#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i3l n GLU 3 N 0.00 0.10 -1.35 0.00 -0.00 -1.15 -4.62 120.64 113.61 1i3l n GLU 3 Ca 0.00 0.04 -0.34 0.00 -0.00 0.00 0.00 57.16 56.86 1i3l n GLU 3 Cb 0.00 -0.67 0.10 0.00 -0.00 0.00 0.00 31.44 30.87 1i3l n GLU 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1i3l s LYS 4 N -2.16 2.02 -0.17 3.44 -0.14 -1.15 -4.49 119.74 117.08 1i3l s LYS 4 Ca -0.05 1.75 -0.01 0.00 -1.36 0.00 0.00 55.97 56.29 1i3l s LYS 4 Cb 0.01 -1.82 -0.01 0.00 -1.68 0.00 0.00 37.83 34.33 1i3l s LYS 4 CO 0.08 -1.92 -0.11 0.08 -0.76 0.00 0.00 175.35 172.71 1i3l s VAL 5 N -2.04 2.96 0.01 3.17 1.01 -0.57 -0.10 120.40 124.84 1i3l s VAL 5 Ca 0.74 -0.66 -0.24 0.00 0.00 0.00 0.00 61.98 61.82 1i3l s VAL 5 Cb -0.29 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 1i3l s VAL 5 CO 0.47 0.49 0.72 -0.22 0.00 0.00 0.00 175.10 176.56 1i3l s LEU 6 N 0.93 4.42 -0.29 3.92 2.96 -0.35 -1.07 118.68 129.20 1i3l s LEU 6 Ca -0.02 1.34 0.03 0.00 -0.22 0.00 0.00 54.13 55.26 1i3l s LEU 6 Cb -0.15 -3.15 0.07 0.00 0.50 0.00 0.00 46.19 43.47 1i3l s LEU 6 CO -0.01 0.00 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.29 1i3l s VAL 7 N 0.10 2.14 0.35 1.68 1.01 0.98 -0.20 120.40 126.47 1i3l s VAL 7 Ca 0.37 -1.85 -0.22 0.00 0.00 0.00 0.00 61.98 60.29 1i3l s VAL 7 Cb -0.19 -2.38 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 1i3l s VAL 7 CO 0.21 -0.24 0.88 0.42 0.00 0.00 0.00 175.10 176.37 1i3l s THR 8 N 1.06 4.40 -1.89 3.92 -4.23 -0.35 -1.65 115.64 116.90 1i3l s THR 8 Ca -0.02 1.49 0.00 0.00 -1.18 0.00 0.00 61.69 61.98 1i3l s THR 8 Cb -0.20 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 69.87 1i3l s THR 8 CO -0.06 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.56 1i3l n GLY 9 N -0.00 0.34 0.02 3.99 0.00 0.34 -2.09 105.19 107.79 1i3l n GLY 9 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1i3l n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i3l n GLY 10 N -0.83 -0.87 0.07 -0.02 0.00 -1.16 -1.98 105.19 100.39 1i3l n GLY 10 Ca -0.23 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 45.91 1i3l n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i3l n ALA 11 N -1.54 3.25 -1.09 4.61 0.00 -1.26 -1.90 120.51 122.58 1i3l n ALA 11 Ca 0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 53.44 53.10 1i3l n ALA 11 Cb 0.12 -1.18 0.03 0.00 0.00 0.00 0.00 19.45 18.42 1i3l n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i3l n GLY 12 N 1.44 -1.49 0.41 0.00 0.00 -0.84 -4.63 105.19 100.09 1i3l n GLY 12 Ca 0.08 -1.62 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 1i3l n GLY 12 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1i3l h TYR 13 N -1.23 -0.99 -0.29 1.61 3.20 -1.89 0.27 116.97 117.65 1i3l h TYR 13 Ca -0.05 -0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.67 1i3l h TYR 13 Cb 0.15 0.33 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 1i3l h TYR 13 CO 0.00 -0.60 -0.31 0.82 -1.64 0.00 0.00 178.16 176.43 1i3l h ILE 14 N -1.03 1.30 -0.51 1.81 2.04 -1.95 -3.04 117.51 116.12 1i3l h ILE 14 Ca -0.10 -1.48 0.03 0.00 1.00 0.00 0.00 64.86 64.30 1i3l h ILE 14 Cb 0.80 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.44 1i3l h ILE 14 CO 0.16 0.48 0.29 1.23 0.00 0.00 0.00 178.15 180.30 1i3l h GLY 15 N 0.46 0.72 1.04 5.37 0.00 -1.77 -0.46 103.07 108.43 1i3l h GLY 15 Ca 0.04 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1i3l h GLY 15 CO 0.08 0.17 0.27 1.48 0.00 0.00 0.00 176.54 178.53 1i3l h SER 16 N 0.57 1.03 -0.30 0.19 4.64 -0.21 0.26 113.55 119.73 1i3l h SER 16 Ca 0.21 -0.19 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 1i3l h SER 16 Cb 0.06 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 1i3l h SER 16 CO -0.11 0.94 0.02 0.45 -0.87 0.00 0.00 176.83 177.26 1i3l h HIS 17 N 1.06 0.64 -0.25 4.77 -0.00 -1.37 -1.62 115.15 118.38 1i3l h HIS 17 Ca 0.24 -0.07 -0.18 0.00 -0.00 0.00 0.00 60.37 60.36 1i3l h HIS 17 Cb 0.25 -0.18 -0.00 0.00 -0.00 0.00 0.00 27.41 27.48 1i3l h HIS 17 CO 0.02 0.60 -0.57 1.15 -0.00 0.00 0.00 177.93 179.13 1i3l h THR 18 N 0.59 1.29 -0.72 2.45 2.02 -0.06 -1.71 112.91 116.77 1i3l h THR 18 Ca 0.13 -1.78 0.05 0.00 0.77 0.00 0.00 66.41 65.58 1i3l h THR 18 Cb 0.34 1.70 -0.05 0.00 -1.74 0.00 0.00 68.15 68.40 1i3l h THR 18 CO 0.01 0.57 0.43 0.58 0.37 0.00 0.00 175.52 177.48 1i3l h VAL 19 N 0.58 1.04 -0.19 3.16 2.07 -0.21 0.19 116.25 122.89 1i3l h VAL 19 Ca 0.01 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.26 1i3l h VAL 19 Cb 1.16 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1i3l h VAL 19 CO 0.12 0.15 0.07 0.25 0.02 0.00 0.00 177.57 178.18 1i3l h LEU 20 N 0.82 0.08 -0.92 2.57 6.46 -1.12 -0.41 115.31 122.80 1i3l h LEU 20 Ca 0.31 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 58.04 1i3l h LEU 20 Cb 0.11 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.02 1i3l h LEU 20 CO -0.15 0.07 0.28 -0.33 -0.62 0.00 0.00 178.44 177.69 1i3l h GLU 21 N 0.16 1.06 -0.12 1.25 4.39 -0.59 -1.54 114.58 119.18 1i3l h GLU 21 Ca 0.08 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1i3l h GLU 21 Cb 0.05 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 1i3l h GLU 21 CO -0.08 0.87 0.07 -0.07 -1.16 0.00 0.00 179.01 178.64 1i3l h LEU 22 N 1.04 0.15 -0.63 1.33 3.38 -0.25 -0.98 115.31 119.35 1i3l h LEU 22 Ca 0.24 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1i3l h LEU 22 Cb 0.21 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1i3l h LEU 22 CO -0.02 0.15 0.42 -0.07 0.09 0.00 0.00 178.44 179.01 1i3l h LEU 23 N 0.13 0.73 -1.56 1.67 3.38 -0.79 -0.34 115.31 118.53 1i3l h LEU 23 Ca 0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1i3l h LEU 23 Cb 0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1i3l h LEU 23 CO -0.01 0.53 -0.22 -0.33 0.09 0.00 0.00 178.44 178.50 1i3l h GLU 24 N 0.86 0.00 -0.01 1.13 5.08 -1.00 -2.11 114.58 118.53 1i3l h GLU 24 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1i3l h GLU 24 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1i3l h GLU 24 CO -0.05 0.22 -0.07 0.00 -1.00 0.00 0.00 179.01 178.11 1i3l n ALA 25 N -2.35 2.73 -0.21 3.43 0.00 -0.40 -4.92 120.51 118.79 1i3l n ALA 25 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1i3l n ALA 25 Cb 0.32 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1i3l n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i3l n GLY 26 N 1.20 0.81 3.91 0.00 0.00 -0.79 -5.07 105.19 105.25 1i3l n GLY 26 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1i3l n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i3l s TYR 27 N -2.13 3.43 -0.30 1.61 2.02 -0.19 -5.01 117.35 116.78 1i3l s TYR 27 Ca 0.00 0.71 0.03 0.00 -0.37 0.00 0.00 57.07 57.44 1i3l s TYR 27 Cb 0.00 -2.47 0.08 0.00 -0.40 0.00 0.00 41.96 39.17 1i3l s TYR 27 CO 0.00 -0.49 -0.03 -0.51 -1.57 0.00 0.00 175.55 172.95 1i3l s LEU 28 N -4.83 4.03 0.29 -1.29 1.43 -1.26 -4.25 118.68 112.81 1i3l s LEU 28 Ca 0.50 -1.69 -0.01 0.00 -1.03 0.00 0.00 54.13 51.90 1i3l s LEU 28 Cb -0.10 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 1i3l s LEU 28 CO 0.45 -0.28 0.50 -2.16 0.23 0.00 0.00 176.35 175.09 1i3l s PRO 29 N 1.04 3.52 -0.15 1.29 0.04 -1.26 -1.51 135.00 137.97 1i3l s PRO 29 Ca -0.01 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1i3l s PRO 29 Cb -0.20 -2.72 0.03 0.00 0.04 0.00 0.00 34.50 31.66 1i3l s PRO 29 CO -0.06 0.24 -0.10 0.08 0.04 0.00 0.00 177.00 177.21 1i3l s VAL 30 N -2.14 1.32 -0.08 -0.36 1.01 -0.23 -4.09 120.40 115.82 1i3l s VAL 30 Ca 0.40 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1i3l s VAL 30 Cb -0.10 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 1i3l s VAL 30 CO 0.33 0.32 -0.03 -0.69 0.00 0.00 0.00 175.10 175.02 1i3l s VAL 31 N 1.57 4.03 0.06 2.92 1.01 0.16 -0.01 120.40 130.14 1i3l s VAL 31 Ca 0.03 -0.35 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1i3l s VAL 31 Cb -0.14 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 1i3l s VAL 31 CO -0.09 0.59 -0.21 0.27 0.00 0.00 0.00 175.10 175.66 1i3l s ILE 32 N -0.74 1.70 -0.15 2.22 -4.36 -0.66 -1.02 121.20 118.19 1i3l s ILE 32 Ca 0.11 -1.31 -0.30 0.00 -0.26 0.00 0.00 60.65 58.89 1i3l s ILE 32 Cb -0.11 -1.50 0.12 0.00 1.25 0.00 0.00 42.46 42.22 1i3l s ILE 32 CO 0.02 0.13 0.98 -0.62 0.24 0.00 0.00 174.94 175.69 1i3l s ASP 33 N -1.41 -0.38 0.00 4.36 2.15 -1.22 -0.50 116.67 119.67 1i3l s ASP 33 Ca 0.07 0.41 0.15 0.00 0.43 0.00 0.00 52.55 53.61 1i3l s ASP 33 Cb -0.09 0.31 0.33 0.00 -0.30 0.00 0.00 42.92 43.17 1i3l s ASP 33 CO 0.03 -0.36 1.24 -0.46 -0.17 0.00 0.00 175.17 175.45 1i3l n ASN 34 N 0.72 2.97 -0.48 -0.34 6.94 -1.13 -1.62 115.26 122.32 1i3l n ASN 34 Ca -0.11 -1.89 -0.06 0.00 -0.02 0.00 0.00 54.58 52.50 1i3l n ASN 34 Cb 0.58 -0.22 -0.03 0.00 -2.36 0.00 0.00 39.78 37.75 1i3l n ASN 34 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1i3l n PHE 35 N 0.86 0.00 -0.19 -2.53 3.01 -1.26 -4.88 117.46 112.47 1i3l n PHE 35 Ca 0.14 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.65 1i3l n PHE 35 Cb 0.46 -1.81 0.34 0.00 -0.01 0.00 0.00 39.48 38.45 1i3l n PHE 35 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1i3l h HIS 36 N 0.00 0.80 -0.58 1.38 2.76 -1.99 -3.19 115.15 114.33 1i3l h HIS 36 Ca -0.13 0.02 -0.27 0.00 -2.20 0.00 0.00 60.37 57.79 1i3l h HIS 36 Cb 0.75 -0.26 -0.39 0.00 1.55 0.00 0.00 27.41 29.05 1i3l h HIS 36 CO 0.39 0.43 -1.12 -1.71 -1.30 0.00 0.00 177.93 174.61 1i3l n ASN 37 N -4.48 1.46 -3.96 3.26 5.15 -1.26 -5.07 115.26 110.37 1i3l n ASN 37 Ca 0.11 -2.22 -0.09 0.00 -0.60 0.00 0.00 54.58 51.77 1i3l n ASN 37 Cb 0.21 -0.47 -0.11 0.00 -0.53 0.00 0.00 39.78 38.88 1i3l n ASN 37 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1i3l s ALA 38 N -3.53 0.04 -0.09 5.20 0.00 -1.21 -4.81 121.76 117.37 1i3l s ALA 38 Ca 0.27 -0.49 -0.18 0.00 0.00 0.00 0.00 51.96 51.56 1i3l s ALA 38 Cb 0.36 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.57 1i3l s ALA 38 CO -0.02 -0.16 0.47 0.12 0.00 0.00 0.00 175.76 176.17 1i3l s PHE 39 N -1.38 3.56 -0.05 0.00 5.36 -1.26 -4.77 117.98 119.45 1i3l s PHE 39 Ca -0.15 0.92 -0.30 0.00 -0.96 0.00 0.00 56.93 56.44 1i3l s PHE 39 Cb -0.09 -2.50 -0.03 0.00 -0.34 0.00 0.00 43.02 40.06 1i3l s PHE 39 CO -0.01 0.27 1.09 0.50 -1.46 0.00 0.00 175.22 175.61 1i3l s ARG 40 N 0.25 4.43 0.00 10.12 3.52 -1.26 -1.21 118.95 134.79 1i3l s ARG 40 Ca 0.26 1.54 0.00 0.00 -0.13 0.00 0.00 55.73 57.39 1i3l s ARG 40 Cb -0.16 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.73 1i3l s ARG 40 CO 0.11 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 174.71 1i3l n GLY 41 N 3.16 -1.59 0.00 8.12 0.00 -1.12 -4.59 105.19 109.17 1i3l n GLY 41 Ca 0.09 -1.57 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1i3l n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i3l n GLY 42 N 3.97 -1.42 0.00 -0.02 0.00 -1.26 -4.89 105.19 101.57 1i3l n GLY 42 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1i3l n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i3l n GLY 43 N 1.49 5.13 0.12 -0.02 0.00 -1.26 -5.07 105.19 105.58 1i3l n GLY 43 Ca 0.06 -1.69 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 1i3l n GLY 43 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1i3l h SER 44 N 0.00 -0.16 -4.10 1.61 0.02 -2.02 -3.46 113.55 105.45 1i3l h SER 44 Ca 0.00 -0.35 -0.52 0.00 -0.84 0.00 0.00 61.79 60.08 1i3l h SER 44 Cb 0.00 0.04 0.10 0.00 0.14 0.00 0.00 62.40 62.68 1i3l h SER 44 CO 0.00 0.31 0.45 -0.76 -1.14 0.00 0.00 176.83 175.69 1i3l s LEU 45 N -9.25 3.68 0.56 5.07 1.43 -1.26 -4.87 118.68 114.03 1i3l s LEU 45 Ca -0.14 2.30 -0.19 0.00 -1.03 0.00 0.00 54.13 55.06 1i3l s LEU 45 Cb 0.01 -4.59 -0.05 0.00 0.03 0.00 0.00 46.19 41.59 1i3l s LEU 45 CO 0.58 -1.47 1.16 -2.84 0.23 0.00 0.00 176.35 174.01 1i3l s PRO 46 N -3.35 3.24 0.27 1.29 0.02 -1.26 -2.79 135.00 