#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fsg s GLU 3 N 0.00 3.19 0.32 1.64 2.12 -1.26 -4.58 118.70 120.12 3fsg s GLU 3 Ca 0.00 -0.29 0.10 0.00 0.36 0.00 0.00 54.97 55.14 3fsg s GLU 3 Cb 0.00 -2.97 -0.06 0.00 0.26 0.00 0.00 34.13 31.37 3fsg s GLU 3 CO 0.00 0.73 -0.08 0.71 -0.54 0.00 0.00 175.26 176.08 3fsg s TYR 4 N -0.97 2.45 -0.05 5.30 2.02 0.04 -4.97 117.35 121.16 3fsg s TYR 4 Ca 0.15 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.42 3fsg s TYR 4 Cb -0.12 -1.29 0.04 0.00 -0.40 0.00 0.00 41.96 40.19 3fsg s TYR 4 CO 0.04 0.59 0.11 -1.17 -1.57 0.00 0.00 175.55 173.55 3fsg s LEU 5 N -3.62 0.85 0.82 -1.29 2.96 -1.26 -1.23 118.68 115.91 3fsg s LEU 5 Ca 0.32 0.23 -0.12 0.00 -0.22 0.00 0.00 54.13 54.34 3fsg s LEU 5 Cb -0.01 0.25 0.08 0.00 0.50 0.00 0.00 46.19 47.00 3fsg s LEU 5 CO 0.17 -0.14 1.18 0.42 -1.32 0.00 0.00 176.35 176.66 3fsg s THR 6 N 1.10 2.02 0.48 3.68 -4.23 -0.57 -4.92 115.64 113.20 3fsg s THR 6 Ca -0.09 0.01 0.34 0.00 -1.18 0.00 0.00 61.69 60.77 3fsg s THR 6 Cb -0.11 -2.99 0.36 0.00 1.34 0.00 0.00 72.50 71.10 3fsg s THR 6 CO -0.05 -0.01 2.18 0.03 -0.54 0.00 0.00 174.62 176.24 3fsg h ARG 7 N -1.08 0.00 -0.18 3.99 3.08 -1.98 -0.67 114.38 117.54 3fsg h ARG 7 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3fsg h ARG 7 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 3fsg h ARG 7 CO 0.66 0.05 0.00 -1.13 -1.07 0.00 0.00 179.97 178.47 3fsg n SER 8 N -3.46 1.05 -3.59 7.04 3.41 -1.26 -4.91 113.62 111.90 3fsg n SER 8 Ca -0.02 -1.92 -0.23 0.00 -0.26 0.00 0.00 58.87 56.43 3fsg n SER 8 Cb 0.17 -0.12 0.08 0.00 -0.26 0.00 0.00 64.21 64.08 3fsg n SER 8 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3fsg n ASN 9 N 0.04 -5.81 -4.43 4.04 3.02 -0.26 -4.95 115.26 106.91 3fsg n ASN 9 Ca 0.08 -0.56 -0.36 0.00 -0.03 0.00 0.00 54.58 53.72 3fsg n ASN 9 Cb 0.18 -5.01 -0.13 0.00 -0.61 0.00 0.00 39.78 34.21 3fsg n ASN 9 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fsg s ILE 10 N -3.33 4.16 0.23 2.41 -1.09 -1.26 -2.95 121.20 119.38 3fsg s ILE 10 Ca 0.52 -0.23 -0.30 0.00 -2.23 0.00 0.00 60.65 58.41 3fsg s ILE 10 Cb -0.23 -2.93 -0.09 0.00 -1.58 0.00 0.00 42.46 37.63 3fsg s ILE 10 CO 0.73 0.36 1.02 -0.55 -1.23 0.00 0.00 174.94 175.28 3fsg s SER 11 N 1.48 7.44 0.14 3.58 0.15 -1.26 -1.51 113.70 123.73 3fsg s SER 11 Ca 0.06 2.07 -0.20 0.00 0.70 0.00 0.00 55.95 58.58 3fsg s SER 11 Cb -0.15 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.60 3fsg s SER 11 CO 0.02 -0.03 0.50 -0.72 1.20 0.00 0.00 173.24 174.22 3fsg s TYR 12 N -0.91 -0.38 0.10 3.44 -0.85 -0.36 -1.06 117.35 117.33 3fsg s TYR 12 Ca 0.44 0.11 0.05 0.00 -0.52 0.00 0.00 57.07 57.15 3fsg s TYR 12 Cb -0.28 0.41 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 3fsg s TYR 12 CO 0.35 -0.78 0.01 -0.06 -1.52 0.00 0.00 175.55 173.56 3fsg s PHE 13 N -3.77 3.00 -0.12 -3.49 0.08 -0.57 -0.78 117.98 112.33 3fsg s PHE 13 Ca 0.02 -0.02 -0.04 0.00 0.12 0.00 0.00 56.93 57.01 3fsg s PHE 13 Cb 0.00 -1.54 0.05 0.00 -0.57 0.00 0.00 43.02 40.97 3fsg s PHE 13 CO -0.12 0.49 0.09 0.45 -0.10 0.00 0.00 175.22 176.02 3fsg s SER 14 N -2.36 1.80 -0.10 1.36 0.15 -1.26 -1.09 113.70 112.20 3fsg s SER 14 Ca 0.26 -0.30 0.03 0.00 0.70 0.00 0.00 55.95 56.64 3fsg s SER 14 Cb -0.12 -0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.04 3fsg s SER 14 CO 0.19 -0.31 -0.20 -0.63 1.20 0.00 0.00 173.24 173.49 3fsg s ILE 15 N 2.16 1.83 0.00 6.45 1.01 0.11 -4.94 121.20 127.82 3fsg s ILE 15 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.81 3fsg s ILE 15 Cb -0.14 -1.61 0.00 0.00 0.01 0.00 0.00 42.46 40.72 3fsg s ILE 15 CO -0.07 0.51 0.00 0.61 0.00 0.00 0.00 174.94 175.99 3fsg n GLY 16 N 3.77 -2.13 3.12 6.18 0.00 -1.26 0.45 105.19 115.33 3fsg n GLY 16 Ca -0.20 -1.78 -0.17 0.00 0.00 0.00 0.00 46.02 43.87 3fsg n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fsg s SER 17 N -3.49 1.41 0.00 1.61 0.01 -1.18 -4.50 113.70 107.55 3fsg s SER 17 Ca 0.00 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 56.74 3fsg s SER 17 Cb 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.18 3fsg s SER 17 CO 0.00 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.20 3fsg n GLY 18 N 1.62 0.52 3.75 3.44 0.00 -1.26 -3.46 105.19 109.80 3fsg n GLY 18 Ca -0.20 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 3fsg n GLY 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fsg s THR 19 N -1.80 2.65 0.07 2.61 2.01 -1.26 -4.03 115.64 115.89 3fsg s THR 19 Ca 0.00 0.57 -0.27 0.00 0.31 0.00 0.00 61.69 62.30 3fsg s THR 19 Cb 0.00 -3.37 -0.06 0.00 0.01 0.00 0.00 72.50 69.09 3fsg s THR 19 CO 0.00 0.10 0.84 -2.16 -0.69 0.00 0.00 174.62 172.71 3fsg s PRO 20 N -0.80 4.57 -0.25 4.92 0.04 -1.26 -0.65 135.00 141.58 3fsg s PRO 20 Ca 0.56 1.21 -0.06 0.00 0.04 0.00 0.00 61.00 62.75 3fsg s PRO 20 Cb -0.41 -3.37 -0.02 0.00 0.04 0.00 0.00 34.50 30.74 3fsg s PRO 20 CO 0.47 0.26 0.04 0.42 0.04 0.00 0.00 177.00 178.22 3fsg s ILE 21 N -0.03 4.02 -0.36 0.56 1.01 0.58 -1.14 121.20 125.83 3fsg s ILE 21 Ca 0.42 -0.32 -0.16 0.00 0.00 0.00 0.00 60.65 60.59 3fsg s ILE 21 Cb -0.22 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.36 3fsg s ILE 21 CO 0.25 0.33 0.38 -0.63 0.00 0.00 0.00 174.94 175.28 3fsg s ILE 22 N 1.57 5.15 -0.26 2.92 -1.09 0.19 -0.45 121.20 129.23 3fsg s ILE 22 Ca 0.06 -0.02 -0.11 0.00 -2.23 0.00 0.00 60.65 58.34 3fsg s ILE 22 Cb -0.15 -3.87 -0.05 0.00 -1.58 0.00 0.00 42.46 36.81 3fsg s ILE 22 CO 0.02 -0.16 0.20 -0.36 -1.23 0.00 0.00 174.94 173.40 3fsg s PHE 23 N 2.06 3.27 -0.15 3.97 0.08 0.86 -1.21 117.98 126.86 3fsg s PHE 23 Ca 0.12 0.22 -0.01 0.00 0.12 0.00 0.00 56.93 57.38 3fsg s PHE 23 Cb -0.17 -2.35 -0.01 0.00 -0.57 0.00 0.00 43.02 39.92 3fsg s PHE 23 CO 0.12 -0.05 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.56 3fsg s LEU 24 N 1.43 2.68 0.67 -0.37 1.43 0.32 -2.68 118.68 122.15 3fsg s LEU 24 Ca 0.08 -0.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.80 3fsg s LEU 24 Cb -0.15 -1.62 0.09 0.00 0.03 0.00 0.00 46.19 44.55 3fsg s LEU 24 CO 0.08 0.12 0.93 -1.38 0.23 0.00 0.00 176.35 176.33 3fsg s HIS 25 N 0.63 2.10 0.83 0.29 -3.43 -1.26 -1.69 115.29 112.75 3fsg s HIS 25 Ca -0.07 -0.12 -0.12 0.00 -0.80 0.00 0.00 55.06 53.95 3fsg s HIS 25 Cb -0.15 -2.95 0.09 0.00 -1.43 0.00 0.00 32.58 28.13 3fsg s HIS 25 CO 0.03 -1.44 1.16 0.20 -2.00 0.00 0.00 174.74 172.68 3fsg s GLY 26 N -4.62 1.59 0.22 -1.38 0.00 -1.19 -2.24 107.32 99.70 3fsg s GLY 26 Ca 0.63 -0.57 -0.32 0.00 0.00 0.00 0.00 44.72 44.47 3fsg s GLY 26 CO 0.43 -0.07 1.71 -2.27 0.00 0.00 0.00 173.10 172.90 3fsg s LEU 27 N -5.71 4.37 0.00 0.66 2.96 -1.26 -2.25 118.68 117.44 3fsg s LEU 27 Ca 0.62 2.89 0.00 0.00 -0.22 0.00 0.00 54.13 57.42 3fsg s LEU 27 Cb -0.12 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.96 3fsg s LEU 27 CO 0.51 -0.97 0.00 -1.20 -1.32 0.00 0.00 176.35 173.37 3fsg n SER 28 N 3.72 0.00 -2.85 3.68 7.64 -1.26 -5.01 113.62 119.54 3fsg n SER 28 Ca 0.15 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.95 3fsg n SER 28 Cb 0.35 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.59 3fsg n SER 28 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fsg n LEU 29 N 0.00 0.00 0.00 -3.43 4.77 -0.95 -2.90 117.00 114.48 3fsg n LEU 29 Ca 0.00 -0.71 -0.02 0.00 -0.03 0.00 0.00 56.01 55.25 3fsg n LEU 29 Cb 0.00 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 40.87 3fsg n LEU 29 CO 0.00 -0.66 0.01 -0.90 -1.33 0.00 0.00 177.39 174.51 3fsg n ASP 30 N -2.96 -0.14 0.00 -1.43 5.75 -1.26 -4.24 116.55 112.27 3fsg n ASP 30 Ca 0.05 -1.25 0.10 0.00 -0.01 0.00 0.00 54.79 53.69 3fsg n ASP 30 Cb 0.20 0.28 0.53 0.00 -1.03 0.00 0.00 41.12 41.09 3fsg n ASP 30 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 3fsg n LYS 31 N -0.07 0.26 0.11 0.11 2.85 -1.26 -1.37 118.16 118.79 3fsg n LYS 31 Ca 0.00 0.09 0.01 0.00 -1.05 0.00 0.00 58.31 57.36 3fsg n LYS 31 Cb 0.07 -1.50 0.32 0.00 -0.65 0.00 0.00 35.03 33.28 3fsg n LYS 31 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 3fsg h GLN 32 N 0.00 0.24 -0.50 -1.58 1.08 -1.94 -3.11 115.11 109.30 3fsg h GLN 32 Ca 0.00 -0.08 -0.08 0.00 -1.45 0.00 0.00 58.65 57.04 3fsg h GLN 32 Cb 0.22 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 3fsg h GLN 32 CO 0.00 0.47 -0.02 0.66 -0.95 0.00 0.00 178.83 178.99 3fsg h SER 33 N 0.22 0.82 -0.20 1.46 4.64 -1.26 -2.03 113.55 117.20 3fsg h SER 33 Ca 0.04 -0.21 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 3fsg h SER 33 Cb 0.54 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 3fsg h SER 33 CO 0.04 0.90 0.06 0.35 -0.87 0.00 0.00 176.83 177.30 3fsg n THR 34 N -4.20 1.06 0.00 2.95 -2.24 -1.17 -3.86 114.28 106.82 3fsg n THR 34 Ca 0.02 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3fsg n THR 34 Cb 0.32 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 3fsg n THR 34 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3fsg n LEU 36 N 0.13 0.00 -0.08 3.22 4.77 -0.76 -1.53 117.00 122.74 3fsg n LEU 36 Ca 0.11 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.93 3fsg n LEU 36 Cb 0.62 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.59 3fsg n LEU 36 CO 0.12 0.00 0.12 0.15 -1.33 0.00 0.00 177.39 176.45 3fsg h PHE 37 N 0.00 0.00 0.06 -1.77 3.57 -1.76 -3.41 116.94 113.63 3fsg h PHE 37 Ca 0.00 0.00 -0.25 0.00 3.53 0.00 0.00 57.97 61.25 3fsg h PHE 37 Cb 0.