#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ijg n ILE 12 N 0.00 0.05 0.25 0.44 -0.00 -1.26 -4.01 119.36 114.84 1ijg n ILE 12 Ca 0.00 -0.16 0.12 0.00 -0.00 0.00 0.00 62.75 62.71 1ijg n ILE 12 Cb 0.00 0.04 0.75 0.00 -0.00 0.00 0.00 39.64 40.43 1ijg n ILE 12 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.55 177.33 1ijg h ASN 13 N 1.21 0.00 -0.05 4.38 2.35 -2.05 -1.36 115.58 120.05 1ijg h ASN 13 Ca 0.00 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 1ijg h ASN 13 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1ijg h ASN 13 CO 0.00 0.00 -0.24 -0.33 -1.65 0.00 0.00 177.43 175.21 1ijg h GLU 14 N 0.00 0.26 -0.45 0.81 4.39 -2.01 -2.48 114.58 115.10 1ijg h GLU 14 Ca 0.02 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.49 1ijg h GLU 14 Cb 0.11 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1ijg h GLU 14 CO -0.00 0.85 0.18 0.82 -1.16 0.00 0.00 179.01 179.71 1ijg h ILE 15 N -0.28 1.17 -0.35 3.13 1.08 -1.70 -2.05 117.51 118.51 1ijg h ILE 15 Ca -0.02 -0.53 -0.12 0.00 -0.39 0.00 0.00 64.86 63.80 1ijg h ILE 15 Cb 0.90 0.63 -0.01 0.00 -3.07 0.00 0.00 36.82 35.27 1ijg h ILE 15 CO 0.05 0.21 -0.26 1.56 -0.69 0.00 0.00 178.15 179.02 1ijg h GLN 16 N 0.64 0.80 -0.60 2.37 1.08 -1.29 -0.86 115.11 117.26 1ijg h GLN 16 Ca 0.16 -0.39 0.01 0.00 -1.45 0.00 0.00 58.65 56.97 1ijg h GLN 16 Cb 0.13 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.52 1ijg h GLN 16 CO -0.02 1.02 0.40 0.00 -0.95 0.00 0.00 178.83 179.28 1ijg h ARG 17 N 0.59 0.79 -0.05 1.46 3.08 -1.00 0.15 114.38 119.40 1ijg h ARG 17 Ca 0.07 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.91 1ijg h ARG 17 Cb 0.83 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1ijg h ARG 17 CO 0.07 0.52 -0.68 1.96 -1.07 0.00 0.00 179.97 180.78 1ijg h GLN 18 N 0.82 0.24 -0.09 0.04 4.20 -1.12 -1.58 115.11 117.61 1ijg h GLN 18 Ca 0.22 -0.19 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 1ijg h GLN 18 Cb -0.09 0.04 0.01 0.00 0.30 0.00 0.00 27.48 27.73 1ijg h GLN 18 CO -0.05 0.83 -0.40 -0.22 -0.67 0.00 0.00 178.83 178.32 1ijg h LYS 19 N 0.17 0.42 -0.41 1.46 3.64 0.05 -0.82 116.57 121.09 1ijg h LYS 19 Ca -0.02 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1ijg h LYS 19 Cb 1.21 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 1ijg h LYS 19 CO 0.10 0.97 0.08 -0.09 -2.27 0.00 0.00 179.45 178.25 1ijg h ARG 20 N -0.02 0.61 -0.27 1.90 1.12 -0.77 -1.13 114.38 115.81 1ijg h ARG 20 Ca -0.02 -0.11 -0.12 0.00 -1.11 0.00 0.00 59.98 58.61 1ijg h ARG 20 Cb 1.04 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.89 1ijg h ARG 20 CO 0.08 0.58 -0.34 -0.97 -3.11 0.00 0.00 179.97 176.21 1ijg h ASN 21 N 0.60 0.62 -0.86 -3.80 -1.24 -1.21 0.23 115.58 109.91 1ijg h ASN 21 Ca 0.13 -0.25 -0.02 0.00 0.71 0.00 0.00 56.30 56.87 1ijg h ASN 21 Cb 0.26 -0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.10 1ijg h ASN 21 CO -0.00 0.91 0.45 -0.09 -1.29 0.00 0.00 177.43 177.41 1ijg h ARG 22 N 0.50 1.22 -0.15 6.67 9.65 0.05 0.11 114.38 132.43 1ijg h ARG 22 Ca 0.05 -0.16 -0.19 0.00 -1.10 0.00 0.00 59.98 58.58 1ijg h ARG 22 Cb 0.83 -0.23 0.01 0.00 -1.39 0.00 0.00 29.97 29.19 1ijg h ARG 22 CO 0.07 0.91 -0.66 -1.49 2.80 0.00 0.00 179.97 181.60 1ijg h TRP 23 N 1.21 0.96 -0.31 2.20 4.06 -1.05 -1.40 115.95 121.62 1ijg h TRP 23 Ca 0.30 -0.41 0.04 0.00 2.06 0.00 0.00 58.89 60.88 1ijg h TRP 23 Cb 0.06 -0.15 -0.04 0.00 -1.00 0.00 0.00 29.16 28.03 1ijg h TRP 23 CO 0.01 1.23 0.07 0.35 -3.56 0.00 0.00 178.44 176.54 1ijg h PHE 24 N 0.42 0.13 -0.79 0.49 3.57 -0.54 -0.40 116.94 119.81 1ijg h PHE 24 Ca -0.04 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1ijg h PHE 24 Cb 1.29 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.98 1ijg h PHE 24 CO 0.09 0.04 0.50 0.82 -2.23 0.00 0.00 178.31 177.54 1ijg h ILE 25 N 0.19 1.21 -0.11 1.41 1.08 -0.77 0.17 117.51 120.69 1ijg h ILE 25 Ca 0.14 -0.42 0.03 0.00 -0.39 0.00 0.00 64.86 64.22 1ijg h ILE 25 Cb 0.14 0.07 -0.04 0.00 -3.07 0.00 0.00 36.82 33.93 1ijg h ILE 25 CO -0.18 0.21 -0.10 -0.74 -0.69 0.00 0.00 178.15 176.66 1ijg h HIS 26 N 1.08 -0.24 -0.38 1.37 -0.00 -0.33 -0.49 115.15 116.15 1ijg h HIS 26 Ca 0.29 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.56 1ijg h HIS 26 Cb -0.09 0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 1ijg h HIS 26 CO -0.01 -0.15 -0.23 1.88 -0.00 0.00 0.00 177.93 179.42 1ijg h TYR 27 N -0.12 0.85 -0.24 5.26 -1.99 -0.81 -0.72 116.97 119.20 1ijg h TYR 27 Ca 0.08 -0.19 -0.01 0.00 2.00 0.00 0.00 58.73 60.60 1ijg h TYR 27 Cb 0.23 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.74 1ijg h TYR 27 CO -0.21 0.91 0.09 1.25 -0.00 0.00 0.00 178.16 180.19 1ijg h LEU 28 N 0.65 0.33 -0.64 3.88 7.12 -0.66 0.14 115.31 126.13 1ijg h LEU 28 Ca 0.09 -0.17 -0.12 0.00 0.13 0.00 0.00 57.88 57.81 1ijg h LEU 28 Cb 0.73 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.76 1ijg h LEU 28 CO 0.06 0.41 -0.26 0.78 -0.13 0.00 0.00 178.44 179.30 1ijg h ASN 29 N 0.23 0.80 -0.30 1.25 2.35 -1.05 -0.74 115.58 118.13 1ijg h ASN 29 Ca 0.08 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.48 1ijg h ASN 29 Cb 0.18 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 1ijg h ASN 29 CO -0.01 1.03 0.03 0.22 -1.65 0.00 0.00 177.43 177.05 1ijg h TYR 30 N 0.67 0.54 -0.57 1.19 3.20 -0.94 0.20 116.97 121.26 1ijg h TYR 30 Ca 0.08 -0.08 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 1ijg h TYR 30 Cb 0.79 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1ijg h TYR 30 CO 0.04 0.61 0.00 -0.07 -1.64 0.00 0.00 178.16 177.10 1ijg h LEU 31 N 0.31 0.96 -0.04 2.82 3.38 -0.63 -1.44 115.31 120.67 1ijg h LEU 31 Ca 0.09 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1ijg h LEU 31 Cb 0.37 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1ijg h LEU 31 CO 0.01 1.01 0.02 1.56 0.09 0.00 0.00 178.44 181.13 1ijg h GLN 32 N 0.91 0.06 -0.78 1.13 4.20 -0.92 0.17 115.11 119.87 1ijg h GLN 32 Ca 0.17 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.95 1ijg h GLN 32 Cb 0.53 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 1ijg h GLN 32 CO 0.03 0.16 0.51 0.66 -0.67 0.00 0.00 178.83 179.52 1ijg h SER 33 N -0.06 0.67 -0.16 1.46 4.64 -0.77 0.82 113.55 120.15 1ijg h SER 33 Ca 0.01 0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.15 1ijg h SER 33 Cb 0.12 -0.13 0.01 0.00 -0.31 0.00 0.00 62.40 62.09 1ijg h SER 33 CO -0.00 0.41 -0.66 -0.07 -0.87 0.00 0.00 176.83 175.64 1ijg h LEU 34 N 0.75 0.87 0.17 5.97 3.38 -0.77 -3.03 115.31 122.65 1ijg h LEU 34 Ca 0.35 -0.61 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1ijg h LEU 34 Cb 0.38 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1ijg h LEU 34 CO -0.13 1.34 -0.08 0.00 0.09 0.00 0.00 178.44 179.65 1ijg h ALA 35 N 0.55 -0.23 -0.76 1.53 0.00 0.32 -3.03 119.26 117.64 1ijg h ALA 35 Ca -0.04 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.84 1ijg h ALA 35 Cb 1.29 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.12 1ijg h ALA 35 CO 0.14 -0.55 0.50 1.88 0.00 0.00 0.00 179.25 181.22 1ijg h TYR 36 N -0.39 0.77 0.00 0.00 0.05 -0.97 -1.13 116.97 115.30 1ijg h TYR 36 Ca -0.02 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ijg h TYR 36 Cb 0.31 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 37.79 1ijg h TYR 36 CO -0.02 0.38 0.00 0.94 -1.05 0.00 0.00 178.16 178.42 1ijg n GLN 37 N -4.49 0.05 -0.13 4.88 0.00 -1.14 -4.25 117.38 112.30 1ijg n GLN 37 Ca 0.12 0.20 -0.12 0.00 -0.00 0.00 0.00 57.00 57.20 1ijg n GLN 37 Cb 0.28 -1.59 -0.07 0.00 0.00 0.00 0.00 30.24 28.86 1ijg n GLN 37 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1ijg h LEU 38 N 0.00 -1.63 -9.85 1.69 4.07 -1.08 -3.42 115.31 105.09 1ijg h LEU 38 Ca 0.00 0.23 -0.63 0.00 0.08 0.00 0.00 57.88 57.56 1ijg h LEU 38 Cb 0.39 0.69 -0.05 0.00 1.08 0.00 0.00 40.66 42.77 1ijg h LEU 38 CO 0.00 -0.39 -0.47 -0.36 -1.08 0.00 0.00 178.44 176.14 1ijg s PHE 39 N -5.76 3.54 -0.11 1.13 0.08 -1.26 -0.51 117.98 115.09 1ijg s PHE 39 Ca -0.15 0.35 0.03 0.00 0.12 0.00 0.00 56.93 57.28 1ijg s PHE 39 Cb 0.10 -1.83 0.01 0.00 -0.57 0.00 0.00 43.02 40.73 1ijg s PHE 39 CO 0.64 0.61 -0.19 -2.00 -0.10 0.00 0.00 175.22 174.18 1ijg s GLU 40 N -2.17 2.54 0.03 0.44 2.12 -0.14 -4.71 118.70 116.82 1ijg s GLU 40 Ca 0.31 -0.69 -0.00 0.00 0.36 0.00 0.00 54.97 54.95 1ijg s GLU 40 Cb -0.13 -2.04 -0.04 0.00 0.26 0.00 0.00 34.13 32.18 1ijg s GLU 40 CO 0.22 0.03 0.15 -1.58 -0.54 0.00 0.00 175.26 173.54 1ijg s TRP 41 N 0.73 3.41 0.06 5.30 0.52 -1.26 -1.99 118.94 125.72 1ijg s TRP 41 Ca -0.11 0.23 0.04 0.00 0.02 0.00 0.00 56.10 56.28 1ijg s TRP 41 Cb -0.16 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.39 1ijg s TRP 41 CO 0.02 0.58 -0.13 -2.00 0.02 0.00 0.00 176.95 175.44 1ijg s GLU 42 N -2.20 0.75 -1.29 4.98 2.56 0.20 -4.80 118.70 118.91 1ijg s GLU 42 Ca 0.30 -0.91 -0.02 0.00 0.00 0.00 0.00 54.97 54.34 1ijg s GLU 42 Cb -0.13 -0.70 0.00 0.00 2.00 0.00 0.00 34.13 35.30 1ijg s GLU 42 CO 0.22 0.15 0.23 0.09 -0.56 0.00 0.00 175.26 175.39 1ijg n ASN 43 N 