56.93 57.45 1rkd s PHE 243 Cb 0.00 -2.07 0.03 0.00 -0.57 0.00 0.00 43.02 40.40 1rkd s PHE 243 CO 0.00 0.57 1.06 1.03 -0.10 0.00 0.00 175.22 177.78 1rkd s ARG 244 N -1.80 3.70 0.25 0.44 0.52 -1.26 -4.98 118.95 115.81 1rkd s ARG 244 Ca 0.30 0.48 0.01 0.00 -0.52 0.00 0.00 55.73 56.00 1rkd s ARG 244 Cb -0.14 -3.90 -0.05 0.00 0.52 0.00 0.00 34.95 31.39 1rkd s ARG 244 CO 0.17 -1.28 0.09 0.14 0.02 0.00 0.00 175.30 174.44 1rkd s VAL 245 N 4.13 0.57 -0.60 3.52 -7.23 -1.26 -5.10 120.40 114.43 1rkd s VAL 245 Ca 0.44 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.41 1rkd s VAL 245 Cb -0.09 -2.58 0.08 0.00 0.56 0.00 0.00 36.38 34.36 1rkd s VAL 245 CO 0.28 -0.05 0.78 -1.58 -0.31 0.00 0.00 175.10 174.22 1rkd s GLN 246 N -4.02 3.09 0.19 4.82 -0.44 -1.26 -5.02 119.66 117.01 1rkd s GLN 246 Ca 0.36 -1.08 -0.30 0.00 -2.50 0.00 0.00 55.36 51.85 1rkd s GLN 246 Cb 0.08 -4.22 -0.08 0.00 -1.64 0.00 0.00 33.01 27.14 1rkd s GLN 246 CO 0.13 -1.57 1.27 0.00 0.50 0.00 0.00 175.29 175.61 1rkd s ALA 247 N 3.12 3.49 0.00 1.58 0.00 -1.26 -4.53 121.76 124.16 1rkd s ALA 247 Ca 0.16 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1rkd s ALA 247 Cb -0.21 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1rkd s ALA 247 CO 0.09 -0.48 0.00 1.33 0.00 0.00 0.00 175.76 176.70 1rkd n VAL 248 N 2.60 0.00 -3.24 0.00 0.24 -0.58 -4.93 118.33 112.42 1rkd n VAL 248 Ca 0.06 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.33 1rkd n VAL 248 Cb 0.43 -0.60 -0.04 0.00 -1.47 0.00 0.00 33.84 32.17 1rkd n VAL 248 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1rkd s ASP 249 N -2.49 -0.55 0.00 -1.34 -1.08 -0.92 -3.95 116.67 106.34 1rkd s ASP 249 Ca 0.00 0.21 0.29 0.00 -0.52 0.00 0.00 52.55 52.53 1rkd s ASP 249 Cb 0.00 1.59 1.67 0.00 -1.46 0.00 0.00 42.92 44.72 1rkd s ASP 249 CO 0.00 -0.30 2.04 0.35 0.52 0.00 0.00 175.17 177.77 1rkd n THR 250 N 5.39 0.01 -1.92 1.71 -2.24 -0.57 -4.37 114.28 112.29 1rkd n THR 250 Ca 0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1rkd n THR 250 Cb 0.51 -0.55 -0.00 0.00 -2.10 0.00 0.00 70.33 68.18 1rkd n THR 250 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1rkd s ILE 251 N -2.07 2.31 -0.58 2.28 2.07 -1.26 -2.29 121.20 121.66 1rkd s ILE 251 Ca 0.41 0.30 0.00 0.00 -1.41 0.00 0.00 60.65 59.95 1rkd s ILE 251 Cb 0.20 -3.18 0.00 0.00 0.13 0.00 0.00 42.46 39.60 1rkd s ILE 251 CO 0.34 0.06 0.00 0.00 -1.91 0.00 0.00 174.94 173.43 1rkd n ALA 252 N 0.28 -0.08 0.00 1.50 0.00 -1.26 -4.67 120.51 116.28 1rkd n ALA 252 Ca 0.02 0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.43 1rkd n ALA 252 Cb 0.41 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 1rkd n ALA 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rkd h ALA 253 N 0.00 0.00 -0.52 0.00 0.00 -1.80 -1.21 119.26 115.73 1rkd h ALA 253 Ca -0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1rkd h ALA 253 Cb 0.57 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1rkd h ALA 253 CO 0.17 -0.33 0.31 0.78 0.00 0.00 0.00 179.25 180.17 1rkd h GLY 254 N -0.33 0.75 1.01 0.00 0.00 -1.90 -0.51 103.07 102.08 1rkd h GLY 254 