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3fsg h PHE 37 CO 0.00 1.13 -1.17 0.74 -2.23 0.00 0.00 178.31 176.78 3fsg h PHE 38 N -1.00 0.24 -0.53 0.41 0.04 -1.58 -3.25 116.94 111.27 3fsg h PHE 38 Ca -0.10 -0.17 0.01 0.00 2.80 0.00 0.00 57.97 60.50 3fsg h PHE 38 Cb 1.08 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 39.19 3fsg h PHE 38 CO 0.22 1.14 0.35 0.93 -0.60 0.00 0.00 178.31 180.36 3fsg h GLU 39 N 0.04 0.69 0.07 1.51 4.39 -1.79 -3.06 114.58 116.42 3fsg h GLU 39 Ca -0.09 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 3fsg h GLU 39 Cb 1.88 -0.16 0.01 0.00 -0.10 0.00 0.00 28.75 30.39 3fsg h GLU 39 CO 0.16 0.46 -0.43 -1.00 -1.16 0.00 0.00 179.01 177.04 3fsg h PRO 40 N 0.71 0.15 -5.40 2.33 0.13 -1.79 -3.38 132.00 124.76 3fsg h PRO 40 Ca 0.19 -0.26 -0.69 0.00 -0.87 0.00 0.00 66.00 64.37 3fsg h PRO 40 Cb -0.08 0.10 -0.08 0.00 0.13 0.00 0.00 31.00 31.07 3fsg h PRO 40 CO -0.04 1.12 2.32 1.28 -0.23 0.00 0.00 178.00 182.46 3fsg n LEU 41 N -4.36 5.35 -3.89 1.56 4.32 -1.16 -4.94 117.00 113.89 3fsg n LEU 41 Ca -0.12 -4.01 -0.26 0.00 -0.02 0.00 0.00 56.01 51.60 3fsg n LEU 41 Cb 0.66 -1.72 -0.17 0.00 -1.62 0.00 0.00 43.42 40.57 3fsg n LEU 41 CO 0.41 0.39 -0.43 -0.94 -1.22 0.00 0.00 177.39 175.60 3fsg s SER 42 N 3.88 2.03 -0.47 -1.43 1.04 -1.24 -4.77 113.70 112.74 3fsg s SER 42 Ca 0.52 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.71 3fsg s SER 42 Cb 0.06 -0.76 0.46 0.00 0.10 0.00 0.00 66.02 65.87 3fsg s SER 42 CO 0.04 -0.12 1.60 -3.20 0.98 0.00 0.00 173.24 172.54 3fsg n ASN 43 N 4.90 6.20 -0.22 7.02 4.05 -1.26 -4.64 115.26 131.31 3fsg n ASN 43 Ca -0.12 -3.77 0.12 0.00 0.45 0.00 0.00 54.58 51.25 3fsg n ASN 43 Cb 0.50 -0.65 0.12 0.00 1.23 0.00 0.00 39.78 40.98 3fsg n ASN 43 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 3fsg n VAL 44 N -0.82 0.00 -0.36 3.44 0.24 -1.26 -4.59 118.33 114.98 3fsg n VAL 44 Ca 0.53 -0.11 0.27 0.00 -2.04 0.00 0.00 64.34 62.99 3fsg n VAL 44 Cb 0.83 0.77 0.53 0.00 -1.47 0.00 0.00 33.84 34.49 3fsg n VAL 44 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3fsg h GLY 45 N 4.93 1.72 -1.83 7.63 0.00 -1.96 -0.34 103.07 113.22 3fsg h GLY 45 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.13 3fsg h GLY 45 CO 0.00 -0.40 0.00 -1.06 0.00 0.00 0.00 176.54 175.08 3fsg n GLN 46 N -4.88 2.42 -4.50 4.80 6.02 -1.26 -4.74 117.38 115.24 3fsg n GLN 46 Ca 0.32 -1.45 -0.25 0.00 -0.01 0.00 0.00 57.00 55.61 3fsg n GLN 46 Cb 1.08 -1.60 -0.10 0.00 1.02 0.00 0.00 30.24 30.64 3fsg n GLN 46 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3fsg s TYR 47 N -1.70 2.41 -0.40 1.08 1.51 -0.14 -4.06 117.35 116.05 3fsg s TYR 47 Ca 0.26 -0.46 -0.17 0.00 -1.01 0.00 0.00 57.07 55.69 3fsg s TYR 47 Cb 0.17 -1.34 0.01 0.00 -0.11 0.00 0.00 41.96 40.69 3fsg s TYR 47 CO 0.12 0.59 0.43 -1.14 -1.11 0.00 0.00 175.55 174.44 3fsg s GLN 48 N -3.61 3.22 -0.32 -0.62 0.74 0.18 -3.10 119.66 116.16 3fsg s GLN 48 Ca 0.32 -0.65 -0.16 0.00 0.05 0.00 0.00 55.36 54.92 3fsg s GLN 48 Cb 0.01 -3.92 -0.02 0.00 1.10 0.00 0.00 33.01 30.18 3fsg s GLN 48 CO 0.17 -0.77 0.44 1.03 -0.55 0.00 0.00 175.29 175.60 3fsg s ARG 49 N 2.13 3.77 -0.26 1.67 3.00 0.17 -0.31 118.95 129.13 3fsg s ARG 49 Ca 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 55.73 55.72 3fsg s ARG 49 Cb -0.17 -3.75 0.03 0.00 0.00 0.00 0.00 34.95 31.07 3fsg s ARG 49 CO 0.13 -0.48 -0.06 0.42 0.00 0.00 0.00 175.30 175.31 3fsg s ILE 50 N 2.20 2.82 -0.38 1.52 1.01 0.41 0.06 121.20 128.84 3fsg s ILE 50 Ca 0.16 -1.13 -0.07 0.00 0.00 0.00 0.00 60.65 59.62 3fsg s ILE 50 Cb -0.16 -2.48 0.07 0.00 0.01 0.00 0.00 42.46 39.90 3fsg s ILE 50 CO 0.11 0.14 0.18 -0.31 0.00 0.00 0.00 174.94 175.06 3fsg s TYR 51 N 1.30 3.34 0.06 3.97 2.02 -0.25 -0.10 117.35 127.68 3fsg s TYR 51 Ca -0.01 -1.66 -0.11 0.00 -0.37 0.00 0.00 57.07 54.92 3fsg s TYR 51 Cb -0.17 -2.70 -0.06 0.00 -0.40 0.00 0.00 41.96 38.63 3fsg s TYR 51 CO -0.04 -0.82 0.40 -0.51 -1.57 0.00 0.00 175.55 173.01 3fsg s LEU 52 N 1.36 4.38 -0.19 -1.29 1.43 -1.09 -1.51 118.68 121.77 3fsg s LEU 52 Ca 0.02 0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 53.78 3fsg s LEU 52 Cb -0.21 -2.87 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 3fsg s LEU 52 CO 0.01 0.21 0.45 -1.81 0.23 0.00 0.00 176.35 175.45 3fsg s ASP 53 N -1.57 6.52 0.62 2.29 1.01 -0.22 -4.33 116.67 120.99 3fsg s ASP 53 Ca 0.30 0.62 -0.18 0.00 0.71 0.00 0.00 52.55 54.00 3fsg s ASP 53 Cb -0.15 -2.26 -0.02 0.00 1.01 0.00 0.00 42.92 41.50 3fsg s ASP 53 CO 0.17 -0.10 1.23 -0.76 0.21 0.00 0.00 175.17 175.92 3fsg s LEU 54 N 1.32 3.60 0.20 1.23 1.43 -1.26 -4.30 118.68 120.90 3fsg s LEU 54 Ca 0.22 2.45 -0.31 0.00 -1.03 0.00 0.00 54.13 55.46 3fsg s LEU 54 Cb -0.15 -4.60 -0.16 0.00 0.03 0.00 0.00 46.19 41.31 3fsg s LEU 54 CO 0.09 -1.77 1.00 -2.65 0.23 0.00 0.00 176.35 173.24 3fsg n PRO 55 N -1.79 0.96 -2.34 1.29 -0.02 -1.26 -4.48 135.00 127.36 3fsg n PRO 55 Ca 0.14 0.34 -0.02 0.00 -2.02 0.00 0.00 63.50 61.95 3fsg n PRO 55 Cb 0.49 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 3fsg n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fsg n GLY 56 N 1.73 0.62 0.00 -1.23 0.00 -1.00 -4.83 105.19 100.49 3fsg n GLY 56 Ca 0.14 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3fsg n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fsg n GLY 58 N -0.78 0.00 1.55 -0.02 0.00 -1.26 -1.09 105.19 103.59 3fsg n GLY 58 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 3fsg n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fsg n ASN 59 N 0.00 4.79 -4.79 1.61 3.02 -1.26 -4.78 115.26 113.85 3fsg n ASN 59 Ca 0.00 -3.07 -0.38 0.00 -0.03 0.00 0.00 54.58 51.10 3fsg n ASN 59 Cb 0.00 -0.65 -0.06 0.00 -0.61 0.00 0.00 39.78 38.46 3fsg n ASN 59 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3fsg s SER 60 N -1.32 6.71 0.58 6.41 0.01 -1.26 -4.35 113.70 120.48 3fsg s SER 60 Ca 0.50 0.84 -0.19 0.00 1.31 0.00 0.00 55.95 58.41 3fsg s SER 60 Cb 0.40 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 64.34 3fsg s SER 60 CO 0.12 0.20 1.21 -1.81 0.41 0.00 0.00 173.24 173.38 3fsg s ASP 61 N -0.38 5.26 0.96 2.44 1.01 -1.15 -2.38 116.67 122.43 3fsg s ASP 61 Ca 0.23 2.40 -0.12 0.00 0.71 0.00 0.00 52.55 55.77 3fsg s ASP 61 Cb -0.16 -2.60 0.17 0.00 1.01 0.00 0.00 42.92 41.34 3fsg s ASP 61 CO 0.11 -1.55 1.09 -2.16 0.21 0.00 0.00 175.17 172.87 3fsg s PRO 62 N -3.27 0.70 0.08 8.23 0.04 -1.26 -2.54 135.00 136.98 3fsg s PRO 62 Ca 0.76 0.84 0.01 0.00 0.04 0.00 0.00 61.00 62.66 3fsg s PRO 62 Cb -0.31 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3fsg s PRO 62 CO 0.34 -2.63 -0.06 0.96 0.04 0.00 0.00 177.00 175.65 3fsg s ILE 63 N -2.83 0.59 -0.04 0.56 -4.36 -1.26 -4.82 121.20 109.05 3fsg s ILE 63 Ca 0.65 -1.81 0.02 0.00 -0.26 0.00 0.00 60.65 59.25 3fsg s ILE 63 Cb -0.20 -1.53 0.01 0.00 1.25 0.00 0.00 42.46 42.00 3fsg s ILE 63 CO 0.58 -0.84 -0.09 -0.44 0.24 0.00 0.00 174.94 174.40 3fsg s SER 64 N -2.85 1.25 0.95 4.36 0.01 -1.26 -3.57 113.70 112.59 3fsg s SER 64 Ca 0.08 -0.19 -0.12 0.00 1.31 0.00 0.00 55.95 57.03 3fsg s SER 64 Cb 0.04 -0.43 0.16 0.00 0.21 0.00 0.00 66.02 66.00 3fsg s SER 64 CO -0.05 0.04 1.09 -2.16 0.41 0.00 0.00 173.24 172.57 3fsg s PRO 65 N 0.40 0.82 -1.08 12.44 0.04 -1.26 -5.07 135.00 141.30 3fsg s PRO 65 Ca -0.07 0.69 -0.06 0.00 0.04 0.00 0.00 61.00 61.61 3fsg s PRO 65 Cb -0.11 -1.77 0.29 0.00 0.04 0.00 0.00 34.50 32.95 3fsg s PRO 65 CO 0.01 -2.51 1.22 -1.13 0.04 0.00 0.00 177.00 174.64 3fsg n SER 66 N -4.05 5.73 -4.15 6.66 3.41 -1.23 -4.81 113.62 115.17 3fsg n SER 66 Ca 0.06 -3.20 -0.15 0.00 -0.26 0.00 0.00 58.87 55.32 3fsg n SER 66 Cb 0.56 -1.30 -0.11 0.00 -0.26 0.00 0.00 64.21 63.10 3fsg n SER 66 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3fsg s THR 67 N -1.91 0.91 0.34 6.66 -4.23 -1.26 -3.88 115.64 112.26 3fsg s THR 67 Ca 0.31 -1.44 0.02 0.00 -1.18 0.00 0.00 61.69 59.40 3fsg s THR 67 Cb -0.03 -1.13 0.27 0.00 1.34 0.00 0.00 72.50 72.95 3fsg s THR 67 CO -0.01 -0.43 1.97 0.28 -0.54 0.00 0.00 174.62 175.89 3fsg h SER 68 N 3.94 0.78 -0.77 3.99 0.02 -1.66 0.07 113.55 119.93 3fsg h SER 68 Ca -0.38 -0.01 0.08 0.00 -0.84 0.00 0.00 61.79 60.64 3fsg h SER 68 Cb 1.19 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.50 3fsg h SER 68 CO 0.47 0.54 0.50 0.44 -1.14 0.00 0.00 176.83 177.64 3fsg h ASP 69 N 0.91 0.68 0.67 3.07 3.32 -1.83 -0.20 116.42 123.03 3fsg h ASP 69 Ca 0.29 0.01 -0.27 0.00 0.02 0.00 0.00 57.03 57.09 3fsg h ASP 69 Cb 0.05 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 3fsg h ASP 69 CO -0.08 0.42 -1.40 -1.13 -1.72 0.00 0.00 179.24 175.34 3fsg h ASN 70 N 0.76 0.12 -0.52 6.45 -0.00 -1.68 -2.08 115.58 118.62 3fsg h ASN 70 Ca 0.34 -0.16 0.06 0.00 -0.00 0.00 0.00 56.30 56.54 3fsg h ASN 70 Cb 0.34 -0.04 -0.05 0.00 -0.00 0.00 0.00 38.32 38.56 3fsg h ASN 70 CO -0.12 1.14 0.22 0.58 -0.00 0.00 0.00 177.43 179.25 3fsg h VAL 71 N 0.02 0.88 0.29 2.57 2.07 -0.37 -0.90 116.25 120.80 3fsg h VAL 71 Ca -0.17 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 3fsg h VAL 71 Cb 1.92 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3fsg h VAL 71 CO 0.12 0.08 -0.22 0.25 0.02 0.00 0.00 177.57 177.82 3fsg h LEU 72 N 0.43 -0.57 -0.54 2.57 5.85 -1.04 -1.28 115.31 120.73 3fsg h LEU 72 Ca 0.24 0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.11 3fsg h LEU 72 Cb 0.22 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 3fsg h LEU 72 CO -0.21 -0.34 0.02 -0.08 -0.34 0.00 0.00 178.44 177.49 3fsg h GLU 73 N -0.51 0.14 -0.67 1.25 4.57 -1.07 0.51 114.58 118.79 3fsg h GLU 73 Ca -0.02 -0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.23 3fsg h GLU 73 Cb 0.45 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.95 3fsg h GLU 73 CO -0.01 0.09 0.35 1.15 -1.18 0.00 0.00 179.01 179.41 3fsg h THR 74 N 0.14 0.91 -0.33 0.32 2.02 -0.95 -1.91 112.91 113.11 3fsg h THR 74 Ca 0.28 -0.22 -0.12 0.00 0.77 0.00 0.00 66.41 67.12 3fsg h THR 74 Cb 0.42 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3fsg h THR 74 CO -0.44 0.11 -0.30 -0.07 0.37 0.00 0.00 175.52 175.20 3fsg h LEU 75 N 0.63 0.74 -0.39 2.58 3.38 0.21 -0.79 115.31 121.67 3fsg h LEU 75 Ca 0.32 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3fsg h LEU 75 Cb 0.27 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3fsg h LEU 75 CO -0.22 0.99 0.14 0.40 0.09 0.00 0.00 178.44 179.84 3fsg h ILE 76 N 0.61 1.20 -0.04 1.22 2.04 -0.71 -0.50 117.51 121.33 3fsg h ILE 76 Ca 0.07 -0.64 0.04 0.00 1.00 0.00 0.00 64.86 65.33 3fsg h ILE 76 Cb 0.81 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 3fsg h ILE 76 CO 0.07 0.23 -0.30 -0.33 0.00 0.00 0.00 178.15 177.81 3fsg h GLU 77 N 0.48 -0.41 -0.48 2.37 5.08 -1.16 -1.62 114.58 118.84 3fsg h GLU 77 Ca 0.13 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.61 3fsg h GLU 77 Cb 0.22 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 3fsg h GLU 77 CO -0.01 -0.27 -0.02 0.00 -1.00 0.00 0.00 179.01 177.71 3fsg h ALA 78 N 0.36 0.44 0.26 3.43 0.00 -0.86 -1.29 119.26 121.60 3fsg h ALA 78 Ca 0.07 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3fsg h ALA 78 Cb 0.53 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3fsg h ALA 78 CO -0.28 -0.40 -0.13 0.82 0.00 0.00 0.00 179.25 179.26 3fsg h ILE 79 N 0.10 0.76 -0.91 0.00 2.04 -0.88 -1.05 117.51 117.57 3fsg h ILE 79 Ca 0.24 -0.16 0.18 0.00 1.00 0.00 0.00 64.86 66.13 3fsg h ILE 79 Cb 0.36 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.23 3fsg h ILE 79 CO -0.42 0.04 0.59 -0.33 0.00 0.00 0.00 178.15 178.03 3fsg h GLU 80 N -0.44 0.53 -0.33 2.37 5.08 -1.06 0.12 114.58 120.86 3fsg h GLU 80 Ca -0.04 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.12 3fsg h GLU 80 Cb 0.33 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3fsg h GLU 80 CO 0.06 0.35 -0.46 1.49 -1.00 0.00 0.00 179.01 179.45 3fsg h GLU 81 N 0.54 0.89 0.24 2.33 4.81 -0.65 0.48 114.58 123.22 3fsg h GLU 81 Ca 0.48 -0.52 -0.32 0.00 -0.13 0.00 0.00 59.36 58.88 3fsg h GLU 81 Cb 1.00 0.04 0.04 0.00 0.63 0.00 0.00 28.75 30.46 3fsg h GLU 81 CO -0.22 1.16 -1.40 0.82 -0.73 0.00 0.00 179.01 178.64 3fsg h ILE 82 N 0.68 1.30 0.00 2.32 2.04 0.19 -3.38 117.51 120.66 3fsg h ILE 82 Ca 0.03 -2.67 0.00 0.00 1.00 0.00 0.00 64.86 63.23 3fsg h ILE 82 Cb 1.06 3.06 0.00 0.00 -0.74 0.00 0.00 36.82 40.20 3fsg h ILE 82 CO 0.11 0.80 0.00 2.30 0.00 0.00 0.00 178.15 181.36 3fsg n ILE 83 N -3.77 0.13 0.00 -0.67 -5.35 0.25 -5.09 119.36 104.87 3fsg n ILE 83 Ca -0.17 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 61.88 3fsg n ILE 83 Cb 1.07 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 40.12 3fsg n ILE 83 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fsg n GLY 84 N -0.07 3.20 0.53 3.28 0.00 0.16 -1.82 105.19 110.48 3fsg n GLY 84 Ca 0.00 0.26 0.09 0.00 0.00 0.00 0.00 46.02 46.37 3fsg n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fsg n ALA 85 N 11.40 3.00 -1.66 4.61 0.00 -1.26 -4.45 120.51 132.16 3fsg n ALA 85 Ca 0.00 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.42 3fsg n ALA 85 Cb 0.00 -0.64 0.01 0.00 0.00 0.00 0.00 19.45 18.82 3fsg n ALA 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fsg n ARG 86 N 0.33 1.68 -2.39 0.00 1.74 -0.76 -4.94 116.66 112.32 3fsg n ARG 86 Ca 0.09 0.60 -0.36 0.00 -0.77 0.00 0.00 57.85 57.40 3fsg n ARG 86 Cb 0.41 -2.20 -0.02 0.00 -1.02 0.00 0.00 32.46 29.63 3fsg n ARG 86 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3fsg s ARG 87 N -2.03 3.89 0.09 5.56 0.52 -1.26 -4.96 118.95 120.76 3fsg s ARG 87 Ca 0.61 1.63 -0.07 0.00 -0.52 0.00 0.00 55.73 57.38 3fsg s ARG 87 Cb -0.55 -2.40 -0.01 0.00 0.52 0.00 0.00 34.95 32.50 3fsg s ARG 87 CO 0.58 -0.40 0.15 -0.59 0.02 0.00 0.00 175.30 175.06 3fsg s PHE 88 N -1.64 0.29 -0.08 -0.53 -0.12 0.41 -4.23 117.98 112.07 3fsg s PHE 88 Ca 0.62 -0.74 -0.03 0.00 -0.05 0.00 0.00 56.93 56.74 3fsg s PHE 88 Cb -0.25 -0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 41.96 3fsg s PHE 88 CO 0.30 -0.53 0.04 0.42 -0.05 0.00 0.00 175.22 175.40 3fsg s ILE 89 N -3.90 4.63 -0.09 -4.49 1.01 -0.29 0.60 121.20 118.67 3fsg s ILE 89 Ca 0.08 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.59 3fsg s ILE 89 Cb 0.05 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.52 3fsg s ILE 89 CO -0.09 0.58 -0.15 -0.76 0.00 0.00 0.00 174.94 174.52 3fsg s LEU 90 N -1.01 2.62 -0.07 2.97 1.43 0.13 -0.64 118.68 124.11 3fsg s LEU 90 Ca 0.15 -0.31 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 3fsg s LEU 90 Cb -0.12 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 3fsg s LEU 90 CO 0.04 0.25 -0.21 -0.47 0.23 0.00 0.00 176.35 176.18 3fsg s TYR 91 N -0.16 2.55 -0.05 0.29 5.04 -0.35 -0.71 117.35 123.96 3fsg s TYR 91 Ca -0.01 -0.66 -0.03 0.00 -2.44 0.00 0.00 57.07 53.93 3fsg s TYR 91 Cb -0.14 -1.66 0.03 0.00 0.35 0.00 0.00 41.96 40.55 3fsg s TYR 91 CO 0.03 -0.18 0.12 0.20 -1.34 0.00 0.00 175.55 174.38 3fsg s GLY 92 N -0.11 -0.02 -0.20 8.97 0.00 -0.31 -0.52 107.32 115.13 3fsg s GLY 92 Ca -0.04 0.52 -0.06 0.00 0.00 0.00 0.00 44.72 45.13 3fsg s GLY 92 CO 0.04 0.75 0.04 -1.58 0.00 0.00 0.00 173.10 172.35 3fsg s HIS 93 N 0.86 3.13 0.00 1.90 2.46 -0.68 -0.85 115.29 122.11 3fsg s HIS 93 Ca -0.07 -0.19 0.00 0.00 0.47 0.00 0.00 55.06 55.28 3fsg s HIS 93 Cb -0.09 -2.10 0.00 0.00 -0.13 0.00 0.00 32.58 30.27 3fsg s HIS 93 CO -0.04 -0.06 0.00 0.45 -2.47 0.00 0.00 174.74 172.62 3fsg n SER 94 N 3.98 0.00 -0.32 9.88 2.88 -0.61 -0.82 113.62 128.61 3fsg n SER 94 Ca -0.17 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.44 3fsg n SER 94 Cb 0.52 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 64.24 3fsg n SER 94 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3fsg h TYR 95 N 0.00 1.05 -0.47 0.66 3.20 -1.85 0.12 116.97 119.68 3fsg h TYR 95 Ca 0.00 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.98 3fsg h TYR 95 Cb 0.00 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 37.91 3fsg h TYR 95 CO 0.00 0.47 0.32 0.78 -1.64 0.00 0.00 178.16 178.09 3fsg h GLY 96 N 0.96 0.39 2.00 1.82 0.00 -0.51 -2.13 103.07 105.60 3fsg h GLY 96 Ca 0.45 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.53 3fsg h GLY 96 CO -0.21 0.08 -0.62 -1.33 0.00 0.00 0.00 176.54 174.46 3fsg h GLY 97 N 0.30 0.00 0.95 4.60 0.00 -0.68 0.16 103.07 108.39 3fsg h GLY 97 Ca 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 3fsg h GLY 97 CO -0.05 0.00 0.10 -1.82 0.00 0.00 0.00 176.54 174.77 3fsg h TYR 98 N 0.00 0.24 -0.15 5.60 3.20 -0.83 -1.84 116.97 123.19 3fsg h TYR 98 Ca -0.01 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3fsg h TYR 98 Cb 1.37 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.56 3fsg h TYR 98 CO 0.00 0.22 0.10 -0.07 -1.64 0.00 0.00 178.16 176.77 3fsg h LEU 99 N 0.19 0.18 -0.49 2.82 3.38 -1.28 -2.38 115.31 117.72 3fsg h LEU 99 Ca 0.06 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.10 3fsg h LEU 99 Cb 0.06 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 40.67 3fsg h LEU 99 CO -0.01 0.16 -0.21 0.00 0.09 0.00 0.00 178.44 178.46 3fsg h ALA 100 N 1.03 0.15 -0.39 1.53 0.00 -0.88 0.15 119.26 120.84 3fsg h ALA 100 Ca 0.06 0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.21 3fsg h ALA 100 Cb 0.01 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 3fsg h ALA 100 CO -0.01 -0.55 -0.05 1.96 0.00 0.00 0.00 179.25 180.60 3fsg h GLN 101 N -0.11 0.05 -0.74 0.00 4.20 -1.10 -0.88 115.11 116.53 3fsg h GLN 101 Ca 0.23 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.98 3fsg h GLN 101 Cb 0.46 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.18 3fsg h GLN 101 CO -0.56 0.03 0.46 0.00 -0.67 0.00 0.00 178.83 178.09 3fsg h ALA 102 N 1.37 0.98 -0.49 3.87 0.00 -0.68 -1.09 119.26 123.22 3fsg h ALA 102 Ca 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3fsg h ALA 102 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3fsg h ALA 102 CO -0.37 0.23 0.21 0.82 0.00 0.00 0.00 179.25 180.15 3fsg h ILE 