1.31 -4.94 -4.77 -1.70 5.03 -1.26 -1.26 115.26 107.67 1ijg n ASN 43 Ca -0.22 -0.12 -0.38 0.00 0.87 0.00 0.00 54.58 54.73 1ijg n ASN 43 Cb 0.54 -3.92 -0.06 0.00 -1.02 0.00 0.00 39.78 35.32 1ijg n ASN 43 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1ijg s LEU 44 N -4.93 4.50 0.29 3.41 1.43 -1.26 -4.13 118.68 118.00 1ijg s LEU 44 Ca 0.11 1.79 -0.30 0.00 -1.03 0.00 0.00 54.13 54.71 1ijg s LEU 44 Cb -0.05 -3.67 -0.12 0.00 0.03 0.00 0.00 46.19 42.37 1ijg s LEU 44 CO 0.14 0.08 1.44 -0.81 0.23 0.00 0.00 176.35 177.43 1ijg n PRO 45 N 1.12 2.30 0.28 1.29 -0.04 -1.26 -4.80 135.00 133.90 1ijg n PRO 45 Ca -0.02 0.82 0.10 0.00 -0.04 0.00 0.00 63.50 64.36 1ijg n PRO 45 Cb 0.49 -2.50 0.55 0.00 -0.04 0.00 0.00 33.50 32.00 1ijg n PRO 45 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1ijg h PRO 46 N 3.83 0.00 -0.01 0.54 0.13 -1.97 0.21 132.00 134.75 1ijg h PRO 46 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ijg h PRO 46 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1ijg h PRO 46 CO 0.72 0.00 -0.02 -2.37 -0.23 0.00 0.00 178.00 176.11 1ijg n THR 47 N -2.54 0.00 -4.05 1.56 5.66 -1.26 -4.78 114.28 108.87 1ijg n THR 47 Ca -0.01 -0.09 -0.35 0.00 -3.05 0.00 0.00 64.05 60.55 1ijg n THR 47 Cb 0.44 -0.13 -0.11 0.00 -1.55 0.00 0.00 70.33 68.98 1ijg n THR 47 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1ijg s ILE 48 N -2.09 4.39 -0.49 1.09 1.09 0.75 -4.66 121.20 121.28 1ijg s ILE 48 Ca 0.41 -0.17 -0.22 0.00 -1.10 0.00 0.00 60.65 59.58 1ijg s ILE 48 Cb 0.21 -2.99 0.04 0.00 -1.06 0.00 0.00 42.46 38.67 1ijg s ILE 48 CO 0.38 0.44 0.74 0.21 -0.10 0.00 0.00 174.94 176.61 1ijg s ASN 49 N 0.72 6.31 0.25 3.58 3.84 -1.26 -4.88 114.94 123.51 1ijg s ASN 49 Ca 0.02 -0.47 -0.03 0.00 0.21 0.00 0.00 52.86 52.60 1ijg s ASN 49 Cb -0.14 -2.35 0.46 0.00 -0.55 0.00 0.00 41.25 38.67 1ijg s ASN 49 CO 0.02 -0.95 1.79 1.55 -2.79 0.00 0.00 177.10 176.72 1ijg h PRO 50 N 9.04 0.72 -0.04 0.43 0.13 -1.97 0.07 132.00 140.39 1ijg h PRO 50 Ca -0.26 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1ijg h PRO 50 Cb 1.09 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 1ijg h PRO 50 CO 0.98 0.48 0.02 1.03 -0.23 0.00 0.00 178.00 180.28 1ijg h SER 51 N 0.74 0.05 -0.89 1.44 0.87 -1.98 -2.12 113.55 111.66 1ijg h SER 51 Ca 0.43 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.96 1ijg h SER 51 Cb 0.48 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.39 1ijg h SER 51 CO -0.29 0.07 0.58 0.15 -0.53 0.00 0.00 176.83 176.81 1ijg h PHE 52 N 0.02 1.13 0.26 2.24 3.57 -1.85 -1.30 116.94 121.01 1ijg h PHE 52 Ca 0.01 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.54 1ijg h PHE 52 Cb 0.03 -0.38 -0.03 0.00 2.79 0.00 0.00 35.95 38.36 1ijg h PHE 52 CO -0.06 0.72 -0.38 1.25 -2.23 0.00 0.00 178.31 177.61 1ijg h LEU 53 N 1.21 -1.06 -0.30 0.59 5.85 -0.61 -1.83 115.31 119.16 1ijg h LEU 53 Ca 0.33 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 59.11 1ijg h LEU 53 Cb -0.12 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1ijg h LEU 53 CO -0.07 -0.49 0.02 -0.08 -0.34 0.00 0.00 178.44 177.48 1ijg h GLU 54 N -0.70 0.53 -0.64 1.25 4.57 -1.28 -2.44 114.58 115.86 1ijg h GLU 54 Ca -0.00 -0.16 0.08 0.00 -1.18 0.00 0.00 59.36 58.10 1ijg h GLU 54 Cb 0.67 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.17 1ijg h GLU 54 CO -0.13 0.65 0.43 0.87 -1.18 0.00 0.00 179.01 179.65 1ijg h LYS 55 N 0.33 0.54 -0.08 1.92 1.57 -1.18 -1.59 116.57 118.08 1ijg h LYS 55 Ca 0.09 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1ijg h LYS 55 Cb 0.40 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1ijg h LYS 55 CO 0.01 0.36 -0.13 0.77 -0.57 0.00 0.00 179.45 179.89 1ijg h SER 56 N 0.55 0.26 -0.66 0.86 0.02 -1.14 -1.13 113.55 112.30 1ijg h SER 56 Ca 0.29 -0.53 0.06 0.00 -0.84 0.00 0.00 61.79 60.77 1ijg h SER 56 Cb 0.41 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 1ijg h SER 56 CO -0.09 0.74 0.44 0.40 -1.14 0.00 0.00 176.83 177.18 1ijg h ILE 57 N -0.22 1.00 0.14 3.27 2.04 -0.93 -0.69 117.51 122.13 1ijg h ILE 57 Ca 0.01 -0.23 -0.30 0.00 1.00 0.00 0.00 64.86 65.34 1ijg h ILE 57 Cb 0.69 0.28 0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1ijg h ILE 57 CO 0.03 0.12 -1.27 0.45 0.00 0.00 0.00 178.15 177.48 1ijg h HIS 58 N 0.66 0.93 0.02 1.37 3.86 -1.26 -1.83 115.15 118.90 1ijg h HIS 58 Ca 0.29 -0.61 -0.20 0.00 -1.16 0.00 0.00 60.37 58.69 1ijg h HIS 58 Cb 0.28 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 1ijg h HIS 58 CO -0.00 1.45 -0.93 1.96 0.86 0.00 0.00 177.93 181.27 1ijg h GLN 59 N 0.23 0.09 0.00 2.45 4.20 -0.81 0.27 115.11 121.55 1ijg h GLN 59 Ca -0.19 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.40 1ijg h GLN 59 Cb 1.95 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.77 1ijg h GLN 59 CO 0.24 0.95 -1.34 1.19 -0.67 0.00 0.00 178.83 179.21 1ijg n PHE 60 N -3.54 0.00 0.00 2.96 3.01 -0.30 -4.81 117.46 114.79 1ijg n PHE 60 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1ijg n PHE 60 Cb 0.86 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 40.16 1ijg n PHE 60 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ijg n GLY 61 N 2.08 0.32 3.61 1.37 0.00 -0.69 -4.46 105.19 107.41 1ijg n GLY 61 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1ijg n GLY 61 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ijg s TYR 62 N -2.00 -0.11 0.02 1.61 1.13 -1.20 -0.04 117.35 116.77 1ijg s TYR 62 Ca 0.00 0.03 -0.09 0.00 -1.41 0.00 0.00 57.07 55.60 1ijg s TYR 62 Cb 0.00 0.53 0.00 0.00 -1.10 0.00 0.00 41.96 41.40 1ijg s TYR 62 CO 0.00 -0.27 0.19 0.54 -2.51 0.00 0.00 175.55 173.49 1ijg s VAL 63 N -2.50 0.10 0.02 -3.49 0.11 -0.81 -4.30 120.40 109.53 1ijg s VAL 63 Ca 0.11 -0.81 -0.16 0.00 -2.93 0.00 0.00 61.98 58.19 1ijg s VAL 63 Cb 0.01 -0.75 -0.06 0.00 -1.53 0.00 0.00 36.38 34.05 1ijg s VAL 63 CO -0.04 -0.44 0.45 -0.83 -3.33 0.00 0.00 175.10 170.91 1ijg s GLY 64 N -1.82 2.53 -0.34 6.54 0.00 0.18 -1.24 107.32 113.18 1ijg s GLY 64 Ca -0.09 -0.15 0.03 0.00 0.00 0.00 0.00 44.72 44.52 1ijg s GLY 64 CO -0.02 0.25 0.07 -0.12 0.00 0.00 0.00 173.10 173.28 1ijg s PHE 65 N -1.05 3.41 -0.01 1.90 5.36 0.59 -0.38 117.98 127.80 1ijg s PHE 65 Ca 0.25 -2.81 0.06 0.00 -0.96 0.00 0.00 56.93 53.47 1ijg s PHE 65 Cb -0.17 -2.73 -0.02 0.00 -0.34 0.00 0.00 43.02 39.76 1ijg s PHE 65 CO 0.15 -0.93 -0.19 -0.47 -1.46 0.00 0.00 175.22 172.31 1ijg s TYR 66 N 0.96 1.73 -1.00 10.12 5.04 -0.66 -1.31 117.35 132.23 1ijg s TYR 66 Ca 0.11 -0.33 -0.16 0.00 -2.44 0.00 0.00 57.07 54.25 1ijg s TYR 66 Cb -0.19 -1.11 0.16 0.00 0.35 0.00 0.00 41.96 41.17 1ijg s TYR 66 CO -0.10 -0.02 1.16 0.21 -1.34 0.00 0.00 175.55 175.46 1ijg s LYS 67 N -0.51 3.77 0.27 4.97 2.20 -1.26 -0.27 119.74 128.91 1ijg s LYS 67 Ca 0.07 -2.17 -0.30 0.00 -0.36 0.00 0.00 55.97 53.22 1ijg s LYS 67 Cb -0.08 -4.87 -0.11 0.00 -1.51 0.00 0.00 37.83 31.27 1ijg s LYS 67 CO -0.01 -1.68 1.50 0.34 -0.36 0.00 0.00 175.35 175.15 1ijg s ASP 68 N 3.08 6.55 0.57 1.43 2.15 -0.52 -4.81 116.67 125.12 1ijg s ASP 68 Ca 0.33 2.77 0.33 0.00 0.43 0.00 0.00 52.55 56.42 1ijg s ASP 68 Cb -0.05 -2.63 1.67 0.00 -0.30 0.00 0.00 42.92 41.61 1ijg s ASP 68 CO -0.07 -0.78 2.13 1.55 -0.17 0.00 0.00 175.17 177.83 1ijg h PRO 69 N 4.96 0.00 0.00 4.34 0.13 -1.95 0.15 132.00 139.63 1ijg h PRO 69 Ca -0.46 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.51 1ijg h PRO 69 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1ijg h PRO 69 CO 0.78 0.06 -1.43 0.28 -0.23 0.00 0.00 178.00 177.46 1ijg n VAL 70 N -3.38 1.50 0.04 1.56 0.31 -1.26 -4.66 118.33 112.45 1ijg n VAL 70 Ca -0.02 -0.02 0.11 0.00 -0.01 0.00 0.00 64.34 64.40 1ijg n VAL 70 Cb 0.21 -2.20 0.28 0.00 -0.91 0.00 0.00 33.84 31.23 1ijg n VAL 70 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1ijg n ILE 71 N -4.41 0.77 -4.49 2.52 -5.35 -1.25 -5.08 119.36 102.08 1ijg n ILE 71 Ca -0.27 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.38 1ijg n ILE 71 Cb 0.61 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 39.07 1ijg n ILE 71 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1ijg n SER 72 N 1.40 -1.92 -4.64 7.28 2.88 0.04 -4.82 113.62 113.84 1ijg n SER 72 Ca 0.21 0.00 -0.48 0.00 -1.33 0.00 0.00 58.87 57.28 1ijg n SER 72 Cb 0.56 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.98 1ijg n SER 72 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1ijg n TYR 73 N -0.30 1.94 -3.79 0.66 4.02 -1.26 -1.43 117.16 117.00 1ijg n TYR 73 Ca 0.00 0.45 -0.13 0.00 -0.01 0.00 0.00 57.90 58.21 1ijg n TYR 73 Cb 0.00 -2.44 -0.12 0.00 -0.02 0.00 0.00 39.34 36.77 1ijg n TYR 73 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 1ijg s ILE 74 N 0.44 0.00 -0.20 -0.72 2.07 0.63 -4.33 121.20 119.09 1ijg s ILE 74 Ca 0.77 -0.01 -0.13 0.00 -1.41 0.00 0.00 60.65 59.86 1ijg s ILE 74 Cb -0.76 -0.36 -0.04 0.00 0.13 0.00 0.00 42.46 41.42 1ijg s ILE 74 CO 0.45 -0.01 0.28 0.00 -1.91 0.00 0.00 174.94 173.75 1ijg s ALA 75 N 0.11 3.59 0.03 1.50 0.00 -1.26 -1.66 121.76 124.07 1ijg s ALA 75 Ca -0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 1ijg s ALA 75 Cb -0.02 -2.45 -0.02 0.00 0.00 0.00 0.00 23.12 20.63 1ijg s ALA 75 CO 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 175.76 175.64 1ijg s ASN 77 N -1.79 6.18 0.00 0.00 0.01 -1.26 0.50 114.94 118.58 1ijg s ASN 77 Ca -0.11 0.21 0.00 0.00 -0.71 0.00 0.00 52.86 52.25 1ijg s ASN 77 Cb -0.06 -1.85 0.00 0.00 0.41 0.00 0.00 41.25 39.75 1ijg s ASN 77 CO -0.03 0.17 0.00 0.61 -1.51 0.00 0.00 177.10 176.34 1ijg n GLY 78 N 0.31 0.99 3.62 0.66 0.00 -1.26 -2.79 105.19 106.72 1ijg n GLY 78 Ca -0.06 -0.48 -0.28 0.00 0.00 0.00 0.00 46.02 45.20 1ijg n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ijg s ALA 79 N -1.00 3.09 -0.30 4.61 0.00 -1.08 -4.93 121.76 122.14 1ijg s ALA 79 Ca 0.00 -1.31 -0.15 0.00 0.00 0.00 0.00 51.96 50.50 1ijg s ALA 79 Cb 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 1ijg s ALA 79 CO 0.00 0.56 0.35 -0.51 0.00 0.00 0.00 175.76 176.16 1ijg s LEU 80 N -2.60 4.21 0.00 0.00 1.43 -1.26 -1.09 118.68 119.36 1ijg s LEU 80 Ca 0.25 0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1ijg s LEU 80 Cb -0.10 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.76 1ijg s LEU 80 CO 0.16 -0.24 0.00 -1.54 0.23 0.00 0.00 176.35 174.96 1ijg n SER 81 N 5.34 0.84 0.00 2.29 3.41 0.81 -4.99 113.62 121.32 1ijg n SER 81 Ca -0.09 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1ijg n SER 81 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1ijg n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ijg n GLY 82 N 2.10 -1.54 3.72 5.00 0.00 -1.26 -1.53 105.19 111.68 1ijg n GLY 82 Ca 0.00 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1ijg n GLY 82 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ijg s GLN 83 N -2.26 4.29 0.31 1.61 1.03 -1.26 -4.60 119.66 118.78 1ijg s GLN 83 Ca 0.00 2.18 -0.29 0.00 0.04 0.00 0.00 55.36 57.29 1ijg s GLN 83 Cb 0.00 -3.21 -0.10 0.00 0.03 0.00 0.00 33.01 29.74 1ijg s GLN 83 CO 0.00 -0.48 1.17 1.03 -2.54 0.00 0.00 175.29 174.48 1ijg s ARG 84 N 0.94 4.47 0.16 9.60 1.81 -1.26 -4.07 118.95 130.59 1ijg s ARG 84 Ca 0.65 1.94 -0.03 0.00 -1.72 0.00 0.00 55.73 56.58 1ijg s ARG 84 Cb -0.39 -3.08 0.04 0.00 -0.45 0.00 0.00 34.95 31.06 1ijg s ARG 84 CO 0.32 0.01 0.22 -0.40 -0.68 0.00 0.00 175.30 174.77 1ijg n ASP 85 N 0.91 0.02 0.04 0.23 3.85 -0.69 -4.77 116.55 116.14 1ijg n ASP 85 Ca -0.00 -1.08 0.21 0.00 -0.71 0.00 0.00 54.79 53.21 1ijg n ASP 85 Cb 0.44 -0.17 0.73 0.00 -1.35 0.00 0.00 41.12 40.78 1ijg n ASP 85 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 1ijg h VAL 86 N -1.11 0.44 -0.53 2.12 2.07 -1.96 0.14 116.25 117.42 1ijg h VAL 86 Ca -0.07 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 1ijg h VAL 86 Cb 0.20 0.64 -0.10 0.00 -1.52 0.00 0.00 31.29 30.51 1ijg h VAL 86 CO 0.05 0.00 0.14 -1.22 0.02 0.00 0.00 177.57 176.56 1ijg n TYR 87 N -3.86 1.75 -1.42 1.57 0.53 -1.26 -4.93 117.16 109.54 1ijg n TYR 87 Ca 0.09 -1.25 -0.15 0.00 -1.02 0.00 0.00 57.90 55.57 1ijg n TYR 87 Cb 0.67 -0.55 -0.07 0.00 -1.03 0.00 0.00 39.34 38.36 1ijg n TYR 87 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 1ijg n ASN 88 N -0.55 -4.69 -4.85 7.72 3.02 0.50 -4.96 115.26 111.46 1ijg n ASN 88 Ca 0.35 0.38 -0.32 0.00 -0.03 0.00 0.00 54.58 54.96 1ijg n ASN 88 Cb 1.19 -4.01 -0.05 0.00 -0.61 0.00 0.00 39.78 36.30 1ijg n ASN 88 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1ijg s GLN 89 N -3.24 3.96 0.51 3.52 -0.21 -1.26 -4.70 119.66 118.23 1ijg s GLN 89 Ca 0.00 0.78 -0.21 0.00 0.02 0.00 0.00 55.36 55.95 1ijg s GLN 89 Cb 0.00 -2.28 -0.07 0.00 1.00 0.00 0.00 33.01 31.66 1ijg s GLN 89 CO 0.00 -0.07 1.12 0.00 -2.12 0.00 0.00 175.29 174.23 1ijg s ALA 90 N -2.33 2.81 -0.03 6.09 0.00 -1.26 -1.70 121.76 125.32 1ijg s ALA 90 Ca 0.56 0.82 0.01 0.00 0.00 0.00 0.00 51.96 53.36 1ijg s ALA 90 Cb -0.10 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 1ijg s ALA 90 CO 0.25 -0.66 0.04 0.25 0.00 0.00 0.00 175.76 175.65 1ijg n THR 91 N -0.99 0.00 -4.63 0.00 -2.24 -1.07 -4.84 114.28 100.51 1ijg n THR 91 Ca 0.10 -0.26 -0.24 0.00 -2.27 0.00 0.00 64.05 61.38 1ijg n THR 91 Cb 0.50 0.74 -0.16 0.00 -2.10 0.00 0.00 70.33 69.31 1ijg n THR 91 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ijg s VAL 92 N -1.60 1.17 -0.25 2.28 1.01 -0.58 -0.03 120.40 122.41 1ijg s VAL 92 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 1ijg s VAL 92 Cb 0.01 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 1ijg s VAL 92 CO 0.06 0.35 0.02 0.12 0.00 0.00 0.00 175.10 175.65 1ijg s PHE 93 N 0.39 3.05 -1.11 5.22 2.19 -0.18 -0.13 117.98 127.40 1ijg s PHE 93 Ca -0.09 -0.87 -0.05 0.00 0.33 0.00 0.00 56.93 56.25 1ijg s PHE 93 Cb -0.13 -2.18 0.29 0.00 -1.31 0.00 0.00 43.02 39.69 1ijg s PHE 93 CO 0.03 -0.52 1.53 0.54 1.83 0.00 0.00 175.22 178.63 1ijg n ARG 94 N 4.84 4.31 -2.16 10.12 1.74 -0.25 -2.34 116.66 132.92 1ijg n ARG 94 Ca -0.17 -4.39 -0.42 0.00 -0.77 0.00 0.00 57.85 52.10 1ijg n ARG 94 Cb 0.50 -2.58 -0.03 0.00 -1.02 0.00 0.00 32.46 29.33 1ijg n ARG 94 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ijg s ALA 95 N -2.23 3.60 -0.30 7.54 0.00 -0.69 -2.63 121.76 127.05 1ijg s ALA 95 Ca 0.32 1.00 -0.20 0.00 0.00 0.00 0.00 51.96 53.08 1ijg s ALA 95 Cb 0.05 -3.59 0.19 0.00 0.00 0.00 0.00 23.12 19.77 1ijg s ALA 95 CO 0.08 -0.85 1.29 0.00 0.00 0.00 0.00 175.76 176.29 1ijg s ALA 96 N 2.03 -2.41 0.00 0.00 0.00 -1.12 -0.02 121.76 120.24 1ijg s ALA 96 Ca 0.65 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.49 1ijg s ALA 96 Cb -0.34 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 20.93 1ijg s ALA 96 CO 0.28 -0.23 0.00 0.45 0.00 0.00 0.00 175.76 176.27 1ijg n SER 97 N 2.50 0.00 0.00 0.00 2.88 -1.06 -4.78 113.62 113.15 1ijg n SER 97 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1ijg n SER 97 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1ijg n SER 97 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ijg n PRO 98 N 0.00 0.00 -0.32 -1.46 -0.04 -1.26 -4.77 135.00 127.15 1ijg n PRO 98 Ca 0.00 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 1ijg n PRO 98 Cb 0.00 0.00 0.28 0.00 -0.04 0.00 0.00 33.50 33.74 1ijg n PRO 98 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1ijg n VAL 99 N 0.00 0.84 -4.42 0.52 0.24 -1.26 -4.84 118.33 109.42 1ijg n VAL 99 Ca 0.00 -0.84 -0.23 0.00 -2.04 0.00 0.00 64.34 61.23 1ijg n VAL 99 Cb 0.00 0.41 -0.16 0.00 -1.47 0.00 0.00 33.84 32.62 1ijg n VAL 99 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1ijg s TYR 100 N -1.17 1.21 -0.10 6.34 5.04 -1.26 -5.11 117.35 122.30 1ijg s TYR 100 Ca 0.42 -0.43 -0.04 0.00 -2.44 0.00 0.00 57.07 54.58 1ijg s TYR 100 Cb 0.22 -0.93 0.05 0.00 0.35 0.00 0.00 41.96 41.65 1ijg s TYR 100 CO 0.28 -0.25 0.20 1.14 -1.34 0.00 0.00 175.55 175.58 1ijg s GLN 101 N 0.78 0.09 0.07 4.97 1.03 -1.26 -2.57 119.66 122.78 1ijg s GLN 101 Ca -0.13 0.59 -0.26 0.00 0.04 0.00 0.00 55.36 55.60 1ijg s GLN 101 Cb -0.15 -0.17 0.09 0.00 0.03 0.00 0.00 33.01 32.80 1ijg s GLN 101 CO 0.02 -0.27 0.74 0.21 -2.54 0.00 0.00 175.29 173.45 1ijg s LYS 102 N 2.09 1.05 0.05 9.60 2.47 0.97 -4.97 119.74 131.00 1ijg s LYS 102 Ca -0.00 -0.35 0.07 0.00 -1.56 0.00 0.00 55.97 54.13 1ijg s LYS 102 Cb -0.12 0.49 -0.03 0.00 -1.46 0.00 0.00 37.83 36.71 1ijg s LYS 102 CO -0.07 -0.45 -0.18 -1.21 0.16 0.00 0.00 175.35 173.59 1ijg s GLU 103 N -3.29 1.20 -0.02 4.03 2.02 -1.26 -1.71 118.70 119.67 1ijg s GLU 103 Ca 0.02 -0.91 -0.28 0.00 0.02 0.00 0.00 54.97 53.82 1ijg s GLU 103 Cb -0.01 -1.29 0.07 0.00 0.10 0.00 0.00 34.13 32.99 1ijg s GLU 103 CO -0.10 0.32 0.63 -0.59 0.02 0.00 0.00 175.26 175.55 1ijg s PHE 104 N -0.87 -0.59 0.41 1.61 -0.71 -0.99 -5.00 117.98 111.83 1ijg s PHE 104 Ca 0.05 0.93 -0.24 0.00 -1.04 0.00 0.00 56.93 56.63 1ijg s PHE 104 Cb -0.09 0.40 -0.09 0.00 -1.21 0.00 0.00 43.02 42.03 1ijg s PHE 104 CO 0.02 -0.62 1.06 0.15 -1.34 0.00 0.00 175.22 174.49 1ijg s LYS 105 N -1.58 4.12 -0.12 1.99 1.02 -1.25 -1.01 119.74 122.91 1ijg s LYS 105 Ca -0.09 1.54 -0.11 0.00 0.02 0.00 0.00 55.97 57.32 1ijg s LYS 105 Cb -0.01 -2.52 -0.05 0.00 -0.52 0.00 0.00 37.83 34.74 1ijg s LYS 105 CO 0.06 -0.19 0.25 -0.51 -0.92 0.00 0.00 175.35 174.04 1ijg s LEU 106 N -2.69 4.34 0.17 3.17 2.01 0.96 -0.21 118.68 126.43 1ijg s LEU 106 Ca 0.58 0.57 -0.30 0.00 0.01 0.00 0.00 54.13 54.99 1ijg s LEU 106 Cb -0.23 -2.29 -0.07 0.00 0.01 0.00 0.00 46.19 43.61 1ijg s LEU 106 CO 0.28 0.26 1.01 -0.47 1.01 0.00 0.00 176.35 178.44 1ijg s TYR 107 N -0.37 3.77 -0.33 0.29 6.04 0.58 -4.89 117.35 122.44 1ijg s TYR 107 Ca 0.17 1.75 0.03 0.00 0.04 0.00 0.00 57.07 59.06 1ijg s TYR 107 Cb -0.13 -3.12 0.10 0.00 -1.04 0.00 0.00 41.96 37.76 1ijg s TYR 107 CO 0.05 -0.04 0.06 -0.80 -1.54 0.00 0.00 175.55 173.28 1ijg s ASN 108 N -0.33 4.59 -0.05 4.32 -0.87 -1.26 -4.87 114.94 116.48 1ijg s ASN 108 Ca 0.46 -2.03 -0.03 0.00 -1.57 0.00 0.00 52.86 49.69 1ijg s ASN 108 Cb -0.26 -1.45 0.00 0.00 -0.02 0.00 0.00 41.25 39.52 1ijg s ASN 108 CO 0.32 -0.39 0.06 0.00 -2.57 0.00 0.00 177.10 174.53 1ijg n TYR 