#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iu8 n SER 2 N 0.00 6.94 -1.39 7.83 7.64 -1.26 -4.76 113.62 128.61 2iu8 n SER 2 Ca 0.00 -3.27 0.00 0.00 1.01 0.00 0.00 58.87 56.61 2iu8 n SER 2 Cb 0.00 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 61.85 2iu8 n SER 2 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2iu8 n GLN 3 N 1.92 0.23 -2.74 1.43 -0.06 -1.26 -4.89 117.38 112.02 2iu8 n GLN 3 Ca 0.49 0.00 -0.40 0.00 -2.00 0.00 0.00 57.00 55.09 2iu8 n GLN 3 Cb 0.29 -1.38 -0.06 0.00 -4.06 0.00 0.00 30.24 25.03 2iu8 n GLN 3 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 2iu8 s SER 4 N 1.44 7.59 -0.08 1.69 0.01 -1.26 -5.07 113.70 118.02 2iu8 s SER 4 Ca 0.00 1.95 0.02 0.00 1.31 0.00 0.00 55.95 59.23 2iu8 s SER 4 Cb 0.00 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.64 2iu8 s SER 4 CO 0.00 0.11 -0.14 -0.89 0.41 0.00 0.00 173.24 172.73 2iu8 s THR 5 N -1.24 1.33 0.34 1.44 2.01 -1.26 -4.39 115.64 113.88 2iu8 s THR 5 Ca 0.42 -0.58 0.08 0.00 0.31 0.00 0.00 61.69 61.93 2iu8 s THR 5 Cb -0.25 -1.21 -0.07 0.00 0.01 0.00 0.00 72.50 70.98 2iu8 s THR 5 CO 0.31 0.40 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.27 2iu8 s TYR 6 N 0.74 2.32 0.24 4.92 2.02 0.11 -4.93 117.35 122.77 2iu8 s TYR 6 Ca -0.12 -0.59 -0.07 0.00 -0.37 0.00 0.00 57.07 55.91 2iu8 s TYR 6 Cb -0.16 -1.41 -0.06 0.00 -0.40 0.00 0.00 41.96 39.93 2iu8 s TYR 6 CO 0.03 0.48 0.53 -1.54 -1.57 0.00 0.00 175.55 173.47 2iu8 s SER 7 N -3.59 6.54 0.39 2.29 1.04 -1.26 0.10 113.70 119.21 2iu8 s SER 7 Ca 0.33 0.80 0.14 0.00 0.48 0.00 0.00 55.95 57.70 2iu8 s SER 7 Cb 0.04 -2.18 0.97 0.00 0.10 0.00 0.00 66.02 64.95 2iu8 s SER 7 CO 0.16 -0.10 1.85 0.25 0.98 0.00 0.00 173.24 176.38 2iu8 h LEU 8 N 2.29 0.52 -0.28 2.42 5.85 -0.19 -0.06 115.31 125.88 2iu8 h LEU 8 Ca -0.47 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.20 2iu8 h LEU 8 Cb 1.18 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 2iu8 h LEU 8 CO 0.69 0.22 -0.21 -0.08 -0.34 0.00 0.00 178.44 178.72 2iu8 h GLU 9 N 0.53 0.63 -0.07 1.25 4.81 -1.66 -1.67 114.58 118.39 2iu8 h GLU 9 Ca 0.48 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 2iu8 h GLU 9 Cb 1.03 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2iu8 h GLU 9 CO -0.22 0.90 -0.10 1.96 -0.73 0.00 0.00 179.01 180.82 2iu8 h GLN 10 N 0.36 -0.14 -0.25 1.92 4.20 -1.40 -1.32 115.11 118.48 2iu8 h GLN 10 Ca 0.05 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.81 2iu8 h GLN 10 Cb 0.75 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.49 2iu8 h GLN 10 CO 0.05 -0.09 -0.55 1.25 -0.67 0.00 0.00 178.83 178.83 2iu8 h LEU 11 N -0.14 -1.77 -1.45 1.46 7.12 -1.01 0.19 115.31 119.70 2iu8 h LEU 11 Ca 0.06 0.22 0.12 0.00 0.13 0.00 0.00 57.88 58.42 2iu8 h LEU 11 Cb 0.23 0.71 -0.05 0.00 -0.53 0.00 0.00 40.66 41.01 2iu8 h LEU 11 CO -0.15 -0.45 0.51 0.00 -0.13 0.00 0.00 178.44 178.22 2iu8 h ALA 12 N -0.18 1.93 -0.10 1.25 0.00 -1.19 0.73 119.26 121.70 2iu8 h ALA 12 Ca 0.05 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2iu8 h ALA 12 Cb 0.65 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2iu8 h ALA 12 CO -0.50 -0.12 -0.26 0.22 0.00 0.00 0.00 179.25 178.58 2iu8 h ASP 13 N 0.57 0.41 -0.42 0.00 3.58 0.06 0.25 116.42 120.88 2iu8 h ASP 13 Ca 0.37 -0.59 0.07 0.00 0.42 0.00 0.00 57.03 57.30 2iu8 h ASP 13 Cb 0.65 -0.12 -0.06 0.00 1.72 0.00 0.00 39.33 41.53 2iu8 h ASP 13 CO -0.14 0.92 0.07 0.15 -2.88 0.00 0.00 179.24 177.37 2iu8 h PHE 14 N -0.09 0.12 0.00 0.28 3.04 0.15 -2.55 116.94 117.89 2iu8 h PHE 14 Ca -0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2iu8 h PHE 14 Cb 0.87 0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.39 2iu8 h PHE 14 CO 0.11 0.00 0.00 -0.07 -2.02 0.00 0.00 178.31 176.33 2iu8 h LEU 15 N 0.20 0.00 -2.42 0.59 4.07 -0.90 -3.48 115.31 113.37 2iu8 h LEU 15 Ca 0.20 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.87 2iu8 h LEU 15 Cb 0.25 0.00 0.17 0.00 1.08 0.00 0.00 40.66 42.16 2iu8 h LEU 15 CO -0.27 0.00 -0.86 0.29 -1.08 0.00 0.00 178.44 176.52 2iu8 n LYS 16 N -2.58 -2.84 -4.11 1.13 4.76 -0.06 -5.04 118.16 109.42 2iu8 n LYS 16 Ca 0.04 0.79 -0.15 0.00 -2.87 0.00 0.00 58.31 56.12 2iu8 n LYS 16 Cb 0.39 -5.56 -0.12 0.00 -1.84 0.00 0.00 35.03 27.91 2iu8 n LYS 16 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2iu8 s VAL 17 N -3.41 0.66 0.54 -0.18 1.01 -0.39 -5.05 120.40 113.58 2iu8 s VAL 17 Ca 0.38 -1.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.14 2iu8 s VAL 17 Cb -0.06 -0.69 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 2iu8 s VAL 17 CO 0.76 -0.27 1.09 -1.61 0.00 0.00 0.00 175.10 175.07 2iu8 s GLU 18 N -1.42 3.46 0.08 2.72 0.41 -1.15 -4.66 118.70 118.14 2iu8 s GLU 18 Ca -0.07 1.49 0.04 0.00 -0.41 0.00 0.00 54.97 56.03 2iu8 s GLU 18 Cb -0.09 -2.03 -0.03 0.00 -1.78 0.00 0.00 34.13 30.20 2iu8 s GLU 18 CO 0.01 -0.74 -0.12 -0.59 -0.49 0.00 0.00 175.26 173.33 2iu8 s PHE 19 N -1.92 1.11 -0.03 1.61 -0.12 -1.26 -0.31 117.98 117.06 2iu8 s PHE 19 Ca 0.70 -0.52 0.06 0.00 -0.05 0.00 0.00 56.93 57.12 2iu8 s PHE 19 Cb -0.21 -0.62 -0.02 0.00 -0.63 0.00 0.00 43.02 41.54 2iu8 s PHE 19 CO 0.26 0.03 -0.20 -1.14 -0.05 0.00 0.00 175.22 174.13 2iu8 s GLN 20 N -2.02 2.28 0.00 1.99 0.74 -0.18 -4.99 119.66 117.49 2iu8 s GLN 20 Ca -0.01 -0.83 0.00 0.00 0.05 0.00 0.00 55.36 54.57 2iu8 s GLN 20 Cb -0.08 -2.21 0.00 0.00 1.10 0.00 0.00 33.01 31.81 2iu8 s GLN 20 CO 0.02 0.59 0.00 0.41 -0.55 0.00 0.00 175.29 175.75 2iu8 n GLY 21 N 2.27 1.33 3.61 2.59 0.00 -1.26 -1.56 105.19 112.17 2iu8 n GLY 21 Ca -0.17 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.18 2iu8 n GLY 21 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2iu8 s ASN 22 N 0.00 5.74 0.45 1.61 3.84 -1.26 -4.85 114.94 120.46 2iu8 s ASN 22 Ca 0.00 1.91 0.31 0.00 0.21 0.00 0.00 52.86 55.29 2iu8 s ASN 22 Cb 0.00 -2.52 1.32 0.00 -0.55 0.00 0.00 41.25 39.50 2iu8 s ASN 22 CO 0.00 -1.73 1.91 1.23 -2.79 0.00 0.00 177.10 175.72 2iu8 h GLY 23 N 13.94 0.00 1.70 1.21 0.00 -1.94 -2.64 103.07 115.33 2iu8 h GLY 23 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2iu8 h GLY 23 CO 0.97 0.00 -0.18 0.00 0.00 0.00 0.00 176.54 177.33 2iu8 n ALA 24 N -1.97 2.62 -1.61 3.60 0.00 -1.26 -1.91 120.51 119.99 2iu8 n ALA 24 Ca 0.01 -0.15 -0.49 0.00 0.00 0.00 0.00 53.44 52.81 2iu8 n ALA 24 Cb 0.25 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 2iu8 n ALA 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2iu8 n THR 25 N -1.79 0.49 -3.62 0.00 -1.04 -1.00 -4.70 114.28 102.63 2iu8 n THR 25 Ca 0.06 -0.12 -0.38 0.00 -2.04 0.00 0.00 64.05 61.57 2iu8 n THR 25 Cb 0.38 -1.05 -0.11 0.00 -1.82 0.00 0.00 70.33 67.73 2iu8 n THR 25 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2iu8 s LEU 26 N 0.54 3.95 -0.11 -4.42 1.43 -1.26 0.00 118.68 118.82 2iu8 s LEU 26 Ca 0.77 -0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 2iu8 s LEU 26 Cb -0.82 -2.08 -0.02 0.00 0.03 0.00 0.00 46.19 43.30 2iu8 s LEU 26 CO 0.48 -0.07 -0.13 -0.76 0.23 0.00 0.00 176.35 176.10 2iu8 s LEU 27 N 1.72 2.75 -0.02 1.79 1.43 0.11 -4.49 118.68 121.99 2iu8 s LEU 27 Ca 0.07 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2iu8 s LEU 27 Cb -0.16 -1.61 0.04 0.00 0.03 0.00 0.00 46.19 44.49 2iu8 s LEU 27 CO 0.09 0.21 0.85 -1.54 0.23 0.00 0.00 176.35 176.20 2iu8 n SER 28 N 3.22 0.59 0.00 2.29 3.41 -0.37 -0.71 113.62 122.05 2iu8 n SER 28 Ca -0.18 -1.82 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 2iu8 n SER 28 Cb 0.53 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 2iu8 n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2iu8 n GLY 29 N -0.27 -1.16 3.54 5.00 0.00 -1.17 -4.78 105.19 106.35 2iu8 n GLY 29 Ca 0.02 -0.99 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 2iu8 n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iu8 s VAL 30 N -2.13 3.03 0.16 1.61 -7.23 -1.26 -0.79 120.40 113.79 2iu8 s VAL 30 Ca 0.00 -1.67 -0.16 0.00 -1.81 0.00 0.00 61.98 58.34 2iu8 s VAL 30 Cb 0.00 -2.48 0.03 0.00 0.56 0.00 0.00 36.38 34.49 2iu8 s VAL 30 CO 0.00 -0.07 0.44 -0.70 -0.31 0.00 0.00 175.10 174.45 2iu8 s GLU 31 N -2.69 1.20 0.46 4.82 2.56 -0.75 -4.87 118.70 119.43 2iu8 s GLU 31 Ca 0.23 -0.81 -0.20 0.00 0.00 0.00 0.00 54.97 54.19 2iu8 s GLU 31 Cb -0.09 0.48 -0.10 0.00 2.00 0.00 0.00 34.13 36.42 2iu8 s GLU 31 CO 0.14 -0.48 0.97 -1.83 -0.56 0.00 0.00 175.26 173.50 2iu8 s GLU 32 N -3.85 4.08 0.31 4.30 -1.05 -1.26 -4.37 118.70 116.86 2iu8 s GLU 32 Ca 0.07 1.14 0.07 0.00 -0.15 0.00 0.00 54.97 56.10 2iu8 s GLU 32 Cb 0.01 -2.15 0.84 0.00 -0.44 0.00 0.00 34.13 32.39 2iu8 s GLU 32 CO -0.07 -0.16 1.69 0.97 0.95 0.00 0.00 175.26 178.63 2iu8 h ILE 33 N 1.66 0.43 -0.00 1.83 2.10 -1.96 -0.91 117.51 120.65 2iu8 h ILE 33 Ca -0.49 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.32 2iu8 h ILE 33 Cb 1.19 -0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.91 2iu8 h ILE 33 CO 0.61 0.07 -0.01 -1.84 -1.08 0.00 0.00 178.15 175.90 2iu8 n GLU 34 N -5.04 0.64 0.00 2.19 0.00 -1.26 -3.64 120.64 113.53 2iu8 n GLU 34 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.38 2iu8 n GLU 34 Cb 0.75 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.69 2iu8 n GLU 34 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2iu8 n GLU 35 N -1.15 4.75 -1.65 3.44 -0.58 -0.45 -5.06 120.64 119.93 2iu8 n GLU 35 Ca 0.17 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.47 2iu8 n GLU 35 Cb 0.21 -0.62 -0.02 0.00 -0.57 0.00 0.00 31.44 30.43 2iu8 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2iu8 n ALA 36 N -1.08 0.61 -2.45 0.62 0.00 -0.57 -4.92 120.51 112.72 2iu8 n ALA 36 Ca 0.00 0.40 -0.27 0.00 0.00 0.00 0.00 53.44 53.57 2iu8 n ALA 36 Cb 0.00 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.24 2iu8 n ALA 36 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2iu8 s LYS 37 N -0.98 2.26 0.56 0.00 -0.14 -1.26 -3.55 119.74 116.63 2iu8 s LYS 37 Ca 0.64 -2.04 0.28 0.00 -1.36 0.00 0.00 55.97 53.49 2iu8 s LYS 37 Cb -0.67 -2.01 1.49 0.00 -1.68 0.00 0.00 37.83 34.96 2iu8 s LYS 37 CO 0.55 -0.50 1.97 1.79 -0.76 0.00 0.00 175.35 178.40 2iu8 h THR 38 N 0.93 0.53 0.00 2.17 1.35 -1.46 0.41 112.91 116.85 2iu8 h THR 38 Ca -0.39 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2iu8 h THR 38 Cb 1.30 0.