103 N 0.88 1.20 -0.03 0.00 2.04 0.00 -1.41 117.51 120.20 3fsg h ILE 103 Ca 0.30 -0.61 -0.09 0.00 1.00 0.00 0.00 64.86 65.46 3fsg h ILE 103 Cb 0.06 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3fsg h ILE 103 CO -0.13 0.23 -0.41 0.00 0.00 0.00 0.00 178.15 177.84 3fsg h ALA 104 N 1.06 1.25 -0.29 1.87 0.00 -0.82 0.17 119.26 122.50 3fsg h ALA 104 Ca 0.17 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 3fsg h ALA 104 Cb 0.16 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3fsg h ALA 104 CO -0.02 0.54 -0.32 0.35 0.00 0.00 0.00 179.25 179.80 3fsg h PHE 105 N 0.06 0.88 -0.11 0.00 3.57 -0.73 -2.74 116.94 117.88 3fsg h PHE 105 Ca 0.00 -0.27 -0.22 0.00 3.53 0.00 0.00 57.97 61.01 3fsg h PHE 105 Cb 0.76 -0.18 0.01 0.00 2.79 0.00 0.00 35.95 39.33 3fsg h PHE 105 CO 0.00 1.03 -0.79 0.45 -2.23 0.00 0.00 178.31 176.78 3fsg h HIS 106 N 0.48 1.00 -1.82 0.41 3.86 -0.86 -3.33 115.15 114.89 3fsg h HIS 106 Ca 0.04 -0.47 -0.69 0.00 -1.16 0.00 0.00 60.37 58.09 3fsg h HIS 106 Cb 0.90 -0.14 -0.34 0.00 1.06 0.00 0.00 27.41 28.89 3fsg h HIS 106 CO 0.07 1.30 0.27 1.28 0.86 0.00 0.00 177.93 181.71 3fsg n LEU 107 N -3.97 6.27 -0.36 2.43 4.77 0.56 -4.87 117.00 121.83 3fsg n LEU 107 Ca -0.09 -5.04 -0.00 0.00 -0.03 0.00 0.00 56.01 50.85 3fsg n LEU 107 Cb 0.75 -0.81 0.13 0.00 -2.33 0.00 0.00 43.42 41.17 3fsg n LEU 107 CO 0.52 1.99 1.26 0.07 -1.33 0.00 0.00 177.39 179.90 3fsg h LYS 108 N 2.87 1.17 0.00 3.23 2.10 -1.60 -0.31 116.57 124.03 3fsg h LYS 108 Ca 0.44 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 3fsg h LYS 108 Cb 0.42 -0.26 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 3fsg h LYS 108 CO 1.17 0.78 0.00 -0.44 -2.00 0.00 0.00 179.45 178.95 3fsg h ASP 109 N 1.21 0.00 0.29 7.07 3.32 -1.89 -3.20 116.42 123.21 3fsg h ASP 109 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3fsg h ASP 109 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3fsg h ASP 109 CO -0.13 0.00 -0.74 1.67 -1.72 0.00 0.00 179.24 178.32 3fsg n GLN 110 N -2.90 0.02 -3.26 3.56 7.27 -0.18 -4.91 117.38 116.98 3fsg n GLN 110 Ca 0.02 -0.00 -0.39 0.00 0.07 0.00 0.00 57.00 56.70 3fsg n GLN 110 Cb 0.37 -1.51 -0.07 0.00 2.41 0.00 0.00 30.24 31.44 3fsg n GLN 110 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 3fsg s THR 111 N -3.01 5.10 -0.42 1.69 2.01 -0.86 -0.45 115.64 119.71 3fsg s THR 111 Ca 0.09 0.88 0.23 0.00 0.31 0.00 0.00 61.69 63.21 3fsg s THR 111 Cb 0.17 -3.82 0.12 0.00 0.01 0.00 0.00 72.50 68.98 3fsg s THR 111 CO 0.78 0.14 1.30 -0.07 -0.69 0.00 0.00 174.62 176.08 3fsg h LEU 112 N 8.32 0.00 0.00 4.42 3.38 -0.18 -3.47 115.31 127.78 3fsg h LEU 112 Ca -0.32 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3fsg h LEU 112 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3fsg h LEU 112 CO 0.72 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.89 3fsg n GLY 113 N 1.20 2.12 2.91 0.83 0.00 -1.26 -4.31 105.19 106.68 3fsg n GLY 113 Ca 0.02 -0.23 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 3fsg n GLY 113 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fsg s VAL 114 N -1.57 0.76 -0.18 1.61 1.01 -0.23 -0.69 120.40 121.11 3fsg s VAL 114 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3fsg s VAL 114 Cb 0.00 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.63 3fsg s VAL 114 CO 0.00 0.29 -0.18 0.12 0.00 0.00 0.00 175.10 175.33 3fsg s PHE 115 N 1.19 2.69 -0.04 5.22 5.36 0.11 -0.46 117.98 132.04 3fsg s PHE 115 Ca -0.06 -1.62 0.05 0.00 -0.96 0.00 0.00 56.93 54.35 3fsg s PHE 115 Cb -0.14 -1.85 -0.01 0.00 -0.34 0.00 0.00 43.02 40.68 3fsg s PHE 115 CO -0.02 -0.79 -0.20 -0.51 -1.46 0.00 0.00 175.22 172.24 3fsg s LEU 116 N 1.32 1.98 -0.14 6.12 1.43 0.09 -1.16 118.68 128.32 3fsg s LEU 116 Ca 0.04 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 3fsg s LEU 116 Cb -0.14 -1.12 -0.01 0.00 0.03 0.00 0.00 46.19 44.96 3fsg s LEU 116 CO -0.12 0.20 -0.14 0.42 0.23 0.00 0.00 176.35 176.94 3fsg s THR 117 N -0.09 2.84 -1.60 5.49 -4.23 -0.03 -4.19 115.64 113.83 3fsg s THR 117 Ca -0.02 -0.72 -0.09 0.00 -1.18 0.00 0.00 61.69 59.67 3fsg s THR 117 Cb -0.12 -2.19 0.08 0.00 1.34 0.00 0.00 72.50 71.61 3fsg s THR 117 CO 0.02 0.52 0.49 0.00 -0.54 0.00 0.00 174.62 175.11 3fsg s PRO 119 N -6.93 4.19 0.24 0.00 0.04 -1.26 -2.99 135.00 128.29 3fsg s PRO 119 Ca 0.36 2.44 -0.30 0.00 0.04 0.00 0.00 61.00 63.55 3fsg s PRO 119 Cb -0.20 -3.05 -0.10 0.00 0.04 0.00 0.00 34.50 31.19 3fsg s PRO 119 CO 0.94 -0.50 1.46 0.08 0.04 0.00 0.00 177.00 179.02 3fsg s VAL 120 N -0.27 2.65 0.00 -0.36 1.01 -1.05 -4.87 120.40 117.51 3fsg s VAL 120 Ca 0.59 0.53 0.00 0.00 0.00 0.00 0.00 61.98 63.10 3fsg s VAL 120 Cb -0.45 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.59 3fsg s VAL 120 CO 0.49 0.08 0.00 -0.38 0.00 0.00 0.00 175.10 175.29 3fsg n ILE 121 N 2.58 0.00 -3.57 2.22 5.41 -1.26 -3.75 119.36 120.99 3fsg n ILE 121 Ca 0.08 0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.42 3fsg n ILE 121 Cb 0.40 -1.30 -0.11 0.00 -0.71 0.00 0.00 39.64 37.92 3fsg n ILE 121 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 3fsg s THR 122 N -2.00 4.88 0.20 1.39 2.01 -1.26 -4.91 115.64 115.95 3fsg s THR 122 Ca 0.00 -0.56 -0.09 0.00 0.31 0.00 0.00 61.69 61.35 3fsg s THR 122 Cb 0.00 -3.61 0.13 0.00 0.01 0.00 0.00 72.50 69.03 3fsg s THR 122 CO 0.00 -0.12 1.75 0.00 -0.69 0.00 0.00 174.62 175.56 3fsg h ALA 123 N 8.46 0.96 -1.84 7.40 0.00 -1.92 -3.42 119.26 128.90 3fsg h ALA 123 Ca -0.29 -0.21 -0.56 0.00 0.00 0.00 0.00 54.91 53.86 3fsg h ALA 123 Cb 1.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3fsg h ALA 123 CO 0.66 0.61 1.42 0.34 0.00 0.00 0.00 179.25 182.28 3fsg s ASP 124 N -6.33 5.45 0.45 0.00 -1.08 -1.26 -4.84 116.67 109.05 3fsg s ASP 124 Ca -0.12 1.41 0.16 0.00 -0.52 0.00 0.00 52.55 53.48 3fsg s ASP 124 Cb 0.15 -2.52 1.10 0.00 -1.46 0.00 0.00 42.92 40.19 3fsg s ASP 124 CO 0.83 -2.04 1.99 0.45 0.52 0.00 0.00 175.17 176.92 3fsg h HIS 125 N 14.90 0.34 0.00 -5.34 3.86 -1.97 -0.58 115.15 126.36 3fsg h HIS 125 Ca -0.34 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.87 3fsg h HIS 125 Cb 1.21 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.57 3fsg h HIS 125 CO 0.96 0.16 0.00 0.66 0.86 0.00 0.00 177.93 180.57 3fsg h SER 126 N 0.32 0.00 -0.01 2.45 4.64 -1.96 -2.94 113.55 116.05 3fsg h SER 126 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3fsg h SER 126 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3fsg h SER 126 CO -0.06 0.00 -0.58 0.29 -0.87 0.00 0.00 176.83 175.61 3fsg n LYS 127 N -2.39 1.04 -2.45 4.77 5.02 -0.24 -5.01 118.16 118.90 3fsg n LYS 127 Ca 0.03 -0.74 -0.37 0.00 -2.02 0.00 0.00 58.31 55.21 3fsg n LYS 127 Cb 0.33 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 3fsg n LYS 127 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3fsg s ARG 128 N -2.53 4.04 -0.25 1.97 0.52 -1.11 -5.02 118.95 116.57 3fsg s ARG 128 Ca 0.15 1.60 -0.19 0.00 -0.52 0.00 0.00 55.73 56.77 3fsg s ARG 128 Cb 0.17 -2.51 -0.02 0.00 0.52 0.00 0.00 34.95 33.11 3fsg s ARG 128 CO 0.62 -0.27 0.56 -0.51 0.02 0.00 0.00 175.30 175.72 3fsg s LEU 129 N -2.75 4.06 0.22 2.53 1.43 -1.26 -5.06 118.68 117.85 3fsg s LEU 129 Ca 0.59 0.61 0.07 0.00 -1.03 0.00 0.00 54.13 54.37 3fsg s LEU 129 Cb -0.24 -2.74 -0.05 0.00 0.03 0.00 0.00 46.19 43.18 3fsg s LEU 129 CO 0.30 -0.31 -0.11 0.42 0.23 0.00 0.00 176.35 176.88 3fsg s THR 130 N 2.34 1.61 0.72 5.49 -4.23 -1.26 -3.79 115.64 116.53 3fsg s THR 130 Ca 0.23 -2.16 -0.02 0.00 -1.18 0.00 0.00 61.69 58.56 3fsg s THR 130 Cb -0.16 -2.15 0.12 0.00 1.34 0.00 0.00 72.50 71.65 3fsg s THR 130 CO 0.09 -0.51 1.00 -0.83 -0.54 0.00 0.00 174.62 173.82 3fsg s GLY 131 N -3.34 1.76 -0.23 3.99 0.00 0.58 -4.88 107.32 105.21 3fsg s GLY 131 Ca 0.24 -1.64 -0.11 0.00 0.00 0.00 0.00 44.72 43.21 3fsg s GLY 131 CO 0.08 -1.09 0.19 0.54 0.00 0.00 0.00 173.10 172.81 3fsg s LYS 132 N -5.16 4.10 0.44 2.90 1.02 -1.26 -3.88 119.74 117.90 3fsg s LYS 132 Ca 0.66 -0.20 -0.22 0.00 0.02 0.00 0.00 55.97 56.22 3fsg s LYS 132 Cb -0.06 -3.52 -0.08 0.00 -0.52 0.00 0.00 37.83 33.65 3fsg s LYS 132 CO 0.44 0.09 1.07 -1.58 -0.92 0.00 0.00 175.35 174.45 3fsg s HIS 133 N 0.98 3.10 0.15 3.18 5.65 -1.23 -4.34 115.29 122.78 3fsg s HIS 133 Ca 0.09 1.60 -0.09 0.00 0.25 0.00 0.00 55.06 56.92 3fsg s HIS 133 Cb -0.13 -3.15 -0.01 0.00 -1.18 0.00 0.00 32.58 28.11 3fsg s HIS 133 CO 0.04 -0.86 0.26 0.96 -0.65 0.00 0.00 174.74 174.50 3fsg s ILE 134 N -1.75 0.08 0.06 0.89 -4.36 -1.26 -5.10 121.20 109.76 3fsg s ILE 134 Ca 0.62 -1.37 0.07 0.00 -0.26 0.00 0.00 60.65 59.71 3fsg s ILE 134 Cb -0.21 -1.77 -0.04 0.00 1.25 0.00 0.00 42.46 41.69 3fsg s ILE 134 CO 0.26 -0.36 -0.15 0.20 0.24 0.00 0.00 174.94 175.13 3fsg s ASN 135 N -2.95 4.03 -0.33 4.36 0.02 -1.26 -4.42 114.94 114.39 3fsg s ASN 135 Ca 0.16 -0.41 -0.03 0.00 -1.02 0.00 0.00 52.86 51.56 3fsg s ASN 135 Cb 0.04 -0.70 0.06 0.00 0.02 0.00 0.00 41.25 40.66 3fsg s ASN 135 CO -0.02 0.23 0.06 -0.63 0.02 0.00 0.00 177.10 176.77 3fsg s ILE 136 N -1.03 3.26 -0.96 0.60 -1.09 0.13 -5.00 121.20 117.12 3fsg s ILE 136 Ca 0.17 -1.42 -0.17 