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.02 1rkd h GLY 254 CO 0.00 0.30 0.60 -0.55 0.00 0.00 0.00 176.54 176.90 1rkd h ASP 255 N 0.69 1.06 -0.31 0.19 3.32 -1.91 -0.76 116.42 118.71 1rkd h ASP 255 Ca 0.18 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 1rkd h ASP 255 Cb -0.01 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1rkd h ASP 255 CO -0.03 0.78 0.01 0.74 -1.72 0.00 0.00 179.24 179.01 1rkd h THR 256 N 1.25 1.25 -0.17 0.35 2.02 -0.84 -2.14 112.91 114.63 1rkd h THR 256 Ca 0.34 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.65 1rkd h THR 256 Cb -0.14 1.25 -0.05 0.00 -1.74 0.00 0.00 68.15 67.47 1rkd h THR 256 CO -0.07 0.30 -0.14 0.15 0.37 0.00 0.00 175.52 176.12 1rkd h PHE 257 N 0.34 -0.36 0.02 3.16 3.57 -0.77 -1.13 116.94 121.76 1rkd h PHE 257 Ca 0.09 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1rkd h PHE 257 Cb 0.42 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1rkd h PHE 257 CO 0.03 -0.21 -0.01 -0.91 -2.23 0.00 0.00 178.31 174.98 1rkd h ASN 258 N -0.16 -0.02 -0.41 0.41 4.21 -0.97 0.55 115.58 119.19 1rkd h ASN 258 Ca 0.11 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.58 1rkd h ASN 258 Cb 0.32 0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 37.50 1rkd h ASN 258 CO -0.27 0.03 0.27 1.23 -1.29 0.00 0.00 177.43 177.40 1rkd h GLY 259 N -0.07 0.58 1.56 2.83 0.00 -1.30 -2.30 103.07 104.37 1rkd h GLY 259 Ca -0.00 -0.22 -0.16 0.00 0.00 0.00 0.00 47.33 46.95 1rkd h GLY 259 CO 0.00 0.21 -0.57 0.00 0.00 0.00 0.00 176.54 176.19 1rkd h ALA 260 N 1.15 0.74 -0.31 3.60 0.00 -1.13 -2.48 119.26 120.83 1rkd h ALA 260 Ca 0.15 -0.52 0.07 0.00 0.00 0.00 0.00 54.91 54.61 1rkd h ALA 260 Cb -0.06 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.58 1rkd h ALA 260 CO -0.03 0.70 -0.16 1.25 0.00 0.00 0.00 179.25 181.00 1rkd h LEU 261 N 0.35 -0.55 -1.02 0.00 5.85 -0.75 -1.55 115.31 117.64 1rkd h LEU 261 Ca 0.00 0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 1rkd h LEU 261 Cb 1.10 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1rkd h LEU 261 CO 0.10 -0.20 -0.41 0.40 -0.34 0.00 0.00 178.44 177.99 1rkd h ILE 262 N -0.12 1.31 -0.48 4.05 1.08 -1.33 -1.25 117.51 120.76 1rkd h ILE 262 Ca 0.16 -1.48 -0.01 0.00 -0.39 0.00 0.00 64.86 63.14 1rkd h ILE 262 Cb 0.37 1.70 -0.02 0.00 -3.07 0.00 0.00 36.82 35.80 1rkd h ILE 262 CO -0.39 0.44 0.26 0.74 -0.69 0.00 0.00 178.15 178.51 1rkd h THR 263 N 0.14 1.17 -0.30 -0.27 2.02 -1.05 -0.89 112.91 113.73 1rkd h THR 263 Ca 0.01 -0.45 -0.12 0.00 0.77 0.00 0.00 66.41 66.62 1rkd h THR 263 Cb 0.78 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1rkd h THR 263 CO 0.06 0.18 -0.28 0.00 0.37 0.00 0.00 175.52 175.85 1rkd h ALA 264 N 1.10 0.44 -0.99 6.16 0.00 -0.79 -2.24 119.26 122.94 1rkd h ALA 264 Ca 0.17 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1rkd h ALA 264 Cb 0.06 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1rkd h ALA 264 CO -0.03 0.45 0.65 -0.07 0.00 0.00 0.00 179.25 180.26 1rkd h LEU 265 N 0.48 1.09 -0.41 0.00 3.38 -1.04 -0.92 115.31 117.89 1rkd h LEU 265 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1rkd h LEU 265 Cb 