109 N 4.39 -0.24 -1.51 2.20 9.36 -1.26 -4.63 117.16 125.48 1ijg n TYR 109 Ca 0.02 0.10 0.14 0.00 3.32 0.00 0.00 57.90 61.49 1ijg n TYR 109 Cb 0.42 -0.17 -0.08 0.00 -0.63 0.00 0.00 39.34 38.88 1ijg n TYR 109 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1ijg n ARG 110 N -0.12 -3.60 -1.63 2.98 0.63 -1.26 -5.05 116.66 108.62 1ijg n ARG 110 Ca -0.01 2.92 0.00 0.00 -0.92 0.00 0.00 57.85 59.84 1ijg n ARG 110 Cb 0.06 -4.04 0.00 0.00 0.45 0.00 0.00 32.46 28.94 1ijg n ARG 110 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1ijg n ASP 111 N -4.05 -8.25 -0.92 6.15 9.92 -1.26 -4.76 116.55 113.37 1ijg n ASP 111 Ca -0.08 1.45 -0.09 0.00 -0.53 0.00 0.00 54.79 55.54 1ijg n ASP 111 Cb 0.66 -4.98 -0.02 0.00 -0.64 0.00 0.00 41.12 36.15 1ijg n ASP 111 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 1ijg n MET 112 N -1.59 -0.71 -2.32 -1.24 1.56 -1.26 -4.82 117.12 106.74 1ijg n MET 112 Ca 0.00 0.62 -0.42 0.00 -0.27 0.00 0.00 57.70 57.63 1ijg n MET 112 Cb 0.19 -4.59 -0.02 0.00 2.15 0.00 0.00 33.22 30.94 1ijg n MET 112 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 1ijg s LYS 113 N -3.74 3.41 0.00 2.12 2.20 -1.26 -4.95 119.74 117.52 1ijg s LYS 113 Ca 0.00 0.79 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 1ijg s LYS 113 Cb 0.00 -4.09 0.00 0.00 -1.51 0.00 0.00 37.83 32.23 1ijg s LYS 113 CO 0.00 -1.79 0.00 0.39 -0.36 0.00 0.00 175.35 173.59 1ijg n GLU 114 N 8.37 1.14 -3.63 4.03 1.02 -1.26 -5.14 120.64 125.18 1ijg n GLU 114 Ca 0.16 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.10 1ijg n GLU 114 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.88 1ijg n GLU 114 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1ijg s GLU 115 N -1.94 2.83 -1.48 3.49 1.03 -1.26 -4.50 118.70 116.86 1ijg s GLU 115 Ca 0.00 -1.23 -0.06 0.00 0.03 0.00 0.00 54.97 53.71 1ijg s GLU 115 Cb 0.00 -2.59 0.02 0.00 -0.80 0.00 0.00 34.13 30.77 1ijg s GLU 115 CO 0.00 0.03 0.58 -3.47 -1.33 0.00 0.00 175.26 171.07 1ijg n ASP 116 N -1.50 -5.50 -4.92 0.83 -0.08 -1.26 -4.91 116.55 99.20 1ijg n ASP 116 Ca -0.00 -0.31 -0.27 0.00 -1.51 0.00 0.00 54.79 52.70 1ijg n ASP 116 Cb 0.59 -4.46 -0.03 0.00 2.34 0.00 0.00 41.12 39.56 1ijg n ASP 116 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1ijg s MET 117 N -5.79 3.37 0.39 -0.67 -1.94 -1.26 -3.96 119.30 109.44 1ijg s MET 117 Ca 0.33 -0.62 0.04 0.00 -1.71 0.00 0.00 55.69 53.73 1ijg s MET 117 Cb -0.15 -2.93 -0.03 0.00 2.01 0.00 0.00 34.83 33.72 1ijg s MET 117 CO 0.41 0.53 0.11 0.20 -0.01 0.00 0.00 175.02 176.26 1ijg s GLY 118 N -3.13 2.50 0.03 -0.03 0.00 0.70 -4.55 107.32 102.85 1ijg s GLY 118 Ca 0.34 -1.37 0.06 0.00 0.00 0.00 0.00 44.72 43.75 1ijg s GLY 118 CO 0.28 -1.83 -0.17 0.14 0.00 0.00 0.00 173.10 171.52 1ijg s VAL 119 N -3.23 1.32 -0.18 1.40 1.01 -0.43 -0.31 120.40 119.98 1ijg s VAL 119 Ca 0.26 -0.98 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 1ijg s VAL 119 Cb 0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1ijg s VAL 119 CO 0.14 0.15 0.07 0.68 0.00 0.00 0.00 175.10 176.14 1ijg s VAL 120 N -0.72 4.85 -0.40 2.92 -7.23 -1.26 -0.30 120.40 118.27 1ijg s VAL 120 Ca 0.05 -0.01 -0.12 0.00 -1.81 0.00 0.00 61.98 60.08 1ijg s VAL 120 Cb -0.08 -3.18 0.03 0.00 0.56 0.00 0.00 36.38 33.72 1ijg s VAL 120 CO 0.01 0.47 0.25 -0.63 -0.31 0.00 0.00 175.10 174.90 1ijg s ILE 121 N 0.23 4.77 0.41 -0.62 1.01 -0.37 -4.80 121.20 121.83 1ijg s ILE 121 Ca 0.04 -0.88 -0.14 0.00 0.00 0.00 0.00 60.65 59.68 1ijg s ILE 121 Cb -0.12 -3.71 -0.08 0.00 0.01 0.00 0.00 42.46 38.57 1ijg s ILE 121 CO 0.00 -0.31 0.81 -0.31 0.00 0.00 0.00 174.94 175.13 1ijg s TYR 122 N 1.58 3.43 0.06 3.97 1.51 -1.26 -1.93 117.35 124.71 1ijg s TYR 122 Ca 0.03 1.21 0.16 0.00 -1.01 0.00 0.00 57.07 57.46 1ijg s TYR 122 Cb -0.20 -2.56 0.38 0.00 -0.11 0.00 0.00 41.96 39.47 1ijg s TYR 122 CO 0.07 -0.10 1.59 -0.97 -1.11 0.00 0.00 175.55 175.03 1ijg h ASN 123 N 1.51 0.00 -5.28 2.29 -1.24 -0.67 -3.35 115.58 108.84 1ijg h ASN 123 Ca -0.47 0.00 0.30 0.00 0.71 0.00 0.00 56.30 56.84 1ijg h ASN 123 Cb 1.18 0.00 -0.14 0.00 0.73 0.00 0.00 38.32 40.09 1ijg h ASN 123 CO 0.64 0.49 0.81 0.54 -1.29 0.00 0.00 177.43 178.62 1ijg s ASN 124 N -6.49 -0.09 0.00 1.15 2.20 -1.26 -4.29 114.94 106.16 1ijg s ASN 124 Ca 0.01 -0.10 0.00 0.00 -0.94 0.00 0.00 52.86 51.83 1ijg s ASN 124 Cb 0.10 0.16 0.00 0.00 -2.00 0.00 0.00 41.25 39.51 1ijg s ASN 124 CO 0.72 -0.29 0.49 0.47 -2.94 0.00 0.00 177.10 175.55 1ijg n ASP 125 N -0.36 0.00 -0.09 3.54 9.92 -1.26 -0.17 116.55 128.12 1ijg n ASP 125 Ca -0.06 0.07 0.01 0.00 -0.53 0.00 0.00 54.79 54.29 1ijg n ASP 125 Cb 0.61 -0.07 0.01 0.00 -0.64 0.00 0.00 41.12 41.03 1ijg n ASP 125 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 1ijg n MET 126 N -0.99 -0.32 -2.68 -1.24 1.56 -1.26 -5.00 117.12 107.20 1ijg n MET 126 Ca 0.00 -0.61 -0.21 0.00 -0.27 0.00 0.00 57.70 56.62 1ijg n MET 126 Cb 0.02 -1.02 0.01 0.00 2.15 0.00 0.00 33.22 34.38 1ijg n MET 126 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1ijg n ALA 127 N 0.07 -0.79 -2.65 -5.12 0.00 0.76 -4.97 120.51 107.81 1ijg n ALA 127 Ca 0.01 0.20 -0.40 0.00 0.00 0.00 0.00 53.44 53.26 1ijg n ALA 127 Cb 0.06 -2.77 -0.05 0.00 0.00 0.00 0.00 19.45 16.68 1ijg n ALA 127 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ijg s PHE 128 N -3.04 3.61 0.53 0.00 5.99 -1.26 -4.47 117.98 119.34 1ijg s PHE 128 Ca 0.13 1.27 -0.19 0.00 0.00 0.00 0.00 56.93 58.14 1ijg s PHE 128 Cb -0.06 -2.78 -0.06 0.00 0.00 0.00 0.00 43.02 40.11 1ijg s PHE 128 CO 0.16 0.14 1.06 -2.14 -0.00 0.00 0.00 175.22 174.44 1ijg s PRO 129 N 0.59 3.54 0.03 10.12 0.02 -1.26 -4.56 135.00 143.49 1ijg s PRO 129 Ca 0.37 1.36 -0.18 0.00 0.02 0.00 0.00 61.00 62.57 1ijg s PRO 129 Cb -0.18 -2.06 -0.21 0.00 0.02 0.00 0.00 34.50 32.08 1ijg s PRO 129 CO 0.19 -0.65 1.17 1.15 -0.33 0.00 0.00 177.00 178.53 1ijg h THR 130 N 1.11 1.39 -0.86 0.99 2.02 -0.73 -3.37 112.91 113.45 1ijg h THR 130 Ca -0.49 -1.97 0.18 0.00 0.77 0.00 0.00 66.41 64.90 1ijg h THR 130 Cb 1.23 2.39 -0.16 0.00 -1.74 0.00 0.00 68.15 69.86 1ijg h THR 130 CO 0.58 0.59 -0.18 0.41 0.37 0.00 0.00 175.52 177.29 1ijg n THR 131 N -4.19 -0.36 -0.32 3.16 -1.04 -1.23 -1.04 114.28 109.26 1ijg n THR 131 Ca -0.09 1.96 0.04 0.00 -2.04 0.00 0.00 64.05 63.92 1ijg n THR 131 Cb 0.66 -2.74 0.19 0.00 -1.82 0.00 0.00 70.33 66.62 1ijg n THR 131 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1ijg h PRO 132 N 0.00 0.84 -0.39 -2.82 0.11 -1.92 -0.81 132.00 127.01 1ijg h PRO 132 Ca 0.43 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.34 1ijg h PRO 132 Cb 0.71 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1ijg h PRO 132 CO -0.88 0.55 -0.37 1.15 -0.21 0.00 0.00 178.00 178.25 1ijg h THR 133 N 0.86 1.27 -0.83 -1.15 2.02 -1.34 -2.42 112.91 111.33 1ijg h THR 133 Ca 0.43 -1.55 0.02 0.00 0.77 0.00 0.00 66.41 66.09 1ijg h THR 133 Cb 0.41 1.38 -0.04 0.00 -1.74 0.00 0.00 68.15 68.16 1ijg h THR 133 CO -0.26 0.52 0.55 -0.07 0.37 0.00 0.00 175.52 176.63 1ijg h LEU 134 N 0.75 0.92 -0.76 2.58 3.38 -1.03 -1.30 115.31 119.86 1ijg h LEU 134 Ca 0.06 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1ijg h LEU 134 Cb 0.97 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1ijg h LEU 134 CO 0.09 0.65 -0.55 -0.33 0.09 0.00 0.00 178.44 178.40 1ijg h GLU 135 N 1.08 0.21 0.06 1.13 5.08 -1.05 -0.62 114.58 120.48 1ijg h GLU 135 Ca 0.32 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1ijg h GLU 135 Cb -0.05 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1ijg h GLU 135 CO -0.08 0.70 -0.03 1.25 -1.00 0.00 0.00 179.01 179.85 1ijg h LEU 136 N 0.16 -0.07 -0.67 1.33 5.85 -0.76 -1.92 115.31 119.23 1ijg h LEU 136 Ca 0.00 -0.16 -0.13 0.00 0.84 0.00 0.00 57.88 58.43 1ijg h LEU 136 Cb 1.01 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1ijg h LEU 136 CO 0.08 0.11 -0.41 -0.26 -0.34 0.00 0.00 178.44 177.62 1ijg h PHE 137 N -0.26 0.67 -0.93 1.25 -1.00 -1.31 -2.87 116.94 112.49 1ijg h PHE 137 Ca -0.01 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.56 1ijg h PHE 137 Cb 0.23 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 39.60 1ijg h PHE 137 CO -0.02 0.88 0.54 0.00 -1.61 0.00 0.00 178.31 178.11 1ijg h ALA 138 N 1.09 1.19 -0.66 2.45 0.00 -1.03 -0.42 119.26 121.88 1ijg h ALA 138 Ca 0.04 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1ijg h ALA 138 Cb 0.91 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1ijg h ALA 138 CO 0.08 0.67 0.24 0.00 0.00 0.00 0.00 179.25 180.24 1ijg h ALA 139 N 1.30 0.86 -0.28 0.00 0.00 -1.23 -1.31 119.26 118.60 1ijg h ALA 139 Ca 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1ijg h ALA 139 Cb -0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ijg h ALA 139 CO -0.06 0.50 0.11 1.49 0.00 0.00 0.00 179.25 181.29 1ijg h GLU 140 N 0.94 0.42 -0.95 0.00 4.57 -1.17 0.21 114.58 118.61 1ijg h GLU 140 Ca 0.22 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 1ijg h GLU 140 Cb 0.24 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 28.72 1ijg h GLU 140 