132.43 1i3l s PRO 46 Ca 0.75 1.70 0.01 0.00 0.02 0.00 0.00 61.00 63.49 1i3l s PRO 46 Cb -0.28 -2.00 0.60 0.00 0.02 0.00 0.00 34.50 32.84 1i3l s PRO 46 CO 0.31 -0.96 1.74 1.49 -0.33 0.00 0.00 177.00 179.26 1i3l h GLU 47 N 1.14 0.55 -0.67 5.54 4.57 -1.41 0.80 114.58 125.09 1i3l h GLU 47 Ca -0.50 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 57.71 1i3l h GLU 47 Cb 1.27 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.68 1i3l h GLU 47 CO 0.56 0.36 0.37 0.66 -1.18 0.00 0.00 179.01 179.79 1i3l h SER 48 N 0.57 0.54 0.24 1.04 4.64 -1.86 0.71 113.55 119.42 1i3l h SER 48 Ca 0.50 0.03 -0.18 0.00 -0.47 0.00 0.00 61.79 61.67 1i3l h SER 48 Cb 0.79 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1i3l h SER 48 CO -0.41 0.34 -0.72 -0.07 -0.87 0.00 0.00 176.83 175.10 1i3l h LEU 49 N 0.67 0.50 -0.75 5.97 3.38 -1.59 -0.45 115.31 123.06 1i3l h LEU 49 Ca 0.31 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1i3l h LEU 49 Cb 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1i3l h LEU 49 CO -0.19 1.07 0.48 -0.09 0.09 0.00 0.00 178.44 179.80 1i3l h ARG 50 N 0.29 0.94 -0.43 1.13 2.43 -0.17 0.37 114.38 118.94 1i3l h ARG 50 Ca -0.03 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 58.95 1i3l h ARG 50 Cb 1.30 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 1i3l h ARG 50 CO 0.13 0.62 -0.25 0.00 -1.51 0.00 0.00 179.97 178.96 1i3l h ARG 51 N 0.97 0.89 -1.01 0.20 3.08 -0.70 -2.03 114.38 115.78 1i3l h ARG 51 Ca 0.29 -0.38 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1i3l h ARG 51 Cb -0.05 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 1i3l h ARG 51 CO -0.08 1.03 0.67 0.28 -1.07 0.00 0.00 179.97 180.80 1i3l h VAL 52 N 0.76 1.26 -0.06 2.04 2.07 -0.49 0.29 116.25 122.11 1i3l h VAL 52 Ca 0.10 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1i3l h VAL 52 Cb 0.80 -0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1i3l h VAL 52 CO 0.07 0.25 -0.02 -0.61 0.02 0.00 0.00 177.57 177.28 1i3l h GLN 53 N 1.36 -0.01 -0.61 1.57 4.15 -0.64 0.16 115.11 121.09 1i3l h GLN 53 Ca 0.37 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.79 1i3l h GLN 53 Cb -0.15 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 1i3l h GLN 53 CO -0.08 -0.01 0.40 1.49 -1.93 0.00 0.00 178.83 178.70 1i3l h GLU 54 N -0.01 0.81 -0.70 1.69 4.22 -0.83 0.35 114.58 120.10 1i3l h GLU 54 Ca 0.03 -0.06 -0.07 0.00 0.08 0.00 0.00 59.36 59.34 1i3l h GLU 54 Cb 0.06 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 1i3l h GLU 54 CO -0.07 0.55 0.16 -0.07 -2.18 0.00 0.00 179.01 177.40 1i3l h LEU 55 N 0.83 1.08 0.00 1.64 3.38 0.05 -3.20 115.31 119.09 1i3l h LEU 55 Ca 0.22 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1i3l h LEU 55 Cb -0.08 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.38 1i3l h LEU 55 CO -0.05 1.04 -1.17 0.35 0.09 0.00 0.00 178.44 178.71 1i3l n THR 56 N -4.23 0.70 -1.59 0.22 -2.24 0.51 -4.94 114.28 102.71 1i3l n THR 56 Ca 0.05 -0.58 -0.07 0.00 -2.27 0.00 0.00 64.05 61.18 1i3l n THR 56 Cb 0.27 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 68.08 1i3l n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i3l n GLY 57 N 1.23 0.60 3.23 3.38 0.00 0.12 -5.01 105.19 108.75 1i3l n GLY 57 Ca -0.03 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 45.13 1i3l n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i3l s ARG 58 N -3.33 0.98 0.35 1.61 0.52 -1.18 -5.06 118.95 112.85 1i3l s ARG 58 Ca 0.00 -1.07 -0.23 0.00 -0.52 0.00 0.00 55.73 53.91 1i3l s ARG 58 Cb 0.00 -1.13 -0.10 0.00 0.52 0.00 0.00 34.95 34.24 1i3l s ARG 58 CO 0.00 0.26 0.91 0.45 0.02 0.00 0.00 175.30 176.94 1i3l s SER 59 N -1.83 7.14 -0.30 0.23 0.15 -1.26 -4.50 113.70 113.33 1i3l s SER 59 Ca 0.03 1.70 -0.08 0.00 0.70 0.00 0.00 55.95 58.30 1i3l s SER 59 Cb -0.10 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 1i3l s SER 59 CO 0.03 -0.16 0.11 -0.69 1.20 0.00 0.00 173.24 173.73 1i3l s VAL 60 N -1.82 4.25 -0.29 4.45 1.01 -1.26 -4.95 120.40 121.79 1i3l s VAL 60 Ca 0.54 -0.57 -0.25 0.00 0.00 0.00 0.00 61.98 61.69 1i3l s VAL 60 Cb -0.15 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1i3l s VAL 60 CO 0.19 0.07 0.85 -0.70 0.00 0.00 0.00 175.10 175.52 1i3l s GLU 61 N 1.55 4.04 0.05 2.72 2.12 -1.26 -5.02 118.70 122.90 1i3l s GLU 61 Ca 0.03 0.78 0.02 0.00 0.36 0.00 0.00 54.97 56.17 1i3l s GLU 61 Cb -0.17 -3.71 -0.03 0.00 0.26 0.00 0.00 34.13 30.49 1i3l s GLU 61 CO 0.04 -0.67 -0.08 0.12 -0.54 0.00 0.00 175.26 174.13 1i3l s PHE 62 N 3.05 0.71 -0.04 5.30 5.36 -1.26 -0.66 117.98 130.43 1i3l s PHE 62 Ca 0.35 -0.52 -0.02 0.00 -0.96 0.00 0.00 56.93 55.78 1i3l s PHE 62 Cb -0.14 -0.42 0.03 0.00 -0.34 0.00 0.00 43.02 42.15 1i3l s PHE 62 CO 0.11 -0.08 0.05 -2.00 -1.46 0.00 0.00 175.22 171.84 1i3l s GLU 63 N -1.72 0.01 -0.25 10.12 2.56 -0.19 -4.95 118.70 124.29 1i3l s GLU 63 Ca -0.08 0.33 -0.29 0.00 0.00 0.00 0.00 54.97 54.92 1i3l s GLU 63 Cb -0.09 -0.54 -0.01 0.00 2.00 0.00 0.00 34.13 35.49 1i3l s GLU 63 CO 0.00 -0.31 1.30 -2.00 -0.56 0.00 0.00 175.26 173.69 1i3l s GLU 64 N 2.04 4.03 0.03 4.30 2.12 -1.26 -3.39 118.70 126.56 1i3l s GLU 64 Ca 0.04 1.42 -0.28 0.00 0.36 0.00 0.00 54.97 56.51 1i3l s GLU 64 Cb -0.12 -3.84 0.09 0.00 0.26 0.00 0.00 34.13 30.52 1i3l s GLU 64 CO -0.03 -0.97 0.91 0.00 -0.54 0.00 0.00 175.26 174.63 1i3l s MET 65 N 3.94 0.90 -0.15 4.30 0.23 -0.64 -4.93 119.30 122.94 1i3l s MET 65 Ca 0.56 -0.38 -0.05 0.00 -1.03 0.00 0.00 55.69 54.79 1i3l s MET 65 Cb -0.19 0.38 -0.04 0.00 -1.53 0.00 0.00 34.83 33.45 1i3l s MET 65 CO 0.20 -0.40 0.04 0.34 -2.03 0.00 0.00 175.02 173.17 1i3l s ASP 66 N -2.59 5.46 0.40 -1.18 -1.08 -1.26 -2.83 116.67 113.58 1i3l s ASP 66 Ca 0.07 0.09 0.28 0.00 -0.52 0.00 0.00 52.55 52.47 1i3l s ASP 66 Cb -0.01 -1.83 1.42 0.00 -1.46 0.00 0.00 42.92 41.04 1i3l s ASP 66 CO -0.06 0.24 1.85 0.16 0.52 0.00 0.00 175.17 177.88 1i3l h ILE 67 N 4.67 0.00 -0.00 4.11 3.07 -1.98 -0.72 117.51 126.66 1i3l h ILE 67 Ca -0.41 -0.08 0.00 0.00 1.55 0.00 0.00 64.86 65.92 1i3l h ILE 67 Cb 1.18 0.76 0.00 0.00 -0.27 0.00 0.00 36.82 38.49 1i3l h ILE 67 CO 0.64 0.00 -0.04 0.18 -1.05 0.00 0.00 178.15 177.88 1i3l n LEU 68 N -2.49 0.20 -4.35 0.16 4.77 -1.26 -4.64 117.00 109.39 1i3l n LEU 68 Ca -0.01 0.12 -0.45 0.00 -0.03 0.00 0.00 56.01 55.64 1i3l n LEU 68 Cb 0.10 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 1i3l n LEU 68 CO 0.15 0.04 0.36 -0.62 -1.33 0.00 0.00 177.39 175.99 1i3l s ASP 69 N -2.43 6.29 0.26 -1.43 -1.08 -0.28 -4.92 116.67 113.08 1i3l s ASP 69 Ca 0.32 -1.75 -0.03 0.00 -0.52 0.00 0.00 52.55 50.57 1i3l s ASP 69 Cb 0.20 -2.27 0.38 0.00 -1.46 0.00 0.00 42.92 39.78 1i3l s ASP 69 CO 0.45 -0.96 1.88 0.06 0.52 0.00 0.00 175.17 177.12 1i3l h GLN 70 N 8.89 1.14 -0.22 4.34 3.07 -1.86 -1.08 115.11 129.39 1i3l h GLN 70 Ca -0.22 -0.07 0.03 0.00 0.09 0.00 0.00 58.65 58.48 1i3l h GLN 70 Cb 1.08 -0.26 -0.03 0.00 0.08 0.00 0.00 27.48 28.36 1i3l h GLN 70 CO 1.04 0.75 0.04 0.78 0.09 0.00 0.00 178.83 181.53 1i3l h GLY 71 N 1.17 0.24 1.16 0.06 0.00 -1.97 0.24 103.07 103.99 1i3l h GLY 71 Ca 0.42 -0.01 -0.07 0.00 0.00 0.00 0.00 47.33 47.67 1i3l h GLY 71 CO -0.16 -0.01 0.12 0.00 0.00 0.00 0.00 176.54 176.49 1i3l h ALA 72 N 1.16 1.01 -0.55 3.60 0.00 -1.83 -1.22 119.26 121.42 1i3l h ALA 72 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1i3l h ALA 72 Cb 0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1i3l h ALA 72 CO -0.14 0.64 0.28 -0.07 0.00 0.00 0.00 179.25 179.96 1i3l h LEU 73 N 0.97 0.71 -0.45 0.00 3.38 -0.57 0.13 115.31 119.48 1i3l h LEU 73 Ca 0.20 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1i3l h LEU 73 Cb 0.40 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1i3l h LEU 73 CO 0.01 0.63 0.29 1.56 0.09 0.00 0.00 178.44 181.02 1i3l h GLN 74 N 0.74 0.58 -0.76 1.13 4.20 -0.22 -0.35 115.11 120.43 1i3l h GLN 74 Ca 0.19 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.83 1i3l h GLN 74 Cb 0.10 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 1i3l h GLN 74 CO -0.03 0.38 0.32 0.00 -0.67 0.00 0.00 178.83 178.83 1i3l h ARG 75 N 0.60 1.12 -0.37 1.46 3.08 -0.85 -1.38 114.38 118.04 1i3l h ARG 75 Ca 0.17 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1i3l h ARG 75 Cb -0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 1i3l h ARG 75 CO -0.04 0.91 0.22 1.25 -1.07 0.00 0.00 179.97 181.24 1i3l h LEU 76 N 1.08 0.44 -1.50 3.04 5.85 -0.10 -0.75 115.31 123.37 1i3l h LEU 76 Ca 0.25 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1i3l h LEU 76 Cb 0.19 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1i3l h LEU 76 CO -0.02 0.35 -0.01 -0.26 -0.34 0.00 0.00 178.44 178.17 1i3l h PHE 77 N 0.48 0.00 0.20 1.25 -1.00 -0.88 -2.23 116.94 114.76 1i3l h PHE 77 Ca 0.13 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.58 1i3l h PHE 77 Cb -0.00 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.57 1i3l h PHE 77 CO -0.04 0.01 -1.56 0.87 -1.61 0.00 0.00 178.31 175.98 1i3l h LYS 78 N 0.00 0.41 -0.58 1.51 1.57 -0.61 -3.37 116.57 115.50 1i3l h LYS 78 Ca -0.00 -0.71 -0.05 0.00 -1.87 0.00 0.00 60.65 58.02 1i3l h LYS 78 Cb 0.50 0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 1i3l h LYS 78 CO 0.00 1.32 0.17 -0.22 -0.57 0.00 0.00 179.45 180.15 1i3l h LYS 79 N 0.11 0.91 -6.24 3.15 3.64 -0.84 -3.45 116.57 113.86 1i3l h LYS 79 Ca -0.27 -0.20 -0.59 0.00 -1.27 0.00 0.00 60.65 58.32 1i3l h LYS 79 Cb 2.10 -0.13 -0.12 0.00 -0.41 0.00 0.00 32.23 33.67 1i3l h LYS 79 CO 0.22 0.83 -0.70 0.71 -2.27 0.00 0.00 179.45 178.23 1i3l s TYR 80 N -5.38 2.51 -0.46 1.91 2.02 -0.87 -5.10 117.35 111.99 1i3l s TYR 80 Ca -0.13 -0.27 -0.10 0.00 -0.37 0.00 0.00 57.07 56.20 1i3l s TYR 80 Cb 0.13 -1.11 0.10 0.00 -0.40 0.00 0.00 41.96 40.68 1i3l s TYR 80 CO 0.81 0.65 0.33 0.45 -1.57 0.00 0.00 175.55 176.22 1i3l s SER 81 N -3.51 5.74 0.15 2.29 0.15 -1.26 -4.68 113.70 112.59 1i3l s SER 81 Ca 0.30 -1.73 -0.02 0.00 0.70 0.00 0.00 55.95 55.21 1i3l s SER 81 Cb -0.06 -2.03 -0.05 0.00 -1.71 0.00 0.00 66.02 62.18 1i3l s SER 81 CO 0.17 -0.65 0.35 -0.36 1.20 0.00 0.00 173.24 173.95 1i3l s PHE 82 N 1.42 3.49 -0.10 3.44 2.99 -1.26 -2.25 117.98 125.71 1i3l s PHE 82 Ca 0.04 0.38 0.13 0.00 0.00 0.00 0.00 56.93 57.48 1i3l s PHE 82 Cb -0.25 -1.87 -0.19 0.00 0.00 0.00 0.00 43.02 40.70 1i3l s PHE 82 CO 0.01 0.44 0.32 0.00 -0.00 0.00 0.00 175.22 175.99 1i3l n MET 83 N -0.25 0.72 -3.52 0.44 0.00 0.85 -0.56 117.12 114.81 1i3l n MET 83 Ca -0.04 -0.10 -0.09 0.00 0.00 0.00 0.00 57.70 57.47 1i3l n MET 83 Cb 0.53 -1.28 -0.02 0.00 0.00 0.00 0.00 33.22 32.44 1i3l n MET 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1i3l s ALA 84 N -2.81 -1.71 -0.04 3.17 0.00 -1.23 -4.58 121.76 114.55 1i3l s ALA 84 Ca -0.04 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1i3l s ALA 84 Cb 0.09 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.82 1i3l s ALA 84 CO 0.54 -0.77 -0.10 0.08 0.00 0.00 0.00 175.76 175.52 1i3l s VAL 85 N -3.37 0.89 -0.28 0.00 1.01 -0.48 -1.21 120.40 116.96 1i3l s VAL 85 Ca 0.05 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 1i3l s VAL 85 Cb -0.01 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.57 1i3l s VAL 85 CO -0.08 0.29 0.04 -0.63 0.00 0.00 0.00 175.10 174.72 1i3l s ILE 86 N 0.45 3.72 -0.69 2.22 1.01 0.73 -0.72 121.20 127.92 1i3l s ILE 86 Ca -0.08 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 1i3l s ILE 86 Cb -0.12 -2.89 0.18 0.00 0.01 0.00 0.00 42.46 39.64 1i3l s ILE 86 CO 0.02 0.14 0.61 -2.28 0.00 0.00 0.00 174.94 173.43 1i3l s HIS 87 N 1.47 3.56 -0.11 3.97 2.46 -0.15 -1.21 115.29 125.28 1i3l s HIS 87 Ca 0.02 -1.91 0.20 0.00 0.47 0.00 0.00 55.06 53.85 1i3l s HIS 87 Cb -0.17 -3.70 -0.24 0.00 -0.13 0.00 0.00 32.58 28.35 1i3l s HIS 87 CO 0.01 -0.98 0.54 1.19 -2.47 0.00 0.00 174.74 173.03 1i3l n PHE 88 N 4.31 0.31 -1.69 3.88 3.72 -0.89 -3.05 117.46 124.06 1i3l n PHE 88 Ca 0.04 0.10 -0.44 0.00 -0.05 0.00 0.00 57.45 57.09 1i3l n PHE 88 Cb 0.43 -0.76 -0.04 0.00 -0.94 0.00 0.00 39.48 38.17 1i3l n PHE 88 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1i3l n ALA 89 N -2.36 1.98 0.00 4.37 0.00 -1.15 -4.79 120.51 118.56 1i3l n ALA 89 Ca -0.10 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1i3l n ALA 89 Cb 0.72 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1i3l n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i3l n GLY 90 N 3.72 0.14 3.82 0.00 0.00 -1.26 -4.94 105.19 106.66 1i3l n GLY 90 Ca 0.17 -1.10 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 1i3l n GLY 90 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i3l s LEU 91 N 0.00 4.36 0.10 0.99 1.43 -1.26 -5.04 118.68 119.25 1i3l s LEU 91 Ca 0.00 0.57 0.05 0.00 -1.03 0.00 0.00 54.13 53.72 1i3l s LEU 91 Cb 0.00 -2.