0.85 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1rkd h LEU 265 CO 0.07 0.75 0.00 0.18 0.09 0.00 0.00 178.44 179.53 1rkd n LEU 266 N -4.45 0.68 -0.58 1.67 4.77 -0.36 -1.34 117.00 117.40 1rkd n LEU 266 Ca 0.13 0.62 0.05 0.00 -0.03 0.00 0.00 56.01 56.78 1rkd n LEU 266 Cb 0.09 -0.48 0.13 0.00 -2.33 0.00 0.00 43.42 40.83 1rkd n LEU 266 CO 0.35 -0.40 0.61 -0.62 -1.33 0.00 0.00 177.39 175.99 1rkd n GLU 267 N -2.20 1.74 -1.88 3.23 1.02 -0.40 -2.94 120.64 119.20 1rkd n GLU 267 Ca 0.04 -1.10 -0.14 0.00 -0.02 0.00 0.00 57.16 55.94 1rkd n GLU 267 Cb 0.30 -1.26 -0.03 0.00 -0.02 0.00 0.00 31.44 30.43 1rkd n GLU 267 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1rkd n GLU 268 N 0.38 -1.03 -2.61 3.49 -0.58 -0.45 -4.97 120.64 114.88 1rkd n GLU 268 Ca 0.10 0.81 -0.40 0.00 -0.42 0.00 0.00 57.16 57.25 1rkd n GLU 268 Cb 0.27 -4.99 -0.05 0.00 -0.57 0.00 0.00 31.44 26.10 1rkd n GLU 268 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1rkd s LYS 269 N -4.01 4.73 0.98 3.49 1.02 -0.86 -5.01 119.74 120.08 1rkd s LYS 269 Ca 0.00 1.65 -0.11 0.00 0.02 0.00 0.00 55.97 57.52 1rkd s LYS 269 Cb 0.00 -3.25 0.18 0.00 -0.52 0.00 0.00 37.83 34.24 1rkd s LYS 269 CO 0.00 0.32 1.09 -1.25 -0.92 0.00 0.00 175.35 174.59 1rkd s PRO 270 N -1.13 0.54 0.14 -1.68 0.04 -1.26 -4.44 135.00 127.22 1rkd s PRO 270 Ca 0.44 1.03 -0.19 0.00 0.04 0.00 0.00 61.00 62.32 1rkd s PRO 270 Cb -0.29 -1.71 0.02 0.00 0.04 0.00 0.00 34.50 32.56 1rkd s PRO 270 CO 0.36 -2.79 1.68 1.25 0.04 0.00 0.00 177.00 177.54 1rkd h LEU 271 N -1.96 -0.31 -1.09 -3.56 5.85 -1.98 -0.73 115.31 111.52 1rkd h LEU 271 Ca -0.51 0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.36 1rkd h LEU 271 Cb 1.29 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.45 1rkd h LEU 271 CO 0.50 -0.12 0.62 1.55 -0.34 0.00 0.00 178.44 180.65 1rkd h PRO 272 N -0.04 1.07 -0.18 5.25 0.13 -1.99 0.37 132.00 136.60 1rkd h PRO 272 Ca 0.13 -0.06 -0.21 0.00 -0.87 0.00 0.00 66.00 64.99 1rkd h PRO 272 Cb 0.23 -0.24 0.01 0.00 0.13 0.00 0.00 31.00 31.13 1rkd h PRO 272 CO -0.29 0.71 -0.71 1.49 -0.23 0.00 0.00 178.00 178.97 1rkd h GLU 273 N 1.10 0.78 -0.72 0.86 4.81 -1.68 -2.05 114.58 117.68 1rkd h GLU 273 Ca 0.40 -0.59 -0.04 0.00 -0.13 0.00 0.00 59.36 59.01 1rkd h GLU 273 Cb 0.16 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1rkd h GLU 273 CO -0.15 1.21 0.31 0.00 -0.73 0.00 0.00 179.01 179.64 1rkd h ALA 274 N 0.64 0.93 -0.56 2.92 0.00 -0.29 -1.27 119.26 121.62 1rkd h ALA 274 Ca -0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1rkd h ALA 274 Cb 1.33 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1rkd h ALA 274 CO 0.15 0.54 0.35 0.82 0.00 0.00 0.00 179.25 181.10 1rkd h ILE 275 N 1.02 1.16 -0.60 0.00 2.04 -0.94 -0.47 117.51 119.72 1rkd h ILE 275 Ca 0.24 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1rkd h ILE 275 Cb 0.18 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1rkd h ILE 275 CO -0.02 0.17 0.30 -0.09 0.00 0.00 0.00 178.15 178.50 1rkd h ARG 276 N 0.76 0.86 -0.48 2.37 2.43 -1.17 0.46 114.38 119.61 1rkd h ARG 276 Ca 0.20 -0.12 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1rkd