CO -0.01 0.46 0.60 -0.07 -1.18 0.00 0.00 179.01 178.80 1ijg h LEU 141 N 0.30 1.11 -0.63 1.64 3.38 -0.91 -0.97 115.31 119.24 1ijg h LEU 141 Ca 0.09 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1ijg h LEU 141 Cb 0.19 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1ijg h LEU 141 CO -0.01 0.83 -0.38 0.00 0.09 0.00 0.00 178.44 178.97 1ijg h ALA 142 N 1.33 0.81 -0.53 1.53 0.00 -0.94 -1.17 119.26 120.29 1ijg h ALA 142 Ca 0.34 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1ijg h ALA 142 Cb -0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ijg h ALA 142 CO -0.07 0.65 0.15 1.49 0.00 0.00 0.00 179.25 181.47 1ijg h GLU 143 N 0.53 0.83 -0.64 0.00 4.81 -0.35 -1.63 114.58 118.14 1ijg h GLU 143 Ca 0.05 -0.19 -0.06 0.00 -0.13 0.00 0.00 59.36 59.03 1ijg h GLU 143 Cb 0.90 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.14 1ijg h GLU 143 CO 0.08 0.78 0.15 -0.07 -0.73 0.00 0.00 179.01 179.22 1ijg h LEU 144 N 0.73 0.97 -1.22 1.64 3.38 -1.04 -1.59 115.31 118.18 1ijg h LEU 144 Ca 0.17 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1ijg h LEU 144 Cb 0.30 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1ijg h LEU 144 CO -0.00 0.95 0.53 0.50 0.09 0.00 0.00 178.44 180.52 1ijg h LYS 145 N 0.94 1.00 -0.27 1.13 1.63 -0.91 -0.18 116.57 119.91 1ijg h LYS 145 Ca 0.20 -0.06 -0.13 0.00 -0.85 0.00 0.00 60.65 59.81 1ijg h LYS 145 Cb 0.37 -0.23 -0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1ijg h LYS 145 CO 0.00 0.66 -0.32 1.49 -3.45 0.00 0.00 179.45 177.83 1ijg h GLU 146 N 1.03 0.70 -0.73 1.90 4.81 -0.86 -1.53 114.58 119.90 1ijg h GLU 146 Ca 0.31 -0.39 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 1ijg h GLU 146 Cb -0.01 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 1ijg h GLU 146 CO -0.09 1.01 0.24 0.82 -0.73 0.00 0.00 179.01 180.27 1ijg h ILE 147 N 0.44 1.26 -0.81 2.32 2.04 -0.72 -1.19 117.51 120.84 1ijg h ILE 147 Ca 0.04 -0.88 0.03 0.00 1.00 0.00 0.00 64.86 65.05 1ijg h ILE 147 Cb 0.90 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 1ijg h ILE 147 CO 0.08 0.35 0.52 0.40 0.00 0.00 0.00 178.15 179.50 1ijg h ILE 148 N 1.08 1.14 -0.10 -0.67 2.04 -0.96 -0.83 117.51 119.20 1ijg h ILE 148 Ca 0.24 -0.35 0.03 0.00 1.00 0.00 0.00 64.86 65.77 1ijg h ILE 148 Cb 0.29 0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 1ijg h ILE 148 CO -0.01 0.19 -0.06 0.28 0.00 0.00 0.00 178.15 178.55 1ijg h SER 149 N 1.03 -0.20 -0.77 1.72 0.02 -0.42 0.13 113.55 115.06 1ijg h SER 149 Ca 0.32 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1ijg h SER 149 Cb -0.02 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 1ijg h SER 149 CO -0.10 -0.09 0.49 0.58 -1.14 0.00 0.00 176.83 176.57 1ijg h VAL 150 N -0.06 1.21 -0.27 2.27 2.07 -0.75 -1.63 116.25 119.08 1ijg h VAL 150 Ca 0.06 -0.41 -0.13 0.00 0.82 0.00 0.00 66.70 67.04 1ijg h VAL 150 Cb 0.15 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1ijg h VAL 150 CO -0.14 0.21 -0.32 -1.13 0.02 0.00 0.00 177.57 176.21 1ijg h ASN 151 N 1.05 0.75 -0.69 0.57 -0.00 -0.79 -1.71 115.58 114.77 1ijg h ASN 151 Ca 0.28 -0.49 -0.07 0.00 -0.00 0.00 0.00 56.30 56.02 1ijg h ASN 151 Cb -0.09 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 37.99 1ijg h ASN 151 CO -0.06 1.09 0.16 0.06 -0.00 0.00 0.00 177.43 178.68 1ijg h GLN 152 N 0.43 1.12 -0.01 6.67 3.07 -0.62 -2.49 115.11 123.29 1ijg h GLN 152 Ca 0.04 -0.27 -0.09 0.00 0.09 0.00 0.00 58.65 58.41 1ijg h GLN 152 Cb 0.90 -0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.30 1ijg h GLN 152 CO 0.08 0.99 -0.43 -0.91 0.09 0.00 0.00 178.83 178.65 1ijg h ASN 153 N 1.06 0.01 0.21 0.06 2.35 -1.26 -2.50 115.58 115.52 1ijg h ASN 153 Ca 0.22 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1ijg h ASN 153 Cb 0.39 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.75 1ijg h ASN 153 CO 0.00 0.44 -0.01 0.00 -1.65 0.00 0.00 177.43 176.22 1ijg h ALA 154 N 1.56 1.06 0.00 -0.83 0.00 -0.83 -1.39 119.26 118.82 1ijg h ALA 154 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ijg h ALA 154 Cb 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ijg h ALA 154 CO 0.06 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.36 1ijg n GLN 155 N -3.18 0.08 0.14 0.00 1.13 -0.94 -2.46 117.38 112.15 1ijg n GLN 155 Ca -0.02 0.38 0.13 0.00 -1.94 0.00 0.00 57.00 55.55 1ijg n GLN 155 Cb 0.13 -1.67 0.38 0.00 0.11 0.00 0.00 30.24 29.19 1ijg n GLN 155 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1ijg h LYS 156 N 0.00 0.00 -2.08 -1.09 1.57 -1.43 -3.39 116.57 110.15 1ijg h LYS 156 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1ijg h LYS 156 Cb 0.23 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.14 1ijg h LYS 156 CO 0.00 0.00 -0.93 0.25 -0.57 0.00 0.00 179.45 178.20 1ijg n THR 157 N -2.46 0.57 0.35 -0.16 -2.24 -1.03 -4.90 114.28 104.41 1ijg n THR 157 Ca 0.05 -4.56 0.12 0.00 -2.27 0.00 0.00 64.05 57.38 1ijg n THR 157 Cb 0.42 -1.75 0.20 0.00 -2.10 0.00 0.00 70.33 67.10 1ijg n THR 157 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1ijg h PRO 158 N 3.85 0.00 -5.86 -0.78 0.13 -1.77 -3.40 132.00 124.17 1ijg h PRO 158 Ca 0.12 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.72 1ijg h PRO 158 Cb 0.80 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.68 1ijg h PRO 158 CO 0.61 0.00 -0.82 0.08 -0.23 0.00 0.00 178.00 177.63 1ijg s VAL 159 N -3.20 1.50 -0.04 1.56 1.01 -1.26 -0.38 120.40 119.59 1ijg s VAL 159 Ca 0.07 -1.22 -0.01 0.00 0.00 0.00 0.00 61.98 60.82 1ijg s VAL 159 Cb 0.09 -1.33 0.03 0.00 0.00 0.00 0.00 36.38 35.16 1ijg s VAL 159 CO 0.68 0.08 0.04 -0.22 0.00 0.00 0.00 175.10 175.67 1ijg s LEU 160 N -1.34 0.64 -0.16 3.92 1.98 -0.61 -4.90 118.68 118.20 1ijg s LEU 160 Ca 0.05 0.04 -0.01 0.00 -2.89 0.00 0.00 54.13 51.32 1ijg s LEU 160 Cb -0.09 -0.16 -0.01 0.00 0.66 0.00 0.00 46.19 46.60 1ijg s LEU 160 CO 0.02 -0.18 -0.13 -0.63 -1.89 0.00 0.00 176.35 173.54 1ijg s ILE 161 N 1.63 2.89 -0.24 6.68 1.01 -1.26 -0.28 121.20 131.63 1ijg s ILE 161 Ca -0.02 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.80 1ijg s ILE 161 Cb -0.13 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 1ijg s ILE 161 CO -0.03 0.50 0.33 -0.60 0.00 0.00 0.00 174.94 175.14 1ijg s ARG 162 N 0.81 4.08 -0.27 2.79 3.00 -0.06 -4.97 118.95 124.32 1ijg s ARG 162 Ca -0.04 0.02 -0.00 0.00 -1.00 0.00 0.00 55.73 54.70 1ijg s ARG 162 Cb -0.15 -3.59 0.08 0.00 0.00 0.00 0.00 34.95 31.29 1ijg s ARG 162 CO 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 175.30 175.22 1ijg s ALA 163 N 1.59 1.67 -0.09 6.12 0.00 -1.26 -2.20 121.76 127.59 1ijg s ALA 163 Ca 0.14 -1.48 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 1ijg s ALA 163 Cb -0.15 -1.52 -0.28 0.00 0.00 0.00 0.00 23.12 21.17 1ijg s ALA 163 CO 0.08 -1.45 0.59 -2.95 0.00 0.00 0.00 175.76 172.03 1ijg h ASN 164 N 8.04 0.43 -2.56 0.00 -1.07 -1.75 -3.41 115.58 115.25 1ijg h ASN 164 Ca -0.14 -0.87 -0.54 0.00 0.07 0.00 0.00 56.30 54.82 1ijg h ASN 164 Cb 1.05 -0.14 -0.07 0.00 -2.07 0.00 0.00 38.32 37.09 1ijg h ASN 164 CO 0.43 1.64 1.09 -1.81 0.07 0.00 0.00 177.43 178.86 1ijg s ASP 165 N -7.08 6.10 0.00 6.14 1.11 -1.26 -4.55 116.67 117.13 1ijg s ASP 165 Ca -0.19 -0.10 0.00 0.00 0.18 0.00 0.00 52.55 52.44 1ijg s ASP 165 Cb 0.04 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.48 1ijg s ASP 165 CO 0.78 -1.81 0.00 -3.20 1.18 0.00 0.00 175.17 172.12 1ijg n ASN 166 N 9.66 1.46 -0.33 0.27 2.85 -1.26 -4.76 115.26 123.16 1ijg n ASN 166 Ca 0.08 -0.03 0.17 0.00 -0.11 0.00 0.00 54.58 54.69 1ijg n ASN 166 Cb 0.49 0.35 0.40 0.00 1.24 0.00 0.00 39.78 42.26 1ijg n ASN 166 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1ijg h ASN 167 N 0.00 0.64 0.00 1.20 7.08 -1.97 -3.30 115.58 119.22 1ijg h ASN 167 Ca 0.00 0.09 0.00 0.00 -3.08 0.00 0.00 56.30 53.31 1ijg h ASN 167 Cb 0.00 -0.02 0.00 0.00 -2.08 0.00 0.00 38.32 36.22 1ijg h ASN 167 CO 0.00 0.20 0.00 0.00 -2.08 0.00 0.00 177.43 175.55 1ijg n GLN 168 N -4.71 0.00 -3.87 4.14 1.13 -1.26 -4.95 117.38 107.86 1ijg n GLN 168 Ca 0.23 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.93 1ijg n GLN 168 Cb 0.68 -0.20 -0.06 0.00 0.11 0.00 0.00 30.24 30.78 1ijg n GLN 168 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1ijg s LEU 169 N -0.45 4.39 -0.26 1.08 1.98 -1.24 -5.08 118.68 119.09 1ijg s LEU 169 Ca 0.00 0.46 -0.16 0.00 -2.89 0.00 0.00 54.13 51.54 1ijg s LEU 169 Cb 0.00 -2.23 -0.04 0.00 0.66 0.00 0.00 46.19 44.59 1ijg s LEU 169 CO 0.00 0.37 0.40 -0.55 -1.89 0.00 0.00 176.35 174.68 1ijg s SER 170 N -1.26 6.31 0.19 3.68 0.15 -1.26 -4.39 113.70 117.12 1ijg s SER 170 Ca 0.18 0.36 -0.11 0.00 0.70 0.00 0.00 55.95 57.09 1ijg s SER 170 Cb -0.12 -2.23 0.11 0.00 -1.71 0.00 0.00 66.02 62.08 1ijg s SER 170 CO 0.08 -0.19 1.79 0.25 1.20 0.00 0.00 173.24 176.38 1ijg h LEU 171 N 8.49 0.87 -1.36 3.45 6.46 -1.91 -1.76 115.31 129.54 1ijg h LEU 171 Ca -0.32 -0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.32 1ijg h LEU 171 Cb 1.16 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.84 