#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 0.00 0.07 2.46 2.08 -1.26 -4.90 119.36 117.81 1ijg n ILE 12 Ca 0.00 0.00 0.13 0.00 0.56 0.00 0.00 62.75 63.44 1ijg n ILE 12 Cb 0.00 1.21 0.62 0.00 -0.75 0.00 0.00 39.64 40.72 1ijg n ILE 12 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 1ijg h ASN 13 N 0.00 0.11 -0.07 4.38 2.35 -2.05 -1.43 115.58 118.86 1ijg h ASN 13 Ca 0.00 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 1ijg h ASN 13 Cb 0.42 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1ijg h ASN 13 CO 0.00 0.07 -0.26 1.05 -1.65 0.00 0.00 177.43 176.64 1ijg h GLU 14 N 0.12 0.30 -0.27 0.81 9.09 -2.00 -2.41 114.58 120.23 1ijg h GLU 14 Ca 0.17 -0.23 -0.04 0.00 0.05 0.00 0.00 59.36 59.31 1ijg h GLU 14 Cb 0.50 0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 27.63 1ijg h GLU 14 CO -0.02 0.86 -0.01 0.82 0.05 0.00 0.00 179.01 180.71 1ijg h ILE 15 N -0.20 1.17 -0.31 -1.06 1.08 -1.80 -2.01 117.51 114.39 1ijg h ILE 15 Ca -0.01 -0.69 -0.14 0.00 -0.39 0.00 0.00 64.86 63.63 1ijg h ILE 15 Cb 0.89 0.98 -0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1ijg h ILE 15 CO 0.05 0.23 -0.35 -0.61 -0.69 0.00 0.00 178.15 176.78 1ijg h GLN 16 N 0.40 0.79 -0.45 2.37 5.75 -1.29 -0.73 115.11 121.95 1ijg h GLN 16 Ca 0.09 -0.43 -0.00 0.00 -0.15 0.00 0.00 58.65 58.15 1ijg h GLN 16 Cb 0.29 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 1ijg h GLN 16 CO 0.01 1.06 0.27 -0.09 -2.65 0.00 0.00 178.83 177.43 1ijg h ARG 17 N 0.56 0.60 -0.00 1.69 2.43 -1.01 0.18 114.38 118.82 1ijg h ARG 17 Ca 0.04 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.00 1ijg h ARG 17 Cb 0.94 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 1ijg h ARG 17 CO 0.09 0.42 -0.77 0.37 -1.51 0.00 0.00 179.97 178.57 1ijg h GLN 18 N 0.62 0.04 -0.07 0.20 5.75 -1.09 -1.71 115.11 118.86 1ijg h GLN 18 Ca 0.16 -0.04 -0.12 0.00 -0.15 0.00 0.00 58.65 58.50 1ijg h GLN 18 Cb -0.03 0.01 0.01 0.00 1.07 0.00 0.00 27.48 28.54 1ijg h GLN 18 CO -0.03 0.79 -0.42 -0.22 -2.65 0.00 0.00 178.83 176.30 1ijg h LYS 19 N 0.03 0.40 -0.39 1.69 3.64 0.21 -0.88 116.57 121.26 1ijg h LYS 19 Ca -0.01 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1ijg h LYS 19 Cb 1.36 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.24 1ijg h LYS 19 CO 0.10 0.99 0.05 -0.09 -2.27 0.00 0.00 179.45 178.23 1ijg h ARG 20 N -0.08 0.59 -0.21 1.90 2.43 -0.74 -1.31 114.38 116.96 1ijg h ARG 20 Ca -0.03 -0.12 -0.12 0.00 -0.81 0.00 0.00 59.98 58.90 1ijg h ARG 20 Cb 1.08 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1ijg h ARG 20 CO 0.09 0.58 -0.37 -0.91 -1.51 0.00 0.00 179.97 177.84 1ijg h ASN 21 N 0.57 0.49 -0.52 -3.80 4.21 -1.24 0.48 115.58 115.76 1ijg h ASN 21 Ca 0.13 -0.20 -0.04 0.00 1.21 0.00 0.00 56.30 57.39 1ijg h ASN 21 Cb 0.29 -0.14 -0.03 0.00 -1.12 0.00 0.00 38.32 37.33 1ijg h ASN 21 CO 0.00 0.82 0.17 -0.09 -1.29 0.00 0.00 177.43 177.04 1ijg h ARG 22 N 0.39 0.85 0.00 0.81 2.43 -0.05 0.87 114.38 119.69 1ijg h ARG 22 Ca 0.04 -0.16 -0.25 0.00 -0.81 0.00 0.00 59.98 58.81 1ijg h ARG 22 Cb 0.83 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1ijg h ARG 22 CO 0.07 0.74 -1.00 -1.49 -1.51 0.00 0.00 179.97 176.78 1ijg h TRP 23 N 0.83 0.80 -0.12 2.20 4.06 -0.99 -1.54 115.95 121.18 1ijg h TRP 23 Ca 0.19 -0.44 0.02 0.00 2.06 0.00 0.00 58.89 60.72 1ijg h TRP 23 Cb 0.25 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.30 1ijg h TRP 23 CO 0.02 1.27 -0.03 0.35 -3.56 0.00 0.00 178.44 176.48 1ijg h PHE 24 N 0.30 -0.06 -0.56 0.49 3.57 -0.43 -0.52 116.94 119.72 1ijg h PHE 24 Ca -0.10 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.45 1ijg h PHE 24 Cb 1.64 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.38 1ijg h PHE 24 CO 0.08 -0.05 0.31 0.82 -2.23 0.00 0.00 178.31 177.23 1ijg h ILE 25 N 0.00 0.98 -0.18 1.41 2.04 -0.84 0.24 117.51 121.17 1ijg h ILE 25 Ca 0.06 -0.20 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1ijg h ILE 25 Cb 0.09 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 1ijg h ILE 25 CO -0.12 0.11 -0.16 -0.74 0.00 0.00 0.00 178.15 177.24 1ijg h HIS 26 N 0.59 -0.39 -0.33 1.37 2.76 -0.53 -0.51 115.15 118.11 1ijg h HIS 26 Ca 0.24 0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.31 1ijg h HIS 26 Cb 0.12 0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 1ijg h HIS 26 CO -0.09 -0.23 -0.31 1.88 -1.30 0.00 0.00 177.93 177.89 1ijg h TYR 27 N -0.17 0.83 -0.09 5.26 -1.99 -0.76 -0.85 116.97 119.19 1ijg h TYR 27 Ca 0.11 -0.21 -0.00 0.00 2.00 0.00 0.00 58.73 60.62 1ijg h TYR 27 Cb 0.34 -0.19 -0.00 0.00 2.00 0.00 0.00 36.73 38.87 1ijg h TYR 27 CO -0.29 0.93 0.05 1.25 -0.00 0.00 0.00 178.16 180.09 1ijg h LEU 28 N 0.61 0.12 -0.70 3.88 6.46 -0.61 0.21 115.31 125.27 1ijg h LEU 28 Ca 0.07 -0.12 -0.13 0.00 -0.12 0.00 0.00 57.88 57.58 1ijg h LEU 28 Cb 0.82 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 1ijg h LEU 28 CO 0.07 0.21 -0.34 0.78 -0.62 0.00 0.00 178.44 178.54 1ijg h ASN 29 N 0.03 0.64 -0.32 1.25 2.35 -1.06 -0.13 115.58 118.33 1ijg h ASN 29 Ca 0.03 -0.26 -0.07 0.00 -0.55 0.00 0.00 56.30 55.45 1ijg h ASN 29 Cb 0.12 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1ijg h ASN 29 CO -0.00 0.93 -0.05 0.22 -1.65 0.00 0.00 177.43 176.88 1ijg h TYR 30 N 0.52 0.68 -0.52 1.19 3.20 -0.99 0.53 116.97 121.57 1ijg h TYR 30 Ca 0.06 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 61.73 1ijg h TYR 30 Cb 0.84 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.92 1ijg h TYR 30 CO 0.04 0.77 0.11 -0.07 -1.64 0.00 0.00 178.16 177.37 1ijg h LEU 31 N 0.39 0.81 0.01 2.82 3.38 -0.45 -1.49 115.31 120.78 1ijg h LEU 31 Ca 0.09 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1ijg h LEU 31 Cb 0.53 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1ijg h LEU 31 CO 0.03 0.84 -0.01 1.56 0.09 0.00 0.00 178.44 180.95 1ijg h GLN 32 N 0.74 -0.02 -0.71 1.13 4.20 -0.83 0.18 115.11 119.81 1ijg h GLN 32 Ca 0.16 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.96 1ijg h GLN 32 Cb 0.36 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 1ijg h GLN 32 CO 0.00 -0.01 0.47 0.66 -0.67 0.00 0.00 178.83 179.29 1ijg h SER 33 N -0.02 0.56 -0.12 1.46 4.64 -0.70 0.62 113.55 119.99 1ijg h SER 33 Ca -0.00 0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.13 1ijg h SER 33 Cb 0.02 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1ijg h SER 33 CO 0.00 0.34 -0.71 -0.07 -0.87 0.00 0.00 176.83 175.52 1ijg h LEU 34 N 0.63 0.84 0.46 5.97 3.38 -0.66 -3.04 115.31 122.89 1ijg h LEU 34 Ca 0.32 -0.65 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1ijg h LEU 34 Cb 0.43 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ijg h LEU 34 CO -0.11 1.35 -0.22 0.00 0.09 0.00 0.00 178.44 179.55 1ijg h ALA 35 N 0.51 -0.62 -1.00 1.53 0.00 0.44 -3.01 119.26 117.10 1ijg h ALA 35 Ca -0.05 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 54.88 1ijg h ALA 35 Cb 1.35 0.24 -0.10 0.00 0.00 0.00 0.00 17.79 19.28 1ijg h ALA 35 CO 0.15 -0.82 0.62 1.88 0.00 0.00 0.00 179.25 181.08 1ijg h TYR 36 N -0.69 1.07 0.00 0.00 0.05 -1.02 -0.52 116.97 115.86 1ijg h TYR 36 Ca -0.06 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1ijg h TYR 36 Cb 0.51 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.93 1ijg h TYR 36 CO -0.03 0.27 0.00 0.94 -1.05 0.00 0.00 178.16 178.30 1ijg n GLN 37 N -4.73 0.18 -0.16 4.88 0.00 -1.15 -4.08 117.38 112.32 1ijg n GLN 37 Ca 0.22 0.35 -0.04 0.00 -0.00 0.00 0.00 57.00 57.53 1ijg n GLN 37 Cb 0.54 -1.81 0.02 0.00 0.00 0.00 0.00 30.24 29.00 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 -0.75 -9.59 1.69 3.38 -0.95 -3.41 115.31 105.68 1ijg h LEU 38 Ca 0.00 0.18 -0.65 0.00 0.09 0.00 0.00 57.88 57.49 1ijg h LEU 38 Cb 0.44 0.42 -0.09 0.00 0.09 0.00 0.00 40.66 41.51 1ijg h LEU 38 CO 0.00 -0.24 -0.56 -0.36 0.09 0.00 0.00 178.44 177.37 1ijg s PHE 39 N -6.14 3.33 -0.13 1.13 0.08 -1.26 0.15 117.98 115.15 1ijg s PHE 39 Ca -0.14 0.24 0.02 0.00 0.12 0.00 0.00 56.93 57.17 1ijg s PHE 39 Cb 0.16 -1.76 0.01 0.00 -0.57 0.00 0.00 43.02 40.86 1ijg s PHE 39 CO 0.71 0.57 -0.19 -2.00 -0.10 0.00 0.00 175.22 174.20 1ijg s GLU 40 N -1.68 2.72 0.03 0.44 2.12 -0.17 -4.71 118.70 117.44 1ijg s GLU 40 Ca 0.23 -0.74 -0.01 0.00 0.36 0.00 0.00 54.97 54.81 1ijg s GLU 40 Cb -0.12 -2.24 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 1ijg s GLU 40 CO 0.13 -0.05 0.17 -1.58 -0.54 0.00 0.00 175.26 173.39 1ijg s TRP 41 N 0.92 3.46 0.09 5.30 0.52 -1.26 -2.08 118.94 125.89 1ijg s TRP 41 Ca -0.06 0.26 0.05 0.00 0.02 0.00 0.00 56.10 56.37 1ijg s TRP 41 Cb -0.15 -1.76 -0.03 0.00 -1.15 0.00 0.00 33.47 30.37 1ijg s TRP 41 CO -0.03 0.60 -0.12 -1.83 0.02 0.00 0.00 176.95 175.59 1ijg s GLU 42 N -2.19 0.85 -1.31 4.98 -1.05 0.22 -4.80 118.70 115.40 1ijg s GLU 42 Ca 0.30 -1.08 -0.01 0.00 -0.15 0.00 0.00 54.97 54.03 1ijg s GLU 42 Cb -0.13 -0.70 0.00 