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 2iu8 h THR 38 CO 0.61 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.88 2iu8 n ALA 39 N -2.48 2.64 -2.62 6.62 0.00 -1.26 -2.96 120.51 120.46 2iu8 n ALA 39 Ca 0.08 -0.19 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 2iu8 n ALA 39 Cb 0.61 -1.51 -0.13 0.00 0.00 0.00 0.00 19.45 18.42 2iu8 n ALA 39 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2iu8 s HIS 40 N -2.07 2.79 -0.00 0.00 3.76 0.14 -1.24 115.29 118.68 2iu8 s HIS 40 Ca 0.45 -0.19 -0.18 0.00 -0.15 0.00 0.00 55.06 54.99 2iu8 s HIS 40 Cb 0.21 -1.70 -0.06 0.00 1.11 0.00 0.00 32.58 32.15 2iu8 s HIS 40 CO 0.37 0.15 0.49 0.42 -0.85 0.00 0.00 174.74 175.33 2iu8 s ILE 41 N -0.54 4.95 0.34 0.60 1.01 0.03 -0.82 121.20 126.78 2iu8 s ILE 41 Ca 0.08 1.03 0.08 0.00 0.00 0.00 0.00 60.65 61.83 2iu8 s ILE 41 Cb -0.12 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 2iu8 s ILE 41 CO 0.02 0.50 0.28 0.28 0.00 0.00 0.00 174.94 176.02 2iu8 s THR 42 N -0.65 0.03 0.10 2.92 -1.32 -0.46 -1.80 115.64 114.46 2iu8 s THR 42 Ca 0.27 -2.00 -0.03 0.00 -1.21 0.00 0.00 61.69 58.72 2iu8 s THR 42 Cb -0.17 -2.49 -0.03 0.00 -1.51 0.00 0.00 72.50 68.30 2iu8 s THR 42 CO 0.15 0.00 0.06 0.72 -2.21 0.00 0.00 174.62 173.34 2iu8 s PHE 43 N -3.38 0.62 -0.22 9.09 -0.12 -1.26 0.03 117.98 122.74 2iu8 s PHE 43 Ca 0.40 -1.06 -0.01 0.00 -0.05 0.00 0.00 56.93 56.21 2iu8 s PHE 43 Cb 0.02 -0.36 0.06 0.00 -0.63 0.00 0.00 43.02 42.11 2iu8 s PHE 43 CO 0.28 -0.50 0.00 -1.17 -0.05 0.00 0.00 175.22 173.79 2iu8 s LEU 44 N -2.98 1.90 -0.08 -1.99 2.96 -0.52 -4.55 118.68 113.42 2iu8 s LEU 44 Ca 0.15 -1.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.04 2iu8 s LEU 44 Cb 0.07 -0.88 -0.07 0.00 0.50 0.00 0.00 46.19 45.81 2iu8 s LEU 44 CO -0.04 -0.28 -0.04 -0.67 -1.32 0.00 0.00 176.35 173.99 2iu8 n ASP 45 N 4.86 3.30 -4.81 3.68 4.64 -1.26 -4.61 116.55 122.35 2iu8 n ASP 45 Ca -0.10 -0.03 -0.36 0.00 -1.38 0.00 0.00 54.79 52.92 2iu8 n ASP 45 Cb 0.45 0.13 -0.07 0.00 -1.04 0.00 0.00 41.12 40.59 2iu8 n ASP 45 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 2iu8 s ASN 46 N -4.52 6.08 0.00 1.67 0.01 -1.26 -4.97 114.94 111.95 2iu8 s ASN 46 Ca -0.09 0.36 0.12 0.00 -0.71 0.00 0.00 52.86 52.54 2iu8 s ASN 46 Cb 0.03 -1.94 0.56 0.00 0.41 0.00 0.00 41.25 40.31 2iu8 s ASN 46 CO 0.23 0.37 1.37 -0.62 -1.51 0.00 0.00 177.10 176.94 2iu8 n GLU 47 N 2.25 0.05 0.05 -0.60 4.71 -1.26 -2.93 120.64 122.91 2iu8 n GLU 47 Ca -0.19 0.25 0.03 0.00 -0.01 0.00 0.00 57.16 57.24 2iu8 n GLU 47 Cb 0.54 -1.50 0.42 0.00 -1.01 0.00 0.00 31.44 29.89 2iu8 n GLU 47 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2iu8 h LYS 48 N 0.00 0.42 0.00 3.49 1.79 -2.03 -3.38 116.57 116.86 2iu8 h LYS 48 Ca 0.00 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 2iu8 h LYS 48 Cb 0.19 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2iu8 h LYS 48 CO 0.00 0.35 0.00 0.66 -1.08 0.00 0.00 179.45 179.38 2iu8 n TYR 49 N -4.41 0.00 0.00 -1.35 4.02 -1.15 -4.71 117.16 109.56 2iu8 n TYR 49 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 2iu8 n TYR 49 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 2iu8 n TYR 49 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2iu8 n ALA 50 N -3.00 0.00 0.23 -0.72 0.00 -1.26 -4.19 120.51 111.58 2iu8 n ALA 50 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2iu8 n ALA 50 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 19.45 19.95 2iu8 n ALA 50 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2iu8 h LYS 51 N 0.00 0.00 -0.00 0.00 2.10 -1.84 -2.92 116.57 113.91 2iu8 h LYS 51 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2iu8 h LYS 51 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2iu8 h LYS 51 CO 0.00 0.18 -0.19 0.72 -2.00 0.00 0.00 179.45 178.16 2iu8 n HIS 52 N -3.34 0.00 -0.02 0.07 8.25 -1.26 -4.23 115.22 114.69 2iu8 n HIS 52 Ca 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.30 2iu8 n HIS 52 Cb 0.41 -0.39 -0.09 0.00 1.12 0.00 0.00 29.99 31.04 2iu8 n HIS 52 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2iu8 h LEU 53 N 0.03 0.61 -1.13 2.41 5.85 -1.85 -2.41 115.31 118.83 2iu8 h LEU 53 Ca 0.00 -0.65 -0.02 0.00 0.84 0.00 0.00 57.88 58.05 2iu8 h LEU 53 Cb 0.49 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2iu8 h LEU 53 CO 0.00 1.17 0.36 0.50 -0.34 0.00 0.00 178.44 180.13 2iu8 h LYS 54 N 0.10 0.97 -0.01 1.25 3.64 -1.74 -2.38 116.57 118.41 2iu8 h LYS 54 Ca -0.04 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2iu8 h LYS 54 Cb 1.16 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2iu8 h LYS 54 CO 0.11 0.73 -0.51 -1.13 -2.27 0.00 0.00 179.45 176.37 2iu8 n SER 55 N -4.36 1.04 -4.61 4.20 3.41 -1.24 -5.00 113.62 107.06 2iu8 n SER 55 Ca 0.07 -0.83 -0.44 0.00 -0.26 0.00 0.00 58.87 57.41 2iu8 n SER 55 Cb 0.11 0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 2iu8 n SER 55 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2iu8 n SER 56 N -0.96 1.65 -0.70 4.04 2.88 -0.90 -4.92 113.62 114.72 2iu8 n SER 56 Ca 0.08 1.18 0.07 0.00 -1.33 0.00 0.00 58.87 58.88 2iu8 n SER 56 Cb 0.36 -1.33 0.12 0.00 -0.75 0.00 0.00 64.21 62.61 2iu8 n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2iu8 n GLU 57 N 0.73 1.82 -1.66 -1.46 -0.58 -1.25 -5.04 120.64 113.20 2iu8 n GLU 57 Ca 0.09 -1.74 -0.39 0.00 -0.42 0.00 0.00 57.16 54.69 2iu8 n GLU 57 Cb 0.33 -1.31 0.04 0.00 -0.57 0.00 0.00 31.44 29.92 2iu8 n GLU 57 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2iu8 n ALA 58 N 0.83 0.67 0.65 0.62 0.00 -1.23 -1.25 120.51 120.79 2iu8 n ALA 58 Ca 0.11 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.79 2iu8 n ALA 58 Cb 0.42 -2.19 0.45 0.00 0.00 0.00 0.00 19.45 18.13 2iu8 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2iu8 n GLY 59 N 1.08 -1.59 3.63 0.00 0.00 -0.00 -4.68 105.19 103.63 2iu8 n GLY 59 Ca 0.11 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2iu8 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iu8 s ALA 60 N -3.11 -1.82 -0.15 4.61 0.00 -1.07 -4.65 121.76 115.57 2iu8 s ALA 60 Ca 0.10 2.00 0.00 0.00 0.00 0.00 0.00 51.96 54.07 2iu8 s ALA 60 Cb 0.13 -1.23 0.03 0.00 0.00 0.00 0.00 23.12 22.04 2iu8 s ALA 60 CO 0.55 -0.32 -0.12 0.42 0.00 0.00 0.00 175.76 176.29 2iu8 s ILE 61 N 0.36 1.47 -0.13 0.00 1.01 0.28 -1.36 121.20 122.82 2iu8 s ILE 61 Ca 0.01 -0.63 -0.29 0.00 0.00 0.00 0.00 60.65 59.73 2iu8 s ILE 61 Cb -0.05 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 2iu8 s ILE 61 CO -0.01 0.38 1.00 -0.63 0.00 0.00 0.00 174.94 175.69 2iu8 s ILE 62 N 1.52 4.77 0.07 2.92 1.01 0.10 -1.03 121.20 130.56 2iu8 s ILE 62 Ca 0.04 2.01 -0.06 0.00 0.00 0.00 0.00 60.65 62.64 2iu8 s ILE 62 Cb -0.13 -4.30 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 2iu8 s ILE 62 CO -0.10 -0.03 0.11 -0.51 0.00 0.00 0.00 174.94 174.41 2iu8 s ILE 63 N 2.24 0.16 0.59 2.92 2.07 0.05 -1.44 121.20 127.81 2iu8 s ILE 63 Ca 0.47 -1.35 -0.02 0.00 -1.41 0.00 0.00 60.65 58.35 2iu8 s ILE 63 Cb -0.18 -1.32 0.04 0.00 0.13 0.00 0.00 42.46 41.14 2iu8 s ILE 63 CO 0.15 -0.74 0.85 -0.94 -1.91 0.00 0.00 174.94 172.35 2iu8 s SER 64 N -2.75 5.19 0.24 4.50 1.04 -1.26 -1.34 113.70 119.32 2iu8 s SER 64 Ca 0.04 0.19 -0.02 0.00 0.48 0.00 0.00 55.95 56.63 2iu8 s SER 64 Cb 0.05 -1.03 0.29 0.00 0.10 0.00 0.00 66.02 65.43 2iu8 s SER 64 CO -0.10 -1.25 1.70 0.03 0.98 0.00 0.00 173.24 174.60 2iu8 h ARG 65 N -0.12 0.72 -0.03 4.02 3.08 -1.90 -1.91 114.38 118.23 2iu8 h ARG 65 Ca -0.43 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 59.37 2iu8 h ARG 65 Cb 1.30 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 2iu8 h ARG 65 CO 0.55 0.83 0.01 1.15 -1.07 0.00 0.00 179.97 181.45 2iu8 h THR 66 N 0.65 1.15 -0.43 2.04 2.02 -1.95 -2.95 112.91 113.44 2iu8 h THR 66 Ca 0.11 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 2iu8 h THR 66 Cb 0.61 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 2iu8 h THR 66 CO 0.04 0.12 0.21 1.56 0.37 0.00 0.00 175.52 177.82 2iu8 h GLN 67 N -0.13 0.60 -0.26 6.66 4.20 -1.93 -2.26 115.11 121.99 2iu8 h GLN 67 Ca 0.01 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.68 2iu8 h GLN 67 Cb 0.19 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2iu8 h GLN 67 CO -0.00 0.47 0.11 0.35 -0.67 0.00 0.00 178.83 179.09 2iu8 h PHE 68 N 0.60 0.20 -0.60 2.96 3.04 -1.27 0.86 116.94 122.73 2iu8 h PHE 68 Ca 0.15 0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.16 2iu8 h PHE 68 Cb 0.07 -0.05 -0.05 0.00 2.56 0.00 0.00 35.95 38.48 2iu8 h PHE 68 CO 0.00 0.10 0.34 1.96 -2.02 0.00 0.00 178.31 178.69 2iu8 h GLN 69 N 0.24 0.62 -0.50 1.11 1.08 -1.26 0.24 115.11 116.64 2iu8 h GLN 69 Ca 0.11 -0.04 0.01 0.00 -1.45 0.00 0.00 58.65 57.29 2iu8 h GLN 69 Cb 0.06 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 2iu8 h GLN 69 CO -0.10 0.41 0.33 0.87 -0.95 0.00 0.00 178.83 179.39 2iu8 h LYS 70 N 0.64 0.62 0.00 1.46 1.57 -0.83 -3.23 116.57 116.80 2iu8 h LYS 70 Ca 0.26 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2iu8 h LYS 70 Cb 0.12 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2iu8 h LYS 70 CO -0.15 0.41 -0.40 0.66 -0.57 0.00 0.00 179.45 179.41 2iu8 n TYR 71 N -4.47 0.00 -0.18 -1.35 4.02 0.23 -4.83 117.16 110.58 2iu8 n TYR 71 Ca 0.05 -1.39 -0.07 0.00 -0.01 0.00 0.00 57.90 56.48 2iu8 n TYR 71 Cb 0.08 -0.23 0.02 0.00 -0.02 0.00 0.00 39.34 39.20 2iu8 n TYR 71 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2iu8 h ARG 72 N 0.79 0.72 -0.56 -0.72 2.43 -0.60 -2.70 114.38 113.75 2iu8 h ARG 72 Ca -0.00 -0.06 0.16 0.00 -0.81 0.00 0.00 59.98 59.27 2iu8 h ARG 72 Cb 1.00 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 2iu8 h ARG 72 CO 0.00 0.52 0.55 0.38 -1.51 0.00 0.00 179.97 179.90 2iu8 h ASP 73 N 0.72 0.00 -4.04 -3.80 2.03 -1.88 -3.45 116.42 106.01 2iu8 h ASP 73 Ca 0.19 0.00 -0.49 0.00 -0.73 0.00 0.00 57.03 56.00 2iu8 h ASP 73 Cb -0.02 0.00 0.05 0.00 -0.83 0.00 0.00 39.33 38.52 2iu8 h ASP 73 CO -0.04 0.00 0.43 -0.76 -1.03 0.00 0.00 179.24 177.84 2iu8 s LEU 74 N -7.55 3.90 -1.07 0.15 1.43 -1.02 -4.97 118.68 109.56 2iu8 s LEU 74 Ca -0.04 2.12 -0.03 0.00 -1.03 0.00 0.00 54.13 55.15 2iu8 s LEU 74 Cb 0.16 -4.43 0.23 0.00 0.03 0.00 0.00 46.19 42.19 2iu8 s LEU 74 CO 0.58 -0.91 2.12 -0.46 0.23 0.00 0.00 176.35 177.92 2iu8 n ASN 75 N -0.81 7.56 -4.47 2.29 6.94 -1.26 -4.97 115.26 120.54 2iu8 n ASN 75 Ca 0.09 -3.47 -0.26 0.00 -0.02 0.00 0.00 54.58 