1ijg h LEU 171 CO 0.67 0.74 0.29 0.50 -0.62 0.00 0.00 178.44 180.02 1ijg h LYS 172 N 0.93 0.73 -0.42 1.25 1.63 -2.00 -1.99 116.57 116.71 1ijg h LYS 172 Ca 0.24 -0.07 -0.12 0.00 -0.85 0.00 0.00 60.65 59.84 1ijg h LYS 172 Cb 0.08 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.55 1ijg h LYS 172 CO -0.03 0.54 -0.21 0.37 -3.45 0.00 0.00 179.45 176.66 1ijg h GLN 173 N 0.74 0.89 -0.80 1.90 4.15 -1.83 -1.25 115.11 118.90 1ijg h GLN 173 Ca 0.19 -0.39 0.09 0.00 0.77 0.00 0.00 58.65 59.30 1ijg h GLN 173 Cb 0.02 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.62 1ijg h GLN 173 CO -0.03 1.04 0.46 0.28 -1.93 0.00 0.00 178.83 178.65 1ijg h VAL 174 N 0.71 0.93 -0.32 2.39 2.07 -0.63 0.63 116.25 122.03 1ijg h VAL 174 Ca 0.09 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 1ijg h VAL 174 Cb 0.78 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1ijg h VAL 174 CO 0.06 0.14 -0.15 1.88 0.02 0.00 0.00 177.57 179.53 1ijg h TYR 175 N 0.79 0.76 -0.60 1.57 -1.99 -1.18 -0.78 116.97 115.55 1ijg h TYR 175 Ca 0.38 -0.19 -0.00 0.00 2.00 0.00 0.00 58.73 60.92 1ijg h TYR 175 Cb 0.31 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.84 1ijg h TYR 175 CO -0.06 0.88 0.37 -0.91 -0.00 0.00 0.00 178.16 178.43 1ijg h ASN 176 N 0.43 0.71 0.58 3.88 2.35 -0.44 -1.57 115.58 121.52 1ijg h ASN 176 Ca 0.07 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1ijg h ASN 176 Cb 0.67 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1ijg h ASN 176 CO 0.05 0.54 -0.26 1.67 -1.65 0.00 0.00 177.43 177.78 1ijg n GLN 177 N -4.42 0.23 -1.67 0.81 0.00 0.14 -4.93 117.38 107.55 1ijg n GLN 177 Ca 0.06 -0.10 -0.56 0.00 -0.00 0.00 0.00 57.00 56.40 1ijg n GLN 177 Cb 0.07 -1.50 -0.07 0.00 0.00 0.00 0.00 30.24 28.74 1ijg n GLN 177 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.06 178.04 1ijg n TYR 178 N -1.30 1.80 0.61 3.69 9.36 -0.31 -4.88 117.16 126.13 1ijg n TYR 178 Ca 0.08 0.63 0.12 0.00 3.32 0.00 0.00 57.90 62.05 1ijg n TYR 178 Cb 0.32 -2.39 0.08 0.00 -0.63 0.00 0.00 39.34 36.73 1ijg n TYR 178 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1ijg n GLU 179 N 4.21 0.26 -1.35 2.98 1.02 -1.26 -4.98 120.64 121.52 1ijg n GLU 179 Ca 0.24 0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.30 1ijg n GLU 179 Cb 0.14 -1.61 -0.04 0.00 -0.02 0.00 0.00 31.44 29.90 1ijg n GLU 179 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ijg n GLY 180 N 1.37 1.13 0.84 0.62 0.00 -1.26 -4.88 105.19 103.01 1ijg n GLY 180 Ca 0.03 -0.55 0.07 0.00 0.00 0.00 0.00 46.02 45.57 1ijg n GLY 180 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ijg n ASN 181 N 0.29 3.21 -3.64 1.61 0.23 -1.26 -5.01 115.26 110.69 1ijg n ASN 181 Ca -0.11 -2.00 -0.01 0.00 -0.53 0.00 0.00 54.58 51.94 1ijg n ASN 181 Cb 0.36 -0.30 -0.01 0.00 -2.08 0.00 0.00 39.78 37.74 1ijg n ASN 181 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ijg s ALA 182 N -1.00 -2.06 0.64 -2.53 0.00 -1.26 -5.15 121.76 110.41 1ijg s ALA 182 Ca 0.30 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 52.83 1ijg s ALA 182 Cb 0.16 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 1ijg s ALA 182 CO 0.21 -0.95 1.02 -2.30 0.00 0.00 0.00 175.76 173.74 1ijg n PRO 183 N -0.40 0.83 -1.93 0.00 -0.02 -1.26 -4.85 135.00 127.36 1ijg n PRO 183 Ca -0.07 0.33 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 1ijg n PRO 183 Cb 0.62 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1ijg n PRO 183 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ijg s VAL 184 N -1.56 2.61 -0.15 -1.45 1.01 -1.26 -4.98 120.40 114.62 1ijg s VAL 184 Ca 0.77 0.44 0.02 0.00 0.00 0.00 0.00 61.98 63.21 1ijg s VAL 184 Cb -0.39 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.72 1ijg s VAL 184 CO 0.46 0.04 -0.21 -0.63 0.00 0.00 0.00 175.10 174.76 1ijg s ILE 185 N 1.04 2.12 -0.54 2.22 1.01 -1.26 -5.06 121.20 120.72 1ijg s ILE 185 Ca 0.69 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 1ijg s ILE 185 Cb -0.44 -1.85 0.14 0.00 0.01 0.00 0.00 42.46 40.32 1ijg s ILE 185 CO 0.32 0.55 0.34 0.12 0.00 0.00 0.00 174.94 176.27 1ijg s PHE 186 N 0.86 3.48 -0.05 3.97 5.36 -1.26 -5.02 117.98 125.31 1ijg s PHE 186 Ca -0.06 -2.58 0.06 0.00 -0.96 0.00 0.00 56.93 53.38 1ijg s PHE 186 Cb -0.15 -3.21 -0.01 0.00 -0.34 0.00 0.00 43.02 39.30 1ijg s PHE 186 CO -0.03 -0.90 -0.23 0.00 -1.46 0.00 0.00 175.22 172.61 1ijg s ALA 187 N 0.44 2.00 -0.29 11.12 0.00 -1.26 -5.10 121.76 128.66 1ijg s ALA 187 Ca 0.13 -0.96 -0.22 0.00 0.00 0.00 0.00 51.96 50.91 1ijg s ALA 187 Cb -0.21 -0.62 0.15 0.00 0.00 0.00 0.00 23.12 22.44 1ijg s ALA 187 CO -0.04 0.39 1.14 -1.58 0.00 0.00 0.00 175.76 175.67 1ijg s HIS 188 N -0.14 -0.36 0.56 0.00 5.04 -1.26 -5.01 115.29 114.11 1ijg s HIS 188 Ca -0.03 0.83 0.39 0.00 -1.54 0.00 0.00 55.06 54.72 1ijg s HIS 188 Cb -0.13 0.36 2.13 0.00 0.04 0.00 0.00 32.58 34.99 1ijg s HIS 188 CO 0.03 -0.18 2.20 1.05 -2.34 0.00 0.00 174.74 175.50 1ijg h GLU 189 N 4.41 0.00 -0.51 2.88 4.11 -2.04 -2.55 114.58 120.87 1ijg h GLU 189 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 1ijg h GLU 189 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1ijg h GLU 189 CO 0.15 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.23 1ijg n ALA 190 N -2.00 2.42 -2.59 1.06 0.00 -1.26 -4.92 120.51 113.22 1ijg n ALA 190 Ca -0.03 -0.96 -0.43 0.00 0.00 0.00 0.00 53.44 52.02 1ijg n ALA 190 Cb 0.12 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 1ijg n ALA 190 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ijg s LEU 191 N -1.12 3.71 0.00 0.00 1.43 -0.96 -5.03 118.68 116.71 1ijg s LEU 191 Ca 0.38 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 1ijg s LEU 191 Cb 0.20 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1ijg s LEU 191 CO 0.27 -1.17 0.00 0.47 0.23 0.00 0.00 176.35 176.15 1ijg n ASP 192 N 7.64 -0.78 0.01 2.29 8.00 -1.26 -4.92 116.55 127.54 1ijg n ASP 192 Ca 0.12 -0.35 0.11 0.00 0.71 0.00 0.00 54.79 55.38 1ijg n ASP 192 Cb 0.48 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.72 1ijg n ASP 192 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1ijg n SER 193 N -2.23 0.64 -0.90 -2.24 3.41 -1.26 -3.67 113.62 107.36 1ijg n SER 193 Ca 0.00 -0.41 0.11 0.00 -0.26 0.00 0.00 58.87 58.31 1ijg n SER 193 Cb 0.00 0.48 0.12 0.00 -0.26 0.00 0.00 64.21 64.55 1ijg n SER 193 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ijg n ASP 194 N -1.57 2.92 -0.21 4.04 -0.08 -1.26 -4.50 116.55 115.88 1ijg n ASP 194 Ca 0.05 -1.90 0.01 0.00 -1.51 0.00 0.00 54.79 51.43 1ijg n ASP 194 Cb 0.35 -0.07 0.12 0.00 2.34 0.00 0.00 41.12 43.86 1ijg n ASP 194 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1ijg h SER 195 N 4.12 0.22 -4.36 1.67 0.02 -1.91 -3.43 113.55 109.87 1ijg h SER 195 Ca 0.00 0.09 -0.66 0.00 -0.84 0.00 0.00 61.79 60.38 1ijg h SER 195 Cb 0.89 0.07 -0.27 0.00 0.14 0.00 0.00 62.40 63.23 1ijg h SER 195 CO 0.00 0.12 -0.87 -0.63 -1.14 0.00 0.00 176.83 174.31 1ijg s ILE 196 N -6.08 1.96 -0.17 3.27 -1.09 -1.26 -2.46 121.20 115.37 1ijg s ILE 196 Ca -0.13 -1.25 -0.07 0.00 -2.23 0.00 0.00 60.65 56.97 1ijg s ILE 196 Cb 0.18 -1.67 0.07 0.00 -1.58 0.00 0.00 42.46 39.45 1ijg s ILE 196 CO 0.75 0.37 0.37 -0.70 -1.23 0.00 0.00 174.94 174.50 1ijg s GLU 197 N -1.05 0.32 -0.12 2.79 2.12 -0.94 -5.00 118.70 116.82 1ijg s GLU 197 Ca 0.10 0.83 -0.04 0.00 0.36 0.00 0.00 54.97 56.22 1ijg s GLU 197 Cb -0.09 0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.33 1ijg s GLU 197 CO 0.01 -0.20 0.04 0.08 -0.54 0.00 0.00 175.26 174.64 1ijg s VAL 198 N 1.89 4.59 0.05 3.70 1.01 -1.26 -0.88 120.40 129.50 1ijg s VAL 198 Ca -0.06 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.87 1ijg s VAL 198 Cb -0.10 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1ijg s VAL 198 CO -0.12 0.57 -0.23 -0.36 0.00 0.00 0.00 175.10 174.97 1ijg s PHE 199 N -0.58 1.99 -0.26 5.22 0.40 0.62 -5.00 117.98 120.37 1ijg s PHE 199 Ca 0.10 -0.39 -0.12 0.00 -0.60 0.00 0.00 56.93 55.92 1ijg s PHE 199 Cb -0.12 -1.18 -0.05 0.00 0.51 0.00 0.00 43.02 42.18 1ijg s PHE 199 CO 0.02 0.11 0.25 0.15 0.70 0.00 0.00 175.22 176.45 1ijg s LYS 200 N -1.23 4.03 -0.24 0.44 1.02 -1.26 -1.58 119.74 120.92 1ijg s LYS 200 Ca 0.09 -0.16 0.11 0.00 0.02 0.00 0.00 55.97 56.03 1ijg s LYS 200 Cb -0.09 -3.61 0.45 0.00 -0.52 0.00 0.00 37.83 34.06 1ijg s LYS 200 CO 0.02 -0.11 1.20 0.25 -0.92 0.00 0.00 175.35 175.79 1ijg n THR 201 N 4.74 2.15 -2.61 2.17 -2.24 0.49 -4.98 114.28 114.00 1ijg n THR 201 Ca -0.12 -3.53 -0.40 0.00 -2.27 0.00 0.00 64.05 57.72 1ijg n THR 201 Cb 0.52 -0.47 -0.05 0.00 -2.10 0.00 0.00 70.33 68.23 1ijg n THR 201 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1ijg s ASP 202 N -3.37 7.45 -0.25 3.42 3.84 -1.18 -4.49 116.67 122.09 1ijg s ASP 202 Ca 0.43 2.12 -0.10 0.00 -0.00 0.00 0.00 52.55 54.99 1ijg s ASP 202 Cb 0.39 -2.62 -0.05 0.00 -1.38 0.00 0.00 42.92 39.26 1ijg s ASP 202 CO -0.02 0.00 0.16 0.00 -0.00 0.00 0.00 175.17 175.31 1ijg s ALA 203 N -1.16 3.54 0.13 2.11 0.00 -1.26 -5.04 121.76 120.08 1ijg s ALA 203 