0.00 -0.44 0.00 0.00 34.13 32.86 1ijg s GLU 42 CO 0.22 0.13 0.11 0.09 0.95 0.00 0.00 175.26 176.76 1ijg n ASN 43 N 0.86 -4.80 -4.76 0.83 3.02 -1.26 -1.30 115.26 107.86 1ijg n ASN 43 Ca -0.18 -0.06 -0.39 0.00 -0.03 0.00 0.00 54.58 53.92 1ijg n ASN 43 Cb 0.56 -3.86 -0.06 0.00 -0.61 0.00 0.00 39.78 35.81 1ijg n ASN 43 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ijg s LEU 44 N -4.69 4.57 0.29 3.41 1.43 -1.26 -4.15 118.68 118.29 1ijg s LEU 44 Ca 0.05 1.88 -0.30 0.00 -1.03 0.00 0.00 54.13 54.73 1ijg s LEU 44 Cb -0.02 -3.66 -0.12 0.00 0.03 0.00 0.00 46.19 42.41 1ijg s LEU 44 CO 0.07 0.11 1.44 -2.65 0.23 0.00 0.00 176.35 175.55 1ijg n PRO 45 N 1.28 2.31 0.08 1.29 -0.02 -1.26 -4.80 135.00 133.88 1ijg n PRO 45 Ca -0.02 0.82 0.19 0.00 -2.02 0.00 0.00 63.50 62.47 1ijg n PRO 45 Cb 0.48 -2.50 0.55 0.00 -0.02 0.00 0.00 33.50 32.02 1ijg n PRO 45 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ijg h PRO 46 N 3.81 0.00 -0.00 0.52 0.11 -1.96 0.25 132.00 134.72 1ijg h PRO 46 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ijg h PRO 46 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1ijg h PRO 46 CO 0.72 0.00 -0.02 0.25 -0.21 0.00 0.00 178.00 178.74 1ijg n THR 47 N -3.22 0.00 -3.82 -1.15 -2.24 -1.26 -4.78 114.28 97.81 1ijg n THR 47 Ca 0.09 -0.06 -0.36 0.00 -2.27 0.00 0.00 64.05 61.46 1ijg n THR 47 Cb 0.91 -0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 68.81 1ijg n THR 47 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1ijg s ILE 48 N -2.17 4.92 -0.53 2.28 -1.09 0.86 -4.67 121.20 120.80 1ijg s ILE 48 Ca 0.40 0.02 -0.22 0.00 -2.23 0.00 0.00 60.65 58.62 1ijg s ILE 48 Cb 0.21 -3.27 0.05 0.00 -1.58 0.00 0.00 42.46 37.87 1ijg s ILE 48 CO 0.40 0.38 0.82 0.21 -1.23 0.00 0.00 174.94 175.52 1ijg s ASN 49 N 0.93 6.30 0.24 3.58 3.04 -1.26 -4.88 114.94 122.89 1ijg s ASN 49 Ca 0.05 -0.55 -0.05 0.00 0.04 0.00 0.00 52.86 52.35 1ijg s ASN 49 Cb -0.14 -2.38 0.40 0.00 -1.54 0.00 0.00 41.25 37.59 1ijg s ASN 49 CO 0.03 -1.10 1.79 -0.65 -3.04 0.00 0.00 177.10 174.13 1ijg h PRO 50 N 9.19 0.67 0.19 0.43 0.11 -1.97 0.25 132.00 140.86 1ijg h PRO 50 Ca -0.27 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 1ijg h PRO 50 Cb 1.08 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 1ijg h PRO 50 CO 1.04 0.44 -0.12 1.03 -0.21 0.00 0.00 178.00 180.19 1ijg h SER 51 N 0.69 -0.29 -0.89 -2.05 0.87 -1.98 -2.11 113.55 107.79 1ijg h SER 51 Ca 0.39 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.98 1ijg h SER 51 Cb 0.42 0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.41 1ijg h SER 51 CO -0.28 -0.19 0.59 0.15 -0.53 0.00 0.00 176.83 176.57 1ijg h PHE 52 N -0.30 1.11 0.29 2.24 3.57 -1.88 -1.04 116.94 120.94 1ijg h PHE 52 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1ijg h PHE 52 Cb 0.25 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 1ijg h PHE 52 CO -0.08 0.68 -0.37 1.25 -2.23 0.00 0.00 178.31 177.56 1ijg h LEU 53 N 1.19 -1.02 -0.43 0.59 5.85 -0.61 -1.93 115.31 118.94 1ijg h LEU 53 Ca 0.34 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 59.06 1ijg h LEU 53 Cb -0.10 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1ijg h LEU 53 CO -0.08 -0.49 -0.11 -0.33 -0.34 0.00 0.00 178.44 177.09 1ijg h GLU 54 N -0.71 0.83 -0.75 1.25 4.39 -1.25 -2.43 114.58 115.90 1ijg h GLU 54 Ca -0.01 -0.32 0.10 0.00 0.34 0.00 0.00 59.36 59.47 1ijg h GLU 54 Cb 0.67 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.22 1ijg h GLU 54 CO -0.11 0.95 0.49 0.87 -1.16 0.00 0.00 179.01 180.05 1ijg h LYS 55 N 0.66 0.63 -0.13 2.33 1.57 -1.13 -1.58 116.57 118.92 1ijg h LYS 55 Ca 0.11 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1ijg h LYS 55 Cb 0.64 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1ijg h LYS 55 CO 0.04 0.41 -0.17 0.77 -0.57 0.00 0.00 179.45 179.94 1ijg h SER 56 N 0.65 0.37 -0.58 0.86 0.02 -1.13 -0.68 113.55 113.05 1ijg h SER 56 Ca 0.35 -0.52 0.03 0.00 -0.84 0.00 0.00 61.79 60.81 1ijg h SER 56 Cb 0.49 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1ijg h SER 56 CO -0.13 0.81 0.38 0.40 -1.14 0.00 0.00 176.83 177.16 1ijg h ILE 57 N -0.07 1.09 0.15 3.27 2.04 -0.93 -0.98 117.51 122.09 1ijg h ILE 57 Ca 0.01 -0.24 -0.30 0.00 1.00 0.00 0.00 64.86 65.34 1ijg h ILE 57 Cb 0.73 0.33 0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1ijg h ILE 57 CO 0.04 0.13 -1.29 0.45 0.00 0.00 0.00 178.15 177.48 1ijg h HIS 58 N 0.70 0.87 0.00 1.37 3.86 -1.23 -1.84 115.15 118.87 1ijg h HIS 58 Ca 0.23 -0.58 -0.19 0.00 -1.16 0.00 0.00 60.37 58.67 1ijg h HIS 58 Cb 0.04 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1ijg h HIS 58 CO -0.00 1.43 -0.86 1.96 0.86 0.00 0.00 177.93 181.32 1ijg h GLN 59 N 0.20 0.15 0.00 2.45 4.20 -0.77 0.86 115.11 122.20 1ijg h GLN 59 Ca -0.19 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.35 1ijg h GLN 59 Cb 1.97 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 29.80 1ijg h GLN 59 CO 0.24 0.92 -1.31 1.19 -0.67 0.00 0.00 178.83 179.20 1ijg n PHE 60 N -3.64 0.00 0.00 2.96 3.01 -0.40 -4.75 117.46 114.63 1ijg n PHE 60 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 1ijg n PHE 60 Cb 0.80 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 40.12 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 2.13 0.49 3.61 1.37 0.00 -0.70 -4.33 105.19 107.76 1ijg n GLY 61 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.01 -0.11 0.01 1.61 1.13 -1.20 0.15 117.35 116.94 1ijg s TYR 62 Ca 0.00 0.00 -0.07 0.00 -1.41 0.00 0.00 57.07 55.60 1ijg s TYR 62 Cb 0.00 0.54 -0.00 0.00 -1.10 0.00 0.00 41.96 41.40 1ijg s TYR 62 CO 0.00 -0.32 0.12 0.54 -2.51 0.00 0.00 175.55 173.38 1ijg s VAL 63 N -2.57 0.10 0.05 -3.49 0.11 -0.76 -4.28 120.40 109.56 1ijg s VAL 63 Ca 0.11 -0.79 -0.17 0.00 -2.93 0.00 0.00 61.98 58.20 1ijg s VAL 63 Cb 0.01 -0.53 -0.06 0.00 -1.53 0.00 0.00 36.38 34.27 1ijg s VAL 63 CO -0.04 -0.43 0.50 -0.83 -3.33 0.00 0.00 175.10 170.97 1ijg s GLY 64 N -1.56 2.59 -0.34 6.54 0.00 0.21 -1.18 107.32 113.58 1ijg s GLY 64 Ca -0.13 -0.07 0.03 0.00 0.00 0.00 0.00 44.72 44.55 1ijg s GLY 64 CO 0.00 0.33 0.07 -0.12 0.00 0.00 0.00 173.10 173.38 1ijg s PHE 65 N -1.11 3.26 -0.03 1.90 5.36 0.63 -0.41 117.98 127.58 1ijg s PHE 65 Ca 0.27 -2.72 0.06 0.00 -0.96 0.00 0.00 56.93 53.58 1ijg s PHE 65 Cb -0.18 -2.64 -0.01 0.00 -0.34 0.00 0.00 43.02 39.85 1ijg s PHE 65 CO 0.17 -0.93 -0.20 -0.47 -1.46 0.00 0.00 175.22 172.33 1ijg s TYR 66 N 1.02 1.90 -0.96 10.12 5.04 -0.56 -1.28 117.35 132.63 1ijg s TYR 66 Ca 0.11 -0.46 -0.18 0.00 -2.44 0.00 0.00 57.07 54.10 1ijg s TYR 66 Cb -0.19 -1.25 0.14 0.00 0.35 0.00 0.00 41.96 41.02 1ijg s TYR 66 CO -0.12 -0.11 1.14 0.21 -1.34 0.00 0.00 175.55 175.33 1ijg s LYS 67 N -0.25 3.67 0.26 4.97 2.20 -1.26 -0.23 119.74 129.09 1ijg s LYS 67 Ca 0.02 -1.94 -0.30 0.00 -0.36 0.00 0.00 55.97 53.39 1ijg s LYS 67 Cb -0.10 -4.89 -0.10 0.00 -1.51 0.00 0.00 37.83 31.22 1ijg s LYS 67 CO 0.01 -1.73 1.47 0.34 -0.36 0.00 0.00 175.35 175.08 1ijg s ASP 68 N 3.39 6.60 0.53 1.43 2.15 -0.56 -4.81 116.67 125.40 1ijg s ASP 68 Ca 0.33 2.72 0.25 0.00 0.43 0.00 0.00 52.55 56.28 1ijg s ASP 68 Cb -0.05 -2.63 1.46 0.00 -0.30 0.00 0.00 42.92 41.40 1ijg s ASP 68 CO -0.08 -0.74 2.11 1.55 -0.17 0.00 0.00 175.17 177.83 1ijg h PRO 69 N 4.99 0.00 0.00 4.34 0.13 -1.95 0.22 132.00 139.72 1ijg h PRO 69 Ca -0.46 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.43 1ijg h PRO 69 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 1ijg h PRO 69 CO 0.78 0.10 -1.70 0.28 -0.23 0.00 0.00 178.00 177.23 1ijg n VAL 70 N -3.84 1.51 -0.02 1.56 0.31 -1.26 -4.66 118.33 111.94 1ijg n VAL 70 Ca -0.02 -0.11 0.11 0.00 -0.01 0.00 0.00 64.34 64.31 1ijg n VAL 70 Cb 0.20 -2.11 0.29 0.00 -0.91 0.00 0.00 33.84 31.30 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 -4.37 0.81 -4.72 2.52 -5.35 -1.25 -5.07 119.36 101.91 1ijg n ILE 71 Ca -0.34 -0.86 0.00 0.00 -0.27 0.00 0.00 62.75 61.29 1ijg n ILE 71 Cb 0.68 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 39.13 1ijg n ILE 71 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ijg n SER 72 N 1.44 -2.49 -4.61 7.28 3.41 0.06 -4.81 113.62 113.90 1ijg n SER 72 Ca 0.22 0.00 -0.51 0.00 -0.26 0.00 0.00 58.87 58.32 1ijg n SER 72 Cb 0.57 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.46 1ijg n SER 72 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1ijg n TYR 73 N -0.21 1.70 -3.81 7.33 0.53 -1.26 -1.50 117.16 119.94 1ijg n TYR 73 Ca 0.00 0.55 -0.12 0.00 -1.02 0.00 0.00 57.90 57.31 1ijg n TYR 73 Cb 0.00 -2.38 -0.12 0.00 -1.03 0.00 0.00 39.34 35.81 1ijg n TYR 73 CO 0.00 0.00 0.00 -1.50 -1.02 0.00 0.00 176.86 174.34 1ijg s ILE 74 N 0.76 0.01 -0.21 -0.72 2.07 0.68 -4.32 121.20 119.46 1ijg s ILE 74 Ca 0.84 -0.08 -0.12 0.00 -1.41 0.00 0.00 60.65 59.88 1ijg s ILE 74 Cb -0.90 -0.31 -0.05 0.00 0.13 0.00 0.00 42.46 41.33 1ijg s ILE 74 CO 