50.92 2iu8 n ASN 75 Cb 0.50 -1.23 -0.11 0.00 -2.36 0.00 0.00 39.78 36.59 2iu8 n ASN 75 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2iu8 s LYS 76 N -2.97 1.69 -0.43 -3.83 -0.14 -1.26 -5.10 119.74 107.70 2iu8 s LYS 76 Ca 0.47 -1.58 -0.27 0.00 -1.36 0.00 0.00 55.97 53.23 2iu8 s LYS 76 Cb 0.23 -1.87 0.02 0.00 -1.68 0.00 0.00 37.83 34.53 2iu8 s LYS 76 CO -0.15 0.37 1.02 -0.80 -0.76 0.00 0.00 175.35 175.03 2iu8 s ASN 77 N -3.07 6.64 -0.08 2.83 0.01 -1.26 -4.59 114.94 115.41 2iu8 s ASN 77 Ca 0.25 0.46 0.01 0.00 -0.71 0.00 0.00 52.86 52.87 2iu8 s ASN 77 Cb -0.07 -2.50 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 2iu8 s ASN 77 CO 0.13 -1.05 -0.10 -0.36 -1.51 0.00 0.00 177.10 174.21 2iu8 s PHE 78 N 3.92 2.86 -0.31 2.20 2.99 -0.60 0.98 117.98 130.02 2iu8 s PHE 78 Ca 0.42 -0.16 -0.09 0.00 0.00 0.00 0.00 56.93 57.10 2iu8 s PHE 78 Cb -0.10 -1.73 -0.01 0.00 0.00 0.00 0.00 43.02 41.19 2iu8 s PHE 78 CO 0.25 0.17 0.14 -0.51 -0.00 0.00 0.00 175.22 175.27 2iu8 s LEU 79 N -0.49 4.04 -0.27 -0.37 1.43 -0.20 -1.01 118.68 121.81 2iu8 s LEU 79 Ca 0.07 -0.54 -0.08 0.00 -1.03 0.00 0.00 54.13 52.55 2iu8 s LEU 79 Cb -0.12 -1.98 -0.02 0.00 0.03 0.00 0.00 46.19 44.10 2iu8 s LEU 79 CO 0.02 -0.19 0.10 -0.63 0.23 0.00 0.00 176.35 175.88 2iu8 s ILE 80 N 1.60 4.40 0.11 -0.59 1.01 0.58 -0.77 121.20 127.53 2iu8 s ILE 80 Ca 0.04 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.51 2iu8 s ILE 80 Cb -0.17 -3.12 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 2iu8 s ILE 80 CO 0.06 0.25 -0.19 0.28 0.00 0.00 0.00 174.94 175.34 2iu8 s THR 81 N 1.61 1.58 -1.08 2.92 -1.32 -0.45 -2.92 115.64 115.98 2iu8 s THR 81 Ca 0.06 -1.57 0.25 0.00 -1.21 0.00 0.00 61.69 59.22 2iu8 s THR 81 Cb -0.16 -1.50 0.02 0.00 -1.51 0.00 0.00 72.50 69.35 2iu8 s THR 81 CO 0.05 -0.16 1.40 -1.54 -2.21 0.00 0.00 174.62 172.16 2iu8 n SER 82 N 0.96 0.59 -3.89 8.08 3.41 -1.26 -2.99 113.62 118.52 2iu8 n SER 82 Ca -0.19 -0.36 -0.19 0.00 -0.26 0.00 0.00 58.87 57.88 2iu8 n SER 82 Cb 0.54 0.28 0.10 0.00 -0.26 0.00 0.00 64.21 64.88 2iu8 n SER 82 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2iu8 n GLU 83 N -1.41 -0.12 -2.01 4.33 1.02 -1.26 -4.99 120.64 116.21 2iu8 n GLU 83 Ca 0.06 -2.02 -0.42 0.00 -0.02 0.00 0.00 57.16 54.76 2iu8 n GLU 83 Cb 0.34 -0.60 -0.03 0.00 -0.02 0.00 0.00 31.44 31.13 2iu8 n GLU 83 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2iu8 s SER 84 N -4.24 6.67 0.51 1.62 0.15 -1.26 -4.85 113.70 112.30 2iu8 s SER 84 Ca 0.52 2.29 0.21 0.00 0.70 0.00 0.00 55.95 59.68 2iu8 s SER 84 Cb -0.03 -2.54 1.31 0.00 -1.71 0.00 0.00 66.02 63.05 2iu8 s SER 84 CO 0.35 -0.89 2.03 -0.65 1.20 0.00 0.00 173.24 175.29 2iu8 h PRO 85 N 9.01 0.05 0.00 5.44 0.11 -1.90 -0.37 132.00 144.34 2iu8 h PRO 85 Ca -0.40 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.62 2iu8 h PRO 85 Cb 1.18 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2iu8 h PRO 85 CO 0.94 0.04 -0.42 1.03 -0.21 0.00 0.00 178.00 179.38 2iu8 h SER 86 N 0.06 0.00 0.94 -2.05 0.87 -1.90 0.74 113.55 112.21 2iu8 h SER 86 Ca 0.19 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.53 2iu8 h SER 86 Cb 0.68 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.61 2iu8 h SER 86 CO -0.01 0.42 -1.08 0.25 -0.53 0.00 0.00 176.83 175.88 2iu8 h LEU 87 N 0.00 0.00 -0.04 2.23 6.46 -1.49 -2.72 115.31 119.74 2iu8 h LEU 87 Ca -0.00 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.67 2iu8 h LEU 87 Cb 0.95 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.89 2iu8 h LEU 87 CO 0.05 0.99 -0.31 0.58 -0.62 0.00 0.00 178.44 179.13 2iu8 h VAL 88 N 0.00 1.45 -0.78 1.05 2.07 -1.21 -3.16 116.25 115.67 2iu8 h VAL 88 Ca -0.05 -1.79 0.18 0.00 0.82 0.00 0.00 66.70 65.87 2iu8 h VAL 88 Cb 1.79 2.45 -0.14 0.00 -1.52 0.00 0.00 31.29 33.88 2iu8 h VAL 88 CO 0.12 0.51 0.01 0.15 0.02 0.00 0.00 177.57 178.38 2iu8 h PHE 89 N -0.25 -0.04 -0.98 1.57 3.57 -0.94 -1.15 116.94 118.72 2iu8 h PHE 89 Ca -0.03 0.06 0.16 0.00 3.53 0.00 0.00 57.97 61.69 2iu8 h PHE 89 Cb 0.99 0.14 -0.10 0.00 2.79 0.00 0.00 35.95 39.77 2iu8 h PHE 89 CO 0.14 -0.25 0.59 0.37 -2.23 0.00 0.00 178.31 176.93 2iu8 h GLN 90 N 0.10 0.80 -0.10 1.11 5.75 -1.48 -0.29 115.11 121.00 2iu8 h GLN 90 Ca 0.43 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.85 2iu8 h GLN 90 Cb 0.77 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.13 2iu8 h GLN 90 CO -0.68 0.53 -0.08 0.87 -2.65 0.00 0.00 178.83 176.82 2iu8 h LYS 91 N 0.82 0.15 0.03 1.69 1.57 -1.18 -1.61 116.57 118.04 2iu8 h LYS 91 Ca 0.53 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 59.20 2iu8 h LYS 91 Cb 0.70 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 33.00 2iu8 h LYS 91 CO -0.34 0.24 -0.36 0.00 -0.57 0.00 0.00 179.45 178.43 2iu8 h LEU 93 N -0.51 -1.74 -2.42 0.00 5.85 -0.98 -1.19 115.31 114.33 2iu8 h LEU 93 Ca -0.05 0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2iu8 h LEU 93 Cb 1.16 0.76 -0.00 0.00 0.37 0.00 0.00 40.66 42.95 2iu8 h LEU 93 CO 0.07 -0.34 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.47 2iu8 h GLU 94 N -0.25 0.00 0.00 1.25 5.08 -1.38 0.12 114.58 119.41 2iu8 h GLU 94 Ca 0.14 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 2iu8 h GLU 94 Cb 0.55 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2iu8 h GLU 94 CO -0.71 0.03 -0.29 -0.07 -1.00 0.00 0.00 179.01 176.97 2iu8 h LEU 95 N 0.00 0.00 0.00 1.33 3.38 -1.10 -3.31 115.31 115.61 2iu8 h LEU 95 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2iu8 h LEU 95 Cb 0.09 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2iu8 h LEU 95 CO 0.00 0.29 -2.05 0.49 0.09 0.00 0.00 178.44 177.27 2iu8 n PHE 96 N -3.95 0.00 -3.84 1.13 3.72 0.28 -4.88 117.46 109.93 2iu8 n PHE 96 Ca -0.02 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.13 2iu8 n PHE 96 Cb 0.36 -0.63 -0.17 0.00 -0.94 0.00 0.00 39.48 38.10 2iu8 n PHE 96 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2iu8 s ILE 97 N -3.01 0.71 -0.12 4.37 1.01 -0.35 -4.53 121.20 119.28 2iu8 s ILE 97 Ca -0.08 -0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.33 2iu8 s ILE 97 Cb 0.10 -0.80 -0.05 0.00 0.01 0.00 0.00 42.46 41.72 2iu8 s ILE 97 CO 0.80 0.30 0.32 0.28 0.00 0.00 0.00 174.94 176.64 2iu8 s THR 98 N 1.84 5.26 0.53 2.92 -1.32 -1.26 -4.23 115.64 119.37 2iu8 s THR 98 Ca 0.05 0.62 -0.22 0.00 -1.21 0.00 0.00 61.69 60.93 2iu8 s THR 98 Cb -0.13 -3.65 -0.05 0.00 -1.51 0.00 0.00 72.50 67.16 2iu8 s THR 98 CO -0.07 0.44 1.38 -2.84 -2.21 0.00 0.00 174.62 171.33 2iu8 s PRO 99 N 0.02 3.22 -0.05 7.08 0.02 -1.26 -5.02 135.00 139.01 2iu8 s PRO 99 Ca 0.19 2.30 0.03 0.00 0.02 0.00 0.00 61.00 63.54 2iu8 s PRO 99 Cb -0.14 -2.33 0.00 0.00 0.02 0.00 0.00 34.50 32.05 2iu8 s PRO 99 CO 0.07 -1.15 -0.15 0.14 -0.33 0.00 0.00 177.00 175.58 2iu8 s VAL 100 N -1.27 1.26 0.86 3.83 -7.23 -1.26 -5.15 120.40 111.44 2iu8 s VAL 100 Ca 0.70 -0.60 -0.09 0.00 -1.81 0.00 0.00 61.98 60.18 2iu8 s VAL 100 Cb -0.42 -1.10 0.17 0.00 0.56 0.00 0.00 36.38 35.59 2iu8 s VAL 100 CO 0.50 0.37 1.18 -1.81 -0.31 0.00 0.00 175.10 175.04 2iu8 s ASP 101 N 0.27 3.62 0.42 4.85 1.01 -1.26 -5.01 116.67 120.57 2iu8 s ASP 101 Ca -0.08 -0.03 0.23 0.00 0.71 0.00 0.00 52.55 53.39 2iu8 s ASP 101 Cb -0.13 -0.15 0.73 0.00 1.01 0.00 0.00 42.92 44.39 2iu8 s ASP 101 CO 0.03 -2.38 1.74 0.77 0.21 0.00 0.00 175.17 175.54 2iu8 h SER 102 N -1.17 0.00 0.00 0.27 4.64 -2.06 -3.47 113.55 111.76 2iu8 h SER 102 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2iu8 h SER 102 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2iu8 h SER 102 CO 0.38 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 177.18 2iu8 n GLY 103 N 0.47 0.68 2.94 -0.77 0.00 -1.26 -5.04 105.19 102.22 2iu8 n GLY 103 Ca 0.01 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 2iu8 n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2iu8 s PHE 104 N -2.00 3.64 0.69 1.61 0.40 -1.26 -5.11 117.98 115.95 2iu8 s PHE 104 Ca 0.00 -3.28 -0.15 0.00 -0.60 0.00 0.00 56.93 52.90 2iu8 s PHE 104 Cb 0.00 -2.82 0.02 0.00 0.51 0.00 0.00 43.02 40.72 2iu8 s PHE 104 CO 0.00 -0.59 1.17 -2.14 0.70 0.00 0.00 175.22 174.36 2iu8 s PRO 105 N -1.41 2.46 3.87 0.24 0.02 -1.26 -4.81 135.00 134.10 2iu8 s PRO 105 Ca 0.25 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.90 2iu8 s PRO 105 Cb -0.06 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.58 2iu8 s PRO 105 CO -0.15 -1.56 0.00 0.41 -0.33 0.00 0.00 177.00 175.37 2iu8 n GLY 106 N 0.07 0.91 3.55 0.52 0.00 -1.26 -4.35 105.19 104.62 2iu8 n GLY 106 Ca 0.12 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 2iu8 n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iu8 s ILE 107 N 0.00 4.86 0.15 -0.61 1.01 -1.25 -1.24 121.20 124.11 2iu8 s ILE 107 Ca 0.00 0.40 -0.31 0.00 0.00 0.00 0.00 60.65 60.74 2iu8 s ILE 107 Cb 0.00 -4.13 -0.09 0.00 0.01 0.00 0.00 42.46 38.25 2iu8 s ILE 107 CO 0.00 -0.43 1.43 -2.28 0.00 0.00 0.00 174.94 173.66 2iu8 s HIS 108 N 2.76 3.18 0.56 3.97 5.65 0.14 -4.90 115.29 126.66 2iu8 s HIS 108 Ca 0.24 0.90 0.44 0.00 0.25 0.00 0.00 55.06 56.88 2iu8 s HIS 108 Cb -0.14 -3.75 1.58 0.00 -1.18 0.00 0.00 32.58 29.09 2iu8 s HIS 108 CO 0.17 -2.64 1.60 -1.35 -0.65 0.00 0.00 174.74 171.86 2iu8 h PRO 109 N 6.51 0.00 -0.59 2.88 0.11 -1.95 0.10 132.00 139.06 2iu8 h PRO 109 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2iu8 h PRO 109 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2iu8 h PRO 109 CO 0.86 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.90 2iu8 n THR 110 N -3.88 1.16 -2.83 -1.15 -2.24 -1.26 -4.88 114.28 99.18 2iu8 n THR 110 Ca 0.36 -0.76 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 2iu8 n THR 110 Cb 1.75 0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.96 2iu8 n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iu8 s ALA 111 N -1.71 3.23 -0.23 6.98 0.00 0.36 -3.03 121.76 127.36 2iu8 s ALA 111 Ca 0.34 0.39 -0.20 0.00 0.00 0.00 0.00 51.96 52.49 2iu8 s ALA 111 Cb 0.21 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 2iu8 s ALA 111 CO 0.17 -0.17 0.59 0.08 0.00 0.00 0.00 175.76 176.43 2iu8 s VAL 112 N 0.85 5.03 -0.17 0.00 1.01 -0.78 -5.01 120.40 121.33 2iu8 s VAL 112 Ca 0.46 1.08 -0.00 0.00 0.00 0.00 0.00 61.98 63.52 2iu8 s VAL 112 Cb -0.20 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.32 2iu8 s VAL 112 CO 0.25 0.09 -0.06 -0.63 0.00 0.00 0.00 175.10 174.75 2iu8 s ILE 113 N 2.11 1.16 0.26 2.22 1.01 -1.26 -0.46 121.20 126.23 2iu8 s ILE 113 Ca 0.26 -0.66 -0.31 0.00 0.00 0.00 0.00 60.65 59.94 2iu8 s ILE 113 Cb -0.16 -1.32 -0.11 0.00 0.01 0.00 0.00 42.46 40.88 2iu8 s ILE 113 CO 0.09 0.14 1.61 -2.28 0.00 0.00 0.00 174.94 174.50 2iu8 s HIS 114 N 1.61 2.83 0.56 3.97 5.65 -0.14 -4.83 115.29 124.95 2iu8 s HIS 114 Ca 0.01 0.68 0.37 0.00 0.25 0.00 0.00 55.06 56.37 2iu8 s HIS 114 Cb -0.15 -4.06 1.28 0.00 -1.18 0.00 0.00 32.58 28.47 2iu8 s HIS 114 CO -0.08 -3.68 1.37 -2.30 -0.65 0.00 0.00 174.74 169.40 2iu8 n PRO 115 N 2.76 0.01 -0.23 2.88 -0.02 -1.26 0.07 135.00 139.21 2iu8 n PRO 115 Ca 0.10 1.01 0.11 0.00 -2.02 0.00 0.00 63.50 62.70 2iu8 n PRO 115 Cb 0.37 -2.41 0.23 0.00 -0.02 0.00 0.00 33.50 31.67 2iu8 n PRO 115 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2iu8 n THR 116 N -3.51 0.67 -2.86 3.45 -2.24 -1.26 -4.94 114.28 103.60 2iu8 n THR 116 Ca 0.33 -0.84 -0.36 0.00 -2.27 0.00 0.00 64.05 60.91 2iu8 n THR 116 Cb 1.71 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 70.69 2iu8 n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iu8 s ALA 117 N -1.26 3.24 -0.21 6.98 0.00 0.11 -2.63 121.76 128.00 2iu8 s ALA 117 Ca 0.38 0.43 -0.05 0.00 0.00 0.00 0.00 51.96 52.72 2iu8 s ALA 117 Cb 0.21 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 2iu8 s ALA 117 CO 0.29 0.21 0.00 0.42 0.00 0.00 0.00 175.76 176.68 2iu8 s ILE 118 N -1.63 3.92 -0.13 0.00 1.01 0.58 -4.93 121.20 120.01 2iu8 s ILE 118 Ca 0.49 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.84 2iu8 s ILE 118 Cb -0.17 -2.78 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2iu8 s ILE 118 CO 0.22 0.42 -0.17 -0.63 0.00 0.00 0.00 174.94 174.78 2iu8 s ILE 119 N 1.13 2.62 0.00 2.92 -1.09 -1.26 -0.81 121.20 124.70 2iu8 s ILE 119 Ca 0.03 -0.81 0.00 0.00 -2.23 0.00 0.00 60.65 57.64 2iu8 s ILE 119 Cb -0.14 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 38.66 2iu8 s ILE 119 CO 0.01 0.53 0.00 -0.62 -1.23 0.00 0.00 174.94 173.64 2iu8 n GLU 120 N 3.72 0.64 -1.59 2.79 -0.58 -0.96 -5.01 120.64 119.64 2iu8 n GLU 120 Ca -0.19 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.24 2iu8 n GLU 120 Cb 0.52 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 31.44 2iu8 n GLU 120 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 2iu8 s ASP 121 N -1.00 5.36 -1.22 1.62 -4.77 -1.26 -4.18 116.67 111.22 2iu8 s ASP 121 Ca 0.00 1.65 0.00 0.00 -3.30 0.00 0.00 52.55 50.90 2iu8 s ASP 121 Cb 0.00 -2.50 0.00 0.00 -1.09 0.00 0.00 42.92 39.33 2iu8 s ASP 121 CO 0.00 -1.46 0.00 1.41 0.70 0.00 0.00 175.17 175.82 2iu8 n HIS 122 N -3.05 -1.04 -3.29 2.11 8.25 -1.26 -0.99 115.22 115.95 2iu8 n HIS 122 Ca 0.08 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.15 2iu8 n HIS 122 Cb 0.53 -2.77 -0.06 0.00 1.12 0.00 0.00 29.99 28.81 2iu8 n HIS 122 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2iu8 s VAL 123 N -2.47 5.00 -0.18 1.59 0.11 -1.26 -3.77 120.40 119.41 2iu8 s VAL 123 Ca 0.00 1.10 -0.16 0.00 -2.93 0.00 0.00 61.98 59.99 2iu8 s VAL 123 Cb 0.00 -3.86 -0.04 0.00 -1.53 0.00 0.00 36.38 30.95 2iu8 s VAL 123 CO 0.00 0.43 0.38 0.00 -3.33 0.00 0.00 175.10 172.57 2iu8 s ILE 125 N 1.04 1.39 0.68 0.00 1.01 -0.37 0.58 121.20 125.54 2iu8 s ILE 125 Ca 0.19 -0.67 -0.10 0.00 0.00 0.00 0.00 60.65 60.07 2iu8 s ILE 125 Cb -0.14 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.92 2iu8 s ILE 125 CO 0.07 0.29 1.05 -1.61 0.00 0.00 0.00 174.94 174.74 2iu8 s GLU 126 N 1.53 2.77 -0.08 2.79 2.02 0.11 -0.69 118.70 127.16 2iu8 s GLU 126 Ca 0.02 0.28 -0.40 0.00 0.02 0.00 0.00 54.97 54.89 2iu8 s GLU 126 Cb -0.14 -2.09 -0.18 0.00 0.10 0.00 0.00 34.13 31.82 2iu8 s GLU 126 CO -0.09 -1.00 1.35 -2.30 0.02 0.00 0.00 175.26 173.24 2iu8 n PRO 127 N -2.92 0.63 -1.15 0.39 -0.02 -1.26 -2.20 135.00 128.48 2iu8 n PRO 127 Ca 0.06 0.23 -0.05 0.00 -2.02 0.00 0.00 63.50 61.72 2iu8 n PRO 127 Cb 0.58 -1.81 -0.02 0.00 -0.02 0.00 0.00 33.50 32.22 2iu8 n PRO 127 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2iu8 n TYR 128 N 2.86 0.00 -1.75 6.00 0.53 -1.17 -1.87 117.16 121.76 2iu8 n TYR 128 Ca 0.22 0.00 -0.33 0.00 -1.02 0.00 0.00 57.90 56.77 2iu8 n TYR 128 Cb 0.11 -1.46 0.05 0.00 -1.03 0.00 0.00 39.34 37.01 2iu8 n TYR 128 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2iu8 s ALA 129 N -1.95 2.44 -0.08 -0.72 0.00 -0.93 -3.37 121.76 117.15 2iu8 s ALA 129 Ca 0.00 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.58 2iu8 s ALA 129 Cb 0.00 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.80 2iu8 s ALA 129 CO 0.00 -1.32 -0.09 0.08 0.00 0.00 0.00 175.76 174.43 2iu8 s VAL 130 N -2.26 0.99 -0.20 0.00 1.01 -0.01 -1.87 120.40 118.07 2iu8 s VAL 130 Ca 0.68 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2iu8 s VAL 130 Cb -0.22 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.24 2iu8 s VAL 130 CO 0.41 0.34 -0.16 -0.69 0.00 0.00 0.00 175.10 175.00 2iu8 s VAL 131 N 1.04 1.96 0.76 2.92 1.01 0.39 -0.90 120.40 127.59 2iu8 s VAL 131 Ca -0.08 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.79 2iu8 s VAL 131 Cb -0.15 -1.89 0.14 0.00 0.00 0.00 0.00 36.38 34.49 2iu8 s VAL 131 CO -0.01 0.34 1.05 0.00 0.00 0.00 0.00 175.10 176.49 2iu8 n GLN 133 N -3.00 1.44 -2.11 0.00 10.64 -1.26 -1.85 117.38 121.23 2iu8 n GLN 133 Ca 0.15 0.52 -0.21 0.00 -1.83 0.00 0.00 57.00 55.63 2iu8 n GLN 133 Cb 0.60 -2.15 -0.04 0.00 -0.86 0.00 0.00 30.24 27.80 2iu8 n GLN 133 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 2iu8 n HIS 134 N 2.36 -0.64 -1.87 2.61 8.25 -1.08 -2.34 115.22 122.52 2iu8 n HIS 134 Ca 0.17 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.32 2iu8 n HIS 134 Cb 0.24 -3.81 0.02 0.00 1.12 0.00 0.00 29.99 27.56 2iu8 n HIS 134 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2iu8 s ALA 135 N -2.95 3.03 -0.11 -1.41 0.00 -0.77 -3.38 121.76 116.17 2iu8 s ALA 135 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 2iu8 s ALA 135 Cb 0.00 -3.06 0.04 0.00 0.00 0.00 0.00 23.12 20.10 2iu8 s ALA 135 CO 0.00 -0.84 0.05 -1.58 0.00 0.00 0.00 175.76 173.39 2iu8 s HIS 136 N -3.24 0.40 -0.25 0.00 2.46 -0.42 -0.31 115.29 113.95 2iu8 s HIS 136 Ca 0.56 -0.17 -0.12 0.00 0.47 0.00 0.00 55.06 55.80 2iu8 s HIS 136 Cb -0.11 -0.70 -0.05 0.00 -0.13 0.00 0.00 32.58 31.59 2iu8 s HIS 136 CO 0.53 -0.37 0.22 0.08 -2.47 0.00 0.00 174.74 172.72 2iu8 s VAL 137 N 2.06 5.31 1.17 0.89 1.01 0.01 -0.19 120.40 130.66 2iu8 s VAL 137 Ca 0.03 0.28 -0.18 0.00 0.00 0.00 0.00 61.98 62.11 2iu8 s VAL 137 Cb -0.14 -3.55 0.27 0.00 0.00 0.00 0.00 36.38 32.96 2iu8 s VAL 137 CO -0.06 0.30 1.11 -0.83 0.00 0.00 0.00 175.10 175.62 2iu8 s GLY 138 N 1.26 1.58 0.26 4.51 0.00 0.65 -2.28 107.32 113.31 2iu8 s GLY 138 Ca 0.10 -0.86 -0.29 0.00 0.00 0.00 0.00 44.72 43.66 2iu8 s GLY 138 CO 0.07 -0.02 1.18 -1.35 0.00 0.00 0.00 173.10 172.98 2iu8 s SER 139 N -3.84 7.10 -1.46 1.64 1.04 -1.26 -3.33 113.70 113.58 2iu8 s SER 139 Ca 0.70 2.36 -0.00 0.00 0.48 0.00 0.00 55.95 59.49 2iu8 s SER 139 Cb -0.11 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.38 2iu8 s SER 139 CO 0.56 -0.30 0.01 0.00 0.98 0.00 0.00 173.24 174.49 2iu8 n ALA 140 N 1.52 -0.51 -2.24 5.32 0.00 -0.16 -1.33 120.51 123.10 2iu8 n ALA 140 Ca 0.01 0.14 -0.32 0.00 0.00 0.00 0.00 53.44 53.27 2iu8 n ALA 140 Cb 0.44 -1.93 -0.06 0.00 0.00 0.00 0.00 19.45 17.90 2iu8 n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2iu8 s HIS 142 N -1.90 2.94 -0.34 0.00 5.65 -0.67 -0.72 115.29 120.25 2iu8 s HIS 142 Ca 0.51 -1.10 -0.05 0.00 0.25 0.00 0.00 55.06 54.67 2iu8 s HIS 142 Cb -0.11 -2.07 0.05 0.00 -1.18 0.00 0.00 32.58 29.27 2iu8 s HIS 142 CO 0.19 -0.60 0.10 0.42 -0.65 0.00 0.00 174.74 174.19 2iu8 s ILE 143 N 1.44 3.59 0.87 0.89 -1.09 0.20 -0.71 121.20 126.38 2iu8 s ILE 143 Ca 0.05 -1.28 -0.11 0.00 -2.23 0.00 0.00 60.65 57.08 2iu8 s ILE 143 Cb -0.14 -3.08 0.11 0.00 -1.58 0.00 0.00 42.46 37.77 2iu8 s ILE 143 CO -0.05 -0.22 1.09 -0.83 -1.23 0.00 0.00 174.94 173.70 2iu8 s GLY 144 N 1.46 1.63 0.19 6.18 0.00 0.21 0.07 107.32 117.04 2iu8 s GLY 144 Ca -0.01 -0.02 -0.32 0.00 0.00 0.00 0.00 44.72 44.37 2iu8 s GLY 144 CO 0.01 0.44 1.11 1.44 0.00 0.00 0.00 173.10 176.11 2iu8 n SER 145 N -3.80 1.20 -0.42 1.64 7.64 -1.26 -1.84 113.62 116.78 2iu8 n SER 145 Ca 0.07 1.15 -0.04 0.00 1.01 0.00 0.00 58.87 61.06 2iu8 n SER 145 Cb 0.55 -1.21 -0.02 0.00 -1.01 0.00 0.00 64.21 62.52 2iu8 n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2iu8 n GLY 146 N 1.90 0.41 3.79 0.23 0.00 -0.78 -1.18 105.19 109.56 2iu8 n GLY 146 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2iu8 n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iu8 s SER 147 N -1.65 5.71 -0.09 1.61 0.01 -0.77 -4.23 113.70 114.29 2iu8 s SER 147 Ca 0.00 1.95 0.01 0.00 1.31 0.00 0.00 55.95 59.22 2iu8 s SER 147 Cb 0.00 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.66 2iu8 s SER 147 CO 0.00 -1.22 -0.13 -0.69 0.41 0.00 0.00 173.24 171.61 2iu8 s VAL 148 N -2.22 3.09 -0.33 3.43 1.01 -0.25 -0.83 120.40 124.30 2iu8 s VAL 148 Ca 0.67 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2iu8 s VAL 148 Cb -0.19 -2.26 0.09 0.00 0.00 0.00 0.00 36.38 34.03 2iu8 s VAL 148 CO 0.33 0.55 0.04 -0.63 0.00 0.00 0.00 175.10 175.39 2iu8 s ILE 149 N -0.14 2.45 0.91 2.22 -1.09 -0.08 -0.79 121.20 124.68 2iu8 s ILE 149 Ca -0.01 -2.11 -0.15 0.00 -2.23 0.00 0.00 60.65 56.15 2iu8 s ILE 149 Cb -0.14 -2.69 0.23 0.00 -1.58 0.00 0.00 42.46 38.28 2iu8 s ILE 149 CO 0.03 -0.47 0.78 0.61 -1.23 0.00 0.00 174.94 174.66 2iu8 n GLY 150 N 4.36 -2.80 3.63 6.18 0.00 0.14 -1.24 105.19 115.45 2iu8 n GLY 150 Ca -0.01 -1.46 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 2iu8 n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iu8 s ALA 151 N -2.92 3.30 -0.30 4.61 0.00 -1.26 -2.79 121.76 122.41 2iu8 s ALA 151 Ca 0.51 0.56 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2iu8 s ALA 151 Cb -0.05 -3.85 0.00 0.00 0.00 0.00 0.00 23.12 19.22 2iu8 s ALA 151 CO 0.40 -1.90 0.00 0.66 0.00 0.00 0.00 175.76 174.92 2iu8 n TYR 152 N 8.38 0.00 -3.29 0.00 4.02 -0.99 -1.25 117.16 124.04 2iu8 n TYR 152 Ca 0.19 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.70 2iu8 n TYR 152 Cb 0.45 -0.88 -0.06 0.00 -0.02 0.00 0.00 39.34 38.83 2iu8 n TYR 152 