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1i3l s LEU 91 CO 0.00 0.29 0.01 -1.59 0.23 0.00 0.00 176.35 175.29 1i3l s LYS 92 N -0.54 2.56 0.00 1.70 -2.85 -1.26 -4.98 119.74 114.37 1i3l s LYS 92 Ca 0.17 -0.86 -0.30 0.00 -1.00 0.00 0.00 55.97 53.98 1i3l s LYS 92 Cb -0.13 -2.54 -0.06 0.00 -2.06 0.00 0.00 37.83 33.04 1i3l s LYS 92 CO 0.06 0.53 1.50 0.00 0.10 0.00 0.00 175.35 177.54 1i3l s ALA 93 N -1.36 3.62 -0.86 0.59 0.00 -1.26 -4.69 121.76 117.80 1i3l s ALA 93 Ca 0.26 0.95 0.12 0.00 0.00 0.00 0.00 51.96 53.30 1i3l s ALA 93 Cb -0.11 -3.65 0.36 0.00 0.00 0.00 0.00 23.12 19.72 1i3l s ALA 93 CO 0.19 -1.06 1.30 -1.33 0.00 0.00 0.00 175.76 174.86 1i3l n MET 94 N 5.78 2.90 -0.20 0.00 2.81 -1.26 -4.84 117.12 122.31 1i3l n MET 94 Ca 0.15 -2.22 0.00 0.00 -1.81 0.00 0.00 57.70 53.82 1i3l n MET 94 Cb 0.43 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 31.55 1i3l n MET 94 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i3l n GLY 95 N 0.42 0.71 0.21 3.03 0.00 -1.26 -4.79 105.19 103.51 1i3l n GLY 95 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 1i3l n GLY 95 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i3l h GLU 96 N 4.13 0.70 -0.84 1.61 5.08 -1.88 -3.39 114.58 119.98 1i3l h GLU 96 Ca 0.00 -0.55 0.16 0.00 -1.00 0.00 0.00 59.36 57.97 1i3l h GLU 96 Cb 0.00 0.11 -0.16 0.00 0.50 0.00 0.00 28.75 29.20 1i3l h GLU 96 CO 0.00 1.17 -0.22 -1.13 -1.00 0.00 0.00 179.01 177.83 1i3l n SER 97 N -3.92 -0.33 -0.24 1.42 3.41 -1.26 -0.01 113.62 112.69 1i3l n SER 97 Ca -0.06 1.45 0.07 0.00 -0.26 0.00 0.00 58.87 60.07 1i3l n SER 97 Cb 0.72 -0.43 0.32 0.00 -0.26 0.00 0.00 64.21 64.57 1i3l n SER 97 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1i3l h VAL 98 N 0.00 0.99 0.00 -3.33 2.07 -1.97 -2.58 116.25 111.44 1i3l h VAL 98 Ca 0.39 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1i3l h VAL 98 Cb 0.60 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1i3l h VAL 98 CO -0.86 0.15 -0.54 1.56 0.02 0.00 0.00 177.57 177.90 1i3l h GLN 99 N 0.83 0.00 -1.80 1.57 1.08 -0.71 -3.40 115.11 112.67 1i3l h GLN 99 Ca 0.37 0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 57.10 1i3l h GLN 99 Cb 0.35 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 27.37 1i3l h GLN 99 CO -0.14 0.00 -1.12 0.36 -0.95 0.00 0.00 178.83 176.97 1i3l n LYS 100 N -2.57 1.33 -0.30 1.46 2.85 -0.89 -4.97 118.16 115.07 1i3l n LYS 100 Ca 0.03 -3.55 0.05 0.00 -1.05 0.00 0.00 58.31 53.79 1i3l n LYS 100 Cb 0.50 -1.68 0.14 0.00 -0.65 0.00 0.00 35.03 33.34 1i3l n LYS 100 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 1i3l h PRO 101 N 2.98 0.02 -0.82 -1.58 0.13 -1.77 -1.33 132.00 129.63 1i3l h PRO 101 Ca 0.07 -0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.29 1i3l h PRO 101 Cb 0.96 -0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.03 1i3l h PRO 101 CO 0.55 0.01 0.54 -0.07 -0.23 0.00 0.00 178.00 178.79 1i3l h LEU 102 N 0.02 0.72 -0.49 1.56 3.38 -1.93 0.75 115.31 119.31 1i3l h LEU 102 Ca 0.44 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.32 1i3l h LEU 102 Cb 0.73 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1i3l h LEU 102 CO -0.86 0.43 -0.09 0.44 0.09 0.00 0.00 178.44 178.46 1i3l h ASP 103 N 0.80 0.93 -0.22 -0.43 3.45 -1.66 0.21 116.42 119.50 1i3l h ASP 103 Ca 0.38 -0.35 -0.02 0.00 0.43 0.00 0.00 57.03 57.47 1i3l h ASP 103 Cb 0.40 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.91 1i3l h ASP 103 CO -0.15 1.06 0.05 1.88 -1.57 0.00 0.00 179.24 180.52 1i3l h TYR 104 N 0.78 0.37 -0.51 4.55 -1.99 -1.20 -0.97 116.97 118.01 1i3l h TYR 104 Ca 0.13 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 60.71 1i3l h TYR 104 Cb 0.64 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 39.25 1i3l h TYR 104 CO 0.05 0.46 -0.10 1.88 -0.00 0.00 0.00 178.16 180.44 1i3l h TYR 105 N 0.18 1.09 0.94 4.88 0.99 -0.82 0.44 116.97 124.66 1i3l h TYR 105 Ca 0.07 -0.23 -0.05 0.00 2.00 0.00 0.00 58.73 60.53 1i3l h TYR 105 Cb 0.27 -0.27 0.01 0.00 1.00 0.00 0.00 36.73 37.74 1i3l h TYR 105 CO 0.01 1.03 -0.45 -0.09 -0.00 0.00 0.00 178.16 178.66 1i3l h ARG 106 N 0.84 -1.21 -0.22 4.88 2.43 -0.49 -0.58 114.38 120.02 1i3l h ARG 106 Ca 0.13 0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1i3l h ARG 106 Cb 0.66 0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1i3l h ARG 106 CO 0.05 -0.81 0.05 0.28 -1.51 0.00 0.00 179.97 178.03 1i3l h VAL 107 N -1.30 1.21 0.04 0.20 2.07 -1.21 -1.17 116.25 116.09 1i3l h VAL 107 Ca -0.13 -0.68 -0.11 0.00 0.82 0.00 0.00 66.70 66.61 1i3l h VAL 107 Cb 0.97 1.23 0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1i3l h VAL 107 CO 0.21 0.21 -0.45 0.78 0.02 0.00 0.00 177.57 178.34 1i3l h ASN 108 N 0.18 0.33 0.00 0.57 2.35 -1.00 -2.90 115.58 115.10 1i3l h ASN 108 Ca 0.07 -0.86 0.00 0.00 -0.55 0.00 0.00 56.30 54.96 1i3l h ASN 108 Cb 0.27 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1i3l h ASN 108 CO 0.00 1.15 -0.09 -0.07 -1.65 0.00 0.00 177.43 176.77 1i3l h LEU 109 N -0.46 0.00 -0.86 1.61 3.38 -1.19 -2.82 115.31 114.98 1i3l h LEU 109 Ca -0.07 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1i3l h LEU 109 Cb 1.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.96 1i3l h LEU 109 CO 0.09 0.50 0.56 0.74 0.09 0.00 0.00 178.44 180.41 1i3l h THR 110 N -0.90 1.15 -0.78 0.22 2.02 -0.64 0.28 112.91 114.25 1i3l h THR 110 Ca 0.00 -0.37 -0.04 0.00 0.77 0.00 0.00 66.41 66.77 1i3l h THR 110 Cb 0.09 -0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.43 1i3l h THR 110 CO 0.00 0.20 0.34 1.23 0.37 0.00 0.00 175.52 177.66 1i3l h GLY 111 N 1.09 1.23 1.04 2.16 0.00 -1.02 -0.44 103.07 107.13 1i3l h GLY 111 Ca 0.34 -0.64 -0.12 0.00 0.00 0.00 0.00 47.33 46.90 1i3l h GLY 111 CO -0.11 0.61 -0.22 -0.84 0.00 0.00 0.00 176.54 175.98 1i3l h THR 112 N 1.12 1.28 -0.48 4.70 2.02 -1.14 -2.02 112.91 118.39 1i3l h THR 112 Ca 0.26 -1.37 0.01 0.00 0.77 0.00 0.00 66.41 66.08 1i3l h THR 112 Cb 0.17 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 1i3l h THR 112 CO -0.03 0.46 0.31 0.40 0.37 0.00 0.00 175.52 177.03 1i3l h ILE 113 N 0.68 1.11 -0.98 3.11 2.04 -0.73 0.15 117.51 122.89 1i3l h ILE 113 Ca 0.09 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.77 1i3l h ILE 113 Cb 0.78 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 1i3l h ILE 113 CO 0.06 0.12 0.64 -0.61 0.00 0.00 0.00 178.15 178.36 1i3l h GLN 114 N 0.64 1.20 -0.38 2.37 5.75 -1.00 0.17 115.11 123.86 1i3l h GLN 114 Ca 0.18 -0.07 -0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1i3l h GLN 114 Cb -0.06 -0.27 -0.01 0.00 1.07 0.00 0.00 27.48 28.20 1i3l h GLN 114 CO -0.05 0.80 0.03 1.25 -2.65 0.00 0.00 178.83 178.21 1i3l h LEU 115 N 1.24 0.63 -0.95 -2.39 5.85 -0.78 -1.97 115.31 116.95 1i3l h LEU 115 Ca 0.39 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1i3l h LEU 115 Cb 0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1i3l h LEU 115 CO -0.12 0.76 0.27 -0.07 -0.34 0.00 0.00 178.44 178.94 1i3l h LEU 116 N 0.48 0.95 -0.90 2.25 3.38 0.05 -0.30 115.31 121.23 1i3l h LEU 116 Ca 0.11 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1i3l h LEU 116 Cb 0.42 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1i3l h LEU 116 CO 0.01 0.85 0.10 -0.33 0.09 0.00 0.00 178.44 179.16 1i3l h GLU 117 N 1.01 0.91 -0.16 1.13 5.08 -0.35 -1.00 114.58 121.21 1i3l h GLU 117 Ca 0.23 -0.22 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 1i3l h GLU 117 Cb 0.20 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1i3l h GLU 117 CO -0.02 0.85 -0.64 0.97 -1.00 0.00 0.00 179.01 179.17 1i3l h ILE 118 N 0.87 1.32 -0.46 3.13 6.09 -1.09 0.27 117.51 127.65 1i3l h ILE 118 Ca 0.18 -1.91 0.01 0.00 -1.37 0.00 0.00 64.86 61.77 1i3l h ILE 118 Cb 0.38 1.88 -0.03 0.00 0.47 0.00 0.00 36.82 39.52 1i3l h ILE 118 CO 0.01 0.59 0.29 0.24 -3.07 0.00 0.00 178.15 176.21 1i3l h MET 119 N 0.44 0.57 0.09 2.19 2.86 -0.75 -1.32 114.93 119.02 1i3l h MET 119 Ca -0.01 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1i3l h MET 119 Cb 1.21 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.75 1i3l h MET 119 CO 0.12 0.38 -0.04 -0.22 1.06 0.00 0.00 176.91 178.20 1i3l h LYS 120 N 0.59 -0.12 -0.90 1.72 3.64 -1.04 0.43 116.57 120.88 1i3l h LYS 120 Ca 0.17 0.01 0.18 0.00 -1.27 0.00 0.00 60.65 59.74 1i3l h LYS 120 Cb -0.04 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 31.71 1i3l h LYS 120 CO -0.06 -0.07 0.48 0.00 -2.27 0.00 0.00 179.45 177.54 1i3l h ALA 121 N 0.77 1.43 -0.45 5.00 0.00 -0.59 -1.43 119.26 123.98 1i3l h ALA 121 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1i3l h ALA 121 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1i3l h ALA 121 CO 0.02 -0.13 0.00 0.72 0.00 0.00 0.00 179.25 179.86 1i3l n HIS 122 N -4.88 0.60 -2.28 0.00 8.25 -0.53 -4.94 115.22 111.44 1i3l n HIS 122 Ca 0.20 -0.30 -0.13 0.00 -0.26 0.00 0.00 57.72 57.23 1i3l n HIS 122 Cb 0.52 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.63 1i3l n HIS 122 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i3l n GLY 123 N 1.38 -0.18 3.21 -1.41 0.00 -0.41 -4.95 105.19 102.84 1i3l n GLY 123 Ca 0.19 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 1i3l n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i3l s VAL 124 N -2.68 5.00 -0.85 1.61 1.01 0.14 -4.94 120.40 119.69 1i3l s VAL 124 Ca 0.01 -3.47 -0.02 0.00 0.00 0.00 0.00 61.98 58.50 1i3l s VAL 124 Cb -0.00 -4.07 0.35 0.00 0.00 0.00 0.00 36.38 32.65 1i3l s VAL 124 CO 0.01 -1.09 2.03 0.29 0.00 0.00 0.00 175.10 176.33 1i3l n LYS 125 N 2.75 2.80 -3.63 2.72 5.02 -1.26 -4.47 118.16 122.09 1i3l n LYS 125 Ca 0.20 -3.54 -0.25 0.00 -2.02 0.00 0.00 58.31 52.70 1i3l n LYS 125 Cb 0.39 -2.27 -0.17 0.00 -0.02 0.00 0.00 35.03 32.95 1i3l n LYS 125 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1i3l s ASN 126 N -1.08 2.08 0.05 4.39 0.01 -1.25 -1.14 114.94 117.99 1i3l s ASN 126 Ca 0.52 -0.45 0.04 0.00 -0.71 0.00 0.00 52.86 52.25 1i3l s ASN 126 Cb 0.43 -0.24 -0.02 0.00 0.41 0.00 0.00 41.25 41.83 1i3l s ASN 126 CO -0.41 -0.32 -0.12 -0.22 -1.51 0.00 0.00 177.10 174.52 1i3l s LEU 127 N 2.13 2.21 -0.15 0.60 2.96 -0.66 -1.38 118.68 124.38 1i3l s LEU 127 Ca 0.03 -0.49 0.02 0.00 -0.22 0.00 0.00 54.13 53.46 1i3l s LEU 127 Cb -0.15 -0.44 0.01 0.00 0.50 0.00 0.00 46.19 46.12 1i3l s LEU 127 CO -0.07 -0.06 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.01 1i3l s VAL 128 N -1.04 1.94 -0.04 1.68 1.01 0.11 -0.94 120.40 123.11 1i3l s VAL 128 Ca -0.02 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.13 1i3l s VAL 128 Cb -0.08 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1i3l s VAL 128 CO 0.01 0.52 -0.22 0.12 0.00 0.00 0.00 175.10 175.54 1i3l s PHE 129 N 1.02 2.49 -0.79 5.22 2.19 -0.15 -0.98 117.98 126.98 1i3l s PHE 129 Ca -0.03 -0.39 -0.26 0.00 0.33 0.00 0.00 56.93 56.58 1i3l s PHE 129 Cb -0.15 -1.57 0.03 0.00 -1.31 0.00 0.00 43.02 40.03 1i3l s PHE 