0.46 -0.04 0.23 0.00 -1.91 0.00 0.00 174.94 173.68 1ijg s ALA 75 N -0.07 3.61 0.03 1.50 0.00 -1.26 -1.50 121.76 124.07 1ijg s ALA 75 Ca -0.02 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 1ijg s ALA 75 Cb -0.02 -2.38 -0.02 0.00 0.00 0.00 0.00 23.12 20.70 1ijg s ALA 75 CO 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 175.76 175.64 1ijg s ASN 77 N -1.85 5.86 0.00 0.00 0.01 -1.26 0.65 114.94 118.35 1ijg s ASN 77 Ca -0.10 0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.14 1ijg s ASN 77 Cb -0.05 -1.67 0.00 0.00 0.41 0.00 0.00 41.25 39.94 1ijg s ASN 77 CO -0.03 0.15 0.00 0.61 -1.51 0.00 0.00 177.10 176.32 1ijg n GLY 78 N 0.24 0.94 3.64 0.66 0.00 -1.26 -2.82 105.19 106.60 1ijg n GLY 78 Ca -0.07 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 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 3.15 -0.29 4.61 0.00 -1.06 -4.93 121.76 122.23 1ijg s ALA 79 Ca 0.00 -1.32 -0.13 0.00 0.00 0.00 0.00 51.96 50.51 1ijg s ALA 79 Cb 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 1ijg s ALA 79 CO 0.00 0.54 0.27 -0.51 0.00 0.00 0.00 175.76 176.06 1ijg s LEU 80 N -2.72 4.15 0.00 0.00 1.43 -1.26 -1.12 118.68 119.15 1ijg s LEU 80 Ca 0.26 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 1ijg s LEU 80 Cb -0.10 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.88 1ijg s LEU 80 CO 0.17 -0.15 0.00 -1.20 0.23 0.00 0.00 176.35 175.40 1ijg n SER 81 N 5.19 0.78 0.00 2.29 7.64 0.61 -4.99 113.62 125.14 1ijg n SER 81 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1ijg n SER 81 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1ijg n SER 81 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ijg n GLY 82 N 2.03 -1.45 3.72 0.23 0.00 -1.26 -1.57 105.19 106.89 1ijg n GLY 82 Ca 0.00 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 1ijg n GLY 82 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ijg s GLN 83 N -2.30 4.27 0.37 1.61 2.00 -1.26 -4.60 119.66 119.74 1ijg s GLN 83 Ca 0.00 2.22 -0.26 0.00 -2.00 0.00 0.00 55.36 55.32 1ijg s GLN 83 Cb 0.00 -3.20 -0.09 0.00 0.80 0.00 0.00 33.01 30.52 1ijg s GLN 83 CO 0.00 -0.52 1.14 1.03 -0.50 0.00 0.00 175.29 176.45 1ijg s ARG 84 N 1.08 4.21 0.03 1.67 1.81 -1.26 -4.10 118.95 122.39 1ijg s ARG 84 Ca 0.67 1.80 -0.00 0.00 -1.72 0.00 0.00 55.73 56.48 1ijg s ARG 84 Cb -0.40 -2.78 0.01 0.00 -0.45 0.00 0.00 34.95 31.32 1ijg s ARG 84 CO 0.31 -0.17 0.05 -0.40 -0.68 0.00 0.00 175.30 174.40 1ijg n ASP 85 N 0.32 0.02 0.12 0.23 5.68 -0.65 -4.78 116.55 117.48 1ijg n ASP 85 Ca 0.03 -1.02 0.20 0.00 -0.50 0.00 0.00 54.79 53.49 1ijg n ASP 85 Cb 0.46 -0.03 0.76 0.00 -1.14 0.00 0.00 41.12 41.17 1ijg n ASP 85 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 1ijg h VAL 86 N -0.86 0.39 -0.52 2.12 -1.51 -1.96 0.14 116.25 114.06 1ijg h VAL 86 Ca -0.01 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 65.40 1ijg h VAL 86 Cb 0.04 0.69 -0.04 0.00 -2.13 0.00 0.00 31.29 29.86 1ijg h VAL 86 CO 0.01 0.00 0.06 -1.22 -1.23 0.00 0.00 177.57 175.19 1ijg n TYR 87 N -3.72 1.81 -1.05 5.19 0.53 -1.26 -4.93 117.16 113.73 1ijg n TYR 87 Ca 0.06 -0.93 -0.02 0.00 -1.02 0.00 0.00 57.90 56.00 1ijg n TYR 87 Cb 0.55 -0.50 -0.01 0.00 -1.03 0.00 0.00 39.34 38.35 1ijg n TYR 87 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1ijg n ASN 88 N 0.03 -5.44 -4.81 7.72 5.15 0.49 -4.96 115.26 113.44 1ijg n ASN 88 Ca 0.29 0.04 -0.33 0.00 -0.60 0.00 0.00 54.58 53.98 1ijg n ASN 88 Cb 1.15 -3.08 -0.06 0.00 -0.53 0.00 0.00 39.78 37.26 1ijg n ASN 88 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1ijg s GLN 89 N -1.82 4.09 0.52 1.20 -0.21 -1.26 -4.68 119.66 117.49 1ijg s GLN 89 Ca 0.00 1.18 -0.21 0.00 0.02 0.00 0.00 55.36 56.35 1ijg s GLN 89 Cb 0.00 -2.15 -0.06 0.00 1.00 0.00 0.00 33.01 31.80 1ijg s GLN 89 CO 0.00 -0.15 1.18 0.00 -2.12 0.00 0.00 175.29 174.20 1ijg s ALA 90 N -2.15 2.80 -0.02 6.09 0.00 -1.26 -1.64 121.76 125.58 1ijg s ALA 90 Ca 0.63 0.96 0.04 0.00 0.00 0.00 0.00 51.96 53.59 1ijg s ALA 90 Cb -0.11 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 1ijg s ALA 90 CO 0.16 -0.85 0.07 2.41 0.00 0.00 0.00 175.76 177.55 1ijg n THR 91 N -0.96 0.08 -4.71 0.00 -1.04 -1.06 -4.84 114.28 101.75 1ijg n THR 91 Ca 0.10 -0.12 -0.24 0.00 -2.04 0.00 0.00 64.05 61.75 1ijg n THR 91 Cb 0.49 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.84 1ijg n THR 91 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1ijg s VAL 92 N -2.23 1.25 -0.26 12.58 1.01 -0.61 0.03 120.40 132.17 1ijg s VAL 92 Ca -0.02 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 1ijg s VAL 92 Cb 0.02 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.32 1ijg s VAL 92 CO 0.17 0.37 0.03 0.12 0.00 0.00 0.00 175.10 175.79 1ijg s PHE 93 N 0.06 3.08 -1.09 5.22 5.36 -0.25 -0.29 117.98 130.07 1ijg s PHE 93 Ca -0.03 -0.95 -0.05 0.00 -0.96 0.00 0.00 56.93 54.93 1ijg s PHE 93 Cb -0.10 -2.19 0.30 0.00 -0.34 0.00 0.00 43.02 40.69 1ijg s PHE 93 CO 0.02 -0.55 1.37 0.54 -1.46 0.00 0.00 175.22 175.13 1ijg n ARG 94 N 4.83 4.19 -2.14 10.12 1.74 -0.28 -2.36 116.66 132.76 1ijg n ARG 94 Ca -0.16 -4.53 -0.42 0.00 -0.77 0.00 0.00 57.85 51.97 1ijg n ARG 94 Cb 0.49 -2.52 -0.03 0.00 -1.02 0.00 0.00 32.46 29.38 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 -2.36 3.61 -0.30 7.54 0.00 -0.71 -2.57 121.76 126.97 1ijg s ALA 95 Ca 0.31 1.02 -0.19 0.00 0.00 0.00 0.00 51.96 53.10 1ijg s ALA 95 Cb 0.01 -3.60 0.19 0.00 0.00 0.00 0.00 23.12 19.72 1ijg s ALA 95 CO 0.05 -0.87 1.26 0.00 0.00 0.00 0.00 175.76 176.21 1ijg s ALA 96 N 2.07 -2.46 0.00 0.00 0.00 -1.13 -0.14 121.76 120.10 1ijg s ALA 96 Ca 0.66 1.92 0.00 0.00 0.00 0.00 0.00 51.96 54.54 1ijg s ALA 96 Cb -0.35 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 20.91 1ijg s ALA 96 CO 0.29 -0.25 0.00 -1.13 0.00 0.00 0.00 175.76 174.66 1ijg n SER 97 N 2.69 0.00 0.00 0.00 3.41 -1.04 -4.78 113.62 113.89 1ijg n SER 97 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.46 1ijg n SER 97 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1ijg n SER 97 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ijg n PRO 98 N 0.00 0.00 -0.32 4.33 -0.04 -1.26 -4.77 135.00 132.94 1ijg n PRO 98 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1ijg n PRO 98 Cb 0.00 0.00 0.29 0.00 -0.04 0.00 0.00 33.50 33.75 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 -4.48 0.52 0.24 -1.26 -4.84 118.33 109.35 1ijg n VAL 99 Ca 0.00 -0.86 -0.24 0.00 -2.04 0.00 0.00 64.34 61.20 1ijg n VAL 99 Cb 0.00 0.47 -0.17 0.00 -1.47 0.00 0.00 33.84 32.68 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 -1.16 1.30 -0.10 6.34 5.04 -1.26 -5.11 117.35 122.40 1ijg s TYR 100 Ca 0.43 -0.47 -0.04 0.00 -2.44 0.00 0.00 57.07 54.55 1ijg s TYR 100 Cb 0.23 -0.98 0.05 0.00 0.35 0.00 0.00 41.96 41.60 1ijg s TYR 100 CO 0.30 -0.26 0.20 1.14 -1.34 0.00 0.00 175.55 175.59 1ijg s GLN 101 N 0.74 0.10 0.04 4.97 1.03 -1.26 -2.50 119.66 122.79 1ijg s GLN 101 Ca -0.13 0.59 -0.27 0.00 0.04 0.00 0.00 55.36 55.59 1ijg s GLN 101 Cb -0.15 -0.16 0.09 0.00 0.03 0.00 0.00 33.01 32.82 1ijg s GLN 101 CO 0.03 -0.26 0.79 0.21 -2.54 0.00 0.00 175.29 173.52 1ijg s LYS 102 N 2.01 0.97 0.05 9.60 2.36 0.80 -4.97 119.74 130.55 1ijg s LYS 102 Ca -0.01 -0.33 0.06 0.00 -2.55 0.00 0.00 55.97 53.14 1ijg s LYS 102 Cb -0.12 0.45 -0.02 0.00 -1.05 0.00 0.00 37.83 37.09 1ijg s LYS 102 CO -0.07 -0.42 -0.18 -1.21 1.55 0.00 0.00 175.35 175.02 1ijg s GLU 103 N -3.21 1.14 -0.01 4.03 2.02 -1.26 -1.74 118.70 119.67 1ijg s GLU 103 Ca 0.03 -0.88 -0.28 0.00 0.02 0.00 0.00 54.97 53.87 1ijg s GLU 103 Cb -0.01 -1.22 0.06 0.00 0.10 0.00 0.00 34.13 33.06 1ijg s GLU 103 CO -0.09 0.30 0.62 -0.59 0.02 0.00 0.00 175.26 175.52 1ijg s PHE 104 N -0.87 -0.57 0.43 1.61 -0.71 -0.99 -5.00 117.98 111.87 1ijg s PHE 104 Ca 0.04 0.88 -0.23 0.00 -1.04 0.00 0.00 56.93 56.59 1ijg s PHE 104 Cb -0.08 0.39 -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 -1.63 4.02 -0.17 1.99 3.01 -1.26 -1.09 119.74 124.61 1ijg s LYS 105 Ca -0.09 1.52 -0.09 0.00 -1.01 0.00 0.00 55.97 56.30 1ijg s LYS 105 Cb -0.01 -2.42 -0.05 0.00 -1.01 0.00 0.00 37.83 34.34 1ijg s LYS 105 CO 0.06 -0.27 0.13 -0.51 0.51 0.00 0.00 175.35 175.27 1ijg s LEU 106 N -2.88 4.26 -0.25 3.17 1.43 0.10 -0.10 118.68 124.40 1ijg s LEU 106 Ca 0.61 0.32 -0.29 0.00 -1.03 0.00 0.00 54.13 53.73 1ijg s LEU 106 Cb -0.22 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.93 1ijg s LEU 106 CO 0.27 0.27 1.15 -0.47 0.23 0.00 0.00 176.35 177.80 1ijg s TYR 107 N -0.20 3.06 -0.03 0.29 6.14 0.14 -4.86 117.35 121.89 1ijg s TYR 107 Ca 0.11 1.18 -0.08 0.00 0.64 0.00 0.00 57.07 58.92 1ijg s TYR 107 Cb -0.11 -3.55 -0.03 0.00 0.42 0.00 0.00 41.96 38.68 1ijg s TYR 107 CO 0.00 -1.06 -0.16 0.09 0.64 0.00 0.00 175.55 175.06 1ijg n ASN 108 N 6.77 1.42 -4.50 4.32 3.02 -1.26 -4.76 115.26 120.26 1ijg n ASN 108 Ca 0.13 0.22 -0.25 0.00 -0.03 0.00 0.00 54.58 54.64 1ijg n ASN 108 Cb 0.46 -0.50 -0.10 0.00 -0.61 0.00 0.00 39.78 39.03 1ijg n ASN 108 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ijg s TYR 109 N -2.38 2.41 0.21 3.10 6.04 -1.26 -5.04 117.35 120.42 1ijg s TYR 109 Ca -0.13 -0.30 -0.10 0.00 0.04 0.00 0.00 57.07 56.57 1ijg s TYR 109 Cb 0.02 -1.11 0.16 0.00 -1.04 0.00 0.00 41.96 39.99 1ijg s TYR 109 CO 0.19 0.61 1.86 0.07 -1.54 0.00 0.00 175.55 176.75 1ijg h ARG 110 N 2.57 1.03 0.00 4.97 0.11 -2.00 -2.72 114.38 118.33 1ijg h ARG 110 Ca -0.44 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 59.56 1ijg h ARG 110 Cb 1.23 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 32.09 1ijg h ARG 110 CO 0.56 0.71 0.00 -0.25 0.10 0.00 0.00 179.97 181.09 1ijg n ASP 111 N -4.52 0.00 0.00 0.08 10.43 -1.26 -0.94 116.55 120.35 1ijg n ASP 111 Ca 0.07 -0.12 0.00 0.00 2.57 0.00 0.00 54.79 57.31 1ijg n ASP 111 Cb 0.04 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.00 1ijg n ASP 111 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 1ijg n MET 112 N -0.93 0.77 -1.61 -1.24 2.81 -1.03 -5.07 117.12 110.82 1ijg n MET 112 Ca 0.02 -0.85 -0.49 0.00 -1.81 0.00 0.00 57.70 54.57 1ijg n MET 112 Cb 0.01 -0.91 -0.04 0.00 -0.71 0.00 0.00 33.22 31.57 1ijg n MET 112 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1ijg n LYS 113 N -0.20 1.45 -4.01 0.03 4.81 -0.11 -4.99 118.16 115.14 1ijg n LYS 113 Ca 0.00 0.52 -0.09 0.00 -0.87 0.00 0.00 58.31 57.87 1ijg n LYS 113 Cb 0.17 -2.13 -0.08 0.00 0.02 0.00 0.00 35.03 33.00 1ijg n LYS 113 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1ijg s GLU 114 N 0.08 0.95 0.63 1.64 2.02 -1.26 -5.13 118.70 117.63 1ijg s GLU 114 Ca 0.77 -1.21 -0.13 0.00 0.02 0.00 0.00 54.97 54.42 1ijg s GLU 114 Cb -0.83 0.31 -0.02 0.00 0.10 0.00 0.00 34.13 33.69 1ijg s GLU 114 CO 0.48 -0.30 1.04 -1.21 0.02 0.00 0.00 175.26 175.29 1ijg s GLU 115 N -3.96 3.29 -1.69 1.61 0.41 -1.26 -3.56 118.70 113.54 1ijg s GLU 115 Ca 0.15 1.00 0.00 0.00 -0.41 0.00 0.00 54.97 55.71 1ijg s GLU 115 Cb 0.05 -2.04 0.00 0.00 -1.78 0.00 0.00 34.13 30.37 1ijg s GLU 115 CO -0.03 -0.82 0.00 -3.47 -0.49 0.00 0.00 175.26 170.45 1ijg n ASP 116 N -2.53 -5.63 -4.90 -0.19 2.03 -1.26 -4.99 116.55 99.07 1ijg n ASP 116 Ca 0.08 -0.01 -0.26 0.00 0.52 0.00 0.00 54.79 55.12 1ijg n ASP 116 Cb 0.53 -4.67 -0.04 0.00 -0.72 0.00 0.00 41.12 36.23 1ijg n ASP 116 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1ijg s MET 117 N -4.95 3.27 0.42 -0.67 1.75 -1.23 -4.09 119.30 113.79 1ijg s MET 117 Ca 0.00 -0.68 0.03 0.00 -1.25 0.00 0.00 55.69 53.79 1ijg s MET 117 Cb 0.00 -2.87 -0.03 0.00 2.84 0.00 0.00 34.83 34.78 1ijg s MET 117 CO 0.00 0.51 0.11 0.20 -0.65 0.00 0.00 175.02 175.19 1ijg s GLY 118 N -3.17 2.63 0.02 2.11 0.00 0.85 -4.55 107.32 105.21 1ijg s GLY 118 Ca 0.33 -1.19 0.06 0.00 0.00 0.00 0.00 44.72 43.92 1ijg s GLY 118 CO 0.27 -1.88 -0.17 0.14 0.00 0.00 0.00 173.10 171.46 1ijg s VAL 119 N -3.17 1.35 -0.20 1.40 1.01 -0.41 0.27 120.40 120.66 1ijg s VAL 119 Ca 0.22 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 61.15 1ijg s VAL 119 Cb 0.03 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1ijg s VAL 119 CO 0.13 0.19 0.11 -0.69 0.00 0.00 0.00 175.10 174.85 1ijg s VAL 120 N -0.67 5.24 -0.39 2.92 1.01 -1.26 -0.27 120.40 126.98 1ijg s VAL 120 Ca 0.05 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.04 1ijg s VAL 120 Cb -0.08 -3.39 0.03 0.00 0.00 0.00 0.00 36.38 32.95 1ijg s VAL 120 CO 0.01 0.44 0.23 -0.63 0.00 0.00 0.00 175.10 175.15 1ijg s ILE 121 N 0.38 4.71 0.39 2.22 1.01 -0.32 -4.80 121.20 124.78 1ijg s ILE 121 Ca 0.07 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.70 1ijg s ILE 121 Cb -0.11 -3.65 -0.09 0.00 0.01 0.00 0.00 42.46 38.62 1ijg s ILE 121 CO -0.01 -0.28 0.82 -0.31 0.00 0.00 0.00 174.94 175.16 1ijg s TYR 122 N 1.57 3.40 -0.06 3.97 1.51 -1.26 -1.83 117.35 124.65 1ijg s TYR 122 Ca 0.03 1.29 0.19 0.00 -1.01 0.00 0.00 57.07 57.56 1ijg s TYR 122 Cb -0.19 -2.61 0.40 0.00 -0.11 0.00 0.00 41.96 39.44 1ijg s TYR 122 CO 0.07 -0.07 1.60 -0.97 -1.11 0.00 0.00 175.55 175.07 1ijg h ASN 123 N 1.73 0.00 -5.11 2.29 -1.24 -0.51 -3.35 115.58 109.39 1ijg h ASN 123 Ca -0.48 0.00 0.28 0.00 0.71 0.00 0.00 56.30 56.82 1ijg h ASN 123 Cb 1.18 0.00 -0.15 0.00 0.73 0.00 0.00 38.32 40.08 1ijg h ASN 123 CO 0.64 0.37 0.79 0.54 -1.29 0.00 0.00 177.43 178.48 1ijg s ASN 124 N -6.36 -0.10 0.00 1.15 2.20 -1.26 -4.29 114.94 106.27 1ijg s ASN 124 Ca 0.03 -0.09 0.00 0.00 -0.94 0.00 0.00 52.86 51.85 1ijg s ASN 124 Cb 0.08 0.18 0.00 0.00 -2.00 0.00 0.00 41.25 39.52 1ijg s ASN 124 CO 0.70 -0.32 0.64 0.47 -2.94 0.00 0.00 177.10 175.65 1ijg n ASP 125 N -0.33 0.00 -0.14 3.54 9.92 -1.26 -0.22 116.55 128.07 1ijg n ASP 125 Ca -0.05 0.20 0.02 0.00 -0.53 0.00 0.00 54.79 54.43 1ijg n ASP 125 Cb 0.61 -0.20 0.02 0.00 -0.64 0.00 0.00 41.12 40.91 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 -1.14 0.12 -2.46 -1.24 1.56 -1.26 -4.98 117.12 107.72 1ijg n MET 126 Ca 0.00 -0.88 -0.21 0.00 -0.27 0.00 0.00 57.70 56.35 1ijg n MET 126 Cb 0.11 -1.06 -0.01 0.00 2.15 0.00 0.00 33.22 34.41 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 0.10 -0.66 -2.70 -5.12 0.00 0.70 -4.95 120.51 107.87 1ijg n ALA 127 Ca 0.02 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 1ijg n ALA 127 Cb 0.12 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.23 1ijg n ALA 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ijg s PHE 128 N -3.03 3.62 0.46 0.00 2.99 -1.26 -4.47 117.98 116.28 1ijg s PHE 128 Ca 0.03 1.64 -0.21 0.00 0.00 0.00 0.00 56.93 58.39 1ijg s PHE 128 Cb -0.01 -3.11 -0.09 0.00 0.00 0.00 0.00 43.02 39.80 1ijg s PHE 128 CO 0.04 -0.05 1.01 -1.25 -0.00 0.00 0.00 175.22 174.96 1ijg s PRO 129 N 1.24 3.98 0.10 0.24 0.04 -1.26 -4.49 135.00 134.85 1ijg s PRO 129 Ca 0.50 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 1ijg s PRO 129 Cb -0.20 -2.17 -0.16 0.00 0.04 0.00 0.00 34.50 32.01 1ijg s PRO 129 CO 0.25 -0.26 1.27 1.15 0.04 0.00 0.00 177.00 179.45 1ijg h THR 130 N 1.74 1.30 -0.94 1.26 2.02 0.50 -3.37 112.91 115.43 1ijg h THR 130 Ca -0.49 -2.14 0.20 0.00 0.77 0.00 0.00 66.41 64.75 1ijg h THR 130 Cb 1.21 2.19 -0.18 0.00 -1.74 0.00 0.00 68.15 69.63 1ijg h THR 130 CO 0.60 0.67 -0.19 0.41 0.37 0.00 0.00 175.52 177.38 1ijg n THR 131 N -3.88 -0.39 -0.33 3.16 -1.04 -1.11 -1.09 114.28 109.60 1ijg n THR 131 Ca -0.08 2.14 0.05 0.00 -2.04 0.00 0.00 64.05 64.12 1ijg n THR 131 Cb 0.81 -2.99 0.21 0.00 -1.82 0.00 0.00 70.33 66.53 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 -0.35 -2.82 0.11 -1.90 -0.85 132.00 127.04 1ijg h PRO 132 Ca 0.47 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.37 1ijg h PRO 132 Cb 0.77 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 1ijg h PRO 132 CO -0.95 0.56 -0.42 1.15 -0.21 0.00 0.00 178.00 178.12 1ijg h THR 133 N 0.87 1.28 -0.80 -1.15 2.02 -1.36 -2.48 112.91 111.28 1ijg h THR 133 Ca 0.45 -1.60 0.02 0.00 0.77 0.00 0.00 66.41 66.05 1ijg h THR 133 Cb 0.46 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.28 1ijg h THR 133 CO -0.27 0.53 0.53 -0.07 0.37 0.00 0.00 175.52 176.61 1ijg h LEU 134 N 0.70 0.89 -0.75 2.58 3.38 -0.97 -1.35 115.31 119.79 1ijg h LEU 134 Ca 0.05 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 1ijg h LEU 134 Cb 1.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1ijg h LEU 134 CO 0.10 0.63 -0.42 -0.33 0.09 0.00 0.00 178.44 178.51 1ijg h GLU 135 N 1.04 0.45 0.08 1.13 5.08 -1.06 -0.64 114.58 120.65 1ijg h GLU 135 Ca 0.30 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1ijg h GLU 135 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1ijg h GLU 135 CO -0.07 0.79 -0.04 1.25 -1.00 0.00 0.00 179.01 179.94 1ijg h LEU 136 N 0.37 -0.09 -0.71 1.33 5.85 -0.81 -1.91 115.31 119.34 1ijg h LEU 136 Ca 0.03 -0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.48 1ijg h LEU 136 Cb 0.90 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1ijg h LEU 136 CO 0.08 0.09 -0.46 -0.26 -0.34 0.00 0.00 178.44 177.54 1ijg h PHE 137 N -0.26 0.52 -0.80 1.25 -1.00 -1.31 -2.81 116.94 112.53 1ijg h PHE 137 Ca -0.01 -0.16 -0.05 0.00 2.81 0.00 0.00 57.97 60.56 1ijg h PHE 137 Cb 0.22 -0.11 -0.04 0.00 3.61 0.00 0.00 35.95 39.64 1ijg h PHE 137 CO -0.02 0.82 0.32 0.00 -1.61 0.00 0.00 178.31 177.82 1ijg h ALA 138 N 1.16 1.04 -0.58 2.45 0.00 -1.05 -0.71 119.26 121.58 1ijg h ALA 138 Ca 0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1ijg h ALA 138 Cb 0.95 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1ijg h ALA 138 CO 0.08 0.67 0.12 0.00 0.00 0.00 0.00 179.25 180.12 1ijg h ALA 139 N 1.17 1.12 -0.16 0.00 0.00 -1.22 -1.25 119.26 118.92 1ijg h ALA 139 Ca 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ijg h ALA 139 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ijg h ALA 139 CO -0.02 0.59 0.03 1.49 