0.00 -2.23 0.00 0.00 60.65 57.00 3fsg s ILE 136 Cb -0.11 -2.93 0.16 0.00 -1.58 0.00 0.00 42.46 38.01 3fsg s ILE 136 CO 0.08 -0.22 1.10 -0.22 -1.23 0.00 0.00 174.94 174.44 3fsg s LEU 137 N 1.28 5.47 0.03 2.97 0.20 -1.26 -0.93 118.68 126.43 3fsg s LEU 137 Ca -0.02 -2.39 -0.05 0.00 0.69 0.00 0.00 54.13 52.37 3fsg s LEU 137 Cb -0.20 -2.35 -0.29 0.00 -0.43 0.00 0.00 46.19 42.92 3fsg s LEU 137 CO -0.00 -0.88 0.98 -0.33 -0.29 0.00 0.00 176.35 175.83 3fsg h GLU 138 N 8.28 0.28 -4.05 1.98 5.08 -1.46 -3.47 114.58 121.22 3fsg h GLU 138 Ca 0.17 -0.48 -0.13 0.00 -1.00 0.00 0.00 59.36 57.92 3fsg h GLU 138 Cb 1.00 0.18 -0.17 0.00 0.50 0.00 0.00 28.75 30.26 3fsg h GLU 138 CO 1.05 1.19 -0.62 -1.21 -1.00 0.00 0.00 179.01 178.42 3fsg s GLU 139 N -2.63 0.57 0.25 2.33 2.02 -1.14 -5.02 118.70 115.09 3fsg s GLU 139 Ca -0.07 -0.97 -0.30 0.00 0.02 0.00 0.00 54.97 53.65 3fsg s GLU 139 Cb 0.07 0.21 -0.09 0.00 0.10 0.00 0.00 34.13 34.42 3fsg s GLU 139 CO 0.87 -0.12 1.06 -0.51 0.02 0.00 0.00 175.26 176.58 3fsg s ASP 140 N -2.46 7.35 -0.10 -0.19 1.01 -1.26 -4.63 116.67 116.39 3fsg s ASP 140 Ca -0.00 2.16 0.03 0.00 0.71 0.00 0.00 52.55 55.45 3fsg s ASP 140 Cb 0.02 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.34 3fsg s ASP 140 CO -0.07 -0.09 -0.20 -0.63 0.21 0.00 0.00 175.17 174.39 3fsg s ILE 141 N -0.96 1.78 -0.58 0.77 1.01 -1.26 -4.80 121.20 117.17 3fsg s ILE 141 Ca 0.45 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 60.27 3fsg s ILE 141 Cb -0.30 -1.57 0.15 0.00 0.01 0.00 0.00 42.46 40.75 3fsg s ILE 141 CO 0.38 0.50 0.35 0.20 0.00 0.00 0.00 174.94 176.37 3fsg s ASN 142 N 0.58 4.72 0.33 3.58 0.01 -1.26 -5.09 114.94 117.81 3fsg s ASN 142 Ca -0.14 -3.01 -0.29 0.00 -0.71 0.00 0.00 52.86 48.71 3fsg s ASN 142 Cb -0.17 -1.73 -0.10 0.00 0.41 0.00 0.00 41.25 39.66 3fsg s ASN 142 CO 0.05 -0.27 1.32 -2.16 -1.51 0.00 0.00 177.10 174.53 3fsg s PRO 143 N -0.29 4.33 -0.11 -0.60 0.04 -1.26 -4.96 135.00 132.16 3fsg s PRO 143 Ca 0.18 2.25 -0.11 0.00 0.04 0.00 0.00 61.00 63.36 3fsg s PRO 143 Cb -0.23 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 3fsg s PRO 143 CO -0.02 -0.22 -0.21 0.28 0.04 0.00 0.00 177.00 176.87 3fsg n VAL 144 N 0.79 0.89 -2.31 -0.36 0.31 -1.26 -4.90 118.33 111.49 3fsg n VAL 144 Ca 0.00 0.29 -0.30 0.00 -0.01 0.00 0.00 64.34 64.32 3fsg n VAL 144 Cb 0.42 -2.00 -0.01 0.00 -0.91 0.00 0.00 33.84 31.34 3fsg n VAL 144 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3fsg s GLU 145 N -2.13 3.66 -1.57 5.55 0.41 -1.26 -4.30 118.70 119.06 3fsg s GLU 145 Ca -0.17 0.58 -0.03 0.00 -0.41 0.00 0.00 54.97 54.94 3fsg s GLU 145 Cb 0.02 -2.22 0.01 0.00 -1.78 0.00 0.00 34.13 30.16 3fsg s GLU 145 CO 0.25 -0.35 0.30 0.09 -0.49 0.00 0.00 175.26 175.07 3fsg n ASN 146 N -2.24 -5.60 0.24 -0.19 5.03 -1.26 -4.84 115.26 106.40 3fsg n ASN 146 Ca 0.04 -0.14 0.07 0.00 0.87 0.00 0.00 54.58 55.42 3fsg n ASN 146 Cb 0.54 -4.60 0.56 0.00 -1.02 0.00 0.00 39.78 35.26 3fsg n ASN 146 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 3fsg h LYS 147 N -0.67 0.00 0.00 3.52 1.57 -1.91 0.03 116.57 119.11 3fsg h LYS 147 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 3fsg h LYS 147 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 3fsg h LYS 147 CO 0.55 0.13 0.00 1.05 -0.57 0.00 0.00 179.45 180.61 3fsg h GLU 148 N 0.00 0.00 -0.00 3.15 9.09 -1.95 -2.37 114.58 122.50 3fsg h GLU 148 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3fsg h GLU 148 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 3fsg h GLU 148 CO 0.02 0.00 -0.41 0.66 0.05 0.00 0.00 179.01 179.33 3fsg n TYR 149 N -2.90 0.00 -0.18 2.06 4.01 -0.01 -4.48 117.16 115.66 3fsg n TYR 149 Ca 0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 3fsg n TYR 149 Cb 0.27 -0.22 0.14 0.00 -0.31 0.00 0.00 39.34 39.22 3fsg n TYR 149 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 3fsg h PHE 150 N 0.37 0.98 0.10 -0.72 3.57 -1.41 -2.49 116.94 117.33 3fsg h PHE 150 Ca 0.00 -0.10 0.02 0.00 3.53 0.00 0.00 57.97 61.42 3fsg h PHE 150 Cb 0.50 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 3fsg h PHE 150 CO 0.00 0.81 -0.36 0.00 -2.23 0.00 0.00 178.31 176.53 3fsg h ALA 151 N 1.26 -0.60 -0.06 2.41 0.00 -1.78 -0.84 119.26 119.64 3fsg h ALA 151 Ca 0.20 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3fsg h ALA 151 Cb 0.32 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3fsg h ALA 151 CO -0.00 -0.90 -0.29 -0.44 0.00 0.00 0.00 179.25 177.62 3fsg h ASP 152 N -0.57 0.11 0.28 0.00 3.32 -1.80 0.18 116.42 117.94 3fsg h ASP 152 Ca 0.03 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3fsg h ASP 152 Cb 0.61 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 3fsg h ASP 152 CO -0.22 0.41 -0.34 0.15 -1.72 0.00 0.00 179.24 177.52 3fsg h PHE 153 N 0.10 -0.92 -0.93 4.55 3.57 -1.06 -2.78 116.94 119.48 3fsg h PHE 153 Ca 0.01 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.63 3fsg h PHE 153 Cb 0.57 0.37 -0.07 0.00 2.79 0.00 0.00 35.95 39.61 3fsg h PHE 153 CO 0.00 -0.47 0.59 -0.07 -2.23 0.00 0.00 178.31 176.14 3fsg h LEU 154 N -0.66 0.84 0.00 0.59 3.38 -0.37 0.20 115.31 119.28 3fsg h LEU 154 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3fsg h LEU 154 Cb 0.62 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3fsg h LEU 154 CO -0.10 0.48 0.00 -1.20 0.09 0.00 0.00 178.44 177.71 3fsg n SER 155 N -4.55 0.00 0.00 -0.43 7.64 0.56 -4.83 113.62 112.02 3fsg n SER 155 Ca 0.16 -1.21 0.00 0.00 1.01 0.00 0.00 58.87 58.83 3fsg n SER 155 Cb 0.32 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 3fsg n SER 155 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3fsg n ASN 157 N -0.55 0.00 -0.06 6.43 5.03 0.71 -4.98 115.26 121.84 3fsg n ASN 157 Ca 0.01 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.35 3fsg n ASN 157 Cb 0.01 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.73 3fsg n ASN 157 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 3fsg n VAL 158 N 0.00 1.21 -2.61 2.41 0.31 -1.26 -4.74 118.33 113.65 3fsg n VAL 158 Ca 0.00 0.02 -0.43 0.00 -0.01 0.00 0.00 64.34 63.92 3fsg n VAL 158 Cb 0.00 -1.92 -0.02 0.00 -0.91 0.00 0.00 33.84 30.99 3fsg n VAL 158 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3fsg s ILE 159 N -2.46 4.22 -0.40 2.52 -1.09 -1.26 0.18 121.20 122.90 3fsg s ILE 159 Ca -0.21 1.23 -0.12 0.00 -2.23 0.00 0.00 60.65 59.32 3fsg s ILE 159 Cb 0.06 -4.60 0.04 0.00 -1.58 0.00 0.00 42.46 36.38 3fsg s ILE 159 CO 0.29 -1.00 0.26 -0.63 -1.23 0.00 0.00 174.94 172.63 3fsg s ILE 160 N 4.43 4.70 0.34 2.92 -1.09 -0.11 -4.77 121.20 127.62 3fsg s ILE 160 Ca 0.48 -0.98 -0.04 0.00 -2.23 0.00 0.00 60.65 57.88 3fsg s ILE 160 Cb -0.07 -3.70 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 3fsg s ILE 160 CO 0.31 -0.36 0.49 0.54 -1.23 0.00 0.00 174.94 174.70 3fsg s ASN 161 N 1.84 0.82 0.19 3.58 2.20 -1.26 -1.01 114.94 121.30 3fsg s ASN 161 Ca 0.03 -1.44 -0.09 0.00 -0.94 0.00 0.00 52.86 50.41 3fsg s ASN 161 Cb -0.21 0.67 0.10 0.00 -2.00 0.00 0.00 41.25 39.81 3fsg s ASN 161 CO 0.06 -1.31 1.69 0.78 -2.94 0.00 0.00 177.10 175.38 3fsg h ASN 162 N 2.11 1.05 -0.63 3.54 2.35 -1.88 -2.38 115.58 119.74 3fsg h ASN 162 Ca -0.28 -0.25 0.01 0.00 -0.55 0.00 0.00 56.30 55.23 3fsg h ASN 162 Cb 1.24 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 3fsg h ASN 162 CO 0.39 1.03 0.41 -0.61 -1.65 0.00 0.00 177.43 177.00 3fsg h GLN 163 N 1.02 0.81 -0.87 0.81 5.75 -1.98 -0.19 115.11 120.47 3fsg h GLN 163 Ca 0.21 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.69 3fsg h GLN 163 Cb 0.41 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 28.73 3fsg h GLN 163 CO 0.01 0.54 0.57 0.00 -2.65 0.00 0.00 178.83 177.30 3fsg h ALA 164 N 1.24 1.44 -0.21 3.38 0.00 -1.80 0.68 119.26 123.99 3fsg h ALA 164 Ca 0.24 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 3fsg h ALA 164 Cb -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.40 3fsg h ALA 164 CO -0.06 0.48 -0.42 2.35 0.00 0.00 0.00 179.25 181.60 3fsg h TRP 165 N 1.10 0.84 -0.28 0.00 -0.00 -0.90 -0.61 115.95 116.10 3fsg h TRP 165 Ca 0.34 -0.30 0.01 0.00 -0.00 0.00 0.00 58.89 58.93 3fsg h TRP 165 Cb -0.01 -0.16 -0.02 0.00 -0.00 0.00 0.00 29.16 28.97 3fsg h TRP 165 CO -0.00 1.07 0.17 0.45 -0.00 0.00 0.00 178.44 180.13 3fsg h HIS 166 N 0.36 0.32 -0.54 2.65 3.86 -0.66 -1.37 115.15 119.77 3fsg h HIS 166 Ca 0.01 0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.26 3fsg h HIS 166 Cb 1.02 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 29.36 3fsg h HIS 166 CO 0.09 0.19 0.36 -0.44 0.86 0.00 0.00 177.93 178.99 3fsg h ASP 167 N 0.35 0.52 0.04 2.45 5.19 -0.76 -1.42 116.42 122.78 3fsg h ASP 167 Ca 0.11 -0.01 -0.21 0.00 -0.62 0.00 0.00 57.03 56.30 3fsg h ASP 167 Cb -0.01 -0.12 0.01 0.00 0.18 0.00 0.00 39.33 39.38 3fsg h ASP 167 CO -0.04 0.36 -0.79 0.22 -3.12 0.00 0.00 179.24 175.86 3fsg h TYR 168 N 0.60 0.86 -0.50 4.55 3.20 -0.49 0.13 116.97 125.31 3fsg h TYR 168 Ca 0.22 -0.39 -0.08 0.00 3.14 0.00 0.00 58.73 61.61 3fsg h TYR 168 Cb 0.12 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 3fsg h TYR 168 CO -0.00 1.20 -0.03 1.96 -1.64 0.00 0.00 178.16 179.65 3fsg h GLN 169 N 0.42 0.86 0.07 1.82 4.20 -0.96 -2.04 115.11 119.48 3fsg h GLN 169 Ca -0.05 -0.25 -0.24 0.00 0.06 0.00 0.00 58.65 58.16 3fsg h GLN 169 Cb 1.41 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.09 3fsg h GLN 169 CO 0.15 0.88 -1.11 -0.91 -0.67 0.00 0.00 178.83 177.17 3fsg h ASN 170 N 0.79 0.28 0.10 1.46 2.35 -0.89 -3.34 115.58 116.34 3fsg h ASN 170 Ca 0.15 -0.29 -0.37 0.00 -0.55 0.00 0.00 56.30 55.24 3fsg h ASN 170 Cb 0.51 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.74 3fsg h ASN 170 CO 0.03 1.20 -2.20 0.18 -1.65 0.00 0.00 177.43 174.99 3fsg n LEU 171 N -3.51 2.31 -0.09 1.61 4.77 0.40 -4.64 117.00 117.85 3fsg n LEU 171 Ca -0.05 0.07 -0.14 0.00 -0.03 0.00 0.00 56.01 55.86 3fsg n LEU 171 Cb 0.96 -0.73 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 3fsg n LEU 171 CO 0.51 0.80 -1.11 -0.38 -1.33 0.00 0.00 177.39 175.88 3fsg n ILE 172 N -3.27 1.05 -0.20 -0.08 2.08 -0.79 -3.52 119.36 114.64 3fsg n ILE 172 Ca -0.36 -0.39 -0.05 0.00 0.56 0.00 0.00 62.75 62.52 3fsg n ILE 172 Cb 1.04 -1.22 0.12 0.00 -0.75 0.00 0.00 39.64 38.83 3fsg n ILE 172 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 3fsg h ILE 173 N -0.08 1.24 -0.68 1.39 2.04 -1.62 -2.27 117.51 117.53 3fsg h ILE 173 Ca -0.42 -0.88 0.04 0.00 1.00 0.00 0.00 64.86 64.61 3fsg h ILE 173 Cb 1.61 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 3fsg h ILE 173 CO -0.09 0.33 0.45 -0.65 0.00 0.00 0.00 178.15 178.19 3fsg h PRO 174 N 0.95 0.76 -0.54 2.37 0.11 -1.80 -0.93 132.00 132.92 3fsg h PRO 174 Ca 0.21 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 3fsg h PRO 174 Cb 0.31 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 3fsg h PRO 174 CO -0.00 0.50 -0.05 0.78 -0.21 0.00 0.00 178.00 179.02 3fsg h GLY 175 N 0.79 1.04 1.19 -0.55 0.00 -1.66 -2.66 103.07 101.21 3fsg h GLY 175 Ca 0.28 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 3fsg h GLY 175 CO -0.08 0.72 0.38 1.41 0.00 0.00 0.00 176.54 178.97 3fsg h LEU 176 N 0.87 0.95 -0.90 3.11 3.38 -0.71 0.95 115.31 122.97 3fsg h LEU 176 Ca 0.15 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 3fsg h LEU 176 Cb 0.59 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3fsg h LEU 176 CO 0.04 0.79 -0.41 1.56 0.09 0.00 0.00 178.44 180.50 3fsg h GLN 177 N 1.06 0.00 0.00 1.13 4.20 -0.94 -3.30 115.11 117.26 3fsg h GLN 177 Ca 0.26 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.82 3fsg h GLN 177 Cb 0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 3fsg h GLN 177 CO -0.04 0.41 -1.99 1.63 -0.67 0.00 0.00 178.83 178.17 3fsg n LYS 178 N -3.57 0.66 -1.67 1.46 5.02 -0.74 -5.00 118.16 114.32 3fsg n LYS 178 Ca -0.00 -0.05 -0.43 0.00 -2.02 0.00 0.00 58.31 55.80 3fsg n LYS 178 Cb 0.53 -1.58 -0.01 0.00 -0.02 0.00 0.00 35.03 33.95 3fsg n LYS 178 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3fsg n GLU 179 N -2.55 1.93 -3.03 1.97 0.28 0.25 -4.42 120.64 115.08 3fsg n GLU 179 Ca -0.15 0.68 -0.44 0.00 -0.16 0.00 0.00 57.16 57.09 3fsg n GLU 179 Cb 0.81 -2.21 -0.04 0.00 1.43 0.00 0.00 31.44 31.44 3fsg n GLU 179 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3fsg s ASP 180 N -0.37 6.27 0.49 -1.84 -1.08 -0.25 -4.89 116.67 115.01 3fsg s ASP 180 Ca 0.56 -1.46 0.22 0.00 -0.52 0.00 0.00 52.55 51.35 3fsg s ASP 180 Cb -0.60 -2.34 1.26 0.00 -1.46 0.00 0.00 42.92 39.77 3fsg s ASP 180 CO 0.62 -1.17 2.04 0.11 0.52 0.00 0.00 175.17 177.28 3fsg h LYS 181 N 9.17 0.00 0.00 4.34 1.57 -1.90 -0.86 116.57 128.89 3fsg h LYS 181 Ca -0.21 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3fsg h LYS 181 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3fsg h LYS 181 CO 1.11 0.15 -0.00 1.15 -0.57 0.00 0.00 179.45 181.28 3fsg h THR 182 N 0.00 1.55 -0.51 -0.16 2.02 -1.97 -1.03 112.91 112.81 3fsg h THR 182 Ca -0.00 -1.67 0.10 0.00 0.77 0.00 0.00 66.41 65.61 3fsg h THR 182 Cb 0.32 2.68 -0.09 0.00 -1.74 0.00 0.00 68.15 69.32 3fsg h THR 182 CO 0.02 0.43 -0.01 0.15 0.37 0.00 0.00 175.52 176.48 3fsg h PHE 183 N -0.72 -0.05 -0.60 3.16 3.57 -1.86 -1.77 116.94 118.67 3fsg h PHE 183 Ca -0.00 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 3fsg h PHE 183 Cb 0.71 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 3fsg h PHE 183 CO 0.18 -0.13 0.31 0.82 -2.23 0.00 0.00 178.31 177.26 3fsg h ILE 184 N 0.10 1.20 -0.78 1.41 2.04 -1.13 0.86 117.51 121.22 3fsg h ILE 184 Ca 0.26 -0.52 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 3fsg h ILE 184 Cb 0.39 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 3fsg h ILE 184 CO -0.44 0.22 0.30 -0.78 0.00 0.00 0.00 178.15 177.46 3fsg h ASP 185 N 0.81 1.07 -0.30 1.72 3.58 -1.01 0.96 116.42 123.25 3fsg h ASP 185 Ca 0.21 -0.18 -0.10 0.00 0.42 0.00 0.00 57.03 57.38 3fsg h ASP 185 Cb 0.07 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.83 3fsg h ASP 185 CO -0.03 0.96 -0.21 1.56 -2.88 0.00 0.00 179.24 178.64 3fsg h GLN 186 N 1.13 0.67 -0.60 0.28 4.20 -0.68 -3.02 115.11 117.08 3fsg h GLN 186 Ca 0.26 -0.32 0.09 0.00 0.06 0.00 0.00 58.65 58.74 3fsg h GLN 186 Cb 0.22 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 3fsg h GLN 186 CO -0.02 0.92 0.40 1.25 -0.67 0.00 0.00 178.83 180.71 3fsg h LEU 187 N 0.42 0.40 0.00 1.46 5.85 0.15 -1.05 115.31 122.54 3fsg h LEU 187 Ca 0.06 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 3fsg h LEU 187 Cb 0.75 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3fsg h LEU 187 CO 0.06 0.25 0.00 0.00 -0.34 0.00 0.00 178.44 178.40 3fsg n GLN 188 N -4.47 0.03 0.03 1.25 6.02 0.26 -1.85 117.38 118.64 3fsg n GLN 188 Ca 0.09 0.13 0.12 0.00 -0.01 0.00 0.00 57.00 57.34 3fsg n GLN 188 Cb 0.34 -1.50 0.22 0.00 1.02 0.00 0.00 30.24 30.31 3fsg n GLN 188 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3fsg n ASN 189 N -1.48 0.58 -3.08 1.08 3.02 -0.40 -4.14 115.26 110.84 3fsg n ASN 189 Ca 0.06 -0.04 -0.22 0.00 -0.03 0.00 0.00 54.58 54.34 3fsg n ASN 189 Cb 0.24 0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 39.58 3fsg n ASN 189 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3fsg n ASN 190 N -1.81 2.55 0.02 6.41 3.02 -0.77 -4.98 115.26 119.70 3fsg n ASN 190 Ca 0.04 -3.33 -0.14 0.00 -0.03 0.00 0.00 54.58 51.13 3fsg n ASN 190 Cb 0.39 -0.59 -0.14 0.00 -0.61 0.00 0.00 39.78 38.83 3fsg n ASN 190 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3fsg h TYR 191 N 3.01 0.26 -3.90 3.10 3.20 -1.64 -2.44 116.97 118.55 3fsg h TYR 191 Ca 0.11 -0.19 -0.50 0.00 3.14 0.00 0.00 58.73 61.30 3fsg h TYR 191 Cb 0.75 -0.01 0.03 0.00 1.54 0.00 0.00 36.73 39.04 3fsg h TYR 191 CO 0.64 1.30 0.46 -1.12 -1.64 0.00 0.00 178.16 177.80 3fsg s SER 192 N -6.64 6.85 0.68 -2.11 0.01 -1.26 -4.49 113.70 106.73 3fsg s SER 192 Ca -0.09 2.22 -0.16 0.00 1.31 0.00 0.00 55.95 59.23 3fsg s SER 192 Cb 0.07 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.71 3fsg s SER 192 CO 0.82 -0.44 1.18 -0.36 0.41 0.00 0.00 173.24 174.86 3fsg s PHE 193 N -1.41 2.27 0.27 2.43 0.08 -1.26 -4.69 117.98 115.67 3fsg s PHE 193 Ca 0.53 1.57 0.19 0.00 0.12 0.00 0.00 56.93 59.34 3fsg s PHE 193 Cb -0.28 -3.41 0.88 0.00 -0.57 0.00 0.00 43.02 39.64 3fsg s PHE 193 CO 0.36 -2.30 1.84 1.79 -0.10 0.00 0.00 175.22 176.81 3fsg h THR 194 N 0.09 0.89 -0.70 0.64 1.35 -1.97 -2.80 112.91 110.40 3fsg h THR 194 Ca -0.48 -1.22 -0.16 0.00 -0.55 0.00 0.00 66.41 64.00 3fsg h THR 194 Cb 1.28 1.73 -0.10 0.00 -1.73 0.00 0.00 68.15 69.34 3fsg h THR 194 CO 0.52 0.30 0.20 2.22 -0.25 0.00 0.00 175.52 178.52 3fsg n PHE 195 N -3.69 2.37 -0.24 4.73 1.16 -1.26 -4.79 117.46 115.74 3fsg n PHE 195 Ca -0.01 -1.07 0.06 0.00 -1.87 0.00 0.00 57.45 54.57 3fsg n PHE 195 Cb 0.42 -0.65 0.31 0.00 -1.61 0.00 0.00 39.48 37.95 3fsg n PHE 195 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 3fsg h GLU 196 N 3.01 0.83 -0.19 3.97 4.81 -1.88 -0.68 114.58 124.46 3fsg h GLU 196 Ca 0.20 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3fsg h GLU 196 Cb 2.25 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 31.43 3fsg h GLU 196 CO 0.68 0.55 0.09 0.93 -0.73 0.00 0.00 179.01 180.53 3fsg h GLU 197 N 0.85 0.25 0.00 1.92 3.07 -1.88 -1.78 114.58 117.01 3fsg h GLU 197 Ca 0.36 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.15 3fsg h GLU 197 Cb 0.30 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 3fsg h GLU 197 CO -0.14 0.19 -0.26 0.87 -1.40 0.00 0.00 179.01 178.28 3fsg h LYS 198 N 0.25 0.00 -0.29 2.33 1.79 -1.51 -1.36 116.57 117.78 3fsg h LYS 198 Ca 0.07 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.41 3fsg h LYS 198 Cb 0.03 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.66 3fsg h LYS 198 CO -0.01 0.26 -0.33 -0.07 -1.08 0.00 0.00 179.45 178.21 3fsg h LEU 199 N 0.00 0.65 -0.79 2.94 3.38 -1.42 -2.70 115.31 117.36 3fsg h LEU 199 Ca -0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3fsg h LEU 199 Cb 0.50 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3fsg h LEU 199 CO 0.03 0.93 0.00 0.11 0.09 0.00 0.00 178.44 179.61 3fsg h LYS 200 N 0.53 0.00 -0.04 1.13 1.57 -1.20 -3.23 116.57 115.32 3fsg h LYS 200 