129 CO -0.05 0.00 1.34 -1.12 1.83 0.00 0.00 175.22 177.22 1i3l s SER 130 N -0.55 6.18 0.00 6.13 0.01 -1.17 -1.46 113.70 122.83 1i3l s SER 130 Ca 0.08 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1i3l s SER 130 Cb -0.11 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.56 1i3l s SER 130 CO 0.00 -1.81 0.00 -0.24 0.41 0.00 0.00 173.24 171.61 1i3l n SER 131 N 9.45 0.36 -3.68 2.44 2.88 0.10 -4.97 113.62 120.21 1i3l n SER 131 Ca 0.09 -0.77 -0.15 0.00 -1.33 0.00 0.00 58.87 56.71 1i3l n SER 131 Cb 0.49 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.88 1i3l n SER 131 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1i3l s SER 132 N -0.92 -0.37 0.03 -3.46 0.15 -1.26 -2.62 113.70 105.26 1i3l s SER 132 Ca 0.00 0.35 0.05 0.00 0.70 0.00 0.00 55.95 57.05 1i3l s SER 132 Cb 0.00 0.43 0.21 0.00 -1.71 0.00 0.00 66.02 64.96 1i3l s SER 132 CO 0.00 -0.48 1.14 0.00 1.20 0.00 0.00 173.24 175.10 1i3l n ALA 133 N 1.26 1.14 0.32 5.45 0.00 0.01 -1.54 120.51 127.14 1i3l n ALA 133 Ca -0.20 0.01 0.21 0.00 0.00 0.00 0.00 53.44 53.45 1i3l n ALA 133 Cb 0.56 -1.07 1.04 0.00 0.00 0.00 0.00 19.45 19.98 1i3l n ALA 133 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1i3l h THR 134 N 0.00 0.01 0.00 0.00 2.02 -1.94 -2.09 112.91 110.92 1i3l h THR 134 Ca 0.00 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 1i3l h THR 134 Cb 0.05 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1i3l h THR 134 CO 0.00 0.00 -0.02 -0.37 0.37 0.00 0.00 175.52 175.50 1i3l h VAL 135 N 0.00 0.14 0.00 3.16 -1.51 -1.56 -1.78 116.25 114.69 1i3l h VAL 135 Ca -0.00 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 1i3l h VAL 135 Cb 0.17 1.20 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 1i3l h VAL 135 CO 0.00 0.02 0.00 -1.22 -1.23 0.00 0.00 177.57 175.14 1i3l n TYR 136 N -3.24 0.56 -4.50 5.19 4.02 -0.79 -1.12 117.16 117.28 1i3l n TYR 136 Ca -0.02 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 58.04 1i3l n TYR 136 Cb 0.16 -0.78 0.00 0.00 -0.02 0.00 0.00 39.34 38.71 1i3l n TYR 136 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1i3l n GLY 137 N 1.20 -0.21 3.66 2.72 0.00 -0.67 -4.62 105.19 107.27 1i3l n GLY 137 Ca 0.06 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 1i3l n GLY 137 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i3l s ASN 138 N -4.00 6.53 0.11 1.61 2.47 -1.26 -4.87 114.94 115.53 1i3l s ASN 138 Ca 0.00 2.52 -0.35 0.00 0.42 0.00 0.00 52.86 55.46 1i3l s ASN 138 Cb 0.00 -2.54 -0.14 0.00 -1.45 0.00 0.00 41.25 37.12 1i3l s ASN 138 CO 0.00 -1.00 1.56 -2.65 -3.72 0.00 0.00 177.10 171.29 1i3l n PRO 139 N 7.18 1.92 0.02 0.43 -0.02 -1.26 -4.86 135.00 138.40 1i3l n PRO 139 Ca 0.19 0.69 -0.05 0.00 -2.02 0.00 0.00 63.50 62.31 1i3l n PRO 139 Cb 0.41 -2.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.35 1i3l n PRO 139 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1i3l h GLN 140 N 5.97 0.00 -3.12 -0.52 4.20 -1.89 -3.48 115.11 116.27 1i3l h GLN 140 Ca -0.46 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.22 1i3l h GLN 140 Cb 1.27 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 28.93 1i3l h GLN 140 CO 0.87 0.52 0.09 1.52 -0.67 0.00 0.00 178.83 181.16 1i3l s TYR 141 N -2.75 -0.41 0.01 2.96 1.13 -1.26 -5.18 117.35 111.85 1i3l s TYR 141 Ca -0.02 0.18 0.02 0.00 -1.41 0.00 0.00 57.07 55.83 1i3l s TYR 141 Cb 0.08 0.43 -0.01 0.00 -1.10 0.00 0.00 41.96 41.36 1i3l s TYR 141 CO 0.81 -0.78 -0.06 -0.51 -2.51 0.00 0.00 175.55 172.51 1i3l s LEU 142 N -2.70 2.09 0.82 -3.49 1.43 -1.26 -4.27 118.68 111.30 1i3l s LEU 142 Ca 0.01 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 1i3l s LEU 142 Cb 0.00 -0.23 0.08 0.00 0.03 0.00 0.00 46.19 46.07 1i3l s LEU 142 CO -0.12 -0.03 1.09 -2.16 0.23 0.00 0.00 176.35 175.37 1i3l s PRO 143 N -0.62 1.91 -0.22 1.29 0.04 -1.26 -5.11 135.00 131.04 1i3l s PRO 143 Ca -0.02 0.76 -0.25 0.00 0.04 0.00 0.00 61.00 61.53 1i3l s PRO 143 Cb -0.05 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 1i3l s PRO 143 CO 0.00 -1.77 0.83 -0.51 0.04 0.00 0.00 177.00 175.59 1i3l s LEU 144 N -5.90 4.11 0.36 -3.56 1.43 -0.08 -4.68 118.68 110.36 1i3l s LEU 144 Ca 0.61 1.08 0.07 0.00 -1.03 0.00 0.00 54.13 54.86 1i3l s LEU 144 Cb -0.16 -3.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.85 1i3l s LEU 144 CO 0.55 -0.48 0.39 1.51 0.23 0.00 0.00 176.35 178.55 1i3l s ASP 145 N 1.28 5.49 0.59 2.29 -4.77 -1.26 -0.57 116.67 119.71 1i3l s ASP 145 Ca 0.36 -0.44 0.34 0.00 -3.30 0.00 0.00 52.55 49.51 1i3l s ASP 145 Cb -0.16 -0.94 1.85 0.00 -1.09 0.00 0.00 42.92 42.58 1i3l s ASP 145 CO 0.09 -0.47 2.21 -0.33 0.70 0.00 0.00 175.17 177.37 1i3l h GLU 146 N 1.04 0.00 0.00 2.11 3.07 -1.94 -1.20 114.58 117.67 1i3l h GLU 146 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 1i3l h GLU 146 Cb 1.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 1i3l h GLU 146 CO 0.55 0.04 0.00 0.00 -1.40 0.00 0.00 179.01 178.20 1i3l n ALA 147 N -2.22 2.40 -1.75 3.43 0.00 -1.26 -4.85 120.51 116.26 1i3l n ALA 147 Ca -0.02 -0.13 -0.37 0.00 0.00 0.00 0.00 53.44 52.92 1i3l n ALA 147 Cb 0.15 -1.46 0.04 0.00 0.00 0.00 0.00 19.45 18.17 1i3l n ALA 147 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1i3l s HIS 148 N -2.61 2.33 0.61 0.00 5.04 -0.46 -4.92 115.29 115.29 1i3l s HIS 148 Ca 0.26 1.48 -0.18 0.00 -1.54 0.00 0.00 55.06 55.07 1i3l s HIS 148 Cb 0.19 -3.59 -0.04 0.00 0.04 0.00 0.00 32.58 29.18 1i3l s HIS 148 CO 0.44 -2.48 1.04 -2.30 -2.34 0.00 0.00 174.74 169.10 1i3l n PRO 149 N -1.45 0.94 -4.22 2.88 -0.02 -1.26 -5.00 135.00 126.86 1i3l n PRO 149 Ca 0.13 0.37 -0.16 0.00 -2.02 0.00 0.00 63.50 61.81 1i3l n PRO 149 Cb 0.48 -2.25 -0.11 0.00 -0.02 0.00 0.00 33.50 31.60 1i3l n PRO 149 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1i3l s THR 150 N -1.49 1.20 0.00 3.45 -4.23 -1.26 -4.48 115.64 108.84 1i3l s THR 150 Ca 0.77 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1i3l s THR 150 Cb -0.41 -1.52 0.00 0.00 1.34 0.00 0.00 72.50 71.91 1i3l s THR 150 CO 0.45 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1i3l n GLY 151 N 0.44 -2.82 3.33 3.99 0.00 -0.27 -5.01 105.19 104.85 1i3l n GLY 151 Ca -0.15 -2.13 -0.19 0.00 0.00 0.00 0.00 46.02 43.56 1i3l n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i3l n GLY 152 N -0.08 -0.36 3.85 -0.02 0.00 -1.26 -4.49 105.19 102.82 1i3l n GLY 152 Ca 0.00 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1i3l n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i3l h THR 154 N -0.55 1.39 -3.15 0.00 2.02 -1.92 -3.47 112.91 107.23 1i3l h THR 154 Ca -0.44 -3.08 -0.39 0.00 0.77 0.00 0.00 66.41 63.26 1i3l h THR 154 Cb 1.21 2.77 -0.14 0.00 -1.74 0.00 0.00 68.15 70.25 1i3l h THR 154 CO 0.60 0.84 -0.69 0.54 0.37 0.00 0.00 175.52 177.18 1i3l s ASN 155 N -6.76 2.10 0.43 4.18 4.22 -1.26 -5.03 114.94 112.82 1i3l s ASN 155 Ca -0.03 -1.12 0.18 0.00 -2.14 0.00 0.00 52.86 49.75 1i3l s ASN 155 Cb 0.08 -0.05 1.11 0.00 1.28 0.00 0.00 41.25 43.67 1i3l s ASN 155 CO 0.84 -0.37 1.86 -0.65 -2.04 0.00 0.00 177.10 176.74 1i3l h PRO 156 N 2.54 0.37 0.10 3.55 0.11 -1.93 0.39 132.00 137.13 1i3l h PRO 156 Ca -0.38 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 1i3l h PRO 156 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1i3l h PRO 156 CO 0.64 0.24 -0.05 -0.92 -0.21 0.00 0.00 178.00 177.71 1i3l h TYR 157 N 0.38 -0.12 -0.38 0.65 5.03 -1.96 -0.97 116.97 119.60 1i3l h TYR 157 Ca 0.46 -0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.68 1i3l h TYR 157 Cb 1.20 0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.50 1i3l h TYR 157 CO -0.00 0.28 -0.12 0.78 -1.32 0.00 0.00 178.16 177.78 1i3l h GLY 158 N -0.56 0.73 1.00 1.82 0.00 -1.51 -2.15 103.07 102.40 1i3l h GLY 158 Ca -0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.77 1i3l h GLY 158 CO 0.02 0.50 0.35 0.50 0.00 0.00 0.00 176.54 177.92 1i3l h LYS 159 N 0.62 0.81 -0.94 4.80 1.57 -0.29 -1.17 116.57 121.96 1i3l h LYS 159 Ca 0.11 -0.08 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 1i3l h LYS 159 Cb 0.57 -0.17 -0.07 0.00 0.08 0.00 0.00 32.23 32.64 1i3l h LYS 159 CO 0.04 0.58 0.59 0.66 -0.57 0.00 0.00 179.45 180.75 1i3l h SER 160 N 0.80 0.92 -0.54 0.86 4.64 -0.74 0.22 113.55 119.72 1i3l h SER 160 Ca 0.21 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 1i3l h SER 160 Cb -0.01 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 1i3l h SER 160 CO -0.04 0.56 0.04 0.11 -0.87 0.00 0.00 176.83 176.63 1i3l h LYS 161 N 1.04 0.92 -0.30 4.77 1.79 -0.62 -1.61 116.57 122.56 1i3l h LYS 161 Ca 0.43 -0.28 -0.06 0.00 -2.18 0.00 0.00 60.65 58.56 1i3l h LYS 161 Cb 0.26 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1i3l h LYS 161 CO -0.20 0.92 -0.03 0.35 -1.08 0.00 0.00 179.45 179.41 1i3l h PHE 162 N 0.80 0.61 -0.76 -1.35 3.57 -0.52 -1.36 116.94 117.94 1i3l h PHE 162 Ca 0.16 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.57 1i3l h PHE 162 Cb 0.48 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1i3l h PHE 162 CO 0.04 0.71 0.48 0.74 -2.23 0.00 0.00 178.31 178.05 1i3l h PHE 163 N 0.34 0.89 -0.57 0.41 0.04 -0.49 -0.92 116.94 116.64 1i3l h PHE 163 Ca 0.08 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.85 1i3l h PHE 163 Cb 0.49 -0.29 -0.03 0.00 2.20 0.00 0.00 35.95 38.32 1i3l h PHE 163 CO 0.04 0.50 0.26 0.82 -0.60 0.00 0.00 178.31 179.34 1i3l h ILE 164 N 0.92 1.21 -0.81 -0.55 2.04 -1.12 -0.41 117.51 118.79 1i3l h ILE 164 Ca 0.31 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.58 1i3l h ILE 164 Cb 0.03 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 1i3l h ILE 164 CO -0.12 0.24 0.53 -0.33 0.00 0.00 0.00 178.15 178.47 1i3l h GLU 165 N 0.78 1.02 -0.68 2.37 5.08 -0.52 -0.94 114.58 121.69 1i3l h GLU 165 Ca 0.20 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1i3l h GLU 165 Cb 0.14 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1i3l h GLU 165 CO -0.02 0.68 0.15 0.93 -1.00 0.00 0.00 179.01 179.75 1i3l h GLU 166 N 1.05 1.09 -0.58 2.33 4.39 -0.62 0.17 114.58 122.40 1i3l h GLU 166 Ca 0.31 -0.26 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 1i3l h GLU 166 Cb -0.05 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.43 1i3l h GLU 166 CO -0.09 0.96 0.27 0.52 -1.16 0.00 0.00 179.01 179.51 1i3l h MET 167 N 1.03 0.85 -0.50 2.33 2.86 -0.60 -1.00 114.93 119.89 1i3l h MET 167 Ca 0.21 -0.13 -0.10 0.00 -2.06 0.00 0.00 59.70 57.62 1i3l h MET 167 Cb 0.38 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1i3l h MET 167 CO 0.00 0.70 -0.08 0.82 1.06 0.00 0.00 176.91 179.41 1i3l h ILE 168 N 0.80 1.26 -0.61 -1.22 2.04 -0.83 -0.32 117.51 118.63 1i3l h ILE 168 Ca 0.20 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.88 1i3l h ILE 168 Cb 0.14 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1i3l h ILE 168 CO -0.02 0.42 0.40 0.03 0.00 0.00 0.00 178.15 178.98 1i3l h ARG 169 N 0.82 0.79 -0.61 2.37 3.08 -0.62 -0.49 114.38 119.73 1i3l h ARG 169 Ca 0.14 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1i3l h ARG 169 Cb 0.60 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 1i3l h ARG 169 CO 0.04 0.52 0.40 -0.44 -1.07 0.00 0.00 179.97 179.42 1i3l h ASP 170 N 0.82 0.69 -0.51 7.04 3.45 -0.63 -1.30 116.42 125.97 1i3l h ASP 170 Ca 0.23 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.67 1i3l h ASP 170 Cb -0.08 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.50 1i3l h ASP 170 CO -0.06 0.49 0.30 0.25 -1.57 0.00 0.00 179.24 178.66 1i3l h LEU 171 N 0.81 0.62 -1.21 1.55 5.85 -0.61 -1.35 115.31 120.97 1i3l h LEU 171 Ca 0.23 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 1i3l h LEU 171 Cb -0.08 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1i3l h LEU 171 CO -0.06 0.50 0.03 0.00 -0.34 0.00 0.00 178.44 178.58 1i3l h GLN 173 N 0.55 0.35 -0.16 0.00 5.75 -0.80 -3.24 