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2iu8 s SER 153 N -2.85 6.90 -0.06 7.72 0.01 -1.12 -4.28 113.70 120.02 2iu8 s SER 153 Ca 0.00 1.07 0.01 0.00 1.31 0.00 0.00 55.95 58.34 2iu8 s SER 153 Cb 0.00 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.87 2iu8 s SER 153 CO 0.00 0.14 -0.07 0.42 0.41 0.00 0.00 173.24 174.14 2iu8 s THR 154 N -0.29 3.68 -0.22 1.44 -4.23 -0.74 -1.30 115.64 113.98 2iu8 s THR 154 Ca 0.28 -0.52 0.01 0.00 -1.18 0.00 0.00 61.69 60.28 2iu8 s THR 154 Cb -0.17 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 71.19 2iu8 s THR 154 CO 0.15 0.57 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.97 2iu8 s VAL 155 N -0.83 2.28 0.66 2.29 1.01 0.73 -0.48 120.40 126.06 2iu8 s VAL 155 Ca 0.13 -1.15 -0.15 0.00 0.00 0.00 0.00 61.98 60.81 2iu8 s VAL 155 Cb -0.11 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.16 2iu8 s VAL 155 CO 0.02 0.31 1.12 -0.83 0.00 0.00 0.00 175.10 175.71 2iu8 s GLY 156 N 1.25 2.17 0.26 4.51 0.00 0.08 -0.25 107.32 115.32 2iu8 s GLY 156 Ca -0.00 0.57 -0.29 0.00 0.00 0.00 0.00 44.72 45.00 2iu8 s GLY 156 CO -0.09 0.92 0.95 -1.84 0.00 0.00 0.00 173.10 173.05 2iu8 n GLU 157 N -2.43 1.10 -1.17 2.90 0.28 -1.26 -2.35 120.64 117.71 2iu8 n GLU 157 Ca 0.11 0.39 -0.06 0.00 -0.16 0.00 0.00 57.16 57.43 2iu8 n GLU 157 Cb 0.52 -1.72 -0.03 0.00 1.43 0.00 0.00 31.44 31.64 2iu8 n GLU 157 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2iu8 n HIS 158 N 0.38 0.00 -1.96 -1.84 8.25 -0.44 -1.65 115.22 117.96 2iu8 n HIS 158 Ca 0.12 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.25 2iu8 n HIS 158 Cb 0.30 -1.70 0.02 0.00 1.12 0.00 0.00 29.99 29.73 2iu8 n HIS 158 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2iu8 s SER 159 N -2.43 5.51 -0.27 0.41 0.01 -0.99 -4.09 113.70 111.86 2iu8 s SER 159 Ca 0.00 1.92 -0.00 0.00 1.31 0.00 0.00 55.95 59.18 2iu8 s SER 159 Cb 0.00 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.76 2iu8 s SER 159 CO 0.00 -1.35 0.03 -0.47 0.41 0.00 0.00 173.24 171.86 2iu8 s TYR 160 N -2.34 2.07 -0.32 2.43 6.14 0.22 -1.67 117.35 123.88 2iu8 s TYR 160 Ca 0.66 -1.74 -0.10 0.00 0.64 0.00 0.00 57.07 56.53 2iu8 s TYR 160 Cb -0.18 -1.69 -0.01 0.00 0.42 0.00 0.00 41.96 40.49 2iu8 s TYR 160 CO 0.38 -0.80 0.16 0.42 0.64 0.00 0.00 175.55 176.34 2iu8 s ILE 161 N 1.50 4.67 0.85 3.14 -1.09 0.12 -2.14 121.20 128.25 2iu8 s ILE 161 Ca 0.03 -0.41 -0.12 0.00 -2.23 0.00 0.00 60.65 57.92 2iu8 s ILE 161 Cb -0.18 -3.39 0.10 0.00 -1.58 0.00 0.00 42.46 37.42 2iu8 s ILE 161 CO -0.14 0.05 1.14 -1.00 -1.23 0.00 0.00 174.94 173.77 2iu8 s HIS 162 N 1.62 2.73 0.35 3.97 3.76 -0.84 0.64 115.29 127.53 2iu8 s HIS 162 Ca 0.05 0.87 -0.27 0.00 -0.15 0.00 0.00 55.06 55.55 2iu8 s HIS 162 Cb -0.17 -3.37 -0.12 0.00 1.11 0.00 0.00 32.58 30.02 2iu8 s HIS 162 CO 0.07 -2.05 1.16 -2.30 -0.85 0.00 0.00 174.74 170.77 2iu8 n PRO 163 N -3.54 1.75 -3.87 8.40 -0.02 -1.26 -3.53 135.00 132.93 2iu8 n PRO 163 Ca 0.07 0.62 -0.27 0.00 -2.02 0.00 0.00 63.50 61.90 2iu8 n PRO 163 Cb 0.59 -2.14 0.02 0.00 -0.02 0.00 0.00 33.50 31.95 2iu8 n PRO 163 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2iu8 n ARG 164 N 0.49 -4.90 -3.28 -0.52 3.00 -0.32 -3.13 116.66 108.00 2iu8 n ARG 164 Ca 0.07 0.57 -0.38 0.00 -0.01 0.00 0.00 57.85 58.09 2iu8 n ARG 164 Cb 0.36 -5.25 -0.06 0.00 0.00 0.00 0.00 32.46 27.51 2iu8 n ARG 164 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2iu8 s VAL 165 N -3.50 4.75 -0.35 1.55 1.01 -1.23 -1.73 120.40 120.89 2iu8 s VAL 165 Ca 0.37 1.18 -0.07 0.00 0.00 0.00 0.00 61.98 63.46 2iu8 s VAL 165 Cb -0.19 -3.88 0.04 0.00 0.00 0.00 0.00 36.38 32.35 2iu8 s VAL 165 CO 0.84 0.52 0.14 -0.69 0.00 0.00 0.00 175.10 175.91 2iu8 s VAL 166 N -1.15 3.90 -0.34 2.92 1.01 -1.03 -1.09 120.40 124.62 2iu8 s VAL 166 Ca 0.30 -1.16 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 2iu8 s VAL 166 Cb -0.19 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2iu8 s VAL 166 CO 0.19 -0.24 0.26 -0.63 0.00 0.00 0.00 175.10 174.68 2iu8 s ILE 167 N 1.41 5.27 0.50 2.22 -1.09 0.03 -0.92 121.20 128.62 2iu8 s ILE 167 Ca -0.00 -0.21 -0.08 0.00 -2.23 0.00 0.00 60.65 58.12 2iu8 s ILE 167 Cb -0.20 -3.74 0.11 0.00 -1.58 0.00 0.00 42.46 37.06 2iu8 s ILE 167 CO 0.03 -0.03 0.68 0.54 -1.23 0.00 0.00 174.94 174.92 2iu8 n ARG 168 N 5.14 -0.63 -1.67 2.79 5.12 -0.15 0.26 116.66 127.52 2iu8 n ARG 168 Ca -0.12 -1.07 -0.38 0.00 -1.93 0.00 0.00 57.85 54.35 2iu8 n ARG 168 Cb 0.50 -0.69 0.05 0.00 -1.16 0.00 0.00 32.46 31.16 2iu8 n ARG 168 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 2iu8 n GLU 169 N -2.43 1.15 -3.86 5.56 0.00 -1.26 -3.89 120.64 115.91 2iu8 n GLU 169 Ca 0.09 0.44 -0.28 0.00 0.00 0.00 0.00 57.16 57.40 2iu8 n GLU 169 Cb 0.30 -2.33 0.00 0.00 0.00 0.00 0.00 31.44 29.41 2iu8 n GLU 169 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2iu8 n ARG 170 N -1.14 -2.58 -4.87 3.44 1.74 -0.38 -4.87 116.66 108.00 2iu8 n ARG 170 Ca 0.13 0.41 -0.32 0.00 -0.77 0.00 0.00 57.85 57.30 2iu8 n ARG 170 Cb 0.46 -4.34 -0.16 0.00 -1.02 0.00 0.00 32.46 27.41 2iu8 n ARG 170 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2iu8 s VAL 171 N -3.77 2.28 -0.33 1.55 1.01 -1.25 -3.60 120.40 116.29 2iu8 s VAL 171 Ca 0.17 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 61.09 2iu8 s VAL 171 Cb -0.07 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 2iu8 s VAL 171 CO 0.88 0.54 0.31 -0.55 0.00 0.00 0.00 175.10 176.29 2iu8 s SER 172 N 0.58 6.14 -0.21 3.32 0.15 -0.77 -1.78 113.70 121.12 2iu8 s SER 172 Ca -0.12 -0.20 -0.08 0.00 0.70 0.00 0.00 55.95 56.25 2iu8 s SER 172 Cb -0.16 -2.17 -0.04 0.00 -1.71 0.00 0.00 66.02 61.93 2iu8 s SER 172 CO 0.04 -0.26 0.09 -0.63 1.20 0.00 0.00 173.24 173.67 2iu8 s ILE 173 N 1.92 4.89 0.00 6.45 -1.09 0.36 -0.42 121.20 133.31 2iu8 s ILE 173 Ca 0.10 0.01 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 2iu8 s ILE 173 Cb -0.17 -3.24 0.00 0.00 -1.58 0.00 0.00 42.46 37.48 2iu8 s ILE 173 CO 0.11 0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 2iu8 n GLY 174 N 3.94 -2.18 3.80 6.18 0.00 0.15 -0.75 105.19 116.33 2iu8 n GLY 174 Ca -0.16 -1.45 -0.36 0.00 0.00 0.00 0.00 46.02 44.04 2iu8 n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iu8 s LYS 175 N -1.80 4.40 -1.86 1.61 1.02 -1.26 -1.89 119.74 119.95 2iu8 s LYS 175 Ca 0.00 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.06 2iu8 s LYS 175 Cb 0.00 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.46 2iu8 s LYS 175 CO 0.00 0.34 0.00 0.54 -0.92 0.00 0.00 175.35 175.31 2iu8 n ARG 176 N 0.66 -1.32 -2.93 1.68 1.74 -0.66 -1.67 116.66 114.16 2iu8 n ARG 176 Ca -0.00 1.09 -0.40 0.00 -0.77 0.00 0.00 57.85 57.76 2iu8 n ARG 176 Cb 0.51 -5.42 -0.05 0.00 -1.02 0.00 0.00 32.46 26.48 2iu8 n ARG 176 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2iu8 s VAL 177 N -2.73 4.70 -0.10 1.55 1.01 -1.26 -4.14 120.40 119.43 2iu8 s VAL 177 Ca 0.00 1.72 -0.00 0.00 0.00 0.00 0.00 61.98 63.70 2iu8 s VAL 177 Cb 0.00 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 2iu8 s VAL 177 CO 0.00 0.35 -0.09 -0.63 0.00 0.00 0.00 175.10 174.73 2iu8 s ILE 178 N 0.01 3.49 -0.18 2.22 1.01 -0.94 -0.61 121.20 126.21 2iu8 s ILE 178 Ca 0.40 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.51 2iu8 s ILE 178 Cb -0.21 -2.46 0.05 0.00 0.01 0.00 0.00 42.46 39.85 2iu8 s ILE 178 CO 0.24 0.55 -0.01 -0.63 0.00 0.00 0.00 174.94 175.09 2iu8 s ILE 179 N -0.18 0.83 0.95 2.92 1.01 -0.91 -1.30 121.20 124.53 2iu8 s ILE 179 Ca 0.02 -0.59 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 2iu8 s ILE 179 Cb -0.13 -1.16 0.16 0.00 0.01 0.00 0.00 42.46 41.34 2iu8 s ILE 179 CO 0.03 -0.03 1.09 -1.10 0.00 0.00 0.00 174.94 174.93 2iu8 s GLN 180 N 1.74 0.83 0.71 2.79 -1.52 -0.31 -1.98 119.66 121.91 2iu8 s GLN 180 Ca -0.00 0.72 -0.16 0.00 -1.95 0.00 0.00 55.36 53.96 2iu8 s GLN 180 Cb -0.16 -1.77 0.02 0.00 -0.22 0.00 0.00 33.01 30.88 2iu8 s GLN 180 CO -0.07 -2.51 1.23 -2.30 -0.25 0.00 0.00 175.29 171.39 2iu8 n PRO 181 N -4.05 0.74 -0.10 2.91 -0.02 -1.26 -3.49 135.00 129.72 2iu8 n PRO 181 Ca 0.06 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2iu8 n PRO 181 Cb 0.56 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2iu8 n PRO 181 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2iu8 n GLY 182 N 0.82 1.67 3.68 -1.23 0.00 -0.71 -2.20 105.19 107.23 2iu8 n GLY 182 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2iu8 n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iu8 n ALA 183 N 0.47 0.53 -4.01 4.61 0.00 -1.23 -3.64 120.51 117.23 2iu8 n ALA 183 Ca 0.00 -0.10 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 2iu8 n ALA 183 Cb 0.00 -2.24 -0.16 0.00 0.00 0.00 0.00 19.45 17.05 2iu8 n ALA 183 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2iu8 s VAL 184 N -1.62 1.67 -0.32 0.00 1.01 -0.36 -2.46 120.40 118.31 2iu8 s VAL 184 Ca 0.78 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 2iu8 s VAL 184 Cb -0.36 -1.68 0.04 0.00 0.00 0.00 0.00 36.38 34.38 2iu8 s VAL 184 CO 0.45 0.27 0.07 -0.63 0.00 0.00 0.00 175.10 175.26 2iu8 s ILE 185 N 1.40 3.56 0.00 2.22 -1.09 -0.09 -0.86 121.20 126.35 2iu8 s ILE 185 Ca 0.01 -1.