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3fsg h LYS 200 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 3fsg h LYS 200 CO 0.07 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.04 3fsg n ASN 201 N -2.39 1.65 -4.75 0.86 5.03 -1.12 -4.88 115.26 109.66 3fsg n ASN 201 Ca 0.02 -1.44 -0.41 0.00 0.87 0.00 0.00 54.58 53.62 3fsg n ASN 201 Cb 0.26 -0.03 -0.04 0.00 -1.02 0.00 0.00 39.78 38.95 3fsg n ASN 201 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3fsg s ILE 202 N -0.55 3.51 -0.65 2.41 1.01 -1.03 -4.98 121.20 120.92 3fsg s ILE 202 Ca 0.06 1.41 -0.14 0.00 0.00 0.00 0.00 60.65 61.97 3fsg s ILE 202 Cb 0.03 -3.90 0.17 0.00 0.01 0.00 0.00 42.46 38.77 3fsg s ILE 202 CO 0.05 0.29 0.59 0.21 0.00 0.00 0.00 174.94 176.08 3fsg s ASN 203 N -0.45 6.33 0.42 3.58 2.47 -1.26 -4.77 114.94 121.26 3fsg s ASN 203 Ca 0.48 -2.20 -0.26 0.00 0.42 0.00 0.00 52.86 51.30 3fsg s ASN 203 Cb -0.32 -2.18 -0.09 0.00 -1.45 0.00 0.00 41.25 37.21 3fsg s ASN 203 CO 0.40 -0.71 1.35 -0.31 -3.72 0.00 0.00 177.10 174.11 3fsg s TYR 204 N 0.95 2.69 -0.74 0.43 2.02 -1.26 -4.89 117.35 116.55 3fsg s TYR 204 Ca 0.10 1.35 -0.01 0.00 -0.37 0.00 0.00 57.07 58.13 3fsg s TYR 204 Cb -0.21 -3.77 0.39 0.00 -0.40 0.00 0.00 41.96 37.96 3fsg s TYR 204 CO -0.02 -2.41 1.93 1.04 -1.57 0.00 0.00 175.55 174.51 3fsg n GLN 205 N 0.07 2.82 -3.82 -0.62 1.13 -1.26 -4.48 117.38 111.22 3fsg n GLN 205 Ca 0.04 -3.55 -0.06 0.00 -1.94 0.00 0.00 57.00 51.49 3fsg n GLN 205 Cb 0.43 -2.28 -0.02 0.00 0.11 0.00 0.00 30.24 28.49 3fsg n GLN 205 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 3fsg s PHE 206 N -3.94 -0.15 0.26 1.08 -0.12 -1.26 -5.07 117.98 108.77 3fsg s PHE 206 Ca 0.56 -0.25 -0.31 0.00 -0.05 0.00 0.00 56.93 56.88 3fsg s PHE 206 Cb 0.46 0.69 -0.12 0.00 -0.63 0.00 0.00 43.02 43.42 3fsg s PHE 206 CO -0.26 -1.09 1.65 -2.30 -0.05 0.00 0.00 175.22 173.17 3fsg n PRO 207 N -0.47 2.74 -3.62 1.99 -0.02 -1.26 -4.64 135.00 129.72 3fsg n PRO 207 Ca -0.05 0.98 -0.29 0.00 -2.02 0.00 0.00 63.50 62.13 3fsg n PRO 207 Cb 0.60 -2.79 -0.15 0.00 -0.02 0.00 0.00 33.50 31.13 3fsg n PRO 207 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3fsg s PHE 208 N 0.44 0.74 -0.08 6.00 5.36 -0.96 -1.06 117.98 128.41 3fsg s PHE 208 Ca 0.68 -1.02 0.04 0.00 -0.96 0.00 0.00 56.93 55.67 3fsg s PHE 208 Cb -0.50 -1.09 -0.01 0.00 -0.34 0.00 0.00 43.02 41.08 3fsg s PHE 208 CO 0.42 -0.77 -0.20 0.21 -1.46 0.00 0.00 175.22 173.42 3fsg s LYS 209 N 1.95 2.84 0.00 10.12 2.20 0.39 -1.13 119.74 136.11 3fsg s LYS 209 Ca 0.07 -0.81 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 3fsg s LYS 209 Cb -0.16 -2.34 0.00 0.00 -1.51 0.00 0.00 37.83 33.82 3fsg s LYS 209 CO -0.27 0.34 0.00 -0.89 -0.36 0.00 0.00 175.35 174.18 3fsg n ILE 210 N 3.09 0.00 0.00 5.43 5.41 -0.39 -0.73 119.36 132.17 3fsg n ILE 210 Ca -0.18 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3fsg n ILE 210 Cb 0.52 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.45 3fsg n ILE 210 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3fsg n VAL 212 N 0.00 0.00 -4.93 1.39 0.24 0.35 -0.53 118.33 114.85 3fsg n VAL 212 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.03 3fsg n VAL 212 Cb 0.00 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.22 3fsg n VAL 212 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3fsg s GLY 213 N 0.00 1.01 0.35 7.63 0.00 -1.26 -2.24 107.32 112.80 3fsg s GLY 213 Ca 0.00 -0.90 0.06 0.00 0.00 0.00 0.00 44.72 43.88 3fsg s GLY 213 CO 0.00 -0.76 1.88 -0.09 0.00 0.00 0.00 173.10 174.12 3fsg h ARG 214 N 5.51 0.41 -0.64 2.90 9.65 -1.22 -2.74 114.38 128.25 3fsg h ARG 214 Ca -0.39 -0.10 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 3fsg h ARG 214 Cb 1.14 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.67 3fsg h ARG 214 CO 0.47 0.50 0.00 0.09 2.80 0.00 0.00 179.97 183.83 3fsg n ASN 215 N -4.26 4.67 -4.57 -3.80 4.13 -0.48 -3.99 115.26 106.96 3fsg n ASN 215 Ca 0.00 -2.56 -0.42 0.00 1.68 0.00 0.00 54.58 53.29 3fsg n ASN 215 Cb 0.27 -0.59 -0.03 0.00 -1.54 0.00 0.00 39.78 37.89 3fsg n ASN 215 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3fsg s ASP 216 N -0.79 6.20 0.00 6.41 -1.08 -1.03 -3.55 116.67 122.83 3fsg s ASP 216 Ca 0.47 0.09 0.28 0.00 -0.52 0.00 0.00 52.55 52.87 3fsg s ASP 216 Cb 0.32 -2.55 1.07 0.00 -1.46 0.00 0.00 42.92 40.31 3fsg s ASP 216 CO 0.19 -1.69 1.77 0.00 0.52 0.00 0.00 175.17 175.96 3fsg n GLN 217 N 8.76 0.64 -0.10 4.34 0.00 -1.25 -0.31 117.38 129.46 3fsg n GLN 217 Ca 0.10 -0.27 -0.17 0.00 0.00 0.00 0.00 57.00 56.67 3fsg n GLN 217 Cb 0.49 -1.49 -0.07 0.00 0.00 0.00 0.00 30.24 29.16 3fsg n GLN 217 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3fsg n VAL 218 N -0.95 1.49 -0.01 -0.39 0.31 -1.26 -4.59 118.33 112.94 3fsg n VAL 218 Ca 0.13 0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 3fsg n VAL 218 Cb 0.30 -2.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.07 3fsg n VAL 218 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 3fsg n VAL 219 N -4.47 0.00 -4.42 2.52 0.24 -1.26 -4.93 118.33 106.02 3fsg n VAL 219 Ca -0.26 -0.47 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 3fsg n VAL 219 Cb 0.57 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.94 3fsg n VAL 219 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fsg n GLY 220 N 0.83 2.18 0.00 7.63 0.00 -0.73 -4.69 105.19 110.41 3fsg n GLY 220 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 3fsg n GLY 220 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3fsg n TYR 221 N 9.07 0.00 -0.05 1.61 0.18 -1.26 -4.45 117.16 122.25 3fsg n TYR 221 Ca 0.00 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.66 3fsg n TYR 221 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 3fsg n TYR 221 CO 0.00 0.00 0.00 1.96 -2.08 0.00 0.00 176.86 176.74 3fsg h GLN 222 N 0.00 0.29 -0.41 -3.48 4.20 -1.84 -1.12 115.11 112.75 3fsg h GLN 222 Ca 0.00 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 3fsg h GLN 222 Cb 0.00 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3fsg h GLN 222 CO 0.00 0.52 0.24 0.93 -0.67 0.00 0.00 178.83 179.85 3fsg h GLU 223 N 0.03 0.55 -0.19 1.46 5.08 -1.86 -1.96 114.58 117.69 3fsg h GLU 223 Ca 0.04 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 3fsg h GLU 223 Cb 0.39 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 3fsg h GLU 223 CO 0.01 0.39 -0.59 1.96 -1.00 0.00 0.00 179.01 179.78 3fsg h GLN 224 N 0.56 0.61 -0.72 2.33 7.50 -1.80 -2.45 115.11 121.14 3fsg h GLN 224 Ca 0.15 -0.41 0.04 0.00 0.50 0.00 0.00 58.65 58.93 3fsg h GLN 224 Cb -0.01 0.06 -0.05 0.00 0.05 0.00 0.00 27.48 27.53 3fsg h GLN 224 CO -0.03 1.03 0.44 -0.07 -1.50 0.00 0.00 178.83 178.70 3fsg h LEU 225 N 0.46 0.71 -1.36 1.46 4.07 -0.76 -2.38 115.31 117.51 3fsg h LEU 225 Ca -0.00 0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.91 3fsg h LEU 225 Cb 1.16 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.74 3fsg h LEU 225 CO 0.11 0.48 -0.13 0.50 -1.08 0.00 0.00 178.44 178.33 3fsg h LYS 226 N 0.85 0.26 -0.64 1.13 3.64 -1.10 -1.95 116.57 118.77 3fsg h LYS 226 Ca 0.30 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.52 3fsg h LYS 226 Cb 0.06 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3fsg h LYS 226 CO -0.13 0.40 0.04 -0.07 -2.27 0.00 0.00 179.45 177.43 3fsg h LEU 227 N 0.25 1.06 -1.87 5.20 3.38 -0.97 -1.96 115.31 120.40 3fsg h LEU 227 Ca 0.05 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.74 3fsg h LEU 227 Cb 0.39 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3fsg h LEU 227 CO 0.02 1.09 0.10 0.40 0.09 0.00 0.00 178.44 180.14 3fsg h ILE 228 N 1.00 1.02 -0.76 1.22 1.08 -1.00 -2.17 117.51 117.91 3fsg h ILE 228 Ca 0.19 -0.06 0.14 0.00 -0.39 0.00 0.00 64.86 64.74 3fsg h ILE 228 Cb 0.52 0.84 -0.14 0.00 -3.07 0.00 0.00 36.82 34.96 3fsg h ILE 228 CO 0.02 0.03 -0.26 -1.13 -0.69 0.00 0.00 178.15 176.13 3fsg h ASN 229 N 0.17 -0.93 -0.37 1.72 -1.24 -0.92 -2.40 115.58 111.61 3fsg h ASN 229 Ca 0.05 0.24 -0.08 0.00 0.71 0.00 0.00 56.30 57.23 3fsg h ASN 229 Cb 0.01 0.54 -0.05 0.00 0.73 0.00 0.00 38.32 39.56 3fsg h ASN 229 CO -0.01 -0.28 0.03 0.00 -1.29 0.00 0.00 177.43 175.89 3fsg n HIS 230 N -5.49 1.27 -3.92 0.67 1.44 -0.83 -4.87 115.22 103.49 3fsg n HIS 230 Ca 0.09 -1.09 -0.35 0.00 -2.01 0.00 0.00 57.72 54.37 3fsg n HIS 230 Cb 0.39 -0.42 -0.14 0.00 0.12 0.00 0.00 29.99 29.94 3fsg n HIS 230 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 3fsg s ASN 231 N -1.88 4.74 0.43 4.39 -0.87 -0.90 -4.29 114.94 116.56 3fsg s ASN 231 Ca 0.45 -1.16 0.30 0.00 -1.57 0.00 0.00 52.86 50.88 3fsg s ASN 231 Cb 0.38 -1.70 1.20 0.00 -0.02 0.00 0.00 41.25 41.10 3fsg s ASN 231 CO 0.08 -0.22 1.87 1.05 -2.57 0.00 0.00 177.10 177.31 3fsg h GLU 232 N 8.00 0.00 -0.20 -0.60 4.11 -1.85 -1.84 114.58 122.21 3fsg h GLU 232 Ca -0.24 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.15 3fsg h GLU 232 Cb 1.