115.11 117.57 1i3l h GLN 173 Ca 0.12 -0.11 -0.10 0.00 -0.15 0.00 0.00 58.65 58.41 1i3l h GLN 173 Cb 0.31 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1i3l h GLN 173 CO 0.01 0.55 -0.32 0.00 -2.65 0.00 0.00 178.83 176.42 1i3l h ALA 174 N 0.79 1.16 -3.15 3.38 0.00 -0.92 -3.39 119.26 117.13 1i3l h ALA 174 Ca 0.06 -0.36 -0.55 0.00 0.00 0.00 0.00 54.91 54.06 1i3l h ALA 174 Cb 0.39 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 17.68 1i3l h ALA 174 CO 0.01 0.54 -0.76 0.34 0.00 0.00 0.00 179.25 179.38 1i3l s ASP 175 N -6.86 3.46 0.00 0.00 3.68 -0.53 -5.00 116.67 111.43 1i3l s ASP 175 Ca -0.05 -1.22 0.07 0.00 2.13 0.00 0.00 52.55 53.48 1i3l s ASP 175 Cb 0.14 -0.67 0.36 0.00 -1.45 0.00 0.00 42.92 41.30 1i3l s ASP 175 CO 0.77 -0.37 1.13 0.29 0.13 0.00 0.00 175.17 177.12 1i3l n LYS 176 N 5.00 0.08 0.16 4.34 4.76 -1.24 -1.91 118.16 129.35 1i3l n LYS 176 Ca -0.06 0.25 0.12 0.00 -2.87 0.00 0.00 58.31 55.76 1i3l n LYS 176 Cb 0.44 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 32.27 1i3l n LYS 176 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1i3l h THR 177 N 0.00 0.00 -4.00 -0.18 1.35 -1.94 -3.46 112.91 104.67 1i3l h THR 177 Ca 0.00 -0.93 -0.49 0.00 -0.55 0.00 0.00 66.41 64.44 1i3l h THR 177 Cb 0.08 1.74 0.04 0.00 -1.73 0.00 0.00 68.15 68.28 1i3l h THR 177 CO 0.00 0.00 0.44 0.26 -0.25 0.00 0.00 175.52 175.97 1i3l s TRP 178 N -3.25 3.00 -0.05 4.73 0.52 -0.80 -4.92 118.94 118.17 1i3l s TRP 178 Ca 0.05 1.58 0.02 0.00 0.02 0.00 0.00 56.10 57.77 1i3l s TRP 178 Cb 0.08 -3.25 0.01 0.00 -1.15 0.00 0.00 33.47 29.16 1i3l s TRP 178 CO 0.71 -1.14 -0.10 -0.80 0.02 0.00 0.00 176.95 175.64 1i3l s ASN 179 N -1.53 1.43 -0.07 2.95 0.01 -0.30 -4.03 114.94 113.41 1i3l s ASN 179 Ca 0.63 -0.23 -0.04 0.00 -0.71 0.00 0.00 52.86 52.50 1i3l s ASN 179 Cb -0.25 -0.62 0.03 0.00 0.41 0.00 0.00 41.25 40.82 1i3l s ASN 179 CO 0.30 0.02 0.16 0.68 -1.51 0.00 0.00 177.10 176.75 1i3l s VAL 180 N 0.63 -0.02 -0.23 1.60 -7.23 0.29 -1.66 120.40 113.77 1i3l s VAL 180 Ca -0.11 0.08 -0.01 0.00 -1.81 0.00 0.00 61.98 60.13 1i3l s VAL 180 Cb -0.14 -0.24 0.03 0.00 0.56 0.00 0.00 36.38 36.58 1i3l s VAL 180 CO 0.02 0.03 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.05 1i3l s VAL 181 N 0.59 2.60 -0.32 1.32 1.01 -0.12 -0.77 120.40 124.72 1i3l s VAL 181 Ca -0.04 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 60.78 1i3l s VAL 181 Cb -0.06 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1i3l s VAL 181 CO -0.03 0.29 0.25 -0.76 0.00 0.00 0.00 175.10 174.85 1i3l s LEU 182 N 1.30 4.38 -0.36 3.92 1.43 0.36 -0.98 118.68 128.73 1i3l s LEU 182 Ca 0.01 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.73 1i3l s LEU 182 Cb -0.16 -2.17 0.02 0.00 0.03 0.00 0.00 46.19 43.91 1i3l s LEU 182 CO -0.07 -0.20 0.19 -0.76 0.23 0.00 0.00 176.35 175.74 1i3l s LEU 183 N 1.78 4.54 -0.69 1.79 1.43 -0.54 -0.72 118.68 126.28 1i3l s LEU 183 Ca 0.07 -0.85 -0.21 0.00 -1.03 0.00 0.00 54.13 52.12 1i3l s LEU 183 Cb -0.17 -2.02 0.09 0.00 0.03 0.00 0.00 46.19 44.12 1i3l s LEU 183 CO 0.11 -0.33 0.91 -0.13 0.23 0.00 0.00 176.35 177.14 1i3l s ARG 184 N 1.57 3.18 0.45 1.70 0.52 0.69 0.01 118.95 127.08 1i3l s ARG 184 Ca 0.03 -1.17 -0.22 0.00 -0.52 0.00 0.00 55.73 53.84 1i3l s ARG 184 Cb -0.18 -4.36 -0.08 0.00 0.52 0.00 0.00 34.95 30.84 1i3l s ARG 184 CO 0.07 -1.72 1.07 0.71 0.02 0.00 0.00 175.30 175.45 1i3l s TYR 185 N 3.33 3.07 0.00 -0.53 2.02 -1.08 -0.79 117.35 123.37 1i3l s TYR 185 Ca 0.20 1.60 0.00 0.00 -0.37 0.00 0.00 57.07 58.50 1i3l s TYR 185 Cb -0.17 -3.15 0.00 0.00 -0.40 0.00 0.00 41.96 38.24 1i3l s TYR 185 CO 0.05 -0.88 0.00 1.19 -1.57 0.00 0.00 175.55 174.34 1i3l n PHE 186 N -0.54 0.00 -3.74 2.71 3.72 -0.87 -0.81 117.46 117.93 1i3l n PHE 186 Ca 0.07 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.11 1i3l n PHE 186 Cb 0.51 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.94 1i3l n PHE 186 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1i3l s ASN 187 N -1.00 5.18 0.27 4.37 -0.87 -0.52 -4.76 114.94 117.60 1i3l s ASN 187 Ca 0.00 -2.78 -0.30 0.00 -1.57 0.00 0.00 52.86 48.20 1i3l s ASN 187 Cb 0.00 -1.84 -0.11 0.00 -0.02 0.00 0.00 41.25 39.29 1i3l s ASN 187 CO 0.00 -0.38 1.52 -2.84 -2.57 0.00 0.00 177.10 172.84 1i3l s PRO 188 N 0.04 4.19 0.34 -0.60 0.02 -1.26 -0.62 135.00 137.11 1i3l s PRO 188 Ca 0.16 2.44 -0.09 0.00 0.02 0.00 0.00 61.00 63.53 1i3l s PRO 188 Cb -0.21 -3.07 0.02 0.00 0.02 0.00 0.00 34.50 31.26 1i3l s PRO 188 CO -0.03 -0.54 0.59 -0.08 -0.33 0.00 0.00 177.00 176.61 1i3l s THR 189 N 0.07 0.00 0.00 0.99 -1.32 0.47 -4.84 115.64 111.01 1i3l s THR 189 Ca 0.62 -1.35 0.00 0.00 -1.21 0.00 0.00 61.69 59.75 1i3l s THR 189 Cb -0.45 -2.64 0.00 0.00 -1.51 0.00 0.00 72.50 67.90 1i3l s THR 189 CO 0.45 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.47 1i3l n GLY 190 N -0.53 -1.89 3.57 6.08 0.00 -1.26 -0.16 105.19 111.00 1i3l n GLY 190 Ca -0.03 -1.71 -0.06 0.00 0.00 0.00 0.00 46.02 44.22 1i3l n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i3l s ALA 191 N -1.45 -1.84 0.36 4.61 0.00 -1.26 -4.57 121.76 117.61 1i3l s ALA 191 Ca 0.00 0.88 -0.27 0.00 0.00 0.00 0.00 51.96 52.57 1i3l s ALA 191 Cb 0.00 0.40 -0.12 0.00 0.00 0.00 0.00 23.12 23.40 1i3l s ALA 191 CO 0.00 -0.77 1.13 1.58 0.00 0.00 0.00 175.76 177.70 1i3l n HIS 192 N -0.29 1.67 0.33 0.00 -0.00 -1.25 -4.79 115.22 110.89 1i3l n HIS 192 Ca -0.07 0.59 0.20 0.00 0.46 0.00 0.00 57.72 58.89 1i3l n HIS 192 Cb 0.61 -2.31 1.04 0.00 -0.12 0.00 0.00 29.99 29.21 1i3l n HIS 192 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1i3l h ALA 193 N 2.04 1.18 0.00 1.57 0.00 -1.93 -1.74 119.26 120.39 1i3l h ALA 193 Ca -0.44 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1i3l h ALA 193 Cb 1.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1i3l h ALA 193 CO 0.60 -0.15 -0.34 0.66 0.00 0.00 0.00 179.25 180.02 1i3l h SER 194 N 0.00 0.00 0.00 0.00 4.64 -1.94 -3.46 113.55 112.78 1i3l h SER 194 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1i3l h SER 194 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1i3l h SER 194 CO -0.00 0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.91 1i3l n GLY 195 N -0.23 0.89 0.16 -0.77 0.00 -0.65 -4.92 105.19 99.67 1i3l n GLY 195 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1i3l n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i3l s ILE 197 N -3.10 1.17 -1.21 0.00 -4.36 -1.26 -5.02 121.20 107.42 1i3l s ILE 197 Ca 0.04 -2.04 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1i3l s ILE 197 Cb 0.07 -1.82 0.00 0.00 1.25 0.00 0.00 42.46 41.96 1i3l s ILE 197 CO 0.73 -0.73 0.00 0.61 0.24 0.00 0.00 174.94 175.79 1i3l n GLY 198 N -0.15 -1.40 3.73 6.27 0.00 -1.26 -3.97 105.19 108.41 1i3l n GLY 198 Ca -0.11 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 1i3l n GLY 198 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i3l s GLU 199 N -1.21 4.34 -0.58 1.61 2.12 -1.26 -4.87 118.70 118.85 1i3l s GLU 199 Ca 0.00 2.13 0.06 0.00 0.36 0.00 0.00 54.97 57.52 1i3l s GLU 199 Cb 0.00 -3.18 0.27 0.00 0.26 0.00 0.00 34.13 31.48 1i3l s GLU 199 CO 0.00 -0.34 0.76 -3.47 -0.54 0.00 0.00 175.26 171.67 1i3l n ASP 200 N 2.84 3.33 -4.76 -1.70 2.03 -1.26 -4.99 116.55 112.03 1i3l n ASP 200 Ca 0.08 -3.38 -0.39 0.00 0.52 0.00 0.00 54.79 51.62 1i3l n ASP 200 Cb 0.42 -0.64 0.00 0.00 -0.72 0.00 0.00 41.12 40.18 1i3l n ASP 200 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1i3l s PRO 201 N -2.52 3.74 -0.17 -0.67 0.04 -1.26 -4.98 135.00 129.18 1i3l s PRO 201 Ca 0.41 2.06 -0.08 0.00 0.04 0.00 0.00 61.00 63.44 1i3l s PRO 201 Cb 0.19 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 1i3l s PRO 201 CO -0.05 -0.65 0.09 -0.65 0.04 0.00 0.00 177.00 175.77 1i3l s GLN 202 N -2.51 3.86 1.29 4.56 -1.52 -1.26 -4.98 119.66 119.10 1i3l s GLN 202 Ca 0.62 -0.28 0.00 0.00 -1.95 0.00 0.00 55.36 53.75 1i3l s GLN 202 Cb -0.36 -3.23 0.00 0.00 -0.22 0.00 0.00 33.01 29.21 1i3l s GLN 202 CO 0.45 0.41 0.00 0.41 -0.25 0.00 0.00 175.29 176.30 1i3l n GLY 203 N 3.14 -1.90 3.66 3.09 0.00 -1.26 -4.76 105.19 107.16 1i3l n GLY 203 Ca -0.17 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 1i3l n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i3l s ILE 204 N 0.00 3.77 0.33 -0.61 1.01 -1.26 -4.95 121.20 119.49 1i3l s ILE 204 Ca 0.00 0.96 -0.29 0.00 0.00 0.00 0.00 60.65 61.32 1i3l s ILE 204 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.75 1i3l s ILE 204 CO 0.00 -0.08 1.38 -2.84 0.00 0.00 0.00 174.94 173.41 1i3l s PRO 205 N 3.73 4.27 0.04 2.79 0.02 -1.26 -4.94 135.00 139.64 1i3l s PRO 205 Ca 0.68 2.34 0.13 0.00 0.02 0.00 0.00 61.00 64.16 1i3l s PRO 205 Cb -0.30 -3.04 -0.18 0.00 0.02 0.00 0.00 34.50 30.99 1i3l s PRO 205 CO 0.25 -0.33 0.88 -0.97 -0.33 0.00 0.00 177.00 176.51 1i3l h ASN 206 N 3.48 0.00 -3.59 2.53 -0.73 -1.92 -3.45 115.58 111.90 1i3l h ASN 206 Ca -0.49 0.00 -0.50 0.00 1.87 0.00 0.00 56.30 57.18 1i3l h ASN 206 Cb 1.23 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.81 1i3l h ASN 206 CO 0.67 0.86 0.05 0.20 -0.37 0.00 0.00 177.43 178.84 1i3l s ASN 207 N -6.17 6.55 0.06 1.15 0.01 -1.26 -5.04 114.94 110.24 1i3l s ASN 207 Ca -0.02 1.06 -0.34 0.00 -0.71 0.00 0.00 52.86 52.84 1i3l s ASN 207 Cb 0.08 -2.29 -0.19 0.00 0.41 0.00 0.00 41.25 39.27 1i3l s ASN 207 CO 0.81 -0.30 1.52 0.25 -1.51 0.00 0.00 177.10 177.87 1i3l h LEU 208 N 1.60 -1.10 -0.53 0.60 5.85 -2.00 -3.18 115.31 116.55 1i3l h LEU 208 Ca -0.47 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.40 1i3l h LEU 208 Cb 1.18 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 42.42 1i3l h LEU 208 CO 0.65 -0.73 -0.03 0.24 -0.34 0.00 0.00 178.44 178.22 1i3l h MET 209 N -1.19 0.08 -0.05 1.25 0.00 -1.96 0.20 114.93 113.26 1i3l h MET 209 Ca -0.12 -0.00 -0.08 0.00 0.00 0.00 0.00 59.70 59.50 1i3l h MET 209 Cb 0.93 -0.02 -0.01 0.00 0.00 0.00 0.00 31.60 32.50 1i3l h MET 209 CO 0.16 0.05 -0.34 -1.35 0.00 0.00 0.00 176.91 175.43 1i3l h PRO 210 N 0.08 0.10 -0.22 -0.22 0.11 -1.98 0.58 132.00 130.45 1i3l h PRO 210 Ca 0.26 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.27 1i3l h PRO 210 Cb 0.41 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 1i3l h PRO 210 CO -0.47 0.43 -0.15 -0.92 -0.21 0.00 0.00 178.00 176.69 1i3l h TYR 211 N 0.09 0.57 -0.14 0.65 3.20 -1.11 -1.14 116.97 119.09 1i3l h TYR 211 Ca 0.01 -0.15 0.03 0.00 3.14 0.00 0.00 58.73 61.76 1i3l h TYR 211 Cb 0.65 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 1i3l h TYR 211 CO 0.00 0.79 -0.08 0.28 -1.64 0.00 0.00 178.16 177.51 1i3l h VAL 212 N 0.18 0.75 -0.65 1.81 2.07 -0.23 -1.09 116.25 119.09 1i3l h VAL 212 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.57 1i3l h VAL 212 Cb 0.66 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1i3l h VAL 212 CO 0.04 0.00 0.42 0.77 0.02 0.00 0.00 177.57 178.82 1i3l h SER 213 N -0.08 0.75 0.56 0.57 4.64 -0.84 -1.48 113.55 117.67 1i3l h SER 213 Ca 0.08 -0.03 -0.08 0.00 -0.47 0.00 0.00 61.79 61.29 1i3l h SER 213 Cb 0.20 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1i3l h SER 213 CO -0.18 0.56 -0.39 1.56 -0.87 0.00 0.00 176.83 177.50 1i3l h GLN 214 N 0.88 0.00 -0.13 4.77 4.20 -0.47 -1.42 115.11 122.95 1i3l h GLN 214 Ca 0.24 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.80 1i3l h GLN 214 Cb -0.08 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.70 1i3l h GLN 214 CO -0.05 0.39 -0.50 0.28 -0.67 0.00 0.00 178.83 178.29 1i3l h VAL 215 N 0.00 1.35 -0.75 -0.54 2.07 -0.27 0.27 116.25 118.38 1i3l h VAL 215 Ca -0.00 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 65.73 1i3l h VAL 215 Cb 0.78 2.