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.27 2iu8 s ILE 185 Cb -0.15 -3.00 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2iu8 s ILE 185 CO -0.09 -0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.10 2iu8 n GLY 186 N 4.76 1.30 3.69 6.18 0.00 0.14 -0.98 105.19 120.29 2iu8 n GLY 186 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 2iu8 n GLY 186 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2iu8 n SER 187 N 0.00 1.13 -4.74 1.61 3.41 -1.17 -4.56 113.62 109.30 2iu8 n SER 187 Ca 0.00 0.63 -0.42 0.00 -0.26 0.00 0.00 58.87 58.83 2iu8 n SER 187 Cb 0.00 -1.51 -0.02 0.00 -0.26 0.00 0.00 64.21 62.42 2iu8 n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2iu8 n GLY 189 N 2.77 -2.00 3.40 0.00 0.00 -1.18 -4.77 105.19 103.40 2iu8 n GLY 189 Ca 0.10 -0.55 -0.44 0.00 0.00 0.00 0.00 46.02 45.13 2iu8 n GLY 189 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2iu8 n PHE 190 N -2.84 4.71 -4.58 1.61 7.35 -1.26 -4.99 117.46 117.47 2iu8 n PHE 190 Ca 0.08 -3.26 -0.26 0.00 -0.76 0.00 0.00 57.45 53.25 2iu8 n PHE 190 Cb 0.52 -2.20 -0.17 0.00 0.35 0.00 0.00 39.48 37.98 2iu8 n PHE 190 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2iu8 s GLY 191 N 2.69 0.90 0.05 7.13 0.00 -1.26 -5.07 107.32 111.77 2iu8 s GLY 191 Ca 0.43 -0.54 -0.04 0.00 0.00 0.00 0.00 44.72 44.57 2iu8 s GLY 191 CO 0.01 0.15 0.06 -0.19 0.00 0.00 0.00 173.10 173.13 2iu8 s TYR 192 N 0.77 0.30 -0.38 1.90 1.51 -1.26 -2.78 117.35 117.41 2iu8 s TYR 192 Ca -0.12 -0.70 0.04 0.00 -1.01 0.00 0.00 57.07 55.28 2iu8 s TYR 192 Cb -0.16 -0.21 0.11 0.00 -0.11 0.00 0.00 41.96 41.59 2iu8 s TYR 192 CO 0.02 -0.39 0.11 0.08 -1.11 0.00 0.00 175.55 174.26 2iu8 s VAL 193 N -3.17 2.19 0.02 0.71 1.01 -0.70 -4.86 120.40 115.60 2iu8 s VAL 193 Ca -0.00 -2.50 -0.30 0.00 0.00 0.00 0.00 61.98 59.18 2iu8 s VAL 193 Cb 0.02 -2.60 -0.08 0.00 0.00 0.00 0.00 36.38 33.72 2iu8 s VAL 193 CO -0.07 -0.66 1.91 -0.89 0.00 0.00 0.00 175.10 175.38 2iu8 s THR 194 N 0.67 3.13 1.06 3.92 2.01 -1.26 -2.23 115.64 122.95 2iu8 s THR 194 Ca 0.13 0.15 -0.16 0.00 0.31 0.00 0.00 61.69 62.12 2iu8 s THR 194 Cb -0.21 -3.10 0.22 0.00 0.01 0.00 0.00 72.50 69.43 2iu8 s THR 194 CO -0.07 -0.01 1.17 -0.94 -0.69 0.00 0.00 174.62 174.07 2iu8 s SER 195 N 4.24 2.18 0.07 3.53 1.04 0.12 -4.92 113.70 119.96 2iu8 s SER 195 Ca 0.86 0.66 -0.29 0.00 0.48 0.00 0.00 55.95 57.66 2iu8 s SER 195 Cb -0.41 -0.96 -0.14 0.00 0.10 0.00 0.00 66.02 64.61 2iu8 s SER 195 CO 0.39 -3.35 1.44 0.00 0.98 0.00 0.00 173.24 172.71 2iu8 h ALA 196 N -2.05 -1.09 0.00 5.32 0.00 -1.95 -2.53 119.26 116.96 2iu8 h ALA 196 Ca -0.47 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2iu8 h ALA 196 Cb 1.29 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2iu8 h ALA 196 CO 0.43 -1.11 0.04 1.19 0.00 0.00 0.00 179.25 179.80 2iu8 n PHE 197 N -4.88 0.00 0.00 0.00 3.01 -1.26 -4.76 117.46 109.57 2iu8 n PHE 197 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2iu8 n PHE 197 Cb 0.38 -0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2iu8 n PHE 197 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2iu8 n GLY 198 N -1.03 0.47 3.83 1.37 0.00 -0.95 -5.10 105.19 103.78 2iu8 n GLY 198 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2iu8 n GLY 198 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iu8 s GLN 199 N -0.82 4.11 -0.22 1.61 -0.21 -1.26 -4.69 119.66 118.18 2iu8 s GLN 199 Ca 0.00 0.73 -0.03 0.00 0.02 0.00 0.00 55.36 56.08 2iu8 s GLN 199 Cb 0.00 -2.67 -0.00 0.00 1.00 0.00 0.00 33.01 31.33 2iu8 s GLN 199 CO 0.00 0.29 -0.06 -1.01 -2.12 0.00 0.00 175.29 172.39 2iu8 s HIS 200 N -1.74 2.95 -0.20 0.91 3.76 -1.26 0.10 115.29 119.81 2iu8 s HIS 200 Ca 0.48 -1.06 -0.25 0.00 -0.15 0.00 0.00 55.06 54.08 2iu8 s HIS 200 Cb -0.13 -2.08 -0.01 0.00 1.11 0.00 0.00 32.58 31.46 2iu8 s HIS 200 CO 0.19 -0.59 0.82 0.21 -0.85 0.00 0.00 174.74 174.52 2iu8 s LYS 201 N 1.45 4.25 0.03 1.40 2.36 -0.94 -4.83 119.74 123.45 2iu8 s LYS 201 Ca 0.05 0.96 -0.30 0.00 -2.55 0.00 0.00 55.97 54.13 2iu8 s LYS 201 Cb -0.14 -3.60 -0.07 0.00 -1.05 0.00 0.00 37.83 32.97 2iu8 s LYS 201 CO -0.04 -0.39 1.57 -1.58 1.55 0.00 0.00 175.35 176.45 2iu8 s HIS 202 N 2.39 2.49 -0.26 4.03 5.65 -1.26 -1.72 115.29 126.61 2iu8 s HIS 202 Ca 0.36 0.46 -0.11 0.00 0.25 0.00 0.00 55.06 56.03 2iu8 s HIS 202 Cb -0.16 -3.86 -0.05 0.00 -1.18 0.00 0.00 32.58 27.33 2iu8 s HIS 202 CO 0.10 -3.40 0.17 -0.51 -0.65 0.00 0.00 174.74 170.45 2iu8 s LEU 203 N 2.78 4.04 0.25 8.88 1.43 -1.12 -4.97 118.68 129.96 2iu8 s LEU 203 Ca 0.70 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.54 2iu8 s LEU 203 Cb -0.36 -2.10 -0.10 0.00 0.03 0.00 0.00 46.19 43.66 2iu8 s LEU 203 CO 0.30 0.00 1.36 -0.54 0.23 0.00 0.00 176.35 177.70 2iu8 s LYS 204 N 1.42 4.33 -0.16 1.70 1.02 -1.26 -4.82 119.74 121.98 2iu8 s LYS 204 Ca 0.07 2.19 -0.07 0.00 0.02 0.00 0.00 55.97 58.18 2iu8 s LYS 204 Cb -0.15 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 2iu8 s LYS 204 CO 0.08 -0.30 0.06 -1.01 -0.92 0.00 0.00 175.35 173.26 2iu8 s HIS 205 N -0.22 3.28 0.00 3.18 3.76 -1.26 -4.90 115.29 119.12 2iu8 s HIS 205 Ca 0.56 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.61 2iu8 s HIS 205 Cb -0.39 -2.02 0.00 0.00 1.11 0.00 0.00 32.58 31.27 2iu8 s HIS 205 CO 0.43 0.27 0.07 1.28 -0.85 0.00 0.00 174.74 175.94 2iu8 n LEU 206 N 3.16 0.15 0.00 0.89 4.77 -0.74 -5.03 117.00 120.20 2iu8 n LEU 206 Ca -0.17 -0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 55.53 2iu8 n LEU 206 Cb 0.53 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.72 2iu8 n LEU 206 CO 0.34 0.04 0.27 0.61 -1.33 0.00 0.00 177.39 177.32 2iu8 n GLY 207 N 0.01 -2.34 3.16 -0.72 0.00 -0.76 -4.88 105.19 99.65 2iu8 n GLY 207 Ca 0.00 -1.51 -0.28 0.00 0.00 0.00 0.00 46.02 44.24 2iu8 n GLY 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2iu8 n LYS 208 N -2.76 0.87 -4.15 1.61 5.02 -1.26 -4.61 118.16 112.88 2iu8 n LYS 208 Ca 0.06 -3.22 -0.29 0.00 -2.02 0.00 0.00 58.31 52.84 2iu8 n LYS 208 Cb 0.24 1.00 -0.17 0.00 -0.02 0.00 0.00 35.03 36.09 2iu8 n LYS 208 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2iu8 s VAL 209 N -2.66 1.47 -0.27 -0.18 1.01 -1.24 -2.13 120.40 116.41 2iu8 s VAL 209 Ca 0.03 -0.59 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 2iu8 s VAL 209 Cb 0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2iu8 s VAL 209 CO 0.02 0.44 0.11 -0.63 0.00 0.00 0.00 175.10 175.04 2iu8 s ILE 210 N 1.35 4.60 -0.25 2.22 1.01 0.31 -1.85 121.20 128.59 2iu8 s ILE 210 Ca 0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.50 2iu8 s ILE 210 Cb -0.13 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2iu8 s ILE 210 CO -0.07 0.28 0.00 -0.63 0.00 0.00 0.00 174.94 174.52 2iu8 s ILE 211 N 1.65 3.51 0.88 2.92 -1.09 0.43 -1.19 121.20 128.32 2iu8 s ILE 211 Ca 0.06 -0.67 -0.14 0.00 -2.23 0.00 0.00 60.65 57.67 2iu8 s ILE 211 Cb -0.16 -2.72 0.20 0.00 -1.58 0.00 0.00 42.46 38.20 2iu8 s ILE 211 CO 0.06 0.24 1.20 -0.62 -1.23 0.00 0.00 174.94 174.59 2iu8 n GLU 212 N 4.80 -1.08 -2.08 2.79 1.02 0.03 0.31 120.64 126.42 2iu8 n GLU 212 Ca -0.16 -1.97 -0.38 0.00 -0.02 0.00 0.00 57.16 54.63 2iu8 n GLU 212 Cb 0.49 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 2iu8 n GLU 212 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2iu8 s ASP 213 N -5.43 6.02 -0.72 1.62 1.01 -1.26 -3.59 116.67 114.32 2iu8 s ASP 213 Ca 0.69 2.52 0.00 0.00 0.71 0.00 0.00 52.55 56.47 2iu8 s ASP 213 Cb -0.02 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2iu8 s ASP 213 CO 0.48 -1.03 0.00 0.47 0.21 0.00 0.00 175.17 175.30 2iu8 n ASP 214 N -0.39 -4.48 -4.80 0.27 10.43 -0.67 -1.16 116.55 115.74 2iu8 n ASP 214 Ca 0.07 0.17 -0.36 0.00 2.57 0.00 0.00 54.79 57.24 2iu8 n ASP 214 Cb 0.46 -2.58 -0.06 0.00 1.84 0.00 0.00 41.12 40.77 2iu8 n ASP 214 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2iu8 s VAL 215 N -2.03 4.41 0.07 2.53 1.01 -1.24 -3.79 120.40 121.35 2iu8 s VAL 215 Ca 0.00 1.50 0.06 0.00 0.00 0.00 0.00 61.98 63.55 2iu8 s VAL 215 Cb 0.00 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2iu8 s VAL 215 CO 0.00 0.07 -0.17 -1.61 0.00 0.00 0.00 175.10 173.39 2iu8 s GLU 216 N -2.26 1.03 -0.03 2.72 2.02 -0.84 -2.20 118.70 119.14 2iu8 s GLU 216 Ca 0.50 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.53 2iu8 s GLU 216 Cb -0.16 -1.13 0.03 0.00 0.10 0.00 0.00 34.13 32.96 2iu8 s GLU 216 CO 0.21 0.27 0.01 0.42 0.02 0.00 0.00 175.26 176.18 2iu8 s ILE 217 N -1.04 0.12 1.02 -1.63 1.01 -0.42 -0.43 121.20 119.83 2iu8 s ILE 217 Ca 0.03 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.61 2iu8 s ILE 217 Cb -0.09 -0.22 0.22 0.00 0.01 0.00 0.00 42.46 42.38 2iu8 s ILE 217 CO 0.02 0.13 1.29 -0.83 0.00 0.00 0.00 174.94 175.55 2iu8 s GLY 218 N 0.97 1.75 0.14 6.18 0.00 0.21 -1.17 107.32 115.41 2iu8 s GLY 218 Ca -0.09 -1.19 -0.30 0.00 0.00 0.00 0.00 44.72 43.14 2iu8 s GLY 218 CO -0.02 -0.38 1.26 0.00 0.00 0.00 0.00 173.10 173.97 2iu8 s ALA 219 N -3.73 3.48 0.00 3.20 0.00 -1.26 -3.17 121.76 120.28 2iu8 s ALA 219 Ca 0.74 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2iu8 s ALA 219 Cb -0.04 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2iu8 s ALA 219 CO 0.54 -0.47 0.00 0.09 0.00 0.00 0.00 175.76 175.92 2iu8 n ASN 220 N 3.17 -5.37 -4.77 0.00 3.02 -0.93 -1.09 115.26 109.29 2iu8 n ASN 220 Ca 0.07 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.24 2iu8 n ASN 220 Cb 0.44 -3.02 -0.01 0.00 -0.61 0.00 0.00 39.78 36.59 2iu8 n ASN 220 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2iu8 s THR 221 N -1.16 2.96 -0.09 3.41 2.01 -1.19 -4.21 115.64 117.37 2iu8 s THR 221 Ca 0.00 0.76 0.01 0.00 0.31 0.00 0.00 61.69 62.78 2iu8 s THR 221 Cb 0.00 -3.41 0.02 0.00 0.01 0.00 0.00 72.50 69.12 2iu8 s THR 221 CO 0.00 0.03 -0.12 0.42 -0.69 0.00 0.00 174.62 174.27 2iu8 s THR 222 N -1.44 1.20 -0.22 -0.82 -4.23 0.53 -1.23 115.64 109.43 2iu8 s THR 222 Ca 0.61 -0.47 0.02 0.00 -1.18 0.00 0.00 61.69 60.68 2iu8 s THR 222 Cb -0.32 -1.13 0.04 0.00 1.34 0.00 0.00 72.50 72.44 2iu8 s THR 222 CO 0.39 0.38 -0.15 -0.63 -0.54 0.00 0.00 174.62 174.07 2iu8 s ILE 223 N 1.05 2.05 0.47 2.99 1.01 -0.04 -1.25 121.20 127.49 2iu8 s ILE 223 Ca -0.07 -1.26 -0.08 0.00 0.00 0.00 0.00 60.65 59.24 2iu8 s ILE 223 Cb -0.15 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 2iu8 s ILE 223 CO -0.01 0.24 0.82 -1.81 0.00 0.00 0.00 174.94 174.18 2iu8 s ASP 224 N 1.22 6.37 0.32 3.58 1.01 0.28 0.29 116.67 129.74 2iu8 s ASP 224 Ca -0.02 1.09 0.07 0.00 0.71 0.00 0.00 52.55 54.40 2iu8 s ASP 224 Cb -0.17 -2.31 -0.02 0.00 1.01 0.00 0.00 42.92 41.43 2iu8 s ASP 224 CO -0.09 -0.55 0.41 0.00 0.21 0.00 0.00 175.17 175.15 2iu8 s ARG 225 N -4.45 3.08 0.44 8.23 1.70 -0.38 -4.37 118.95 123.20 2iu8 s ARG 225 Ca 0.50 -1.03 -0.03 0.00 -0.47 0.00 0.00 55.73 54.69 2iu8 s ARG 225 Cb -0.10 -2.75 -0.03 0.00 -0.57 0.00 0.00 34.95 31.49 2iu8 s ARG 225 CO 0.41 0.13 0.72 0.20 -1.08 0.00 0.00 175.30 175.67 2iu8 s GLY 226 N -4.10 1.45 0.17 3.88 0.00 -1.19 -3.10 107.32 104.43 2iu8 s GLY 226 Ca 0.42 -0.64 -0.14 0.00 0.00 0.00 0.00 44.72 44.36 2iu8 s GLY 226 CO 0.30 -0.50 1.74 -0.09 0.00 0.00 0.00 173.10 174.54 2iu8 h ARG 227 N 0.38 0.27 0.00 2.90 2.43 -1.92 -2.01 114.38 116.42 2iu8 h ARG 227 Ca -0.48 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2iu8 h ARG 227 Cb 1.21 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2iu8 h ARG 227 CO 0.61 0.18 0.00 1.97 -1.51 0.00 0.00 179.97 181.22 2iu8 n PHE 228 N -5.06 0.00 -4.43 2.20 1.16 -1.26 -1.79 117.46 