0.00 0.00 0.00 179.25 181.33 1ijg h GLU 140 N 0.87 0.27 -0.61 0.00 4.57 -1.15 -0.04 114.58 118.50 1ijg h GLU 140 Ca 0.18 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.27 1ijg h GLU 140 Cb 0.35 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1ijg h GLU 140 CO 0.00 0.44 0.29 -0.07 -1.18 0.00 0.00 179.01 178.50 1ijg h LEU 141 N 0.05 0.77 -0.62 1.64 3.38 -0.96 -1.13 115.31 118.44 1ijg h LEU 141 Ca 0.05 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 1ijg h LEU 141 Cb 0.31 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ijg h LEU 141 CO 0.00 0.65 -0.38 0.00 0.09 0.00 0.00 178.44 178.80 1ijg h ALA 142 N 1.47 0.80 -0.43 1.53 0.00 -0.97 -1.31 119.26 120.35 1ijg h ALA 142 Ca 0.21 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1ijg h ALA 142 Cb 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1ijg h ALA 142 CO -0.03 0.65 0.06 1.49 0.00 0.00 0.00 179.25 181.42 1ijg h GLU 143 N 0.55 0.72 -0.72 0.00 4.81 -0.24 -1.54 114.58 118.17 1ijg h GLU 143 Ca 0.05 -0.20 -0.06 0.00 -0.13 0.00 0.00 59.36 59.02 1ijg h GLU 143 Cb 0.90 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1ijg h GLU 143 CO 0.08 0.76 0.20 -0.07 -0.73 0.00 0.00 179.01 179.25 1ijg h LEU 144 N 0.57 1.06 -0.98 1.64 3.38 -1.13 -1.49 115.31 118.37 1ijg h LEU 144 Ca 0.13 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1ijg h LEU 144 Cb 0.40 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1ijg h LEU 144 CO 0.01 1.00 0.64 0.50 0.09 0.00 0.00 178.44 180.68 1ijg h LYS 145 N 1.07 1.19 -0.35 1.13 1.63 -0.97 -0.23 116.57 120.03 1ijg h LYS 145 Ca 0.23 -0.07 -0.13 0.00 -0.85 0.00 0.00 60.65 59.83 1ijg h LYS 145 Cb 0.33 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.69 1ijg h LYS 145 CO -0.00 0.79 -0.28 1.49 -3.45 0.00 0.00 179.45 177.99 1ijg h GLU 146 N 1.22 0.81 -0.59 1.90 4.81 -0.79 -1.42 114.58 120.53 1ijg h GLU 146 Ca 0.39 -0.40 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1ijg h GLU 146 Cb 0.02 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1ijg h GLU 146 CO -0.13 1.04 0.31 0.82 -0.73 0.00 0.00 179.01 180.31 1ijg h ILE 147 N 0.60 1.20 -0.97 2.32 2.04 -0.78 -1.06 117.51 120.87 1ijg h ILE 147 Ca 0.07 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1ijg h ILE 147 Cb 0.85 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1ijg h ILE 147 CO 0.07 0.22 0.64 0.40 0.00 0.00 0.00 178.15 179.48 1ijg h ILE 148 N 0.80 1.23 -0.23 -0.67 2.04 -0.94 -0.79 117.51 118.95 1ijg h ILE 148 Ca 0.21 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1ijg h ILE 148 Cb 0.07 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 35.97 1ijg h ILE 148 CO -0.03 0.24 0.15 0.28 0.00 0.00 0.00 178.15 178.78 1ijg h SER 149 N 1.29 0.27 -0.73 1.72 0.02 -0.37 0.67 113.55 116.42 1ijg h SER 149 Ca 0.36 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.28 1ijg h SER 149 Cb -0.12 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 1ijg h SER 149 CO -0.09 0.22 0.43 0.58 -1.14 0.00 0.00 176.83 176.83 1ijg h VAL 150 N 0.30 1.21 -0.24 2.27 2.07 -0.63 -1.56 116.25 119.68 1ijg h VAL 150 Ca 0.08 -0.48 -0.13 0.00 0.82 0.00 0.00 66.70 66.99 1ijg h VAL 150 Cb -0.01 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1ijg h VAL 150 CO -0.02 0.22 -0.35 -1.13 0.02 0.00 0.00 177.57 176.32 1ijg h ASN 151 N 1.00 0.72 -0.55 0.57 -0.00 -0.86 -1.68 115.58 114.77 1ijg h ASN 151 Ca 0.26 -0.51 -0.06 0.00 -0.00 0.00 0.00 56.30 55.99 1ijg h ASN 151 Cb -0.02 -0.20 -0.03 0.00 -0.00 0.00 0.00 38.32 38.07 1ijg h ASN 151 CO -0.05 1.09 0.14 0.06 -0.00 0.00 0.00 177.43 178.68 1ijg h GLN 152 N 0.37 0.92 -0.27 6.67 3.07 -0.76 -2.47 115.11 122.63 1ijg h GLN 152 Ca 0.02 -0.20 -0.10 0.00 0.09 0.00 0.00 58.65 58.47 1ijg h GLN 152 Cb 0.93 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 28.34 1ijg h GLN 152 CO 0.08 0.82 -0.26 -0.97 0.09 0.00 0.00 178.83 178.59 1ijg h ASN 153 N 0.88 0.53 0.06 0.06 -0.73 -1.23 -2.68 115.58 112.46 1ijg h ASN 153 Ca 0.19 -0.18 -0.00 0.00 1.87 0.00 0.00 56.30 58.18 1ijg h ASN 153 Cb 0.32 -0.14 -0.00 0.00 0.27 0.00 0.00 38.32 38.76 1ijg h ASN 153 CO -0.00 0.78 -0.01 0.00 -0.37 0.00 0.00 177.43 177.83 1ijg h ALA 154 N 1.26 1.20 0.00 1.57 0.00 -0.82 -1.16 119.26 121.32 1ijg h ALA 154 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ijg h ALA 154 Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ijg h ALA 154 CO 0.05 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.35 1ijg n GLN 155 N -3.39 0.08 0.13 0.00 1.13 -1.01 -2.35 117.38 111.98 1ijg n GLN 155 Ca -0.03 0.22 0.13 0.00 -1.94 0.00 0.00 57.00 55.38 1ijg n GLN 155 Cb 0.09 -1.50 0.35 0.00 0.11 0.00 0.00 30.24 29.29 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 -1.39 -3.39 116.57 110.18 1ijg h LYS 156 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1ijg h LYS 156 Cb 0.19 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.10 1ijg h LYS 156 CO 0.00 0.00 -0.91 0.25 -0.57 0.00 0.00 179.45 178.22 1ijg n THR 157 N -2.46 0.63 0.26 -0.16 -2.24 -0.99 -4.90 114.28 104.42 1ijg n THR 157 Ca 0.05 -4.58 0.12 0.00 -2.27 0.00 0.00 64.05 57.38 1ijg n THR 157 Cb 0.45 -1.82 0.17 0.00 -2.10 0.00 0.00 70.33 67.03 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 3.91 0.00 -5.56 -0.78 0.13 -1.78 -3.40 132.00 124.52 1ijg h PRO 158 Ca 0.12 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.70 1ijg h PRO 158 Cb 0.79 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.62 1ijg h PRO 158 CO 0.62 0.00 -0.83 0.08 -0.23 0.00 0.00 178.00 177.63 1ijg s VAL 159 N -3.22 1.37 -0.08 1.56 1.01 -1.26 -0.63 120.40 119.16 1ijg s VAL 159 Ca 0.06 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1ijg s VAL 159 Cb 0.07 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.31 1ijg s VAL 159 CO 0.68 0.39 -0.10 -0.22 0.00 0.00 0.00 175.10 175.85 1ijg s LEU 160 N -0.30 1.49 -0.17 3.92 0.20 -0.37 -4.90 118.68 118.56 1ijg s LEU 160 Ca 0.04 -0.29 -0.01 0.00 0.69 0.00 0.00 54.13 54.56 1ijg s LEU 160 Cb -0.08 -0.81 -0.00 0.00 -0.43 0.00 0.00 46.19 44.87 1ijg s LEU 160 CO -0.00 -0.02 -0.12 -0.63 -0.29 0.00 0.00 176.35 175.29 1ijg s ILE 161 N 0.99 2.86 -0.22 6.68 1.01 -1.26 -0.17 121.20 131.09 1ijg s ILE 161 Ca -0.09 -0.69 -0.13 0.00 0.00 0.00 0.00 60.65 59.74 1ijg s ILE 161 Cb -0.15 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 1ijg s ILE 161 CO -0.00 0.50 0.29 -0.60 0.00 0.00 0.00 174.94 175.12 1ijg s ARG 162 N 0.96 4.12 -0.27 2.79 3.52 -0.01 -4.97 118.95 125.10 1ijg s ARG 162 Ca -0.02 -0.02 -0.01 0.00 -0.13 0.00 0.00 55.73 55.56 1ijg s ARG 162 Cb -0.15 -3.54 0.08 0.00 -1.56 0.00 0.00 34.95 29.78 1ijg s ARG 162 CO -0.01 -0.00 0.05 0.00 -0.81 0.00 0.00 175.30 174.52 1ijg s ALA 163 N 1.22 1.55 -0.08 6.12 0.00 -1.26 -2.17 121.76 127.14 1ijg s ALA 163 Ca 0.14 -1.39 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 1ijg s ALA 163 Cb -0.14 -1.48 -0.29 0.00 0.00 0.00 0.00 23.12 21.20 1ijg s ALA 163 CO 0.06 -1.44 0.65 -2.95 0.00 0.00 0.00 175.76 172.08 1ijg h ASN 164 N 8.08 0.48 -2.75 0.00 7.08 -1.75 -3.41 115.58 123.31 1ijg h ASN 164 Ca -0.15 -0.89 -0.54 0.00 -3.08 0.00 0.00 56.30 51.64 1ijg h ASN 164 Cb 1.05 -0.16 -0.07 0.00 -2.08 0.00 0.00 38.32 37.07 1ijg h ASN 164 CO 0.43 1.64 1.06 -1.81 -2.08 0.00 0.00 177.43 176.66 1ijg s ASP 165 N -7.12 6.21 0.00 6.14 -0.00 -1.26 -4.55 116.67 116.08 1ijg s ASP 165 Ca -0.18 -0.03 0.00 0.00 -0.00 0.00 0.00 52.55 52.34 1ijg s ASP 165 Cb 0.04 -2.55 0.00 0.00 -0.00 0.00 0.00 42.92 40.41 1ijg s ASP 165 CO 0.81 -1.71 0.00 -3.20 -0.00 0.00 0.00 175.17 171.07 1ijg n ASN 166 N 9.27 1.49 -0.31 0.27 2.85 -1.26 -4.76 115.26 122.81 1ijg n ASN 166 Ca 0.08 -0.00 0.16 0.00 -0.11 0.00 0.00 54.58 54.71 1ijg n ASN 166 Cb 0.49 0.30 0.41 0.00 1.24 0.00 0.00 39.78 42.22 1ijg n ASN 166 CO 0.00 0.00 0.00 -1.13 -2.11 0.00 0.00 177.26 174.02 1ijg h ASN 167 N 0.00 0.62 0.00 1.20 -0.73 -1.97 -3.30 115.58 111.40 1ijg h ASN 167 Ca 0.00 0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.24 1ijg h ASN 167 Cb 0.00 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.55 1ijg h ASN 167 CO 0.00 0.23 0.00 0.00 -0.37 0.00 0.00 177.43 177.29 1ijg n GLN 168 N -4.65 0.00 -3.97 6.67 1.13 -1.26 -4.95 117.38 110.35 1ijg n GLN 168 Ca 0.22 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.93 1ijg n GLN 168 Cb 0.64 -0.26 -0.06 0.00 0.11 0.00 0.00 30.24 30.66 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 -0.65 4.23 -0.26 1.08 2.96 -1.24 -5.08 118.68 119.71 1ijg s LEU 169 Ca 0.00 0.34 -0.15 0.00 -0.22 0.00 0.00 54.13 54.10 1ijg s LEU 169 Cb 0.00 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 1ijg s LEU 169 CO 0.00 0.33 0.37 -0.55 -1.32 0.00 0.00 176.35 175.18 1ijg s SER 170 N -1.44 6.27 0.21 3.68 0.15 -1.26 -4.37 113.70 116.94 1ijg s SER 170 Ca 0.20 0.31 -0.08 0.00 0.70 0.00 0.00 55.95 57.08 1ijg s SER 170 Cb -0.12 -2.21 0.16 0.00 -1.71 0.00 