h ARG 276 Cb -0.03 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 1rkd h ARG 276 CO -0.04 0.68 0.25 0.35 -1.51 0.00 0.00 179.97 179.71 1rkd h PHE 277 N 0.82 0.47 -0.59 2.20 3.57 -0.91 -0.78 116.94 121.71 1rkd h PHE 277 Ca 0.21 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.63 1rkd h PHE 277 Cb 0.10 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1rkd h PHE 277 CO -0.00 0.25 -0.02 0.00 -2.23 0.00 0.00 178.31 176.31 1rkd h ALA 278 N 1.24 0.85 -0.87 2.41 0.00 -0.68 -1.55 119.26 120.66 1rkd h ALA 278 Ca 0.20 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1rkd h ALA 278 Cb 0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1rkd h ALA 278 CO -0.13 0.67 0.53 0.45 0.00 0.00 0.00 179.25 180.77 1rkd h HIS 279 N 0.95 1.14 -0.45 0.00 3.86 0.22 -0.23 115.15 120.64 1rkd h HIS 279 Ca 0.17 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.35 1rkd h HIS 279 Cb 0.57 -0.37 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 1rkd h HIS 279 CO 0.04 0.75 0.17 0.00 0.86 0.00 0.00 177.93 179.76 1rkd h ALA 280 N 1.29 0.59 -0.58 2.45 0.00 -0.77 0.54 119.26 122.77 1rkd h ALA 280 Ca 0.31 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1rkd h ALA 280 Cb -0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1rkd h ALA 280 CO -0.06 0.21 0.22 0.00 0.00 0.00 0.00 179.25 179.61 1rkd h ALA 281 N 1.02 0.75 -0.05 0.00 0.00 -0.93 -1.97 119.26 118.09 1rkd h ALA 281 Ca 0.15 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1rkd h ALA 281 Cb 0.21 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1rkd h ALA 281 CO -0.01 0.38 -0.70 0.00 0.00 0.00 0.00 179.25 178.92 1rkd h ALA 282 N 1.07 0.72 -0.49 0.00 0.00 -0.93 -1.83 119.26 117.81 1rkd h ALA 282 Ca 0.19 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1rkd h ALA 282 Cb 0.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1rkd h ALA 282 CO -0.01 0.79 0.25 0.00 0.00 0.00 0.00 179.25 180.29 1rkd h ALA 283 N 1.10 0.63 0.25 0.00 0.00 -0.73 -0.86 119.26 119.65 1rkd h ALA 283 Ca -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1rkd h ALA 283 Cb 1.25 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1rkd h ALA 283 CO 0.11 0.17 -0.15 0.82 0.00 0.00 0.00 179.25 180.20 1rkd h ILE 284 N 0.65 0.68 -0.92 0.00 2.04 -1.17 -2.93 117.51 115.86 1rkd h ILE 284 Ca 0.17 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.21 1rkd h ILE 284 Cb 0.08 0.68 -0.10 0.00 -0.74 0.00 0.00 36.82 36.74 1rkd h ILE 284 CO -0.02 0.00 0.50 0.00 0.00 0.00 0.00 178.15 178.63 1rkd h ALA 285 N 0.35 1.46 0.00 1.87 0.00 -1.04 0.17 119.26 122.08 1rkd h ALA 285 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1rkd h ALA 285 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1rkd h ALA 285 CO 0.03 -0.11 0.00 1.33 0.00 0.00 0.00 179.25 180.50 1rkd n VAL 286 N -4.85 0.57 0.95 0.00 0.24 -0.36 -1.58 118.33 113.30 1rkd n VAL 286 Ca 0.20 0.14 0.11 0.00 -2.04 0.00 0.00 64.34 62.75 1rkd n VAL 286 Cb 0.52 -0.79 0.31 0.00 -1.47 0.00 0.00 33.84 32.42 1rkd n VAL 286 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1rkd n THR 287 N -1.48 0.31 -4.36 3.34 -2.24 0.59 -1.53 114.28 108.91 1rkd n THR 287 Ca 0.05 -0.47 -0.24 0.00 -2.27 0.00 0.00 64.05 61.13 1rkd n THR 287 Cb 0.23 0.54 -0.13 0.00 -2.10 0.00 0.00 70.33 68.87 1rkd n THR 287 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1rkd s ARG 288 N -1.69 1.17 0.38 -0.78 0.52 -0.61 -4.74 118.95 113.20 1rkd s ARG 288 Ca 0.33 -1.10 -0.24 0.00 -0.52 0.00 0.00 55.73 54.20 1rkd s ARG 288 Cb 0.19 -1.40 -0.10 0.00 0.52 0.00 0.00 34.95 34.15 1rkd s ARG 288 CO 0.27 0.33 0.97 0.15 0.02 0.00 0.00 175.30 177.04 1rkd s LYS 289 N -1.73 4.37 0.00 3.54 1.02 -1.26 -4.41 119.74 121.27 1rkd s LYS 289 Ca 0.06 1.29 0.00 0.00 0.02 0.00 0.00 55.97 57.35 1rkd s LYS 289 Cb -0.10 -2.53 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 1rkd s LYS 289 CO 0.04 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 1rkd n GLY 290 N 0.10 -0.46 0.00 -3.33 0.00 -1.26 -4.08 105.19 96.15 1rkd n GLY 290 Ca 0.04 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1rkd n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rkd n ALA 291 N -0.41 0.00 -0.35 4.61 0.00 -1.26 -4.24 120.51 118.86 1rkd n ALA 291 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1rkd n ALA 291 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.65 1rkd n ALA 291 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1rkd h GLN 292 N 0.00 0.98 0.00 0.00 4.15 -1.92 -0.67 115.11 117.64 1rkd h GLN 292 Ca 0.00 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 1rkd h GLN 292 Cb 0.00 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.47 1rkd h GLN 292 CO 0.00 0.65 -0.10 -1.35 -1.93 0.00 0.00 178.83 176.10 1rkd h PRO 293 N 1.01 0.00 0.00 -2.39 0.11 -1.85 -2.50 132.00 126.37 1rkd h PRO 293 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1rkd h PRO 293 Cb 0.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1rkd h PRO 293 CO -0.23 0.10 0.00 -1.13 -0.21 0.00 0.00 178.00 176.52 1rkd n SER 294 N -3.61 0.06 -4.70 -2.05 3.41 -0.26 -4.86 113.62 101.62 1rkd n SER 294 Ca -0.02 0.51 -0.42 0.00 -0.26 0.00 0.00 58.87 58.68 1rkd n SER 294 Cb 0.22 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.62 1rkd n SER 294 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1rkd s VAL 295 N -3.01 3.58 0.59 -3.33 1.01 -0.94 -3.97 120.40 114.33 1rkd s VAL 295 Ca 0.12 1.03 -0.12 0.00 0.00 0.00 0.00 61.98 63.01 1rkd s VAL 295 Cb 0.16 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 1rkd s VAL 295 CO 0.48 0.02 1.02 -2.16 0.00 0.00 0.00 175.10 174.46 1rkd s PRO 296 N 2.05 3.68 0.37 2.72 0.04 -1.26 -5.02 135.00 137.58 1rkd s PRO 296 Ca 0.64 0.79 -0.00 0.00 0.04 0.00 0.00 61.00 62.47 1rkd s PRO 296 Cb -0.33 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 1rkd s PRO 296 CO 0.28 -0.50 0.59 -1.58 0.04 0.00 0.00 177.00 175.84 1rkd s TRP 297 N -3.05 3.50 0.17 0.56 0.52 -1.26 -4.28 118.94 115.10 1rkd s TRP 297 Ca 0.56 0.42 -0.16 0.00 0.02 0.00 0.00 56.10 56.94 1rkd s TRP 297 Cb -0.11 -1.98 0.13 0.00 -1.15 0.00 0.00 33.47 30.36 1rkd s TRP 297 CO 0.49 0.03 1.67 -0.09 0.02 0.00 0.00 176.95 179.07 1rkd h ARG 298 N 0.64 0.04 -0.81 4.98 9.65 -1.23 -1.20 114.38 126.46 1rkd h ARG 298 Ca -0.49 -0.00 0.07 0.00 -1.10 0.00 0.00 59.98 58.46 1rkd h ARG 298 Cb 1.22 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.73 1rkd h ARG 298 CO 0.61 0.03 0.53 0.93 2.80 0.00 0.00 179.97 184.87 1rkd h GLU 299 N 0.05 0.82 -0.41 0.20 3.07 -1.95 -1.16 114.58 115.20 1rkd h GLU 299 Ca 0.21 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 58.88 1rkd h GLU 299 Cb 0.32 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 1rkd h GLU 299 CO -0.41 0.54 -0.32 0.93 -1.40 0.00 0.00 179.01 178.35 1rkd h GLU 300 N 0.84 0.93 -0.10 2.33 5.08 -1.63 -1.51 114.58 120.53 1rkd h GLU 300 Ca 0.36 -0.45 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1rkd h GLU 300 Cb 0.30 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1rkd h GLU 300 CO -0.13 1.11 0.04 0.82 -1.00 0.00 0.00 179.01 179.85 1rkd h ILE 301 N 0.78 1.12 -0.68 3.13 2.04 -0.73 -1.62 117.51 121.55 1rkd h ILE 301 Ca 0.08 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1rkd h ILE 301 Cb 0.90 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1rkd h ILE 301 CO 0.08 0.11 0.42 0.44 0.00 0.00 0.00 178.15 179.19 1rkd h ASP 302 N 0.03 0.81 -0.99 1.72 3.32 -1.16 -0.91 116.42 119.23 1rkd h ASP 302 Ca 0.03 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.03 1rkd h ASP 302 Cb 0.13 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.43 1rkd h ASP 302 CO -0.00 0.62 0.64 0.00 -1.72 0.00 0.00 179.24 178.78 1rkd h ALA 303 N 1.22 1.26 -0.60 3.45 0.00 -1.18 0.34 119.26 123.76 1rkd h ALA 303 Ca 0.24 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1rkd h ALA 303 Cb -0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 17.79 17.32 1rkd h ALA 303 CO -0.05 0.67 0.23 0.35 0.00 0.00 0.00 179.25 180.45 1rkd h PHE 304 N 1.35 0.93 -0.30 0.00 3.04 -0.81 -2.12 116.94 119.03 1rkd h PHE 304 Ca 0.36 -0.08 -0.10 0.00 3.98 0.00 0.00 57.97 62.13 1rkd h PHE 304 Cb -0.13 -0.28 -0.01 0.00 2.56 0.00 0.00 35.95 38.10 1rkd h PHE 304 CO 0.00 0.75 -0.21 -0.07 -2.02 0.00 0.00 178.31 176.77 1rkd h LEU 305 N 0.84 0.70 -1.46 0.59 3.38 -0.29 -2.91 115.31 116.16 1rkd h LEU 305 Ca 0.20 -0.44 0.11 0.00 0.09 0.00 0.00 57.88 57.84 1rkd h LEU 305 Cb 0.23 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1rkd h LEU 305 CO -0.01 0.98 0.49 0.44 0.09 0.00 0.00 178.44 180.43 1rkd h ASP 306 N 0.42 0.53 1.02 -0.43 3.32 -0.17 0.40 116.42 121.50 1rkd h ASP 306 Ca 0.06 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1rkd h ASP 306 Cb 0.75 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.21 1rkd h ASP 306 CO 0.06 0.30 0.00 0.54 -1.72 0.00 0.00 179.24 178.42 1rkd n ARG 307 N -4.50 0.07 -2.83 3.56 1.74 -0.81 -4.66 116.66 109.23 1rkd n ARG 307 Ca 0.13 0.12 -0.43 0.00 -0.77 0.00 0.00 57.85 56.89 1rkd n ARG 307 Cb 0.39 -1.60 -0.01 0.00 -1.02 0.00 0.00 32.46 30.22 1rkd n ARG 307 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1rkd s GLN 308 N -3.04 3.87 0.00 5.56 2.00 0.13 -5.10 119.66 123.07 1rkd s GLN 308 Ca 0.11 -2.06 0.00 0.00 -2.00 0.00 0.00 55.36 51.42 1rkd s GLN 308 Cb 0.15 -5.14 0.00 0.00 0.80 0.00 0.00 33.01 28.82 1rkd s GLN 308 CO 0.50 -1.91 0.30 0.54 -0.50 0.00 0.00 175.29 174.22