108.29 2iu8 n PHE 228 Ca 0.04 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.38 2iu8 n PHE 228 Cb 0.19 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 37.97 2iu8 n PHE 228 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 2iu8 s LYS 229 N 0.00 1.88 0.18 3.97 -0.14 -1.26 -4.43 119.74 119.93 2iu8 s LYS 229 Ca 0.00 -1.73 -0.21 0.00 -1.36 0.00 0.00 55.97 52.67 2iu8 s LYS 229 Cb 0.00 -1.86 -0.08 0.00 -1.68 0.00 0.00 37.83 34.22 2iu8 s LYS 229 CO 0.00 0.28 0.71 -1.01 -0.76 0.00 0.00 175.35 174.57 2iu8 s HIS 230 N -2.49 3.75 0.38 3.18 3.76 -1.26 -3.19 115.29 119.42 2iu8 s HIS 230 Ca 0.31 1.43 -0.24 0.00 -0.15 0.00 0.00 55.06 56.41 2iu8 s HIS 230 Cb -0.03 -2.63 -0.09 0.00 1.11 0.00 0.00 32.58 30.93 2iu8 s HIS 230 CO 0.17 0.43 1.03 -1.12 -0.85 0.00 0.00 174.74 174.40 2iu8 s SER 231 N -1.42 6.88 -0.08 1.40 0.01 -0.91 -4.60 113.70 114.98 2iu8 s SER 231 Ca 0.38 2.01 -0.04 0.00 1.31 0.00 0.00 55.95 59.61 2iu8 s SER 231 Cb -0.19 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.50 2iu8 s SER 231 CO 0.22 -0.40 0.19 -0.69 0.41 0.00 0.00 173.24 172.97 2iu8 s VAL 232 N -1.65 -0.04 -0.25 3.43 1.01 -0.74 -0.53 120.40 121.63 2iu8 s VAL 232 Ca 0.56 0.16 -0.00 0.00 0.00 0.00 0.00 61.98 62.69 2iu8 s VAL 232 Cb -0.21 -0.30 0.04 0.00 0.00 0.00 0.00 36.38 35.90 2iu8 s VAL 232 CO 0.27 0.06 -0.08 -0.69 0.00 0.00 0.00 175.10 174.66 2iu8 s VAL 233 N 1.15 2.63 0.57 2.92 1.01 -0.34 -0.33 120.40 128.01 2iu8 s VAL 233 Ca -0.09 -1.21 -0.06 0.00 0.00 0.00 0.00 61.98 60.62 2iu8 s VAL 233 Cb -0.10 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 2iu8 s VAL 233 CO -0.07 0.14 0.87 -0.13 0.00 0.00 0.00 175.10 175.92 2iu8 s ARG 234 N 1.26 3.06 0.03 2.72 0.52 -0.30 -0.79 118.95 125.45 2iu8 s ARG 234 Ca -0.02 0.03 -0.33 0.00 -0.52 0.00 0.00 55.73 54.90 2iu8 s ARG 234 Cb -0.17 -2.30 -0.17 0.00 0.52 0.00 0.00 34.95 32.83 2iu8 s ARG 234 CO -0.05 -0.59 0.84 0.39 0.02 0.00 0.00 175.30 175.91 2iu8 n GLU 235 N -2.51 0.00 -0.85 3.54 1.02 -1.26 -2.65 120.64 117.93 2iu8 n GLU 235 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2iu8 n GLU 235 Cb 0.57 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.78 2iu8 n GLU 235 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2iu8 n GLY 236 N 1.37 0.54 3.77 0.62 0.00 -0.31 -1.14 105.19 110.03 2iu8 n GLY 236 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2iu8 n GLY 236 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iu8 s SER 237 N -2.47 6.72 -0.18 1.61 0.01 -1.08 -4.21 113.70 114.09 2iu8 s SER 237 Ca 0.00 2.33 0.01 0.00 1.31 0.00 0.00 55.95 59.60 2iu8 s SER 237 Cb 0.00 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.64 2iu8 s SER 237 CO 0.00 -0.54 -0.16 -0.54 0.41 0.00 0.00 173.24 172.41 2iu8 s LYS 238 N -2.10 2.59 -0.22 12.44 -0.14 0.03 -1.99 119.74 130.34 2iu8 s LYS 238 Ca 0.54 -0.80 -0.04 0.00 -1.36 0.00 0.00 55.97 54.31 2iu8 s LYS 238 Cb -0.31 -2.44 -0.01 0.00 -1.68 0.00 0.00 37.83 33.39 2iu8 s LYS 238 CO 0.39 -0.28 -0.03 0.42 -0.76 0.00 0.00 175.35 175.09 2iu8 s ILE 239 N 1.34 3.44 0.00 2.17 1.01 0.43 -1.46 121.20 128.14 2iu8 s ILE 239 Ca 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.20 2iu8 s ILE 239 Cb -0.14 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.75 2iu8 s ILE 239 CO -0.11 0.41 0.00 -0.67 0.00 0.00 0.00 174.94 174.57 2iu8 n ASP 240 N 4.81 -0.51 -4.76 3.58 -0.08 0.05 0.68 116.55 120.31 2iu8 n ASP 240 Ca -0.18 -0.35 -0.39 0.00 -1.51 0.00 0.00 54.79 52.36 2iu8 n ASP 240 Cb 0.51 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.91 2iu8 n ASP 240 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 2iu8 s ASN 241 N -1.42 7.45 -0.80 1.67 0.01 -1.26 -2.60 114.94 117.99 2iu8 s ASN 241 Ca 0.00 1.96 -0.03 0.00 -0.71 0.00 0.00 52.86 54.08 2iu8 s ASN 241 Cb 0.00 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.06 2iu8 s ASN 241 CO 0.00 0.01 0.45 0.18 -1.51 0.00 0.00 177.10 176.23 2iu8 n LEU 242 N 1.06 -2.39 -4.90 0.60 4.32 -0.25 -1.45 117.00 114.00 2iu8 n LEU 242 Ca -0.00 -0.21 -0.34 0.00 -0.02 0.00 0.00 56.01 55.44 2iu8 n LEU 242 Cb 0.48 -1.85 -0.05 0.00 -1.62 0.00 0.00 43.42 40.37 2iu8 n LEU 242 CO 0.48 0.21 -0.16 -0.69 -1.22 0.00 0.00 177.39 176.02 2iu8 s VAL 243 N -2.99 5.44 -0.32 4.08 1.01 -1.26 -3.15 120.40 123.21 2iu8 s VAL 243 Ca 0.22 -0.07 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 2iu8 s VAL 243 Cb -0.10 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 2iu8 s VAL 243 CO 0.28 0.38 0.22 -1.58 0.00 0.00 0.00 175.10 174.39 2iu8 s GLN 244 N -1.76 3.55 -0.29 2.72 2.00 -1.15 -0.34 119.66 124.38 2iu8 s GLN 244 Ca 0.25 -0.60 -0.03 0.00 -2.00 0.00 0.00 55.36 52.98 2iu8 s GLN 244 Cb -0.13 -3.74 0.04 0.00 0.80 0.00 0.00 33.01 29.98 2iu8 s GLN 244 CO 0.16 -0.39 0.01 0.42 -0.50 0.00 0.00 175.29 174.99 2iu8 s ILE 245 N 1.71 3.22 0.38 -2.34 -1.09 -0.38 -1.82 121.20 120.87 2iu8 s ILE 245 Ca 0.06 -1.17 -0.06 0.00 -2.23 0.00 0.00 60.65 57.25 2iu8 s ILE 245 Cb -0.17 -2.77 0.09 0.00 -1.58 0.00 0.00 42.46 38.03 2iu8 s ILE 245 CO 0.10 -0.02 0.44 0.00 -1.23 0.00 0.00 174.94 174.23 2iu8 n ALA 246 N 4.70 -0.81 -2.30 9.38 0.00 -0.99 -0.55 120.51 129.94 2iu8 n ALA 246 Ca -0.14 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.28 2iu8 n ALA 246 Cb 0.45 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.84 2iu8 n ALA 246 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2iu8 s HIS 247 N -1.90 2.95 -0.56 0.00 -3.43 -1.26 -3.32 115.29 107.76 2iu8 s HIS 247 Ca 0.26 0.94 0.00 0.00 -0.80 0.00 0.00 55.06 55.47 2iu8 s HIS 247 Cb -0.01 -3.58 0.00 0.00 -1.43 0.00 0.00 32.58 27.55 2iu8 s HIS 247 CO 0.19 -2.07 0.00 1.04 -2.00 0.00 0.00 174.74 171.90 2iu8 n GLN 248 N 5.39 -0.38 -2.49 -0.38 6.02 -1.26 -1.86 117.38 122.42 2iu8 n GLN 248 Ca 0.12 0.66 -0.41 0.00 -0.01 0.00 0.00 57.00 57.36 2iu8 n GLN 248 Cb 0.44 -4.39 -0.04 0.00 1.02 0.00 0.00 30.24 27.27 2iu8 n GLN 248 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2iu8 s VAL 249 N -2.20 3.88 -0.19 5.09 1.01 -1.21 -3.45 120.40 123.33 2iu8 s VAL 249 Ca 0.00 1.56 -0.03 0.00 0.00 0.00 0.00 61.98 63.51 2iu8 s VAL 249 Cb 0.00 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2iu8 s VAL 249 CO 0.00 0.24 -0.05 -1.61 0.00 0.00 0.00 175.10 173.68 2iu8 s GLU 250 N -0.09 3.46 -0.18 2.72 2.02 -0.63 -1.79 118.70 124.21 2iu8 s GLU 250 Ca 0.51 -0.61 -0.06 0.00 0.02 0.00 0.00 54.97 54.84 2iu8 s GLU 250 Cb -0.30 -2.93 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 2iu8 s GLU 250 CO 0.34 -0.03 0.03 0.08 0.02 0.00 0.00 175.26 175.71 2iu8 s VAL 251 N 1.04 4.42 0.00 2.63 1.01 0.56 -0.55 120.40 129.51 2iu8 s VAL 251 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2iu8 s VAL 251 Cb -0.15 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2iu8 s VAL 251 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2iu8 n GLY 252 N 3.76 -1.78 3.84 4.51 0.00 0.13 -1.15 105.19 114.50 2iu8 n GLY 252 Ca -0.17 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 2iu8 n GLY 252 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iu8 s GLN 253 N -1.40 4.02 -1.50 1.61 -0.21 -1.26 -3.74 119.66 117.18 2iu8 s GLN 253 Ca 0.00 0.54 -0.05 0.00 0.02 0.00 0.00 55.36 55.87 2iu8 s GLN 253 Cb 0.00 -2.93 0.02 0.00 1.00 0.00 0.00 33.01 31.10 2iu8 s GLN 253 CO 0.00 0.47 0.49 0.72 -2.12 0.00 0.00 175.29 174.85 2iu8 n HIS 254 N 0.81 -1.80 -3.32 0.91 8.25 -0.29 -0.81 115.22 118.97 2iu8 n HIS 254 Ca -0.05 0.43 -0.19 0.00 -0.26 0.00 0.00 57.72 57.64 2iu8 n HIS 254 Cb 0.52 -4.05 0.00 0.00 1.12 0.00 0.00 29.99 27.58 2iu8 n HIS 254 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2iu8 s SER 255 N -2.60 5.89 -0.01 0.41 0.01 -1.26 -3.53 113.70 112.60 2iu8 s SER 255 Ca 0.27 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.38 2iu8 s SER 255 Cb -0.13 -1.18 0.02 0.00 0.21 0.00 0.00 66.02 64.94 2iu8 s SER 255 CO 0.34 -0.53 0.01 -0.04 0.41 0.00 0.00 173.24 173.42 2iu8 s MET 256 N -4.26 0.05 -0.28 12.44 -1.94 0.12 -0.79 119.30 124.63 2iu8 s MET 256 Ca 0.47 0.09 0.01 0.00 -1.71 0.00 0.00 55.69 54.56 2iu8 s MET 256 Cb -0.10 -0.22 0.08 0.00 2.01 0.00 0.00 34.83 36.60 2iu8 s MET 256 CO 0.32 -0.10 0.01 0.42 -0.01 0.00 0.00 175.02 175.67 2iu8 s ILE 257 N 0.68 1.60 0.61 2.53 1.01 -0.53 -0.92 121.20 126.17 2iu8 s ILE 257 Ca -0.06 -1.58 -0.16 0.00 0.00 0.00 0.00 60.65 58.84 2iu8 s ILE 257 Cb -0.09 -2.02 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 2iu8 s ILE 257 CO -0.02 -0.37 1.10 -0.69 0.00 0.00 0.00 174.94 174.96 2iu8 s VAL 258 N 1.30 3.37 0.35 2.92 1.01 -0.51 -0.77 120.40 128.07 2iu8 s VAL 258 Ca 0.02 0.69 -0.19 0.00 0.00 0.00 0.00 61.98 62.51 2iu8 s VAL 258 Cb -0.19 -3.21 -0.14 0.00 0.00 0.00 0.00 36.38 32.84 2iu8 s VAL 258 CO -0.11 -0.34 0.08 0.00 0.00 0.00 0.00 175.10 174.73 2iu8 n ALA 259 N -2.03 -2.80 -0.17 5.51 0.00 -1.26 -2.27 120.51 117.49 2iu8 n ALA 259 Ca 0.10 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2iu8 n ALA 259 Cb 0.52 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.67 2iu8 n ALA 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2iu8 n GLN 260 N 1.18 0.00 -0.51 0.00 6.02 -0.53 -1.46 117.38 122.08 2iu8 n GLN 260 Ca 0.10 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.80 2iu8 n GLN 260 Cb 0.35 -4.06 0.24 0.00 1.02 0.00 0.00 30.24 27.79 2iu8 n GLN 260 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2iu8 n ALA 261 N 0.97 -3.54 -3.40 -1.58 0.00 -0.96 -4.16 120.51 107.84 2iu8 n ALA 261 Ca 0.00 -1.31 -0.16 0.00 0.00 0.00 0.00 53.44 51.98 2iu8 n ALA 261 Cb 0.00 -1.80 -0.06 0.00 0.00 0.00 0.00 19.45 17.60 2iu8 n ALA 261 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2iu8 s GLY 262 N -2.24 -0.48 -0.03 0.00 0.00 -0.44 -2.95 107.32 101.18 2iu8 s GLY 262 Ca 0.64 0.89 -0.01 0.00 0.00 0.00 0.00 44.72 46.24 2iu8 s GLY 262 CO 0.65 0.57 0.03 -0.42 0.00 0.00 0.00 173.10 173.93 2iu8 s ILE 263 N -1.83 -0.01 0.67 0.90 1.01 -0.76 -1.44 121.20 119.74 2iu8 s ILE 263 Ca -0.08 0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.77 2iu8 s ILE 263 Cb -0.01 -0.16 0.06 0.00 0.01 0.00 0.00 42.46 42.36 2iu8 s ILE 263 CO 0.04 0.14 0.96 0.00 0.00 0.00 0.00 174.94 176.08 2iu8 s ALA 264 N 1.45 3.32 0.57 9.38 0.00 -0.07 -2.34 121.76 134.07 2iu8 s ALA 264 Ca -0.04 -1.02 -0.18 0.00 0.00 0.00 0.00 51.96 50.72 2iu8 s ALA 264 Cb -0.13 -2.48 -0.09 0.00 0.00 0.00 0.00 