Ca 0.43 -0.98 -0.35 0.00 0.00 0.00 0.00 51.96 51.06 1ijg s ALA 203 Cb -0.29 -2.36 -0.16 0.00 0.00 0.00 0.00 23.12 20.31 1ijg s ALA 203 CO 0.37 -0.34 1.19 -0.35 0.00 0.00 0.00 175.76 176.62 1ijg n PRO 204 N 4.62 1.00 -2.44 0.00 -0.04 -1.26 -4.83 135.00 132.04 1ijg n PRO 204 Ca -0.15 0.36 -0.43 0.00 -0.04 0.00 0.00 63.50 63.24 1ijg n PRO 204 Cb 0.52 -1.89 -0.02 0.00 -0.04 0.00 0.00 33.50 32.07 1ijg n PRO 204 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1ijg s TYR 205 N 0.02 2.68 -0.02 0.54 5.04 -1.26 -4.82 117.35 119.54 1ijg s TYR 205 Ca 0.78 0.85 0.03 0.00 -2.44 0.00 0.00 57.07 56.29 1ijg s TYR 205 Cb -0.93 -4.00 0.05 0.00 0.35 0.00 0.00 41.96 37.42 1ijg s TYR 205 CO 0.51 -1.64 0.85 1.33 -1.34 0.00 0.00 175.55 175.26 1ijg n VAL 206 N 6.38 0.57 -0.14 3.14 0.24 -1.26 -4.84 118.33 122.42 1ijg n VAL 206 Ca 0.15 -0.63 -0.04 0.00 -2.04 0.00 0.00 64.34 61.77 1ijg n VAL 206 Cb 0.47 0.55 0.04 0.00 -1.47 0.00 0.00 33.84 33.43 1ijg n VAL 206 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1ijg h VAL 207 N 2.69 0.85 -0.90 3.34 2.07 -1.93 -0.16 116.25 122.22 1ijg h VAL 207 Ca 0.00 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1ijg h VAL 207 Cb 0.97 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 1ijg h VAL 207 CO 0.00 0.06 0.58 -2.24 0.02 0.00 0.00 177.57 175.99 1ijg h ASP 208 N 0.32 0.98 -0.15 0.57 2.03 -1.99 0.56 116.42 118.75 1ijg h ASP 208 Ca 0.21 -0.01 -0.02 0.00 -0.73 0.00 0.00 57.03 56.48 1ijg h ASP 208 Cb 0.21 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 38.48 1ijg h ASP 208 CO -0.22 0.69 0.00 0.11 -1.03 0.00 0.00 179.24 178.79 1ijg h LYS 209 N 1.15 0.26 -0.87 4.15 1.57 -1.76 -1.50 116.57 119.56 1ijg h LYS 209 Ca 0.35 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 59.14 1ijg h LYS 209 Cb -0.04 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.18 1ijg h LYS 209 CO -0.11 0.48 0.52 -0.07 -0.57 0.00 0.00 179.45 179.71 1ijg h LEU 210 N -0.00 0.78 -1.00 2.94 3.38 -0.70 0.59 115.31 121.30 1ijg h LEU 210 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1ijg h LEU 210 Cb 0.37 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1ijg h LEU 210 CO 0.01 0.45 0.47 -1.13 0.09 0.00 0.00 178.44 178.33 1ijg h ASN 211 N 0.89 1.05 -0.60 -0.43 -1.24 -0.64 0.83 115.58 115.43 1ijg h ASN 211 Ca 0.41 -0.08 -0.05 0.00 0.71 0.00 0.00 56.30 57.29 1ijg h ASN 211 Cb 0.33 -0.27 -0.03 0.00 0.73 0.00 0.00 38.32 39.09 1ijg h ASN 211 CO -0.23 0.84 0.21 0.00 -1.29 0.00 0.00 177.43 176.95 1ijg h ALA 212 N 1.34 1.16 -0.40 1.57 0.00 0.11 -1.42 119.26 121.62 1ijg h ALA 212 Ca 0.30 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ijg h ALA 212 Cb 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1ijg h ALA 212 CO -0.05 0.58 0.05 0.37 0.00 0.00 0.00 179.25 180.20 1ijg h GLN 213 N 0.93 0.67 -0.84 0.00 5.75 -0.12 -1.27 115.11 120.24 1ijg h GLN 213 Ca 0.21 -0.19 0.06 0.00 -0.15 0.00 0.00 58.65 58.58 1ijg h GLN 213 Cb 0.26 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 28.68 1ijg h GLN 213 CO -0.01 0.73 0.55 -0.22 -2.65 0.00 0.00 178.83 177.23 1ijg h LYS 214 N 0.51 0.94 -0.27 1.69 3.64 -0.37 0.79 116.57 123.50 1ijg h LYS 214 Ca 0.12 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.34 1ijg h LYS 214 Cb 0.39 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1ijg h LYS 214 CO 0.01 0.62 -0.25 -0.91 -2.27 0.00 0.00 179.45 176.66 1ijg h ASN 215 N 0.97 0.52 -0.27 4.20 2.35 -0.80 0.02 115.58 122.57 1ijg h ASN 215 Ca 0.35 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1ijg h ASN 215 Cb 0.16 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1ijg h ASN 215 CO -0.12 0.76 0.04 0.00 -1.65 0.00 0.00 177.43 176.46 1ijg h ALA 216 N 1.28 0.35 -0.59 -0.83 0.00 0.21 0.50 119.26 120.18 1ijg h ALA 216 Ca 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1ijg h ALA 216 Cb 0.67 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1ijg h ALA 216 CO 0.05 0.04 0.21 0.28 0.00 0.00 0.00 179.25 179.82 1ijg h VAL 217 N 0.25 1.24 -0.84 0.00 2.07 -0.70 -0.35 116.25 117.91 1ijg h VAL 217 Ca 0.08 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 1ijg h VAL 217 Cb 0.33 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1ijg h VAL 217 CO 0.01 0.29 0.49 -0.25 0.02 0.00 0.00 177.57 178.13 1ijg h TRP 218 N 0.82 1.13 -0.12 1.57 2.91 -0.77 -1.56 115.95 119.93 1ijg h TRP 218 Ca 0.19 -0.01 -0.10 0.00 1.13 0.00 0.00 58.89 60.10 1ijg h TRP 218 Cb 0.25 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.52 1ijg h TRP 218 CO 0.01 0.76 -0.37 -0.91 -1.03 0.00 0.00 178.44 176.91 1ijg h ASN 219 N 1.16 0.25 -0.48 2.65 2.35 -0.46 0.23 115.58 121.28 1ijg h ASN 219 Ca 0.30 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.91 1ijg h ASN 219 Cb -0.02 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1ijg h ASN 219 CO -0.05 0.60 0.15 -0.08 -1.65 0.00 0.00 177.43 176.40 1ijg h GLU 220 N 0.21 0.75 -0.08 0.81 4.81 -0.38 0.17 114.58 120.88 1ijg h GLU 220 Ca 0.02 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1ijg h GLU 220 Cb 0.75 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 1ijg h GLU 220 CO 0.06 0.71 0.05 1.98 -0.73 0.00 0.00 179.01 181.08 1ijg h MET 221 N 0.64 0.11 -0.81 1.92 4.05 -0.82 -1.49 114.93 118.52 1ijg h MET 221 Ca 0.15 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.58 1ijg h MET 221 Cb 0.28 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.01 1ijg h MET 221 CO -0.00 0.12 0.53 0.52 0.23 0.00 0.00 176.91 178.31 1ijg h MET 222 N 0.06 1.04 -0.90 0.39 2.86 -0.70 -2.11 114.93 115.58 1ijg h MET 222 Ca 0.03 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1ijg h MET 222 Cb 0.04 -0.24 -0.04 0.00 0.06 0.00 0.00 31.60 31.42 1ijg h MET 222 CO -0.01 0.69 0.52 1.15 1.06 0.00 0.00 176.91 180.32 1ijg h THR 223 N 1.08 1.25 -0.78 2.22 2.02 -0.69 0.75 112.91 118.76 1ijg h THR 223 Ca 0.31 -0.59 0.03 0.00 0.77 0.00 0.00 66.41 66.93 1ijg h THR 223 Cb -0.09 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.30 1ijg h THR 223 CO -0.08 0.27 0.51 0.15 0.37 0.00 0.00 175.52 176.75 1ijg h PHE 224 N 1.24 0.93 -0.01 3.16 3.57 -0.62 -1.15 116.94 124.06 1ijg h PHE 224 Ca 0.32 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.84 1ijg h PHE 224 Cb -0.01 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.42 1ijg h PHE 224 CO 0.01 0.54 -0.03 1.28 -2.23 0.00 0.00 178.31 177.87 1ijg n LEU 225 N -4.45 0.94 -0.27 0.59 4.77 -0.81 -4.60 117.00 113.17 1ijg n LEU 225 Ca 0.10 -0.29 -0.03 0.00 -0.03 0.00 0.00 56.01 55.76 1ijg n LEU 225 Cb 0.11 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1ijg n LEU 225 CO 0.35 0.16 -0.03 0.61 -1.33 0.00 0.00 177.39 177.15 1ijg n GLY 226 N 1.16 0.56 3.90 -0.72 0.00 -0.43 -4.62 105.19 105.03 1ijg n GLY 226 Ca 0.19 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 1ijg n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ijg s ILE 227 N -2.13 5.25 -0.52 -0.61 1.01 0.18 -4.80 121.20 119.57 1ijg s ILE 227 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1ijg s ILE 227 Cb 0.00 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1ijg s ILE 227 CO 0.00 0.08 0.00 1.17 0.00 0.00 0.00 174.94 176.19 1ijg n LYS 228 N 0.19 -0.46 -0.05 2.79 4.81 -1.26 -4.06 118.16 120.11 1ijg n LYS 228 Ca -0.04 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 1ijg n LYS 228 Cb 0.51 -4.17 0.00 0.00 0.02 0.00 0.00 35.03 31.39 1ijg n LYS 228 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ijg n ASP 247 N 0.91 -0.39 0.06 3.14 8.00 -1.26 -5.11 116.55 121.91 1ijg n ASP 247 Ca -0.07 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.32 1ijg n ASP 247 Cb 0.49 -0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 41.52 1ijg n ASP 247 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1ijg h GLU 248 N 0.00 -0.13 -0.41 -1.24 4.81 -2.04 -1.70 114.58 113.87 1ijg h GLU 248 Ca 0.00 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.31 1ijg h GLU 248 Cb 0.00 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 1ijg h GLU 248 CO 0.00 -0.09 0.03 0.37 -0.73 0.00 0.00 179.01 178.59 1ijg h GLN 249 N -0.14 0.14 0.01 1.92 4.15 -2.00 0.65 115.11 119.84 1ijg h GLN 249 Ca 0.02 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.43 1ijg h GLN 249 Cb 0.16 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1ijg h GLN 249 CO -0.05 0.09 -0.00 0.82 -1.93 0.00 0.00 178.83 177.75 1ijg h ILE 250 N 0.14 1.16 -0.62 2.39 5.03 -1.83 -0.98 117.51 122.80 1ijg h ILE 250 Ca 0.20 -0.48 -0.05 0.00 -0.12 0.00 0.00 64.86 64.41 1ijg h ILE 250 Cb 0.27 1.48 -0.03 0.00 -3.03 0.00 0.00 36.82 35.52 1ijg h ILE 250 CO -0.31 0.12 0.18 -0.08 -0.68 0.00 0.00 178.15 177.38 1ijg h GLU 251 N -0.21 0.94 -0.32 2.37 4.57 -0.95 -2.01 114.58 118.98 1ijg h GLU 251 Ca -0.00 -0.19 -0.10 0.00 -1.18 0.00 0.00 59.36 57.89 1ijg h GLU 251 Cb 0.21 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1ijg h GLU 251 CO 0.00 0.82 -0.23 0.77 -1.18 0.00 0.00 179.01 179.19 1ijg h SER 252 N 0.91 0.63 -0.59 1.04 0.02 0.40 -0.48 113.55 115.48 1ijg h SER 252 Ca 0.20 -0.22 