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 1i3l h VAL 215 CO 0.05 0.54 0.47 0.00 0.02 0.00 0.00 177.57 178.65 1i3l h ALA 216 N 0.51 1.42 0.00 1.67 0.00 -0.95 -0.93 119.26 120.98 1i3l h ALA 216 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1i3l h ALA 216 Cb 1.13 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1i3l h ALA 216 CO 0.10 0.52 0.00 1.51 0.00 0.00 0.00 179.25 181.38 1i3l n ILE 217 N -4.40 0.63 -0.13 0.00 0.13 -0.57 -4.84 119.36 110.19 1i3l n ILE 217 Ca 0.08 -0.18 0.00 0.00 -1.10 0.00 0.00 62.75 61.55 1i3l n ILE 217 Cb 0.05 -0.69 0.00 0.00 -0.84 0.00 0.00 39.64 38.16 1i3l n ILE 217 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1i3l n GLY 218 N 1.07 0.94 0.11 4.50 0.00 -0.35 -4.97 105.19 106.48 1i3l n GLY 218 Ca 0.05 -0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 1i3l n GLY 218 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1i3l h ARG 219 N 3.57 0.08 -6.73 1.61 2.43 -0.68 -3.44 114.38 111.21 1i3l h ARG 219 Ca 0.00 -0.08 -0.69 0.00 -0.81 0.00 0.00 59.98 58.40 1i3l h ARG 219 Cb 0.00 0.02 -0.26 0.00 -0.42 0.00 0.00 29.97 29.31 1i3l h ARG 219 CO 0.00 0.84 -0.88 1.03 -1.51 0.00 0.00 179.97 179.45 1i3l s ARG 220 N -3.23 1.78 0.04 0.20 1.81 -0.83 -4.97 118.95 113.75 1i3l s ARG 220 Ca -0.01 -1.11 -0.27 0.00 -1.72 0.00 0.00 55.73 52.61 1i3l s ARG 220 Cb 0.11 -1.97 -0.17 0.00 -0.45 0.00 0.00 34.95 32.47 1i3l s ARG 220 CO 0.80 0.51 1.42 0.93 -0.68 0.00 0.00 175.30 178.28 1i3l h GLU 221 N 4.77 -0.48 -2.82 3.54 4.39 -1.90 -3.39 114.58 118.71 1i3l h GLU 221 Ca -0.46 0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.20 1i3l h GLU 221 Cb 1.14 0.11 -0.16 0.00 -0.10 0.00 0.00 28.75 29.74 1i3l h GLU 221 CO 0.43 -0.21 0.01 0.00 -1.16 0.00 0.00 179.01 178.09 1i3l s ALA 222 N -5.36 -1.27 0.15 3.43 0.00 -1.26 -4.63 121.76 112.81 1i3l s ALA 222 Ca -0.15 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.06 1i3l s ALA 222 Cb 0.03 0.38 -0.07 0.00 0.00 0.00 0.00 23.12 23.46 1i3l s ALA 222 CO 0.58 -0.50 1.01 -1.17 0.00 0.00 0.00 175.76 175.69 1i3l s LEU 223 N -1.98 4.51 -0.24 0.00 2.96 -0.31 -4.89 118.68 118.73 1i3l s LEU 223 Ca -0.05 1.92 -0.14 0.00 -0.22 0.00 0.00 54.13 55.63 1i3l s LEU 223 Cb -0.01 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 1i3l s LEU 223 CO -0.02 -0.10 0.34 0.20 -1.32 0.00 0.00 176.35 175.46 1i3l s ASN 224 N -0.17 6.28 -0.28 3.68 0.02 -1.26 -0.41 114.94 122.80 1i3l s ASN 224 Ca 0.47 0.32 -0.14 0.00 -1.02 0.00 0.00 52.86 52.49 1i3l s ASN 224 Cb -0.26 -2.20 -0.04 0.00 0.02 0.00 0.00 41.25 38.78 1i3l s ASN 224 CO 0.32 -0.11 0.35 -0.69 0.02 0.00 0.00 177.10 176.99 1i3l s VAL 225 N 1.67 5.19 -1.25 1.60 1.01 0.23 -4.94 120.40 123.91 1i3l s VAL 225 Ca 0.15 0.48 -0.18 0.00 0.00 0.00 0.00 61.98 62.43 1i3l s VAL 225 Cb -0.15 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.62 1i3l s VAL 225 CO 0.09 0.15 1.66 -0.36 0.00 0.00 0.00 175.10 176.64 1i3l s PHE 226 N 2.03 2.84 0.00 5.22 2.99 -1.26 -0.17 117.98 129.62 1i3l s PHE 226 Ca 0.14 -1.59 0.00 0.00 0.00 0.00 0.00 56.93 55.47 1i3l s PHE 226 Cb -0.16 -4.70 0.00 0.00 0.00 0.00 0.00 43.02 38.17 1i3l s PHE 226 CO 0.10 -1.77 0.00 0.41 -0.00 0.00 0.00 175.22 173.96 1i3l n GLY 227 N 5.42 -1.87 0.67 4.36 0.00 0.32 -4.35 105.19 109.74 1i3l n GLY 227 Ca 0.45 -1.34 0.03 0.00 0.00 0.00 0.00 46.02 45.17 1i3l n GLY 227 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1i3l n ASN 228 N -1.07 0.85 -0.69 1.61 6.94 -1.24 -4.43 115.26 117.22 1i3l n ASN 228 Ca 0.00 -2.39 0.05 0.00 -0.02 0.00 0.00 54.58 52.22 1i3l n ASN 228 Cb 0.00 -0.30 0.20 0.00 -2.36 0.00 0.00 39.78 37.32 1i3l n ASN 228 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1i3l n ASP 229 N -0.25 2.66 -4.77 0.53 3.85 -0.93 -4.32 116.55 113.32 1i3l n ASP 229 Ca 0.06 -3.42 -0.27 0.00 -0.71 0.00 0.00 54.79 50.45 1i3l n ASP 229 Cb 0.80 -0.54 0.10 0.00 -1.35 0.00 0.00 41.12 40.13 1i3l n ASP 229 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1i3l s TYR 230 N -3.04 2.59 -1.48 2.11 2.02 -0.57 -4.95 117.35 114.04 1i3l s TYR 230 Ca 0.39 0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 57.44 1i3l s TYR 230 Cb 0.35 -3.40 0.01 0.00 -0.40 0.00 0.00 41.96 38.53 1i3l s TYR 230 CO 0.02 -1.72 2.68 -3.47 -1.57 0.00 0.00 175.55 171.49 1i3l n ASP 231 N -3.14 8.40 -4.35 2.29 2.03 -1.26 -4.10 116.55 116.41 1i3l n ASP 231 Ca 0.10 -2.85 -0.23 0.00 0.52 0.00 0.00 54.79 52.33 1i3l n ASP 231 Cb 0.60 -1.46 -0.11 0.00 -0.72 0.00 0.00 41.12 39.43 1i3l n ASP 231 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1i3l s THR 232 N 0.57 1.95 0.58 5.18 -4.23 -1.26 -4.97 115.64 113.46 1i3l s THR 232 Ca 0.62 -1.94 0.31 0.00 -1.18 0.00 0.00 61.69 59.50 1i3l s THR 232 Cb 0.18 -1.91 0.44 0.00 1.34 0.00 0.00 72.50 72.56 1i3l s THR 232 CO -0.08 -0.26 1.76 1.05 -0.54 0.00 0.00 174.62 176.56 1i3l h GLU 233 N 3.25 0.00 0.00 3.99 -0.00 -1.89 -1.33 114.58 118.61 1i3l h GLU 233 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.93 1i3l h GLU 233 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.96 1i3l h GLU 233 CO 0.50 0.00 0.00 -0.40 -0.00 0.00 0.00 179.01 179.11 1i3l n ASP 234 N -3.79 1.44 0.00 3.06 3.85 -1.26 -5.00 116.55 114.85 1i3l n ASP 234 Ca 0.17 -1.59 0.00 0.00 -0.71 0.00 0.00 54.79 52.66 1i3l n ASP 234 Cb 1.02 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.79 1i3l n ASP 234 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1i3l n GLY 235 N -0.30 3.08 3.96 6.12 0.00 -0.50 -4.91 105.19 112.64 1i3l n GLY 235 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1i3l n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i3l s THR 236 N -1.87 4.88 0.42 2.61 -4.23 -1.26 -1.51 115.64 114.68 1i3l s THR 236 Ca 0.00 -0.73 -0.26 0.00 -1.18 0.00 0.00 61.69 59.52 1i3l s THR 236 Cb 0.00 -3.75 -0.09 0.00 1.34 0.00 0.00 72.50 69.99 1i3l s THR 236 CO 0.00 -0.40 1.40 0.61 -0.54 0.00 0.00 174.62 175.69 1i3l n GLY 237 N -1.67 0.91 3.39 3.99 0.00 -1.26 -4.64 105.19 105.90 1i3l n GLY 237 Ca -0.05 0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1i3l n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i3l s VAL 238 N -1.17 2.83 0.05 1.61 1.01 -0.29 -1.83 120.40 122.61 1i3l s VAL 238 Ca 0.59 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 1i3l s VAL 238 Cb -0.48 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1i3l s VAL 238 CO 0.59 0.56 -0.01 -0.13 0.00 0.00 0.00 175.10 176.12 1i3l s ARG 239 N -0.22 0.63 -0.84 2.72 1.81 -0.35 -1.60 118.95 121.10 1i3l s ARG 239 Ca -0.00 -1.19 -0.17 0.00 -1.72 0.00 0.00 55.73 52.65 1i3l s ARG 239 Cb -0.13 0.22 0.16 0.00 -0.45 0.00 0.00 34.95 34.75 1i3l s ARG 239 CO 0.03 -0.13 0.94 0.34 -0.68 0.00 0.00 175.30 175.81 1i3l s ASP 240 N -2.91 6.61 0.00 0.23 3.68 -0.92 -0.57 116.67 122.79 1i3l s ASP 240 Ca 0.07 -2.17 -0.30 0.00 2.13 0.00 0.00 52.55 52.27 1i3l s ASP 240 Cb 0.08 -2.32 -0.04 0.00 -1.45 0.00 0.00 42.92 39.19 1i3l s ASP 240 CO -0.10 -0.90 1.16 -0.31 0.13 0.00 0.00 175.17 175.14 1i3l s TYR 241 N 1.82 3.39 -0.05 -5.34 1.51 -1.26 -1.44 117.35 115.98 1i3l s TYR 241 Ca 0.24 1.35 0.04 0.00 -1.01 0.00 0.00 57.07 57.69 1i3l s TYR 241 Cb -0.09 -3.36 -0.00 0.00 -0.11 0.00 0.00 41.96 38.39 1i3l s TYR 241 CO -0.07 -1.04 -0.17 -1.50 -1.11 0.00 0.00 175.55 171.67 1i3l s ILE 242 N 1.50 1.41 0.07 2.71 2.07 0.21 -4.64 121.20 124.53 1i3l s ILE 242 Ca 0.56 -0.69 -0.31 0.00 -1.41 0.00 0.00 60.65 58.80 1i3l s ILE 242 Cb -0.26 -1.23 -0.08 0.00 0.13 0.00 0.00 42.46 41.03 1i3l s ILE 242 CO 0.26 0.41 1.50 -2.28 -1.91 0.00 0.00 174.94 172.92 1i3l s HIS 243 N 0.16 2.85 0.57 3.50 5.65 -1.26 -0.39 115.29 126.36 1i3l s HIS 243 Ca -0.06 0.68 0.28 0.00 0.25 0.00 0.00 55.06 56.20 1i3l s HIS 243 Cb -0.13 -3.79 1.49 0.00 -1.18 0.00 0.00 32.58 28.97 1i3l s HIS 243 CO 0.03 -2.99 1.96 -0.24 -0.65 0.00 0.00 174.74 172.85 1i3l h VAL 244 N 4.59 0.51 -0.35 0.89 3.04 -0.85 0.39 116.25 124.48 1i3l h VAL 244 Ca -0.41 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.13 1i3l h VAL 244 Cb 1.20 0.69 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 1i3l h VAL 244 CO 0.90 0.00 -0.35 0.58 -1.01 0.00 0.00 177.57 177.69 1i3l h VAL 245 N 0.00 1.28 -0.42 1.51 2.07 -1.89 0.34 116.25 119.14 1i3l h VAL 245 Ca 0.22 -1.53 -0.09 0.00 0.82 0.00 0.00 66.70 66.12 1i3l h VAL 245 Cb 1.05 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 1i3l h VAL 245 CO -0.00 0.50 -0.09 0.44 0.02 0.00 0.00 177.57 178.45 1i3l h ASP 246 N 0.65 0.81 -0.36 0.57 3.32 -1.34 -1.37 116.42 118.70 1i3l h ASP 246 Ca 0.05 -0.35 0.06 0.00 0.02 0.00 0.00 57.03 56.81 1i3l h ASP 246 Cb 0.94 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.22 1i3l h ASP 246 CO 0.09 0.97 0.04 0.25 -1.72 0.00 0.00 179.24 178.87 1i3l h LEU 247 N 0.63 -0.05 -0.54 1.55 5.85 -1.18 -0.06 115.31 121.51 1i3l h LEU 247 Ca 0.11 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1i3l h LEU 247 Cb 0.61 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 1i3l h LEU 247 CO 0.04 0.01 0.33 0.00 -0.34 0.00 0.00 178.44 178.47 1i3l h ALA 248 N 1.29 0.69 -0.09 1.25 0.00 -0.74 -0.89 119.26 120.77 1i3l h ALA 248 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1i3l h ALA 248 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i3l h ALA 248 CO -0.25 0.05 0.06 0.87 0.00 0.00 0.00 179.25 179.97 1i3l h LYS 249 N 0.65 0.10 0.00 0.00 1.57 -0.43 -0.64 116.57 117.82 1i3l h LYS 249 Ca 0.21 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 1i3l h LYS 249 Cb 0.01 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1i3l h LYS 249 CO -0.09 0.07 -0.15 0.78 -0.57 0.00 0.00 179.45 179.49 1i3l h GLY 250 N 0.11 0.00 2.00 3.86 0.00 0.42 -1.83 103.07 107.62 1i3l h GLY 250 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.24 1i3l h GLY 250 CO -0.01 0.00 -0.57 0.45 0.00 0.00 0.00 176.54 176.41 1i3l h HIS 251 N 0.00 0.00 -0.14 5.60 3.86 -0.92 0.65 115.15 124.20 1i3l h HIS 251 Ca -0.00 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 1i3l h HIS 251 Cb 0.29 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.77 1i3l h HIS 251 CO 0.00 0.57 -0.80 0.82 0.86 0.00 0.00 177.93 179.38 1i3l h ILE 252 N 0.00 1.28 -0.56 2.45 1.08 -1.34 -1.44 117.51 118.98 1i3l h ILE 252 Ca -0.01 -1.99 -0.05 0.00 -0.39 0.00 0.00 64.86 62.42 1i3l h ILE 252 Cb 1.08 2.01 -0.03 0.00 -3.07 0.00 0.00 36.82 36.81 1i3l h ILE 252 CO 0.07 0.63 0.16 0.00 -0.69 0.00 0.00 178.15 178.33 1i3l h ALA 253 N 0.55 1.23 -0.74 1.87 0.00 -1.13 -1.65 119.26 119.39 1i3l h ALA 253 Ca -0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1i3l h ALA 253 Cb 1.43 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1i3l h ALA 253 CO 0.16 0.54 0.44 0.00 0.00 0.00 0.00 179.25 180.39 1i3l h ALA 254 N 1.35 1.38 -0.44 0.00 0.00 -0.49 -1.20 119.26 119.87 1i3l h ALA 254 Ca 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1i3l h ALA 254 Cb 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1i3l h ALA 254 CO -0.01 0.53 0.25 -0.07 0.00 0.00 0.00 179.25 179.96 1i3l h LEU 255 N 1.02 0.54 -1.22 0.00 3.38 -0.38 -1.30 115.31 117.36 1i3l h LEU 255 Ca 0.27 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 1i3l h LEU 255 Cb -0.03 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1i3l h LEU 255 CO -0.05 0.45 0.10 0.03 0.09 0.00 0.00 178.44 179.07 1i3l h ARG 256 N 0.57 0.65 -0.63 1.13 3.08 -0.93 -2.45 114.38 115.79 1i3l h ARG 256 Ca 0.15 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1i3l h ARG 256 Cb 0.03 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 1i3l h ARG 256 CO -0.03 0.59 0.38 -0.22 -1.07 0.00 0.00 179.97 179.63 1i3l h LYS 257 N 0.63 0.85 -0.72 0.04 1.63 -0.20 -2.08 116.57 116.72 1i3l h LYS 257 Ca 0.14 -0.07 0.09 0.00 -0.85 0.00 0.00 60.65 59.96 1i3l h LYS 257 Cb 0.24 -0.18 -0.05 0.00 -0.60 0.00 0.00 32.23 31.64 1i3l h LYS 257 CO -0.00 0.60 0.47 -0.07 -3.45 0.00 0.00 179.45 177.00 1i3l h LEU 258 N 0.85 0.58 -2.61 5.20 3.38 -0.80 -0.02 115.31 121.89 1i3l h LEU 258 Ca 0.23 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1i3l h