0.00 66.02 62.14 1ijg s SER 170 CO 0.11 -0.16 1.81 0.25 1.20 0.00 0.00 173.24 176.44 1ijg h LEU 171 N 8.45 1.05 -1.03 3.45 6.46 -1.91 -1.67 115.31 130.11 1ijg h LEU 171 Ca -0.32 -0.14 0.01 0.00 -0.12 0.00 0.00 57.88 57.31 1ijg h LEU 171 Cb 1.16 -0.27 -0.05 0.00 -0.73 0.00 0.00 40.66 40.77 1ijg h LEU 171 CO 0.65 0.89 0.66 0.50 -0.62 0.00 0.00 178.44 180.52 1ijg h LYS 172 N 1.13 1.30 -0.57 1.25 1.63 -2.00 -1.97 116.57 117.34 1ijg h LYS 172 Ca 0.27 -0.08 -0.10 0.00 -0.85 0.00 0.00 60.65 59.89 1ijg h LYS 172 Cb 0.12 -0.29 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 1ijg h LYS 172 CO -0.03 0.86 -0.04 1.96 -3.45 0.00 0.00 179.45 178.74 1ijg h GLN 173 N 1.33 1.03 -0.78 1.90 1.08 -1.83 -1.21 115.11 116.64 1ijg h GLN 173 Ca 0.36 -0.34 0.08 0.00 -1.45 0.00 0.00 58.65 57.30 1ijg h GLN 173 Cb -0.14 -0.09 -0.07 0.00 -0.05 0.00 0.00 27.48 27.13 1ijg h GLN 173 CO -0.08 1.03 0.44 0.28 -0.95 0.00 0.00 178.83 179.55 1ijg h VAL 174 N 0.93 0.93 -0.30 -0.54 2.07 -0.60 0.45 116.25 119.20 1ijg h VAL 174 Ca 0.16 -0.26 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 1ijg h VAL 174 Cb 0.60 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1ijg h VAL 174 CO 0.04 0.14 -0.44 1.88 0.02 0.00 0.00 177.57 179.21 1ijg h TYR 175 N 0.77 1.01 -0.90 1.57 -1.99 -1.09 -0.92 116.97 115.42 1ijg h TYR 175 Ca 0.37 -0.34 0.04 0.00 2.00 0.00 0.00 58.73 60.80 1ijg h TYR 175 Cb 0.30 -0.20 -0.05 0.00 2.00 0.00 0.00 36.73 38.78 1ijg h TYR 175 CO -0.07 1.14 0.59 -0.91 -0.00 0.00 0.00 178.16 178.92 1ijg h ASN 176 N 0.59 0.96 1.07 3.88 -0.26 -0.48 -1.50 115.58 119.83 1ijg h ASN 176 Ca 0.03 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1ijg h ASN 176 Cb 1.04 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 38.08 1ijg h ASN 176 CO 0.10 0.65 -0.15 1.67 -1.06 0.00 0.00 177.43 178.64 1ijg n GLN 177 N -4.45 0.12 -1.66 0.81 0.00 0.08 -4.93 117.38 107.35 1ijg n GLN 177 Ca 0.12 0.08 -0.58 0.00 -0.00 0.00 0.00 57.00 56.63 1ijg n GLN 177 Cb 0.12 -1.62 -0.07 0.00 0.00 0.00 0.00 30.24 28.66 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 -1.83 1.72 1.00 3.69 9.36 -0.36 -4.88 117.16 125.87 1ijg n TYR 178 Ca 0.06 0.70 0.11 0.00 3.32 0.00 0.00 57.90 62.09 1ijg n TYR 178 Cb 0.38 -2.36 0.06 0.00 -0.63 0.00 0.00 39.34 36.80 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 4.00 0.02 -1.45 2.98 1.02 -1.26 -4.98 120.64 120.97 1ijg n GLU 179 Ca 0.24 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 57.25 1ijg n GLU 179 Cb 0.11 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 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 1.50 1.14 0.90 0.62 0.00 -1.26 -4.88 105.19 103.21 1ijg n GLY 180 Ca 0.05 -0.46 0.09 0.00 0.00 0.00 0.00 46.02 45.69 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 0.02 3.14 -3.63 1.61 2.04 -1.26 -5.01 115.26 112.18 1ijg n ASN 181 Ca -0.12 -1.92 -0.00 0.00 -0.44 0.00 0.00 54.58 52.10 1ijg n ASN 181 Cb 0.42 -0.26 -0.01 0.00 -2.53 0.00 0.00 39.78 37.40 1ijg n ASN 181 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ijg s ALA 182 N -1.12 -2.15 0.60 -2.53 0.00 -1.26 -5.15 121.76 110.16 1ijg s ALA 182 Ca 0.31 0.81 -0.18 0.00 0.00 0.00 0.00 51.96 52.90 1ijg s ALA 182 Cb 0.17 0.30 -0.05 0.00 0.00 0.00 0.00 23.12 23.54 1ijg s ALA 182 CO 0.23 -0.96 0.88 -2.30 0.00 0.00 0.00 175.76 173.61 1ijg n PRO 183 N -0.41 0.80 -1.98 0.00 -0.02 -1.26 -4.84 135.00 127.28 1ijg n PRO 183 Ca -0.07 0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 1ijg n PRO 183 Cb 0.62 -2.08 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 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 2.74 -0.16 -1.45 1.01 -1.26 -4.98 120.40 114.75 1ijg s VAL 184 Ca 0.75 0.54 0.02 0.00 0.00 0.00 0.00 61.98 63.29 1ijg s VAL 184 Cb -0.42 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.63 1ijg s VAL 184 CO 0.48 0.05 -0.20 -0.63 0.00 0.00 0.00 175.10 174.79 1ijg s ILE 185 N 0.97 2.01 -0.51 2.22 1.01 -1.26 -5.07 121.20 120.57 1ijg s ILE 185 Ca 0.68 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 1ijg s ILE 185 Cb -0.42 -1.80 0.13 0.00 0.01 0.00 0.00 42.46 40.38 1ijg s ILE 185 CO 0.33 0.54 0.32 0.12 0.00 0.00 0.00 174.94 176.24 1ijg s PHE 186 N 1.07 3.49 -0.08 3.97 5.36 -1.26 -5.02 117.98 125.51 1ijg s PHE 186 Ca -0.01 -2.57 0.05 0.00 -0.96 0.00 0.00 56.93 53.44 1ijg s PHE 186 Cb -0.14 -3.21 -0.01 0.00 -0.34 0.00 0.00 43.02 39.32 1ijg s PHE 186 CO -0.07 -0.91 -0.24 0.00 -1.46 0.00 0.00 175.22 172.54 1ijg s ALA 187 N 0.54 2.16 -0.29 11.12 0.00 -1.26 -5.10 121.76 128.93 1ijg s ALA 187 Ca 0.13 -1.00 -0.22 0.00 0.00 0.00 0.00 51.96 50.87 1ijg s ALA 187 Cb -0.22 -0.74 0.14 0.00 0.00 0.00 0.00 23.12 22.31 1ijg s ALA 187 CO -0.04 0.35 1.06 -1.58 0.00 0.00 0.00 175.76 175.56 1ijg s HIS 188 N 0.09 -0.45 0.66 0.00 5.04 -1.26 -5.02 115.29 114.35 1ijg s HIS 188 Ca -0.11 1.02 0.39 0.00 -1.54 0.00 0.00 55.06 54.81 1ijg s HIS 188 Cb -0.16 0.36 2.12 0.00 0.04 0.00 0.00 32.58 34.94 1ijg s HIS 188 CO 0.06 -0.22 2.21 1.05 -2.34 0.00 0.00 174.74 175.50 1ijg h GLU 189 N 4.78 0.00 -0.53 2.88 4.11 -2.04 -2.49 114.58 121.29 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 -2.03 2.42 -2.61 1.06 0.00 -1.26 -4.92 120.51 113.16 1ijg n ALA 190 Ca -0.02 -0.97 -0.43 0.00 0.00 0.00 0.00 53.44 52.01 1ijg n ALA 190 Cb 0.19 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 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 -1.09 3.75 0.00 0.00 1.43 -0.94 -5.03 118.68 116.80 1ijg s LEU 191 Ca 0.38 0.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.18 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 -1.12 0.00 0.47 0.23 0.00 0.00 176.35 176.20 1ijg n ASP 192 N 7.49 -0.70 0.02 2.29 9.92 -1.26 -4.91 116.55 129.40 1ijg n ASP 192 Ca 0.12 -0.19 0.11 0.00 -0.53 0.00 0.00 54.79 54.31 1ijg n ASP 192 Cb 0.48 0.00 0.03 0.00 -0.64 0.00 0.00 41.12 41.00 1ijg n ASP 192 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1ijg n SER 193 N -1.62 0.62 -0.86 -2.24 7.64 -1.26 -3.74 113.62 112.16 1ijg n SER 193 Ca 0.00 -0.24 0.12 0.00 1.01 0.00 0.00 58.87 59.76 1ijg n SER 193 Cb 0.00 0.75 0.08 0.00 -1.01 0.00 0.00 64.21 64.03 1ijg n SER 193 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1ijg n ASP 194 N -1.92 2.80 -0.20 6.43 5.75 -1.26 -4.49 116.55 123.66 1ijg n ASP 194 Ca 0.02 -1.90 0.01 0.00 -0.01 0.00 0.00 54.79 52.91 1ijg n ASP 194 Cb 0.43 0.08 0.12 0.00 -1.03 0.00 0.00 41.12 40.72 1ijg n ASP 194 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1ijg h SER 195 N 4.24 0.03 -4.29 -1.12 0.87 -1.91 -3.43 113.55 107.94 1ijg h SER 195 Ca 0.00 0.11 -0.61 0.00 -1.23 0.00 0.00 61.79 60.06 1ijg h SER 195 Cb 0.94 0.14 -0.26 0.00 -0.44 0.00 0.00 62.40 62.79 1ijg h SER 195 CO 0.00 0.02 -0.85 -0.63 -0.53 0.00 0.00 176.83 174.84 1ijg s ILE 196 N -6.10 1.79 -0.15 2.23 -1.09 -1.26 -2.48 121.20 114.14 1ijg s ILE 196 Ca -0.13 -1.24 -0.07 0.00 -2.23 0.00 0.00 60.65 56.98 1ijg s ILE 196 Cb 0.18 -1.55 0.06 0.00 -1.58 0.00 0.00 42.46 39.58 1ijg s ILE 196 CO 0.74 0.26 0.35 -0.70 -1.23 0.00 0.00 174.94 174.36 1ijg s GLU 197 N -1.16 0.29 -0.15 2.79 2.12 -0.92 -5.00 118.70 116.67 1ijg s GLU 197 Ca 0.09 0.78 -0.06 0.00 0.36 0.00 0.00 54.97 56.15 1ijg s GLU 197 Cb -0.09 0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.30 1ijg s GLU 197 CO 0.02 -0.21 0.04 0.08 -0.54 0.00 0.00 175.26 174.66 1ijg s VAL 198 N 1.85 4.64 0.02 3.70 1.01 -1.26 -0.83 120.40 129.54 1ijg s VAL 198 Ca -0.06 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.91 1ijg s VAL 198 Cb -0.10 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 1ijg s VAL 198 CO -0.11 0.52 -0.26 -0.36 0.00 0.00 0.00 175.10 174.89 1ijg s PHE 199 N -0.10 2.32 -0.27 5.22 0.40 0.76 -4.99 117.98 121.32 1ijg s PHE 199 Ca 0.06 -0.42 -0.15 0.00 -0.60 0.00 0.00 56.93 55.81 1ijg s PHE 199 Cb -0.12 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 1ijg s PHE 199 CO 0.01 0.07 0.39 0.15 0.70 0.00 0.00 175.22 176.55 1ijg s LYS 200 N -1.02 4.01 -0.24 0.44 -0.14 -1.26 -1.24 119.74 120.30 1ijg s LYS 200 Ca 0.11 0.07 0.10 0.00 -1.36 0.00 0.00 55.97 54.89 1ijg s LYS 200 Cb -0.10 -3.66 0.44 0.00 -1.68 0.00 0.00 37.83 32.83 1ijg s LYS 200 CO 0.01 -0.29 1.20 0.25 -0.76 0.00 0.00 175.35 175.76 1ijg n THR 201 N 5.13 2.28 -2.50 2.17 -2.24 0.20 -4.97 114.28 114.34 1ijg n THR 201 Ca -0.08 -3.59 -0.40 0.00 -2.27 0.00 0.00 64.05 57.71 1ijg n THR 201 Cb 0.51 -0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 68.14 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 7.30 -0.25 3.42 -4.77 -1.17 -4.50 116.67 113.32 1ijg s ASP 202 Ca 0.43 2.24 -0.10 0.00 -3.30 0.00 0.00 52.55 51.82 1ijg s ASP 202 Cb 0.39 -2.62 -0.04 0.00 -1.09 0.00 0.00 42.92 39.55 1ijg s ASP 202 CO -0.03 -0.12 0.14 0.00 0.70 0.00 0.00 175.17 175.86 1ijg s ALA 203 N -1.12 3.44 0.12 2.11 0.00 -1.26 -5.04 121.76 120.00 1ijg s ALA 203 Ca 0.44 -1.02 -0.35 0.00 0.00 0.00 0.00 51.96 51.03 1ijg s ALA 203 Cb -0.31 -2.28 -0.17 0.00 0.00 0.00 0.00 23.12 20.35 1ijg s ALA 203 CO 0.40 -0.39 1.13 -0.35 0.00 0.00 0.00 175.76 176.55 1ijg n PRO 204 N 4.71 0.83 -2.51 0.00 -0.04 -1.26 -4.82 135.00 131.91 1ijg n PRO 204 Ca -0.15 0.30 -0.43 0.00 -0.04 0.00 0.00 63.50 63.18 1ijg n PRO 204 Cb 0.52 -1.78 -0.02 0.00 -0.04 0.00 0.00 33.50 32.17 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 -0.08 2.79 0.00 0.54 5.04 -1.26 -4.81 117.35 119.58 1ijg s TYR 205 Ca 0.78 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 56.30 1ijg s TYR 205 Cb -0.96 -4.04 0.00 0.00 0.35 0.00 0.00 41.96 37.31 1ijg s TYR 205 CO 0.52 -1.40 0.77 1.33 -1.34 0.00 0.00 175.55 175.43 1ijg n VAL 206 N 6.40 0.58 -0.16 3.14 0.24 -1.26 -4.83 118.33 122.44 1ijg n VAL 206 Ca 0.14 -0.62 -0.02 0.00 -2.04 0.00 0.00 64.34 61.80 1ijg n VAL 206 Cb 0.47 0.74 0.07 0.00 -1.47 0.00 0.00 33.84 33.66 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 0.97 0.65 -1.01 3.34 2.07 -1.93 -0.18 116.25 120.17 1ijg h VAL 207 Ca 0.00 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1ijg h VAL 207 Cb 0.62 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1ijg h VAL 207 CO 0.00 0.03 0.67 -2.24 0.02 0.00 0.00 177.57 176.05 1ijg h ASP 208 N 0.17 1.15 -0.13 0.57 -0.00 -1.99 0.35 116.42 116.56 1ijg h ASP 208 Ca 0.26 -0.03 -0.03 0.00 -0.00 0.00 0.00 57.03 57.23 1ijg h ASP 208 Cb 0.38 -0.29 -0.00 0.00 -0.00 0.00 0.00 39.33 39.42 1ijg h ASP 208 CO -0.38 0.83 -0.05 0.11 -0.00 0.00 0.00 179.24 179.75 1ijg h LYS 209 N 1.36 0.25 -1.00 4.15 1.57 -1.69 -1.56 116.57 119.65 1ijg h LYS 209 Ca 0.37 -0.11 0.10 0.00 -1.87 0.00 0.00 60.65 59.15 1ijg h LYS 209 Cb -0.15 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.07 1ijg h LYS 209 CO -0.08 0.58 0.64 -0.07 -0.57 0.00 0.00 179.45 179.94 1ijg h LEU 210 N -0.08 0.96 -0.91 2.94 3.38 -0.75 0.50 115.31 121.35 1ijg h LEU 210 Ca 0.03 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1ijg h LEU 210 Cb 0.49 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1ijg h LEU 210 CO 0.02 0.55 0.35 -1.13 0.09 0.00 0.00 178.44 178.32 1ijg h ASN 211 N 1.05 1.04 -0.02 -0.43 -1.24 -0.63 0.79 115.58 116.14 1ijg h ASN 211 Ca 0.48 -0.13 -0.07 0.00 0.71 0.00 0.00 56.30 57.28 1ijg h ASN 211 Cb 0.39 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.15 1ijg h ASN 211 CO -0.23 0.90 -0.18 0.00 -1.29 0.00 0.00 177.43 176.62 1ijg h ALA 212 N 1.26 1.29 -0.31 1.57 0.00 0.06 -1.36 119.26 121.77 1ijg h ALA 212 Ca 0.27 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1ijg h ALA 212 Cb 0.15 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ijg h ALA 212 CO -0.03 0.47 -0.44 0.37 0.00 0.00 0.00 179.25 179.62 1ijg h GLN 213 N 0.34 0.85 -0.77 0.00 5.75 -0.24 -1.75 115.11 119.29 1ijg h GLN 213 Ca 0.06 -0.50 0.04 0.00 -0.15 0.00 0.00 58.65 58.11 1ijg h GLN 213 Cb 0.52 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 29.07 1ijg h GLN 213 CO 0.03 1.13 0.51 -0.22 -2.65 0.00 0.00 178.83 177.63 1ijg h LYS 214 N 0.63 0.89 -0.15 1.69 3.64 -0.35 0.14 116.57 123.06 1ijg h LYS 214 Ca 0.03 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 1ijg h LYS 214 Cb 1.04 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1ijg h LYS 214 CO 0.10 0.59 -0.40 -0.91 -2.27 0.00 0.00 179.45 176.56 1ijg h ASN 215 N 0.91 0.35 -0.33 4.20 2.35 -0.97 -0.49 115.58 121.61 1ijg h ASN 215 Ca 0.31 -0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 1ijg h ASN 215 Cb 0.09 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1ijg h ASN 215 CO -0.09 0.72 -0.08 0.00 -1.65 0.00 0.00 177.43 176.33 1ijg h ALA 216 N 1.30 0.45 -0.48 -0.83 0.00 0.06 0.55 119.26 120.31 1ijg h ALA 216 Ca 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1ijg h ALA 216 Cb 0.84 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1ijg h ALA 216 CO 0.07 0.29 0.25 0.28 0.00 0.00 0.00 179.25 180.13 1ijg h VAL 217 N 0.41 1.18 -0.66 0.00 2.07 -0.69 -0.42 116.25 118.14 1ijg h VAL 217 Ca 0.08 -0.48 0.02 0.00 0.82 0.00 0.00 66.70 67.14 1ijg h VAL 217 Cb 0.57 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1ijg h VAL 217 CO 0.03 0.19 0.42 -0.25 0.02 0.00 0.00 177.57 177.99 1ijg h TRP 218 N 0.63 0.79 0.00 1.57 2.91 -0.84 -1.38 115.95 119.64 1ijg h TRP 218 Ca 0.17 0.02 -0.08 0.00 1.13 0.00 0.00 58.89 60.13 1ijg h TRP 218 Cb 0.08 -0.26 -0.01 0.00 -0.51 0.00 0.00 29.16 28.46 1ijg h TRP 218 CO -0.01 0.47 -0.37 -0.91 -1.03 0.00 0.00 178.44 176.58 1ijg h ASN 219 N 0.84 0.00 -0.31 2.65 2.35 -0.50 0.68 115.58 121.29 1ijg h ASN 219 Ca 0.26 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 1ijg h ASN 219 Cb -0.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1ijg h ASN 219 CO -0.09 0.37 0.06 -0.08 -1.65 0.00 0.00 177.43 176.04 1ijg h GLU 220 N 0.00 0.51 0.08 0.81 4.81 -0.24 -0.16 114.58 120.38 1ijg h GLU 220 Ca -0.00 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1ijg h GLU 220 Cb 0.73 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1ijg h GLU 220 CO 0.05 0.60 -0.08 1.98 -0.73 0.00 0.00 179.01 180.83 1ijg h MET 221 N 0.34 -0.18 -0.85 1.92 4.05 -0.68 -1.58 114.93 117.96 1ijg h MET 221 Ca 0.10 0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.58 1ijg h MET 221 Cb 0.33 0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.12 1ijg h MET 221 CO 0.00 -0.12 0.53 0.52 0.23 0.00 0.00 176.91 178.07 1ijg h MET 222 N -0.19 0.95 -0.67 0.39 2.86 -0.71 -1.97 114.93 115.61 1ijg h MET 222 Ca 0.01 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 1ijg h MET 222 Cb 0.18 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1ijg h MET 222 CO -0.03 0.63 0.22 1.15 1.06 0.00 0.00 176.91 179.94 1ijg h THR 223 N 0.98 1.24 -0.74 2.22 2.02 -0.69 0.89 112.91 118.83 1ijg h THR 223 Ca 0.36 -0.81 0.02 0.00 0.77 0.00 0.00 66.41 66.75 1ijg h THR 223 Cb 0.13 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1ijg h THR 223 CO -0.16 0.32 0.49 0.15 0.37 0.00 0.00 175.52 176.69 1ijg h PHE 224 N 0.98 0.91 -0.03 3.16 3.57 -0.55 -1.14 116.94 123.85 1ijg h PHE 224 Ca 0.22 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1ijg h PHE 224 Cb 0.25 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1ijg h PHE 224 CO 0.02 0.55 0.00 1.28 -2.23 0.00 0.00 178.31 177.93 1ijg n LEU 225 N -4.44 1.12 -0.24 0.59 4.77 -0.88 -4.68 117.00 113.25 1ijg n LEU 225 Ca 0.09 -0.39 -0.03 0.00 -0.03 0.00 0.00 56.01 55.65 1ijg n LEU 225 Cb 0.07 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1ijg n LEU 225 CO 0.36 0.19 -0.03 0.61 -1.33 0.00 0.00 177.39 177.19 1ijg n GLY 226 N 1.12 0.63 3.89 -0.72 0.00 -0.43 -4.62 105.19 105.06 1ijg n GLY 226 Ca 0.20 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.10 5.17 0.00 -0.61 1.01 0.24 -4.79 121.20 120.12 1ijg s ILE 227 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.76 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 0.11 0.00 1.17 0.00 0.00 0.00 174.94 176.22 1ijg n LYS 228 N 0.32 0.00 -0.04 2.79 4.81 -1.26 -4.06 118.16 120.71 1ijg n LYS 228 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 1ijg n LYS 228 Cb 0.52 -1.65 0.00 0.00 0.02 0.00 0.00 35.03 33.91 1ijg n LYS 228 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1ijg n ASP 247 N 0.00 -0.44 0.16 3.14 2.03 -1.26 -5.13 116.55 115.05 1ijg n ASP 247 Ca 0.00 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.16 1ijg n ASP 247 Cb 0.00 0.07 -0.08 0.00 -0.72 0.00 0.00 41.12 40.39 1ijg n ASP 247 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1ijg h GLU 248 N 0.00 -0.70 -0.47 -0.67 4.81 -2.04 -1.48 114.58 114.03 1ijg h GLU 248 Ca 0.00 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1ijg h GLU 248 Cb 0.00 0.16 -0.09 0.00 0.63 0.00 0.00 28.75 29.45 1ijg h GLU 248 CO 0.00 -0.47 -0.13 1.96 -0.73 0.00 0.00 179.01 179.65 1ijg h GLN 249 N -0.73 -0.01 -0.01 1.92 4.20 -2.01 0.53 115.11 119.00 1ijg h GLN 249 Ca -0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ijg h GLN 249 Cb 0.71 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.50 1ijg h GLN 249 CO -0.19 -0.01 0.00 0.82 -0.67 0.00 0.00 178.83 178.79 1ijg h ILE 250 N -0.01 1.20 -0.66 2.54 2.04 -1.85 -1.10 117.51 119.66 1ijg h ILE 250 Ca 0.23 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1ijg h ILE 250 Cb 0.35 1.