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 1ijg h SER 252 Cb 0.28 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1ijg h SER 252 CO -0.01 0.85 -0.00 0.28 -1.14 0.00 0.00 176.83 176.81 1ijg h SER 253 N 0.54 1.02 -0.32 3.07 0.02 -0.81 -2.52 113.55 114.56 1ijg h SER 253 Ca 0.08 -0.31 -0.08 0.00 -0.84 0.00 0.00 61.79 60.64 1ijg h SER 253 Cb 0.70 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1ijg h SER 253 CO 0.05 1.08 -0.11 1.23 -1.14 0.00 0.00 176.83 177.95 1ijg h GLY 254 N 0.94 0.69 0.88 -3.77 0.00 -1.14 -2.97 103.07 97.70 1ijg h GLY 254 Ca 0.17 -0.59 0.13 0.00 0.00 0.00 0.00 47.33 47.04 1ijg h GLY 254 CO 0.03 0.54 0.44 -0.84 0.00 0.00 0.00 176.54 176.71 1ijg h THR 255 N 0.41 0.82 -0.78 4.70 2.02 -0.93 0.35 112.91 119.51 1ijg h THR 255 Ca 0.08 -0.11 0.16 0.00 0.77 0.00 0.00 66.41 67.31 1ijg h THR 255 Cb 0.61 0.47 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 1ijg h THR 255 CO 0.04 0.06 0.52 0.58 0.37 0.00 0.00 175.52 177.08 1ijg h VAL 256 N 0.32 0.77 0.11 3.16 2.07 -1.28 0.16 116.25 121.56 1ijg h VAL 256 Ca 0.31 -0.13 -0.32 0.00 0.82 0.00 0.00 66.70 67.37 1ijg h VAL 256 Cb 0.77 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1ijg h VAL 256 CO -0.08 0.07 -1.73 -0.26 0.02 0.00 0.00 177.57 175.60 1ijg h PHE 257 N 0.39 0.43 -0.19 1.57 -1.00 -1.10 -3.39 116.94 113.65 1ijg h PHE 257 Ca 0.38 -0.31 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 1ijg h PHE 257 Cb 0.93 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.46 1ijg h PHE 257 CO -0.00 1.68 0.02 1.25 -1.61 0.00 0.00 178.31 179.65 1ijg h LEU 258 N -0.17 0.31 -0.41 1.54 7.12 -0.55 -3.11 115.31 120.03 1ijg h LEU 258 Ca -0.38 -0.28 0.07 0.00 0.13 0.00 0.00 57.88 57.43 1ijg h LEU 258 Cb 1.87 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 41.85 1ijg h LEU 258 CO 0.05 0.51 0.03 0.07 -0.13 0.00 0.00 178.44 178.96 1ijg h LYS 259 N 0.09 0.13 -0.70 1.25 2.10 -0.93 0.13 116.57 118.63 1ijg h LYS 259 Ca 0.05 -0.01 0.10 0.00 -2.00 0.00 0.00 60.65 58.80 1ijg h LYS 259 Cb 0.34 -0.03 -0.07 0.00 -0.90 0.00 0.00 32.23 31.57 1ijg h LYS 259 CO 0.01 0.09 0.33 1.03 -2.00 0.00 0.00 179.45 178.91 1ijg h SER 260 N 0.14 0.41 -0.42 7.07 0.87 -1.75 0.38 113.55 120.25 1ijg h SER 260 Ca 0.20 0.07 -0.15 0.00 -1.23 0.00 0.00 61.79 60.68 1ijg h SER 260 Cb 0.28 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1ijg h SER 260 CO -0.32 0.23 -0.32 0.03 -0.53 0.00 0.00 176.83 175.92 1ijg h ARG 261 N 0.56 0.97 -0.56 2.24 3.08 -1.18 -2.79 114.38 116.70 1ijg h ARG 261 Ca 0.35 -0.47 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1ijg h ARG 261 Cb 0.41 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1ijg h ARG 261 CO -0.29 1.14 0.21 0.93 -1.07 0.00 0.00 179.97 180.89 1ijg h GLU 262 N 0.80 0.84 0.02 0.04 5.08 0.09 0.57 114.58 122.03 1ijg h GLU 262 Ca 0.08 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1ijg h GLU 262 Cb 0.91 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1ijg h GLU 262 CO 0.09 0.74 -0.13 1.49 -1.00 0.00 0.00 179.01 180.20 1ijg h GLU 263 N 0.77 -0.22 -0.23 2.33 4.81 -0.92 -1.11 114.58 120.01 1ijg h GLU 263 Ca 0.18 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1ijg h GLU 263 Cb 0.22 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1ijg h GLU 263 CO -0.01 -0.14 -0.12 0.00 -0.73 0.00 0.00 179.01 178.00 1ijg h ALA 264 N 0.72 1.36 -0.22 2.92 0.00 -1.37 -1.92 119.26 120.75 1ijg h ALA 264 Ca 0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1ijg h ALA 264 Cb 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ijg h ALA 264 CO -0.11 0.43 0.06 0.00 0.00 0.00 0.00 179.25 179.63 1ijg h GLU 266 N 0.31 0.63 -0.53 0.00 3.07 -0.44 -2.55 114.58 115.07 1ijg h GLU 266 Ca 0.08 -0.54 -0.06 0.00 -0.50 0.00 0.00 59.36 58.34 1ijg h GLU 266 Cb 0.12 0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1ijg h GLU 266 CO -0.00 1.16 0.08 0.87 -1.40 0.00 0.00 179.01 179.72 1ijg h LYS 267 N 0.41 0.88 -0.49 2.33 1.57 -1.05 -1.45 116.57 118.78 1ijg h LYS 267 Ca -0.06 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1ijg h LYS 267 Cb 1.42 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.60 1ijg h LYS 267 CO 0.15 0.86 0.29 0.82 -0.57 0.00 0.00 179.45 181.00 1ijg h ILE 268 N 0.77 1.16 0.00 1.86 2.04 -1.12 0.61 117.51 122.83 1ijg h ILE 268 Ca 0.16 -0.37 -0.08 0.00 1.00 0.00 0.00 64.86 65.57 1ijg h ILE 268 Cb 0.41 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1ijg h ILE 268 CO 0.01 0.16 -0.39 0.78 0.00 0.00 0.00 178.15 178.71 1ijg h ASN 269 N 0.65 0.00 0.01 1.72 -0.26 -1.27 -1.87 115.58 114.56 1ijg h ASN 269 Ca 0.17 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.91 1ijg h ASN 269 Cb 0.01 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 1ijg h ASN 269 CO -0.03 0.39 -0.01 -0.08 -1.06 0.00 0.00 177.43 176.65 1ijg h GLU 270 N 0.00 -0.02 -0.84 0.81 4.22 -0.94 0.41 114.58 118.22 1ijg h GLU 270 Ca -0.00 0.00 0.04 0.00 0.08 0.00 0.00 59.36 59.48 1ijg h GLU 270 Cb 0.70 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.91 1ijg h GLU 270 CO 0.05 0.61 0.53 1.25 -2.18 0.00 0.00 179.01 179.28 1ijg h LEU 271 N -0.98 0.88 -2.05 1.64 6.46 -0.92 -3.04 115.31 117.30 1ijg h LEU 271 Ca -0.00 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1ijg h LEU 271 Cb 0.64 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 1ijg h LEU 271 CO 0.00 0.60 0.00 -1.22 -0.62 0.00 0.00 178.44 177.20 1ijg n TYR 272 N -4.58 0.23 -3.67 1.25 4.01 -0.71 -4.99 117.16 108.70 1ijg n TYR 272 Ca 0.11 -0.19 -0.25 0.00 -0.16 0.00 0.00 57.90 57.40 1ijg n TYR 272 Cb 0.10 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.19 1ijg n TYR 272 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ijg n GLY 273 N 0.80 -0.53 1.18 2.72 0.00 0.06 -5.00 105.19 104.42 1ijg n GLY 273 Ca 0.11 0.24 -0.06 0.00 0.00 0.00 0.00 46.02 46.30 1ijg n GLY 273 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ijg n LEU 274 N -4.90 0.00 -2.77 0.99 4.32 -0.75 -5.00 117.00 108.89 1ijg n LEU 274 Ca 0.00 -0.73 -0.03 0.00 -0.02 0.00 0.00 56.01 55.23 1ijg n LEU 274 Cb 0.56 -0.14 0.05 0.00 -1.62 0.00 0.00 43.42 42.26 1ijg n LEU 274 CO 0.68 -0.58 -0.03 -3.20 -1.22 0.00 0.00 177.39 173.03 1ijg n ASN 275 N -2.84 1.42 -4.80 -1.43 5.15 -1.26 -4.63 115.26 106.87 1ijg n ASN 275 Ca 0.05 -2.29 -0.35 0.00 -0.60 0.00 0.00 54.58 51.40 1ijg n ASN 275 Cb 0.18 -0.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.92 1ijg n ASN 275 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1ijg s VAL 276 N -3.42 3.99 0.03 3.44 -7.23 -1.26 -4.66 120.40 111.28 1ijg s VAL 276 Ca 0.27 1.38 0.00 0.00 -1.81 0.00 0.00 61.98 61.82 1ijg s VAL 276 Cb 0.38 -3.64 -0.02 0.00 0.56 0.00 0.00 36.38 33.65 1ijg s VAL 276 CO -0.01 -0.13 -0.04 -0.54 -0.31 0.00 0.00 175.10 174.07 1ijg s LYS 277 N -2.82 0.36 0.02 4.82 1.02 -0.39 -4.90 119.74 117.84 1ijg s LYS 277 Ca 0.61 -0.67 0.07 0.00 0.02 0.00 0.00 55.97 55.99 1ijg s LYS 277 Cb -0.16 0.06 -0.02 0.00 -0.52 0.00 0.00 37.83 37.18 1ijg s LYS 277 CO 0.21 -0.04 -0.20 0.54 -0.92 0.00 0.00 175.35 174.94 1ijg s VAL 278 N -1.60 1.58 0.21 3.17 0.11 -1.26 -0.63 120.40 121.98 1ijg s VAL 278 Ca -0.14 -1.03 -0.19 0.00 -2.93 0.00 0.00 61.98 57.70 1ijg s VAL 278 Cb -0.09 -1.35 0.03 0.00 -1.53 0.00 0.00 36.38 33.44 1ijg s VAL 278 CO -0.01 0.29 0.58 -1.59 -3.33 0.00 0.00 175.10 171.03 1ijg s LYS 279 N -0.87 1.46 0.10 1.54 -2.85 -0.84 -4.96 119.74 113.33 1ijg s LYS 279 Ca 0.07 -0.85 -0.31 0.00 -1.00 0.00 0.00 55.97 53.88 1ijg s LYS 279 Cb -0.08 0.55 -0.08 0.00 -2.06 0.00 0.00 37.83 36.16 1ijg s LYS 279 CO 0.01 -0.64 1.44 -0.06 0.10 0.00 0.00 175.35 176.20 1ijg s PHE 280 N -3.87 3.08 0.29 1.78 0.40 -1.26 -0.97 117.98 117.44 1ijg s PHE 280 Ca 0.09 0.82 0.04 0.00 -0.60 0.00 0.00 56.93 57.28 1ijg s PHE 280 Cb -0.02 -3.74 0.68 0.00 0.51 0.00 0.00 43.02 40.45 1ijg s PHE 280 CO -0.02 -2.69 1.77 -0.09 0.70 0.00 0.00 175.22 174.90 1ijg h ARG 281 N 7.09 0.70 -6.14 0.44 9.65 -1.05 -3.39 114.38 121.68 1ijg h ARG 281 Ca -0.42 -0.04 -0.58 0.00 -1.10 0.00 0.00 59.98 57.84 1ijg h ARG 281 Cb 1.20 -0.16 -0.06 0.00 -1.39 0.00 0.00 29.97 29.56 1ijg h ARG 281 CO 0.88 0.47 0.81 -0.47 2.80 0.00 0.00 179.97 184.46 1ijg s TYR 282 N -5.89 3.28 0.00 2.20 5.04 -1.26 -4.97 117.35 115.76 1ijg s TYR 282 Ca -0.11 1.39 0.00 0.00 -2.44 0.00 0.00 57.07 55.91 1ijg s TYR 282 Cb 0.24 -3.38 0.00 0.00 0.35 0.00 0.00 41.96 39.17 1ijg s TYR 282 CO 0.80 -0.57 0.00 -0.25 -1.34 0.00 0.00 175.55 174.18 1ijg n ASP 283 N 6.47 0.52 0.00 4.32 10.43 -1.26 -5.13 116.55 131.89 1ijg n ASP 283 Ca 0.12 -0.19 0.00 0.00 2.57 0.00 0.00 54.79 57.29 1ijg n ASP 283 Cb 0.46 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.42 1ijg n ASP 283 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1ijg n ILE 284 N -0.14 0.00 1.83 0.53 2.08 -1.26 -5.22 119.36 117.18 1ijg n ILE 284 Ca 0.00 0.00 0.15 0.00 0.56 0.00 0.00 62.75 63.46 1ijg n ILE 284 Cb 0.00 -0.54 0.80 0.00 -0.75 0.00 0.00 39.64 39.15 1ijg n ILE 284 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63