LEU 258 Cb -0.03 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1i3l h LEU 258 CO -0.04 0.35 0.00 0.11 0.09 0.00 0.00 178.44 178.95 1i3l h LYS 259 N 0.65 0.00 -0.00 1.13 1.79 -1.21 0.04 116.57 118.97 1i3l h LYS 259 Ca 0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.80 1i3l h LYS 259 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1i3l h LYS 259 CO -0.11 0.00 -0.01 0.39 -1.08 0.00 0.00 179.45 178.63 1i3l n GLU 260 N -3.02 0.67 -3.37 3.15 1.02 -0.02 -4.89 120.64 114.18 1i3l n GLU 260 Ca -0.02 -0.05 -0.17 0.00 -0.02 0.00 0.00 57.16 56.90 1i3l n GLU 260 Cb 0.11 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.11 1i3l n GLU 260 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1i3l n GLN 261 N -1.12 -6.37 0.02 3.49 1.13 -0.00 -4.91 117.38 109.62 1i3l n GLN 261 Ca 0.18 0.80 0.09 0.00 -1.94 0.00 0.00 57.00 56.13 1i3l n GLN 261 Cb 0.21 -5.68 0.41 0.00 0.11 0.00 0.00 30.24 25.29 1i3l n GLN 261 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1i3l n GLY 263 N 0.41 -0.01 3.60 0.00 0.00 -1.26 -4.58 105.19 103.35 1i3l n GLY 263 Ca 0.04 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 1i3l n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i3l s ARG 265 N 2.59 1.20 -0.06 0.00 1.81 0.05 -4.96 118.95 119.59 1i3l s ARG 265 Ca 0.25 -1.01 0.02 0.00 -1.72 0.00 0.00 55.73 53.27 1i3l s ARG 265 Cb -0.15 -1.36 0.01 0.00 -0.45 0.00 0.00 34.95 33.01 1i3l s ARG 265 CO 0.11 0.33 -0.11 0.42 -0.68 0.00 0.00 175.30 175.38 1i3l s ILE 266 N -0.98 1.02 0.01 1.52 1.01 -1.26 -0.49 121.20 122.03 1i3l s ILE 266 Ca 0.06 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.31 1i3l s ILE 266 Cb -0.09 -0.94 -0.01 0.00 0.01 0.00 0.00 42.46 41.43 1i3l s ILE 266 CO 0.03 0.33 -0.03 -0.31 0.00 0.00 0.00 174.94 174.95 1i3l s TYR 267 N 0.70 0.28 0.30 3.97 1.51 0.10 -4.96 117.35 119.25 1i3l s TYR 267 Ca -0.14 -0.20 -0.27 0.00 -1.01 0.00 0.00 57.07 55.45 1i3l s TYR 267 Cb -0.16 -0.18 -0.10 0.00 -0.11 0.00 0.00 41.96 41.42 1i3l s TYR 267 CO 0.03 -0.05 0.95 -0.80 -1.11 0.00 0.00 175.55 174.57 1i3l s ASN 268 N -0.53 7.43 -0.44 2.29 0.01 -1.26 -0.22 114.94 122.21 1i3l s ASN 268 Ca -0.04 1.89 0.04 0.00 -0.71 0.00 0.00 52.86 54.04 1i3l s ASN 268 Cb -0.04 -2.59 0.12 0.00 0.41 0.00 0.00 41.25 39.15 1i3l s ASN 268 CO -0.00 -0.00 0.17 -0.76 -1.51 0.00 0.00 177.10 174.99 1i3l s LEU 269 N -1.76 4.54 0.28 0.60 1.43 0.03 -4.67 118.68 119.13 1i3l s LEU 269 Ca 0.47 -2.62 -0.06 0.00 -1.03 0.00 0.00 54.13 50.89 1i3l s LEU 269 Cb -0.21 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1i3l s LEU 269 CO 0.27 -0.30 0.42 -0.83 0.23 0.00 0.00 176.35 176.13 1i3l s GLY 270 N 0.28 1.12 0.00 -3.19 0.00 -1.26 -2.04 107.32 102.23 1i3l s GLY 270 Ca 0.14 -1.31 0.18 0.00 0.00 0.00 0.00 44.72 43.74 1i3l s GLY 270 CO -0.04 -0.92 0.63 -1.30 0.00 0.00 0.00 173.10 171.47 1i3l n THR 271 N -0.45 0.96 -0.30 0.90 -2.24 -1.26 -4.57 114.28 107.32 1i3l n THR 271 Ca 0.00 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1i3l n THR 271 Cb 0.62 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1i3l n THR 271 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i3l n GLY 272 N 1.42 0.74 3.35 3.38 0.00 -1.25 -4.85 105.19 107.98 1i3l n GLY 272 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1i3l n GLY 272 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i3l s THR 273 N -2.66 3.28 0.05 2.61 2.01 -1.26 -4.76 115.64 114.91 1i3l s THR 273 Ca 0.00 -0.55 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 1i3l s THR 273 Cb 0.00 -2.44 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 1i3l s THR 273 CO 0.00 0.47 0.23 -0.83 -0.69 0.00 0.00 174.62 173.80 1i3l s GLY 274 N 0.92 2.20 0.03 4.40 0.00 -1.26 -4.21 107.32 109.40 1i3l s GLY 274 Ca -0.01 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 43.99 1i3l s GLY 274 CO 0.00 -0.68 -0.11 -0.19 0.00 0.00 0.00 173.10 172.12 1i3l s TYR 275 N -1.46 0.95 0.64 1.90 2.02 0.27 -4.86 117.35 116.81 1i3l s TYR 275 Ca 0.33 -0.31 -0.06 0.00 -0.37 0.00 0.00 57.07 56.65 1i3l s TYR 275 Cb -0.13 -0.57 0.03 0.00 -0.40 0.00 0.00 41.96 40.89 1i3l s TYR 275 CO 0.24 -0.00 0.96 -1.54 -1.57 0.00 0.00 175.55 173.63 1i3l s SER 276 N -0.93 5.23 0.18 2.29 1.04 -1.26 -1.21 113.70 119.05 1i3l s SER 276 Ca -0.00 0.60 -0.13 0.00 0.48 0.00 0.00 55.95 56.89 1i3l s SER 276 Cb -0.07 -1.43 0.18 0.00 0.10 0.00 0.00 66.02 64.80 1i3l s SER 276 CO 0.01 -1.31 1.73 0.58 0.98 0.00 0.00 173.24 175.22 1i3l h VAL 277 N -0.38 0.77 -0.50 5.02 2.07 -1.62 -0.61 116.25 120.99 1i3l h VAL 277 Ca -0.45 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.90 1i3l h VAL 277 Cb 1.28 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1i3l h VAL 277 CO 0.60 0.05 0.01 -0.07 0.02 0.00 0.00 177.57 178.19 1i3l h LEU 278 N 0.28 0.80 -0.94 2.57 3.38 -1.94 -1.15 115.31 118.31 1i3l h LEU 278 Ca 0.24 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1i3l h LEU 278 Cb 0.29 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1i3l h LEU 278 CO -0.29 0.86 0.06 1.56 0.09 0.00 0.00 178.44 180.72 1i3l h GLN 279 N 0.78 0.84 -0.48 1.13 4.20 -1.78 -0.30 115.11 119.50 1i3l h GLN 279 Ca 0.15 -0.20 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 1i3l h GLN 279 Cb 0.45 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1i3l h GLN 279 CO 0.02 0.80 -0.19 0.52 -0.67 0.00 0.00 178.83 179.31 1i3l h MET 280 N 0.79 0.96 -0.27 1.46 2.86 -0.57 -0.89 114.93 119.27 1i3l h MET 280 Ca 0.16 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.41 1i3l h MET 280 Cb 0.39 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1i3l h MET 280 CO 0.01 1.06 0.15 0.28 1.06 0.00 0.00 176.91 179.47 1i3l h VAL 281 N 0.84 1.12 -0.37 -2.22 2.07 -0.91 -0.89 116.25 115.89 1i3l h VAL 281 Ca 0.12 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1i3l h VAL 281 Cb 0.75 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1i3l h VAL 281 CO 0.06 0.12 0.19 1.56 0.02 0.00 0.00 177.57 179.52 1i3l h GLN 282 N 0.32 0.52 -0.22 1.57 4.20 -0.90 -0.66 115.11 119.94 1i3l h GLN 282 Ca 0.10 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1i3l h GLN 282 Cb 0.06 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1i3l h GLN 282 CO -0.02 0.44 0.08 0.00 -0.67 0.00 0.00 178.83 178.67 1i3l h ALA 283 N 1.05 1.73 -0.01 3.87 0.00 -0.97 -1.10 119.26 123.84 1i3l h ALA 283 Ca 0.13 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 1i3l h ALA 283 Cb 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1i3l h ALA 283 CO -0.02 0.22 -0.67 0.52 0.00 0.00 0.00 179.25 179.30 1i3l h MET 284 N 0.31 0.03 -0.51 0.00 2.86 -0.54 0.19 114.93 117.27 1i3l h MET 284 Ca 0.08 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 1i3l h MET 284 Cb 0.08 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1i3l h MET 284 CO -0.01 0.69 -0.08 0.93 1.06 0.00 0.00 176.91 179.50 1i3l h GLU 285 N 0.02 0.96 -0.25 1.72 5.08 0.04 -0.12 114.58 122.04 1i3l h GLU 285 Ca -0.01 -0.35 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 1i3l h GLU 285 Cb 1.19 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1i3l h GLU 285 CO 0.09 1.01 0.02 0.87 -1.00 0.00 0.00 179.01 180.00 1i3l h LYS 286 N 0.83 0.42 -0.55 2.33 1.57 -1.05 0.60 116.57 120.72 1i3l h LYS 286 Ca 0.14 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1i3l h LYS 286 Cb 0.63 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1i3l h LYS 286 CO 0.04 0.58 0.10 0.00 -0.57 0.00 0.00 179.45 179.61 1i3l h ALA 287 N 0.83 0.73 0.00 3.86 0.00 -0.76 -3.27 119.26 120.64 1i3l h ALA 287 Ca 0.07 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1i3l h ALA 287 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1i3l h ALA 287 CO 0.01 0.46 -0.67 0.66 0.00 0.00 0.00 179.25 179.71 1i3l h SER 288 N 0.80 0.00 -0.16 0.00 4.64 -0.99 -3.47 113.55 114.37 1i3l h SER 288 Ca 0.17 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.42 1i3l h SER 288 Cb 0.39 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 1i3l h SER 288 CO 0.01 0.24 -0.06 0.61 -0.87 0.00 0.00 176.83 176.75 1i3l n GLY 289 N 1.21 0.58 3.62 -0.77 0.00 0.20 -5.00 105.19 105.03 1i3l n GLY 289 Ca -0.00 -0.23 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 1i3l n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i3l s LYS 290 N -1.56 2.17 0.16 1.61 -0.14 -1.24 -5.07 119.74 115.67 1i3l s LYS 290 Ca 0.00 -1.55 -0.12 0.00 -1.36 0.00 0.00 55.97 52.95 1i3l s LYS 290 Cb 0.00 -2.06 -0.07 0.00 -1.68 0.00 0.00 37.83 34.02 1i3l s LYS 290 CO 0.00 0.29 0.52 0.15 -0.76 0.00 0.00 175.35 175.55 1i3l s LYS 291 N -3.67 3.88 -0.46 1.68 3.01 -1.26 -4.54 119.74 118.38 1i3l s LYS 291 Ca 0.32 0.36 0.03 0.00 -1.01 0.00 0.00 55.97 55.67 1i3l s LYS 291 Cb -0.05 -2.85 0.15 0.00 -1.01 0.00 0.00 37.83 34.07 1i3l s LYS 291 CO 0.19 0.44 0.28 0.42 0.51 0.00 0.00 175.35 177.20 1i3l s ILE 292 N -1.57 1.29 0.64 2.17 1.01 -1.26 -4.61 121.20 118.87 1i3l s ILE 292 Ca 0.40 -2.69 -0.18 0.00 0.00 0.00 0.00 60.65 58.19 1i3l s ILE 292 Cb -0.14 -1.89 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 1i3l s ILE 292 CO 0.20 -0.97 1.24 -2.84 0.00 0.00 0.00 174.94 172.57 1i3l s PRO 293 N 0.17 2.65 0.04 2.79 0.02 -1.26 -4.86 135.00 134.55 1i3l s PRO 293 Ca 0.21 1.90 -0.05 0.00 0.02 0.00 0.00 61.00 63.08 1i3l s PRO 293 Cb -0.17 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 1i3l s PRO 293 CO -0.05 -1.48 0.10 1.52 -0.33 0.00 0.00 177.00 176.76 1i3l s TYR 294 N -1.60 0.22 -0.04 6.54 1.13 -1.26 -1.16 117.35 121.18 1i3l s TYR 294 Ca 0.79 -0.56 0.02 0.00 -1.41 0.00 0.00 57.07 55.90 1i3l s TYR 294 Cb -0.33 -0.15 0.02 0.00 -1.10 0.00 0.00 41.96 40.39 1i3l s TYR 294 CO 0.38 -0.39 -0.07 0.15 -2.51 0.00 0.00 175.55 173.12 1i3l s LYS 295 N -2.86 0.95 -0.26 -3.49 1.02 0.45 -4.89 119.74 110.66 1i3l s LYS 295 Ca -0.03 -0.19 -0.25 0.00 0.02 0.00 0.00 55.97 55.51 1i3l s LYS 295 Cb 0.00 -0.90 -0.00 0.00 -0.52 0.00 0.00 37.83 36.42 1i3l s LYS 295 CO -0.06 -0.01 0.87 0.08 -0.92 0.00 0.00 175.35 175.31 1i3l s VAL 296 N 0.66 4.78 0.32 3.17 1.01 -1.26 -0.60 120.40 128.48 1i3l s VAL 296 Ca -0.10 1.60 0.01 0.00 0.00 0.00 0.00 61.98 63.49 1i3l s VAL 296 Cb -0.13 -4.17 0.01 0.00 0.00 0.00 0.00 36.38 32.09 1i3l s VAL 296 CO 0.01 -0.15 0.07 1.33 0.00 0.00 0.00 175.10 176.36 1i3l n VAL 297 N 5.36 0.00 -1.01 2.92 0.24 0.76 -4.92 118.33 121.68 1i3l n VAL 297 Ca 0.07 -1.45 -0.31 0.00 -2.04 0.00 0.00 64.34 60.61 1i3l n VAL 297 Cb 0.47 0.16 0.12 0.00 -1.47 0.00 0.00 33.84 33.12 1i3l n VAL 297 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i3l s ALA 298 N -2.53 1.91 0.52 2.33 0.00 -1.26 -0.53 121.76 122.21 1i3l s ALA 298 Ca 0.05 0.42 -0.22 0.00 0.00 0.00 0.00 51.96 52.21 1i3l s ALA 298 Cb -0.00 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.71 1i3l s ALA 298 CO 0.03 -2.21 1.34 1.03 0.00 0.00 0.00 175.76 175.95 1i3l s ARG 299 N -4.78 3.28 -0.10 0.00 0.52 -1.26 -3.24 118.95 113.37 1i3l s ARG 299 Ca 0.64 2.20 -0.20 0.00 -0.52 0.00 0.00 55.73 57.84 1i3l s ARG 299 Cb -0.20 -2.33 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 1i3l s ARG 299 CO 0.57 -1.06 0.56 0.50 0.02 0.00 0.00 175.30 175.89 1i3l s ARG 300 N -2.82 4.38 0.22 3.54 3.52 -1.26 -4.91 118.95 121.62 1i3l s ARG 300 Ca 0.69 0.62 -0.32 0.00 -0.13 0.00 0.00 55.73 56.59 1i3l s ARG 300 Cb -0.39 -3.44 -0.14 0.00 -1.56 0.00 0.00 34.95 29.42 1i3l s ARG 300 CO 0.47 0.13 1.33 -1.91 -0.81 0.00 0.00 175.30 174.51 1i3l n GLU 301 N 3.69 1.78 -0.98 5.12 2.13 -1.26 -1.02 120.64 130.10 1i3l n GLU 301 Ca -0.05 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1i3l n GLU 301 Cb 0.51 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 29.98 1i3l n GLU 301 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i3l n GLY 302 N 2.11 0.82 3.77 8.31 0.00 -1.26 -5.01 105.19 113.93 1i3l n GLY 302 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1i3l