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 3fsg h GLU 232 CO 0.54 0.00 -0.05 0.09 0.07 0.00 0.00 179.01 179.67 3fsg n ASN 233 N -2.75 3.05 -4.72 3.06 3.02 -1.26 -5.03 115.26 110.62 3fsg n ASN 233 Ca 0.01 -3.26 -0.42 0.00 -0.03 0.00 0.00 54.58 50.89 3fsg n ASN 233 Cb 0.28 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 3fsg n ASN 233 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3fsg s GLY 234 N -2.39 2.60 0.13 7.41 0.00 -0.69 -2.26 107.32 112.11 3fsg s GLY 234 Ca 0.40 0.78 0.08 0.00 0.00 0.00 0.00 44.72 45.98 3fsg s GLY 234 CO 0.04 1.89 -0.18 -0.54 0.00 0.00 0.00 173.10 174.31 3fsg s GLU 235 N 0.76 1.17 -0.16 2.90 2.02 -0.29 -4.97 118.70 120.14 3fsg s GLU 235 Ca 0.55 -1.28 -0.15 0.00 0.02 0.00 0.00 54.97 54.11 3fsg s GLU 235 Cb -0.28 -1.27 0.04 0.00 0.10 0.00 0.00 34.13 32.72 3fsg s GLU 235 CO 0.30 0.27 0.42 -1.50 0.02 0.00 0.00 175.26 174.77 3fsg s ILE 236 N -1.73 0.00 -0.19 -1.63 2.07 -1.26 -1.26 121.20 117.21 3fsg s ILE 236 Ca 0.11 -0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.35 3fsg s ILE 236 Cb -0.07 -0.60 0.03 0.00 0.13 0.00 0.00 42.46 41.96 3fsg s ILE 236 CO 0.05 -0.01 -0.13 -0.69 -1.91 0.00 0.00 174.94 172.25 3fsg s VAL 237 N 0.18 1.75 -0.18 4.00 1.01 0.31 -4.96 120.40 122.52 3fsg s VAL 237 Ca -0.00 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3fsg s VAL 237 Cb -0.03 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.65 3fsg s VAL 237 CO 0.01 0.30 -0.13 -0.22 0.00 0.00 0.00 175.10 175.05 3fsg s LEU 238 N 1.37 2.15 0.06 3.92 2.96 -1.26 -0.50 118.68 127.39 3fsg s LEU 238 Ca 0.01 -0.76 0.09 0.00 -0.22 0.00 0.00 54.13 53.25 3fsg s LEU 238 Cb -0.15 -1.27 -0.03 0.00 0.50 0.00 0.00 46.19 45.24 3fsg s LEU 238 CO -0.09 -0.10 -0.25 -0.76 -1.32 0.00 0.00 176.35 173.82 3fsg s LEU 239 N 1.39 2.20 0.90 -0.68 1.43 -0.95 -5.00 118.68 117.98 3fsg s LEU 239 Ca 0.01 -0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 3fsg s LEU 239 Cb -0.15 -1.21 0.14 0.00 0.03 0.00 0.00 46.19 45.00 3fsg s LEU 239 CO -0.09 0.22 1.10 0.20 0.23 0.00 0.00 176.35 178.01 3fsg s ASN 240 N -1.41 3.22 -1.35 2.29 0.01 -1.26 -1.83 114.94 114.61 3fsg s ASN 240 Ca 0.11 1.84 -0.06 0.00 -0.71 0.00 0.00 52.86 54.04 3fsg s ASN 240 Cb -0.10 -2.43 0.02 0.00 0.41 0.00 0.00 41.25 39.15 3fsg s ASN 240 CO 0.03 -2.85 1.03 0.54 -1.51 0.00 0.00 177.10 174.34 3fsg n ARG 241 N -4.05 -6.74 -3.69 -0.60 1.74 -1.26 -4.87 116.66 97.19 3fsg n ARG 241 Ca 0.09 0.76 -0.10 0.00 -0.77 0.00 0.00 57.85 57.83 3fsg n ARG 241 Cb 0.53 -5.71 -0.11 0.00 -1.02 0.00 0.00 32.46 26.16 3fsg n ARG 241 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3fsg s THR 242 N -3.38 -0.15 0.00 0.55 2.01 -1.26 -4.56 115.64 108.85 3fsg s THR 242 Ca 0.38 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.49 3fsg s THR 242 Cb -0.17 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.73 3fsg s THR 242 CO 0.76 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 175.35 3fsg n GLY 243 N 4.51 5.06 0.17 4.40 0.00 -1.26 -1.38 105.19 116.69 3fsg n GLY 243 Ca -0.20 -1.78 -0.04 0.00 0.00 0.00 0.00 46.02 44.00 3fsg n GLY 243 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3fsg h HIS 244 N 0.00 0.26 -0.34 1.61 2.76 -1.93 -2.94 115.15 114.57 3fsg h HIS 244 Ca 0.00 -0.09 -0.55 0.00 -2.20 0.00 0.00 60.37 57.53 3fsg h HIS 244 Cb 0.00 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 28.86 3fsg h HIS 244 CO 0.00 0.72 2.16 0.09 -1.30 0.00 0.00 177.93 179.60 3fsg n ASN 245 N -3.90 7.52 -1.83 3.26 3.02 -1.26 -4.90 115.26 117.17 3fsg n ASN 245 Ca -0.02 -2.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.80 3fsg n ASN 245 Cb 0.59 -1.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.31 3fsg n ASN 245 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3fsg n LEU 246 N 2.65 0.00 0.00 3.41 0.00 -1.11 -1.40 117.00 120.56 3fsg n LEU 246 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.65 3fsg n LEU 246 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.86 3fsg n LEU 246 CO 0.59 0.00 0.00 -0.38 0.00 0.00 0.00 177.39 177.60 3fsg n ILE 248 N 1.76 0.00 -0.26 1.96 5.41 -1.26 -0.23 119.36 126.74 3fsg n ILE 248 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.74 3fsg n ILE 248 Cb 0.00 0.00 0.11 0.00 -0.71 0.00 0.00 39.64 39.04 3fsg n ILE 248 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3fsg h ASP 249 N 0.00 0.67 -1.64 4.38 3.32 -1.57 -3.32 116.42 118.26 3fsg h ASP 249 Ca 0.00 0.02 -0.49 0.00 0.02 0.00 0.00 57.03 56.58 3fsg h ASP 249 Cb 0.00 -0.12 -0.41 0.00 0.22 0.00 0.00 39.33 39.02 3fsg h ASP 249 CO 0.00 0.44 -0.99 0.00 -1.72 0.00 0.00 179.24 176.97 3fsg n GLN 250 N -4.71 1.99 0.02 3.56 1.13 0.68 -4.91 117.38 115.13 3fsg n GLN 250 Ca 0.09 -3.87 -0.10 0.00 -1.94 0.00 0.00 57.00 51.19 3fsg n GLN 250 Cb 0.16 -1.78 -0.04 0.00 0.11 0.00 0.00 30.24 28.69 3fsg n GLN 250 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 3fsg h ARG 251 N 2.91 -0.16 -0.35 -1.09 2.43 -1.71 -1.98 114.38 114.43 3fsg h ARG 251 Ca 0.09 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 3fsg h ARG 251 Cb 0.93 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.49 3fsg h ARG 251 CO 0.64 -0.10 0.19 0.93 -1.51 0.00 0.00 179.97 180.11 3fsg h GLU 252 N -0.16 0.37 -0.48 0.20 5.08 -1.93 -2.67 114.58 114.99 3fsg h GLU 252 Ca 0.07 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3fsg h GLU 252 Cb 0.26 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 3fsg h GLU 252 CO -0.18 0.25 0.24 0.00 -1.00 0.00 0.00 179.01 178.32 3fsg h ALA 253 N 1.17 0.61 -0.09 3.43 0.00 -1.88 -0.69 119.26 121.81 3fsg h ALA 253 Ca 0.14 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3fsg h ALA 253 Cb 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3fsg h ALA 253 CO -0.09 -0.11 0.01 0.28 0.00 0.00 0.00 179.25 179.35 3fsg h VAL 254 N 0.47 0.96 -0.59 0.00 2.07 -1.17 0.15 116.25 118.13 3fsg h VAL 254 Ca 0.21 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.69 3fsg h VAL 254 Cb 0.12 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 3fsg h VAL 254 CO -0.15 0.01 0.29 1.23 0.02 0.00 0.00 177.57 178.97 3fsg h GLY 255 N 0.05 0.89 0.74 2.17 0.00 -1.16 -0.27 103.07 105.50 3fsg h GLY 255 Ca 0.04 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 3fsg h GLY 255 CO -0.06 0.40 -0.04 -2.75 0.00 0.00 0.00 176.54 174.09 3fsg h PHE 256 N 0.84 -0.10 -0.00 5.60 3.57 -0.82 -1.63 116.94 124.39 3fsg h PHE 256 Ca 0.21 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 3fsg h PHE 256 Cb 0.08 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3fsg h PHE 256 CO 0.01 0.17 -0.45 0.45 -2.23 0.00 0.00 178.31 176.26 3fsg h HIS 257 N -0.37 0.01 -0.10 0.41 3.86 -0.43 -0.95 115.15 117.58 3fsg h HIS 257 Ca -0.01 -0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.08 3fsg h HIS 257 Cb 0.31 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.79 3fsg h HIS 257 CO 0.01 0.45 -0.39 0.35 0.86 0.00 0.00 177.93 179.22 3fsg h PHE 258 N 0.01 0.58 -0.87 2.45 3.57 -0.96 -1.03 116.94 120.68 3fsg h PHE 258 Ca -0.00 -0.25 0.09 0.00 3.53 0.00 0.00 57.97 61.34 3fsg h PHE 258 Cb 0.79 -0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.37 3fsg h PHE 258 CO 0.00 0.99 0.52 -0.44 -2.23 0.00 0.00 178.31 177.16 3fsg h ASP 259 N 0.00 0.78 -0.52 0.41 3.32 -1.13 -1.43 116.42 117.86 3fsg h ASP 259 Ca -0.02 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 3fsg h ASP 259 Cb 1.02 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.43 3fsg h ASP 259 CO 0.08 0.47 0.17 0.25 -1.72 0.00 0.00 179.24 178.48 3fsg h LEU 260 N 0.90 0.76 -0.56 1.55 5.85 -0.94 -1.59 115.31 121.28 3fsg h LEU 260 Ca 0.41 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.97 3fsg h LEU 260 Cb 0.31 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 3fsg h LEU 260 CO -0.22 0.76 0.29 0.15 -0.34 0.00 0.00 178.44 179.08 3fsg h PHE 261 N 0.71 0.53 -0.28 1.25 3.57 -0.61 0.56 116.94 122.68 3fsg h PHE 261 Ca 0.17 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3fsg h PHE 261 Cb 0.27 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 3fsg h PHE 261 CO 0.02 0.26 0.14 -0.07 -2.23 0.00 0.00 178.31 176.42 3fsg h LEU 262 N 0.56 0.37 -0.96 0.59 3.38 -0.93 -1.79 115.31 116.52 3fsg h LEU 262 Ca 0.25 -0.12 0.11 0.00 0.09 0.00 0.00 57.88 58.21 3fsg h LEU 262 Cb 0.16 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 3fsg h LEU 262 CO -0.17 0.38 0.60 0.44 0.09 0.00 0.00 178.44 179.78 3fsg h ASP 263 N 0.33 0.89 -0.93 -0.43 5.19 -0.91 0.10 116.42 120.65 3fsg h ASP 263 Ca 0.10 0.04 0.09 0.00 -0.62 0.00 0.00 57.03 56.64 3fsg h ASP 263 Cb 0.11 -0.14 -0.07 0.00 0.18 0.00 0.00 39.33 39.41 3fsg h ASP 263 CO -0.01 0.50 0.58 -0.08 -3.12 0.00 0.00 179.24 177.10 3fsg h GLU 264 N 0.98 0.96 0.06 3.56 4.81 -0.09 -2.52 114.58 122.34 3fsg h GLU 264 Ca 0.46 -0.06 -0.25 0.00 -0.13 0.00 0.00 59.36 59.39 3fsg h GLU 264 Cb 0.41 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3fsg h GLU 264 CO -0.25 0.63 -1.20 -0.07 -0.73 0.00 0.00 179.01 177.39 3fsg h LEU 265 N 0.98 0.21 0.00 1.64 4.07 -0.36 -3.51 115.31 118.34 3fsg h LEU 265 Ca 0.44 -0.24 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3fsg h LEU 265 Cb 0.32 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.00 3fsg h LEU 265 CO -0.22 1.19 0.00 -3.20 -1.08 0.00 0.00 178.44 175.13