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 1ijg h ILE 250 CO -0.49 0.15 0.23 -0.33 0.00 0.00 0.00 178.15 177.71 1ijg h GLU 251 N -0.23 1.00 -0.39 2.37 3.07 -0.94 -2.08 114.58 117.38 1ijg h GLU 251 Ca 0.00 -0.18 -0.09 0.00 -0.50 0.00 0.00 59.36 58.59 1ijg h GLU 251 Cb 0.24 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.98 1ijg h GLU 251 CO 0.00 0.84 -0.13 0.77 -1.40 0.00 0.00 179.01 179.08 1ijg h SER 252 N 0.97 0.69 -0.29 1.42 0.02 0.11 -0.31 113.55 116.16 1ijg h SER 252 Ca 0.22 -0.21 -0.13 0.00 -0.84 0.00 0.00 61.79 60.83 1ijg h SER 252 Cb 0.24 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1ijg h SER 252 CO -0.01 0.85 -0.29 0.28 -1.14 0.00 0.00 176.83 176.51 1ijg h SER 253 N 0.64 0.83 -0.37 3.07 0.02 -0.84 -2.57 113.55 114.32 1ijg h SER 253 Ca 0.11 -0.33 -0.10 0.00 -0.84 0.00 0.00 61.79 60.63 1ijg h SER 253 Cb 0.59 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 1ijg h SER 253 CO 0.04 1.06 -0.15 1.23 -1.14 0.00 0.00 176.83 177.87 1ijg h GLY 254 N 0.93 0.82 0.16 -3.77 0.00 -1.10 -3.00 103.07 97.11 1ijg h GLY 254 Ca 0.08 -0.72 0.19 0.00 0.00 0.00 0.00 47.33 46.88 1ijg h GLY 254 CO 0.07 0.65 0.61 -0.84 0.00 0.00 0.00 176.54 177.04 1ijg h THR 255 N 0.54 0.71 -1.02 4.70 2.02 -0.90 0.45 112.91 119.41 1ijg h THR 255 Ca 0.08 -0.25 0.26 0.00 0.77 0.00 0.00 66.41 67.27 1ijg h THR 255 Cb 0.69 -0.09 -0.12 0.00 -1.74 0.00 0.00 68.15 66.89 1ijg h THR 255 CO 0.05 0.14 0.62 0.58 0.37 0.00 0.00 175.52 177.27 1ijg h VAL 256 N 0.74 0.51 0.09 3.16 2.07 -1.31 0.16 116.25 121.68 1ijg h VAL 256 Ca 0.57 -0.18 -0.24 0.00 0.82 0.00 0.00 66.70 67.67 1ijg h VAL 256 Cb 0.91 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1ijg h VAL 256 CO -0.35 0.09 -1.24 -0.26 0.02 0.00 0.00 177.57 175.82 1ijg h PHE 257 N 0.51 0.36 -0.12 1.57 -1.00 -1.09 -3.39 116.94 113.79 1ijg h PHE 257 Ca 0.65 -0.27 -0.01 0.00 2.81 0.00 0.00 57.97 61.15 1ijg h PHE 257 Cb 1.35 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.89 1ijg h PHE 257 CO -0.01 1.49 0.04 1.25 -1.61 0.00 0.00 178.31 179.47 1ijg h LEU 258 N -0.44 0.18 -0.57 1.54 6.46 -0.34 -3.11 115.31 119.03 1ijg h LEU 258 Ca -0.27 -0.21 0.07 0.00 -0.12 0.00 0.00 57.88 57.34 1ijg h LEU 258 Cb 1.64 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 41.47 1ijg h LEU 258 CO 0.03 0.35 0.27 0.07 -0.62 0.00 0.00 178.44 178.54 1ijg h LYS 259 N 0.01 0.48 -0.77 1.25 2.10 -0.93 0.16 116.57 118.87 1ijg h LYS 259 Ca 0.04 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1ijg h LYS 259 Cb 0.23 -0.11 -0.04 0.00 -0.90 0.00 0.00 32.23 31.42 1ijg h LYS 259 CO -0.00 0.32 0.44 0.66 -2.00 0.00 0.00 179.45 178.87 1ijg h SER 260 N 0.50 0.94 -0.42 7.07 4.64 -1.74 0.07 113.55 124.61 1ijg h SER 260 Ca 0.27 -0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 61.44 1ijg h SER 260 Cb 0.24 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1ijg h SER 260 CO -0.22 0.74 -0.07 0.03 -0.87 0.00 0.00 176.83 176.45 1ijg h ARG 261 N 1.07 0.78 -0.39 4.77 3.08 -1.18 -2.70 114.38 119.82 1ijg h ARG 261 Ca 0.27 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1ijg h ARG 261 Cb -0.00 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1ijg h ARG 261 CO -0.05 0.89 0.24 0.93 -1.07 0.00 0.00 179.97 180.92 1ijg h GLU 262 N 0.61 0.53 -0.01 0.04 5.08 -0.00 0.68 114.58 121.49 1ijg h GLU 262 Ca 0.11 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ijg h GLU 262 Cb 0.58 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1ijg h GLU 262 CO 0.03 0.39 -0.20 0.93 -1.00 0.00 0.00 179.01 179.16 1ijg h GLU 263 N 0.52 -0.30 -0.26 2.33 5.08 -0.96 -1.02 114.58 119.96 1ijg h GLU 263 Ca 0.14 0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1ijg h GLU 263 Cb -0.01 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1ijg h GLU 263 CO -0.03 -0.20 -0.04 0.00 -1.00 0.00 0.00 179.01 177.74 1ijg h ALA 264 N 0.59 1.45 -0.25 3.43 0.00 -1.32 -1.87 119.26 121.28 1ijg h ALA 264 Ca 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1ijg h ALA 264 Cb 0.40 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ijg h ALA 264 CO -0.20 0.39 0.02 0.00 0.00 0.00 0.00 179.25 179.46 1ijg h GLU 266 N 0.36 0.55 -0.41 0.00 5.08 -0.40 -2.50 114.58 117.27 1ijg h GLU 266 Ca 0.09 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 1ijg h GLU 266 Cb 0.21 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1ijg h GLU 266 CO 0.00 1.07 0.14 0.87 -1.00 0.00 0.00 179.01 180.10 1ijg h LYS 267 N 0.38 0.63 -0.39 2.33 1.57 -1.05 -1.33 116.57 118.70 1ijg h LYS 267 Ca -0.04 -0.13 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1ijg h LYS 267 Cb 1.33 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.52 1ijg h LYS 267 CO 0.14 0.61 0.23 0.82 -0.57 0.00 0.00 179.45 180.67 1ijg h ILE 268 N 0.52 1.04 -0.02 1.86 2.04 -1.08 0.57 117.51 122.44 1ijg h ILE 268 Ca 0.13 -0.16 -0.07 0.00 1.00 0.00 0.00 64.86 65.76 1ijg h ILE 268 Cb 0.23 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1ijg h ILE 268 CO -0.01 0.08 -0.33 0.78 0.00 0.00 0.00 178.15 178.68 1ijg h ASN 269 N 0.46 0.04 0.11 1.72 -0.26 -1.25 -1.85 115.58 114.56 1ijg h ASN 269 Ca 0.15 -0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.88 1ijg h ASN 269 Cb 0.01 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1ijg h ASN 269 CO -0.07 0.37 -0.05 -0.33 -1.06 0.00 0.00 177.43 176.29 1ijg h GLU 270 N 0.04 -0.14 -0.78 0.81 5.08 -0.82 0.34 114.58 119.10 1ijg h GLU 270 Ca 0.00 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1ijg h GLU 270 Cb 0.61 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.81 1ijg h GLU 270 CO 0.04 0.16 0.42 1.25 -1.00 0.00 0.00 179.01 179.88 1ijg h LEU 271 N -1.00 0.56 -2.13 1.33 5.85 -0.92 -2.99 115.31 116.02 1ijg h LEU 271 Ca -0.01 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1ijg h LEU 271 Cb 0.36 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1ijg h LEU 271 CO 0.02 0.31 0.00 -1.22 -0.34 0.00 0.00 178.44 177.21 1ijg n TYR 272 N -4.81 0.24 -3.56 1.25 4.01 -0.70 -4.99 117.16 108.61 1ijg n TYR 272 Ca 0.13 -0.24 -0.25 0.00 -0.16 0.00 0.00 57.90 57.39 1ijg n TYR 272 Cb 0.30 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 39.38 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 0.67 -0.54 0.94 2.72 0.00 0.04 -5.00 105.19 104.03 1ijg n GLY 273 Ca 0.10 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.78 0.00 -2.75 0.99 4.77 -0.81 -5.00 117.00 109.42 1ijg n LEU 274 Ca -0.00 -0.56 -0.04 0.00 -0.03 0.00 0.00 56.01 55.37 1ijg n LEU 274 Cb 0.56 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.57 1ijg n LEU 274 CO 0.64 -0.58 -0.02 -3.20 -1.33 0.00 0.00 177.39 172.90 1ijg n ASN 275 N -2.90 1.28 -4.81 -1.43 4.05 -1.26 -4.64 115.26 105.54 1ijg n ASN 275 Ca 0.04 -2.36 -0.33 0.00 0.45 0.00 0.00 54.58 52.38 1ijg n ASN 275 Cb 0.14 -0.41 -0.06 0.00 1.23 0.00 0.00 39.78 40.69 1ijg n ASN 275 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1ijg s VAL 276 N -3.21 4.23 0.02 3.44 -7.23 -1.26 -4.66 120.40 111.73 1ijg s VAL 276 Ca 0.26 1.40 -0.01 0.00 -1.81 0.00 0.00 61.98 61.83 1ijg s VAL 276 Cb 0.39 -3.57 -0.02 0.00 0.56 0.00 0.00 36.38 33.74 1ijg s VAL 276 CO -0.01 -0.29 -0.02 -0.54 -0.31 0.00 0.00 175.10 173.94 1ijg s LYS 277 N -3.16 0.32 0.04 4.82 -0.14 -0.42 -4.90 119.74 116.30 1ijg s LYS 277 Ca 0.63 -0.59 0.08 0.00 -1.36 0.00 0.00 55.97 54.73 1ijg s LYS 277 Cb -0.11 0.12 -0.03 0.00 -1.68 0.00 0.00 37.83 36.13 1ijg s LYS 277 CO 0.15 -0.05 -0.23 0.08 -0.76 0.00 0.00 175.35 174.53 1ijg s VAL 278 N -1.44 1.87 0.22 3.17 1.01 -1.26 -0.61 120.40 123.35 1ijg s VAL 278 Ca -0.16 -1.24 -0.20 0.00 0.00 0.00 0.00 61.98 60.38 1ijg s VAL 278 Cb -0.10 -1.60 0.04 0.00 0.00 0.00 0.00 36.38 34.72 1ijg s VAL 278 CO -0.01 0.31 0.62 -1.59 0.00 0.00 0.00 175.10 174.43 1ijg s LYS 279 N -1.11 1.52 0.09 2.72 -2.85 -0.88 -4.96 119.74 114.26 1ijg s LYS 279 Ca 0.09 -0.81 -0.31 0.00 -1.00 0.00 0.00 55.97 53.95 1ijg s LYS 279 Cb -0.09 0.57 -0.08 0.00 -2.06 0.00 0.00 37.83 36.18 1ijg s LYS 279 CO 0.02 -0.67 1.44 -0.06 0.10 0.00 0.00 175.35 176.18 1ijg s PHE 280 N -3.86 3.03 0.17 1.78 0.40 -1.26 -1.00 117.98 117.25 1ijg s PHE 280 Ca 0.08 0.81 -0.14 0.00 -0.60 0.00 0.00 56.93 57.08 1ijg s PHE 280 Cb -0.03 -3.74 0.11 0.00 0.51 0.00 0.00 43.02 39.87 1ijg s PHE 280 CO -0.02 -2.69 1.79 -0.09 0.70 0.00 0.00 175.22 174.91 1ijg h ARG 281 N 7.23 0.47 -6.10 0.44 2.43 -0.52 -3.34 114.38 114.99 1ijg h ARG 281 Ca -0.41 -0.03 -0.57 0.00 -0.81 0.00 0.00 59.98 58.16 1ijg h ARG 281 Cb 1.20 -0.10 -0.10 0.00 -0.42 0.00 0.00 29.97 30.55 1ijg h ARG 281 CO 0.89 0.31 0.87 -0.47 -1.51 0.00 0.00 179.97 180.05 1ijg s TYR 282 N -6.14 2.47 -0.60 2.20 5.04 -1.26 -4.93 117.35 114.13 1ijg s TYR 282 Ca -0.13 -0.13 0.04 0.00 -2.44 0.00 0.00 57.07 54.42 1ijg s TYR 282 Cb 0.13 -4.48 0.15 0.00 0.35 0.00 0.00 41.96 38.11 1ijg s TYR 282 CO 0.73 -1.85 0.38 0.34 -1.34 0.00 0.00 175.55 173.82 1ijg s ASP 283 N 3.56 4.35 -0.81 4.32 3.68 -1.25 -5.03 116.67 125.48 1ijg s ASP 283 Ca 0.32 -3.42 -0.22 0.00 2.13 0.00 0.00 52.55 51.36 1ijg s ASP 283 Cb -0.11 -1.51 -0.18 0.00 -1.45 0.00 0.00 42.92 39.66 1ijg s ASP 283 CO 0.15 -0.15 2.37 0.00 0.13 0.00 0.00 175.17 177.67 1ijg n ILE 284 N 2.55 -0.01 -1.35 4.11 0.13 -1.26 -5.19 119.36 118.33 1ijg n ILE 284 Ca 0.14 -0.51 0.00 0.00 -1.10 0.00 0.00 62.75 61.28 1ijg n ILE 284 Cb 0.35 -1.53 0.00 0.00 -0.84 0.00 0.00 39.64 37.62 1ijg n ILE 284 CO 0.00 0.00 0.00 0.55 2.80 0.00 0.00 176.55 179.90