n GLY 302 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i3l s ASP 303 N -2.71 7.09 0.16 1.61 -0.00 -0.19 -5.04 116.67 117.58 1i3l s ASP 303 Ca 0.00 2.07 -0.02 0.00 -0.00 0.00 0.00 52.55 54.60 1i3l s ASP 303 Cb 0.00 -2.60 -0.05 0.00 -0.00 0.00 0.00 42.92 40.27 1i3l s ASP 303 CO 0.00 -0.26 0.35 -0.69 -0.00 0.00 0.00 175.17 174.58 1i3l s VAL 304 N -1.45 5.22 0.02 -1.27 1.01 -1.26 -4.99 120.40 117.67 1i3l s VAL 304 Ca 0.51 -0.22 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1i3l s VAL 304 Cb -0.25 -3.67 -0.18 0.00 0.00 0.00 0.00 36.38 32.27 1i3l s VAL 304 CO 0.32 -0.04 1.43 0.00 0.00 0.00 0.00 175.10 176.81 1i3l h ALA 305 N 2.49 -0.02 -2.93 5.51 0.00 -1.96 -3.44 119.26 118.92 1i3l h ALA 305 Ca -0.47 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.14 1i3l h ALA 305 Cb 1.18 0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.73 1i3l h ALA 305 CO 0.71 -0.36 -0.37 0.00 0.00 0.00 0.00 179.25 179.23 1i3l s ALA 306 N -4.96 -0.69 -0.14 0.00 0.00 -1.26 -1.13 121.76 113.58 1i3l s ALA 306 Ca -0.15 0.64 -0.06 0.00 0.00 0.00 0.00 51.96 52.40 1i3l s ALA 306 Cb 0.03 -0.32 0.06 0.00 0.00 0.00 0.00 23.12 22.89 1i3l s ALA 306 CO 0.66 -0.16 0.30 0.00 0.00 0.00 0.00 175.76 176.56 1i3l s TYR 308 N 2.10 -0.38 0.29 0.00 -0.85 -1.26 -2.18 117.35 115.08 1i3l s TYR 308 Ca -0.03 0.44 -0.02 0.00 -0.52 0.00 0.00 57.07 56.95 1i3l s TYR 308 Cb -0.11 0.29 -0.04 0.00 0.38 0.00 0.00 41.96 42.48 1i3l s TYR 308 CO -0.10 -0.60 0.52 0.00 -1.52 0.00 0.00 175.55 173.85 1i3l s ALA 309 N -2.25 3.70 -0.45 9.51 0.00 -1.26 -0.90 121.76 130.11 1i3l s ALA 309 Ca -0.06 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 1i3l s ALA 309 Cb -0.01 -2.16 0.06 0.00 0.00 0.00 0.00 23.12 21.00 1i3l s ALA 309 CO -0.00 0.19 0.35 1.21 0.00 0.00 0.00 175.76 177.51 1i3l s ASN 310 N -3.48 6.09 0.00 0.00 3.04 0.26 -3.89 114.94 116.96 1i3l s ASN 310 Ca 0.41 -1.20 0.12 0.00 0.04 0.00 0.00 52.86 52.23 1i3l s ASN 310 Cb -0.10 -2.16 0.42 0.00 -1.54 0.00 0.00 41.25 37.87 1i3l s ASN 310 CO 0.32 -0.57 1.32 -0.81 -3.04 0.00 0.00 177.10 174.31 1i3l n PRO 311 N 5.17 1.54 0.09 0.43 -0.04 -1.26 -4.51 135.00 136.42 1i3l n PRO 311 Ca -0.12 -0.83 -0.12 0.00 -0.04 0.00 0.00 63.50 62.39 1i3l n PRO 311 Cb 0.45 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.61 1i3l n PRO 311 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1i3l h SER 312 N 1.45 -0.45 -0.52 3.54 0.02 -1.96 -2.21 113.55 113.42 1i3l h SER 312 Ca 0.00 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1i3l h SER 312 Cb 0.33 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 1i3l h SER 312 CO 0.00 -0.24 0.33 0.25 -1.14 0.00 0.00 176.83 176.04 1i3l h LEU 313 N -0.32 0.56 -0.96 5.07 5.85 -1.96 -0.03 115.31 123.52 1i3l h LEU 313 Ca 0.02 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1i3l h LEU 313 Cb 0.34 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1i3l h LEU 313 CO -0.09 0.40 0.60 0.00 -0.34 0.00 0.00 178.44 179.01 1i3l h ALA 314 N 1.21 1.22 -0.20 1.25 0.00 -1.81 0.29 119.26 121.21 1i3l h ALA 314 Ca 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1i3l h ALA 314 Cb -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 1i3l h ALA 314 CO -0.06 0.65 0.05 0.37 0.00 0.00 0.00 179.25 180.26 1i3l h GLN 315 N 1.31 0.33 -0.13 0.00 4.15 -0.78 -0.91 115.11 119.08 1i3l h GLN 315 Ca 0.35 -0.08 -0.03 0.00 0.77 0.00 0.00 58.65 59.66 1i3l h GLN 315 Cb -0.09 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.55 1i3l h GLN 315 CO -0.07 0.44 -0.03 1.49 -1.93 0.00 0.00 178.83 178.74 1i3l h GLU 316 N 0.15 0.24 0.04 1.69 4.57 -0.53 -2.42 114.58 118.32 1i3l h GLU 316 Ca 0.06 -0.09 -0.24 0.00 -1.18 0.00 0.00 59.36 57.91 1i3l h GLU 316 Cb 0.26 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 1i3l h GLU 316 CO 0.00 0.53 -1.32 0.93 -1.18 0.00 0.00 179.01 177.97 1i3l h GLU 317 N -0.06 0.08 0.00 1.92 5.08 -0.53 -3.38 114.58 117.69 1i3l h GLU 317 Ca 0.03 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1i3l h GLU 317 Cb 0.44 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1i3l h GLU 317 CO 0.01 1.07 -0.38 -0.07 -1.00 0.00 0.00 179.01 178.64 1i3l h LEU 318 N -0.71 0.00 1.09 1.33 3.38 -1.32 -3.48 115.31 115.61 1i3l h LEU 318 Ca -0.33 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.37 1i3l h LEU 318 Cb 1.48 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.20 1i3l h LEU 318 CO -0.10 0.04 -0.23 0.61 0.09 0.00 0.00 178.44 178.85 1i3l n GLY 319 N 1.26 0.32 3.21 0.83 0.00 -0.50 -4.90 105.19 105.41 1i3l n GLY 319 Ca 0.04 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 1i3l n GLY 319 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1i3l s TRP 320 N -2.44 1.68 0.01 1.61 -0.00 -1.00 -4.97 118.94 113.82 1i3l s TRP 320 Ca 0.00 -0.35 -0.05 0.00 -0.00 0.00 0.00 56.10 55.70 1i3l s TRP 320 Cb 0.00 -1.03 -0.01 0.00 -0.00 0.00 0.00 33.47 32.43 1i3l s TRP 320 CO 0.00 0.04 0.08 0.95 -0.00 0.00 0.00 176.95 178.02 1i3l s THR 321 N -0.69 0.09 0.04 5.86 -4.23 -1.26 -2.92 115.64 112.54 1i3l s THR 321 Ca 0.07 -0.77 -0.30 0.00 -1.18 0.00 0.00 61.69 59.50 1i3l s THR 321 Cb -0.08 -0.37 -0.05 0.00 1.34 0.00 0.00 72.50 73.34 1i3l s THR 321 CO 0.01 -0.42 1.14 0.00 -0.54 0.00 0.00 174.62 174.81 1i3l s ALA 322 N -1.41 3.33 -0.12 3.99 0.00 -1.26 -4.94 121.76 121.35 1i3l s ALA 322 Ca -0.15 0.77 0.21 0.00 0.00 0.00 0.00 51.96 52.78 1i3l s ALA 322 Cb -0.08 -3.42 -0.20 0.00 0.00 0.00 0.00 23.12 19.41 1i3l s ALA 322 CO 0.01 -0.39 0.63 0.00 0.00 0.00 0.00 175.76 176.01 1i3l n ALA 323 N 3.94 2.40 -2.68 0.00 0.00 -1.26 -4.95 120.51 117.95 1i3l n ALA 323 Ca 0.08 -0.56 -0.37 0.00 0.00 0.00 0.00 53.44 52.59 1i3l n ALA 323 Cb 0.48 -0.80 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 1i3l n ALA 323 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1i3l s LEU 324 N -5.09 4.32 0.00 0.00 1.43 -1.26 -5.08 118.68 113.00 1i3l s LEU 324 Ca -0.05 0.67 0.03 0.00 -1.03 0.00 0.00 54.13 53.75 1i3l s LEU 324 Cb 0.11 -2.46 0.08 0.00 0.03 0.00 0.00 46.19 43.95 1i3l s LEU 324 CO 0.85 0.16 0.60 0.61 0.23 0.00 0.00 176.35 178.80 1i3l n GLY 325 N 2.88 1.26 0.27 -3.19 0.00 -1.26 -4.65 105.19 100.50 1i3l n GLY 325 Ca -0.12 -2.09 -0.05 0.00 0.00 0.00 0.00 46.02 43.76 1i3l n GLY 325 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1i3l h LEU 326 N 0.00 -0.75 -0.65 0.99 5.85 -1.98 -0.04 115.31 118.74 1i3l h LEU 326 Ca -0.20 0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1i3l h LEU 326 Cb 0.81 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1i3l h LEU 326 CO 0.24 -0.24 0.42 0.44 -0.34 0.00 0.00 178.44 178.96 1i3l h ASP 327 N -0.12 0.70 -0.37 1.25 3.32 -1.95 -0.84 116.42 118.40 1i3l h ASP 327 Ca 0.22 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1i3l h ASP 327 Cb 0.46 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1i3l h ASP 327 CO -0.54 0.50 0.18 -0.09 -1.72 0.00 0.00 179.24 177.57 1i3l h ARG 328 N 0.83 0.53 -0.52 3.56 9.65 -1.74 0.37 114.38 127.06 1i3l h ARG 328 Ca 0.25 -0.08 0.04 0.00 -1.10 0.00 0.00 59.98 59.09 1i3l h ARG 328 Cb -0.04 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.40 1i3l h ARG 328 CO -0.08 0.47 0.27 0.52 2.80 0.00 0.00 179.97 183.95 1i3l h MET 329 N 0.47 0.52 -0.45 0.20 2.86 -0.66 -0.67 114.93 117.19 1i3l h MET 329 Ca 0.13 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 1i3l h MET 329 Cb 0.11 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1i3l h MET 329 CO -0.02 0.34 -0.12 0.00 1.06 0.00 0.00 176.91 178.18 1i3l h GLU 331 N 0.72 0.61 -0.35 0.00 4.81 -0.70 0.15 114.58 119.81 1i3l h GLU 331 Ca 0.11 -0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.14 1i3l h GLU 331 Cb 0.67 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1i3l h GLU 331 CO 0.05 0.51 -0.27 -0.44 -0.73 0.00 0.00 179.01 178.12 1i3l h ASP 332 N 0.55 0.74 -0.27 1.04 3.32 -1.07 -0.07 116.42 120.66 1i3l h ASP 332 Ca 0.15 -0.28 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1i3l h ASP 332 Cb 0.10 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1i3l h ASP 332 CO -0.02 0.97 -0.10 0.25 -1.72 0.00 0.00 179.24 178.62 1i3l h LEU 333 N 0.62 0.55 -0.60 1.55 5.85 -0.98 -2.47 115.31 119.84 1i3l h LEU 333 Ca 0.08 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.41 1i3l h LEU 333 Cb 0.78 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 1i3l h LEU 333 CO 0.06 0.82 0.39 -0.25 -0.34 0.00 0.00 178.44 179.13 1i3l h TRP 334 N 0.28 0.75 -0.28 1.25 2.91 -0.52 -1.78 115.95 118.57 1i3l h TRP 334 Ca 0.06 0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.15 1i3l h TRP 334 Cb 0.60 -0.25 -0.04 0.00 -0.51 0.00 0.00 29.16 28.95 1i3l h TRP 334 CO 0.06 0.47 0.02 -0.09 -1.03 0.00 0.00 178.44 177.87 1i3l h ARG 335 N 0.81 0.10 -0.15 2.65 2.43 -0.91 0.11 114.38 119.42 1i3l h ARG 335 Ca 0.22 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1i3l h ARG 335 Cb -0.09 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 1i3l h ARG 335 CO -0.05 0.07 0.01 2.35 -1.51 0.00 0.00 179.97 180.84 1i3l h TRP 336 N 0.11 0.01 -0.57 2.20 2.91 -1.19 0.00 115.95 119.42 1i3l h TRP 336 Ca 0.13 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.14 1i3l h TRP 336 Cb 0.16 0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 28.81 1i3l h TRP 336 CO -0.20 -0.01 0.26 0.37 -1.03 0.00 0.00 178.44 177.84 1i3l h GLN 337 N 0.06 0.84 -0.35 2.65 5.75 -0.88 0.24 115.11 123.42 1i3l h GLN 337 Ca 0.07 -0.13 -0.14 0.00 -0.15 0.00 0.00 58.65 58.30 1i3l h GLN 337 Cb 0.08 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 1i3l h GLN 337 CO -0.11 0.69 -0.34 -0.22 -2.65 0.00 0.00 178.83 176.20 1i3l h LYS 338 N 0.78 0.85 0.00 1.69 3.64 -0.68 -2.83 116.57 120.03 1i3l h LYS 338 Ca 0.20 -0.45 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1i3l h LYS 338 Cb 0.14 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1i3l h LYS 338 CO -0.02 1.09 -0.08 1.96 -2.27 0.00 0.00 179.45 180.12 1i3l h GLN 339 N 0.65 0.00 -2.30 1.90 4.20 -0.94 -3.37 115.11 115.25 1i3l h GLN 339 Ca 0.06 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.18 1i3l h GLN 339 Cb 0.93 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.32 1i3l h GLN 339 CO 0.09 0.08 -0.95 0.09 -0.67 0.00 0.00 178.83 177.47 1i3l n ASN 340 N -3.14 0.47 0.21 1.46 3.02 0.06 -4.97 115.26 112.37 1i3l n ASN 340 Ca 0.03 -2.66 0.18 0.00 -0.03 0.00 0.00 54.58 52.09 1i3l n ASN 340 Cb 0.49 -0.61 0.84 0.00 -0.61 0.00 0.00 39.78 39.88 1i3l n ASN 340 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1i3l h PRO 341 N 4.92 0.00 -0.12 3.52 0.11 -1.68 -1.10 132.00 137.65 1i3l h PRO 341 Ca 0.18 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.24 1i3l h PRO 341 Cb 0.86 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.94 1i3l h PRO 341 CO 0.48 0.00 -0.24 0.43 -0.21 0.00 0.00 178.00 178.45 1i3l n SER 342 N -3.59 2.22 0.00 -2.05 7.64 -1.26 -5.07 113.62 111.52 1i3l n SER 342 Ca 0.02 -3.64 0.00 0.00 1.01 0.00 0.00 58.87 56.26 1i3l n SER 342 Cb 0.38 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1i3l n SER 342 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i3l n GLY 343 N -1.13 0.74 0.24 0.23 0.00 -0.42 -3.07 105.19 101.78 1i3l n GLY 343 Ca 0.23 -0.79 0.13 0.00 0.00 0.00 0.00 46.02 45.59 1i3l n GLY 343 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1i3l h PHE 344 N 0.00 0.00 0.00 1.61 0.04 -1.94 -3.46 116.94 113.20 1i3l h PHE 344 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1i3l h PHE 344 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1i3l h PHE 344 CO 0.00 0.01 0.00 0.41 -0.60 0.00 0.00 178.31 178.13 1i3l n GLY 345 N 0.76 -1.08 0.00 -1.45 0.00 -1.17 -5.06 105.19 97.18 1i3l n GLY 345 Ca 0.03 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1i3l n GLY 345 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73