23.12 20.42 2iu8 s ALA 264 CO -0.03 -1.19 0.42 0.41 0.00 0.00 0.00 175.76 175.37 2iu8 n GLY 265 N -2.80 -1.77 3.57 0.00 0.00 -1.26 -3.44 105.19 99.49 2iu8 n GLY 265 Ca 0.08 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 2iu8 n GLY 265 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2iu8 n SER 266 N 0.77 -3.63 -4.73 1.61 7.64 -0.78 -0.74 113.62 113.77 2iu8 n SER 266 Ca 0.11 -0.53 -0.35 0.00 1.01 0.00 0.00 58.87 59.11 2iu8 n SER 266 Cb 0.48 -2.99 -0.08 0.00 -1.01 0.00 0.00 64.21 60.60 2iu8 n SER 266 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2iu8 s THR 267 N -3.01 4.56 -0.22 0.44 2.01 -1.22 -2.62 115.64 115.58 2iu8 s THR 267 Ca 0.49 -0.25 -0.05 0.00 0.31 0.00 0.00 61.69 62.19 2iu8 s THR 267 Cb -0.26 -2.97 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 2iu8 s THR 267 CO 0.60 0.53 -0.02 -0.54 -0.69 0.00 0.00 174.62 174.50 2iu8 s LYS 268 N -1.15 3.47 -0.18 4.92 -0.14 -0.01 -1.60 119.74 125.05 2iu8 s LYS 268 Ca 0.16 -0.58 -0.06 0.00 -1.36 0.00 0.00 55.97 54.13 2iu8 s LYS 268 Cb -0.12 -3.07 -0.04 0.00 -1.68 0.00 0.00 37.83 32.93 2iu8 s LYS 268 CO 0.06 -0.15 0.04 0.42 -0.76 0.00 0.00 175.35 174.96 2iu8 s ILE 269 N 1.38 4.53 0.00 2.17 -1.09 0.28 0.13 121.20 128.60 2iu8 s ILE 269 Ca 0.05 -0.13 0.00 0.00 -2.23 0.00 0.00 60.65 58.34 2iu8 s ILE 269 Cb -0.14 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 2iu8 s ILE 269 CO -0.01 0.46 0.00 0.61 -1.23 0.00 0.00 174.94 174.77 2iu8 n GLY 270 N 3.63 -1.12 3.85 6.18 0.00 -0.62 -0.69 105.19 116.43 2iu8 n GLY 270 Ca -0.17 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 43.90 2iu8 n GLY 270 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2iu8 s ASN 271 N -1.07 6.76 -1.49 1.61 0.01 -1.26 -3.32 114.94 116.18 2iu8 s ASN 271 Ca 0.00 1.09 -0.07 0.00 -0.71 0.00 0.00 52.86 53.17 2iu8 s ASN 271 Cb 0.00 -2.29 0.01 0.00 0.41 0.00 0.00 41.25 39.38 2iu8 s ASN 271 CO 0.00 -0.03 0.80 1.41 -1.51 0.00 0.00 177.10 177.77 2iu8 n HIS 272 N 0.23 -2.27 -3.77 2.20 8.25 0.01 -0.93 115.22 118.94 2iu8 n HIS 272 Ca -0.01 0.69 -0.37 0.00 -0.26 0.00 0.00 57.72 57.77 2iu8 n HIS 272 Cb 0.52 -4.58 -0.06 0.00 1.12 0.00 0.00 29.99 26.99 2iu8 n HIS 272 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2iu8 s VAL 273 N -3.22 5.38 -0.24 1.59 1.01 -1.26 -3.45 120.40 120.20 2iu8 s VAL 273 Ca 0.41 0.38 -0.03 0.00 0.00 0.00 0.00 61.98 62.74 2iu8 s VAL 273 Cb -0.19 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.72 2iu8 s VAL 273 CO 0.51 0.60 -0.03 -0.63 0.00 0.00 0.00 175.10 175.55 2iu8 s ILE 274 N -0.95 3.24 -0.41 2.22 1.01 -0.08 -0.70 121.20 125.53 2iu8 s ILE 274 Ca 0.17 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 59.92 2iu8 s ILE 274 Cb -0.13 -2.57 0.02 0.00 0.01 0.00 0.00 42.46 39.78 2iu8 s ILE 274 CO 0.06 0.28 0.34 -0.63 0.00 0.00 0.00 174.94 174.99 2iu8 s ILE 275 N 1.42 5.21 1.00 2.92 1.01 -0.10 0.69 121.20 133.35 2iu8 s ILE 275 Ca 0.03 -0.52 -0.12 0.00 0.00 0.00 0.00 60.65 60.05 2iu8 s ILE 275 Cb -0.16 -3.94 0.19 0.00 0.01 0.00 0.00 42.46 38.57 2iu8 s ILE 275 CO -0.03 -0.31 1.08 -0.83 0.00 0.00 0.00 174.94 174.85 2iu8 s GLY 276 N 1.72 1.60 0.18 6.18 0.00 0.75 -1.42 107.32 116.34 2iu8 s GLY 276 Ca 0.07 0.04 -0.32 0.00 0.00 0.00 0.00 44.72 44.52 2iu8 s GLY 276 CO 0.11 0.61 1.07 0.61 0.00 0.00 0.00 173.10 175.50 2iu8 n GLY 277 N -0.13 -0.20 3.29 0.20 0.00 -1.26 -2.35 105.19 104.73 2iu8 n GLY 277 Ca 0.06 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2iu8 n GLY 277 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2iu8 n GLN 278 N 1.52 -0.73 -0.84 1.61 6.02 -0.53 -0.98 117.38 123.45 2iu8 n GLN 278 Ca 0.15 0.18 -0.30 0.00 -0.01 0.00 0.00 57.00 57.02 2iu8 n GLN 278 Cb 0.25 -4.27 0.17 0.00 1.02 0.00 0.00 30.24 27.41 2iu8 n GLN 278 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2iu8 s ALA 279 N -1.48 1.18 -0.02 -1.58 0.00 -0.99 -4.29 121.76 114.57 2iu8 s ALA 279 Ca 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 51.96 52.22 2iu8 s ALA 279 Cb 0.00 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.80 2iu8 s ALA 279 CO 0.00 -2.77 0.04 0.20 0.00 0.00 0.00 175.76 173.23 2iu8 s GLY 280 N -2.88 0.03 -0.11 0.00 0.00 0.17 -1.33 107.32 103.19 2iu8 s GLY 280 Ca 0.66 0.25 0.01 0.00 0.00 0.00 0.00 44.72 45.64 2iu8 s GLY 280 CO 0.59 0.44 -0.13 -0.42 0.00 0.00 0.00 173.10 173.58 2iu8 s ILE 281 N 0.59 1.34 1.26 0.90 1.01 -0.52 -1.06 121.20 124.72 2iu8 s ILE 281 Ca -0.05 -0.53 -0.17 0.00 0.00 0.00 0.00 60.65 59.90 2iu8 s ILE 281 Cb -0.07 -1.25 0.31 0.00 0.01 0.00 0.00 42.46 41.46 2iu8 s ILE 281 CO -0.02 0.41 1.00 -0.89 0.00 0.00 0.00 174.94 175.44 2iu8 s THR 282 N 1.16 1.70 0.51 2.92 2.01 -0.86 -0.89 115.64 122.19 2iu8 s THR 282 Ca -0.04 0.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 2iu8 s THR 282 Cb -0.14 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2iu8 s THR 282 CO -0.03 0.00 0.82 -0.83 -0.69 0.00 0.00 174.62 173.89 2iu8 s GLY 283 N -2.87 1.52 -1.60 4.40 0.00 -1.26 -4.11 107.32 103.40 2iu8 s GLY 283 Ca 0.68 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.91 2iu8 s GLY 283 CO 0.62 -0.31 0.00 1.42 0.00 0.00 0.00 173.10 174.83 2iu8 n HIS 284 N -2.34 -0.11 -4.31 1.90 8.25 0.09 -4.89 115.22 113.80 2iu8 n HIS 284 Ca 0.01 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.21 2iu8 n HIS 284 Cb 0.55 -2.79 -0.08 0.00 1.12 0.00 0.00 29.99 28.80 2iu8 n HIS 284 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2iu8 s ILE 285 N -2.60 2.01 0.04 1.59 -4.36 -1.25 -4.94 121.20 111.67 2iu8 s ILE 285 Ca 0.00 -1.79 0.08 0.00 -0.26 0.00 0.00 60.65 58.67 2iu8 s ILE 285 Cb 0.00 -2.80 -0.02 0.00 1.25 0.00 0.00 42.46 40.89 2iu8 s ILE 285 CO 0.00 0.00 -0.22 0.00 0.24 0.00 0.00 174.94 174.96 2iu8 s ILE 287 N -0.76 3.19 0.98 0.00 -1.09 0.12 -0.92 121.20 122.73 2iu8 s ILE 287 Ca 0.08 -0.58 -0.11 0.00 -2.23 0.00 0.00 60.65 57.81 2iu8 s ILE 287 Cb -0.09 -2.39 0.17 0.00 -1.58 0.00 0.00 42.46 38.56 2iu8 s ILE 287 CO 0.01 0.48 1.02 0.00 -1.23 0.00 0.00 174.94 175.23 2iu8 n ALA 288 N 4.09 -1.51 -1.54 9.38 0.00 0.35 -1.58 120.51 129.71 2iu8 n ALA 288 Ca -0.18 -0.71 -0.35 0.00 0.00 0.00 0.00 53.44 52.19 2iu8 n ALA 288 Cb 0.52 -2.10 0.08 0.00 0.00 0.00 0.00 19.45 17.94 2iu8 n ALA 288 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2iu8 s ASP 289 N -2.51 4.44 -1.32 0.00 1.01 -1.26 -3.87 116.67 113.16 2iu8 s ASP 289 Ca 0.66 2.47 -0.07 0.00 0.71 0.00 0.00 52.55 56.32 2iu8 s ASP 289 Cb -0.23 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.11 2iu8 s ASP 289 CO 0.61 -2.10 0.93 1.41 0.21 0.00 0.00 175.17 176.22 2iu8 n HIS 290 N -2.29 -2.41 -4.24 4.23 8.25 -0.10 -4.31 115.22 114.35 2iu8 n HIS 290 Ca 0.14 0.80 -0.35 0.00 -0.26 0.00 0.00 57.72 58.05 2iu8 n HIS 290 Cb 0.49 -4.60 -0.09 0.00 1.12 0.00 0.00 29.99 26.92 2iu8 n HIS 290 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2iu8 s VAL 291 N -3.25 4.62 -0.19 1.59 1.01 -1.25 -2.59 120.40 120.35 2iu8 s VAL 291 Ca 0.46 -0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 2iu8 s VAL 291 Cb -0.20 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 2iu8 s VAL 291 CO 0.57 0.60 -0.11 -0.63 0.00 0.00 0.00 175.10 175.54 2iu8 s ILE 292 N -0.87 2.93 -0.30 2.22 1.01 0.11 -0.90 121.20 125.40 2iu8 s ILE 292 Ca 0.13 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 60.02 2iu8 s ILE 292 Cb -0.12 -2.29 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 2iu8 s ILE 292 CO 0.03 0.48 0.17 -0.04 0.00 0.00 0.00 174.94 175.58 2iu8 s MET 293 N 1.14 3.60 0.89 2.79 -1.94 0.22 -0.18 119.30 125.81 2iu8 s MET 293 Ca 0.01 -0.55 -0.12 0.00 -1.71 0.00 0.00 55.69 53.32 2iu8 s MET 293 Cb -0.14 -3.62 0.08 0.00 2.01 0.00 0.00 34.83 33.16 2iu8 s MET 293 CO -0.03 -0.32 0.87 -1.33 -0.01 0.00 0.00 175.02 174.19 2iu8 n MET 294 N 5.03 -0.22 -1.69 2.03 2.81 -0.14 -0.18 117.12 124.76 2iu8 n MET 294 Ca -0.14 -0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.36 2iu8 n MET 294 Cb 0.50 -2.18 0.04 0.00 -0.71 0.00 0.00 33.22 30.88 2iu8 n MET 294 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2iu8 n ALA 295 N -3.70 0.99 -1.35 3.04 0.00 -1.26 -2.93 120.51 115.30 2iu8 n ALA 295 Ca 0.10 0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.52 2iu8 n ALA 295 Cb 0.52 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 17.67 2iu8 n ALA 295 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2iu8 n GLN 296 N -0.91 -1.18 -2.15 0.00 6.02 -0.15 -4.79 117.38 114.22 2iu8 n GLN 296 Ca 0.11 0.90 -0.39 0.00 -0.01 0.00 0.00 57.00 57.61 2iu8 n GLN 296 Cb 0.45 -5.05 -0.01 0.00 1.02 0.00 0.00 30.24 26.65 2iu8 n GLN 296 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2iu8 s THR 297 N -2.28 2.84 -0.35 5.09 2.01 -1.15 -4.68 115.64 117.12 2iu8 s THR 297 Ca 0.00 0.72 0.01 0.00 0.31 0.00 0.00 61.69 62.73 2iu8 s THR 297 Cb 0.00 -3.41 0.09 0.00 0.01 0.00 0.00 72.50 69.19 2iu8 s THR 297 CO 0.00 0.08 0.08 -0.83 -0.69 0.00 0.00 174.62 173.26 2iu8 s GLY 298 N -0.94 1.91 -0.25 4.40 0.00 -0.33 0.42 107.32 112.53 2iu8 s GLY 298 Ca 0.58 -2.37 -0.18 0.00 0.00 0.00 0.00 44.72 42.76 2iu8 s GLY 298 CO 0.44 0.91 0.50 0.14 0.00 0.00 0.00 173.10 175.08 2iu8 s VAL 299 N 1.05 5.09 -0.19 1.40 1.01 -0.22 -0.04 120.40 128.50 2iu8 s VAL 299 Ca 0.06 0.86 0.07 0.00 0.00 0.00 0.00 61.98 62.98 2iu8 s VAL 299 Cb -0.20 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 2iu8 s VAL 299 CO -0.06 0.12 0.24 0.35 0.00 0.00 0.00 175.10 175.75 2iu8 n THR 300 N 4.99 0.00 -4.07 3.92 -2.24 -1.26 -2.02 114.28 113.60 2iu8 n THR 300 Ca -0.05 -0.26 -0.10 0.00 -2.27 0.00 0.00 64.05 61.38 2iu8 n THR 300 Cb 0.50 0.69 -0.11 0.00 -2.10 0.00 0.00 70.33 69.31 2iu8 n THR 300 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2iu8 s LYS 301 N -2.06 0.55 0.33 -0.78 1.02 -1.26 -4.93 119.74 112.61 2iu8 s LYS 301 Ca 0.00 -0.95 -0.29 0.00 0.02 0.00 0.00 55.97 54.75 2iu8 s LYS 301 Cb 0.05 -0.05 -0.11 0.00 -0.52 0.00 0.00 37.83 37.20 2iu8 s LYS 301 CO 0.30 -0.03 1.53 0.43 -0.92 0.00 0.00 175.35 176.67 2iu8 n SER 302 N 0.86 3.78 -4.70 2.83 7.64 -1.26 -4.92 113.62 117.85 2iu8 n SER 302 Ca -0.19 1.19 -0.37 0.00 1.01 0.00 0.00 58.87 60.51 2iu8 n SER 302 Cb 0.58 -1.60 -0.08 0.00 -1.01 0.00 0.00 64.21 62.10 2iu8 n SER 302 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2iu8 s ILE 303 N -0.54 5.28 0.00 0.44 1.01 -0.09 -4.96 121.20 122.34 2iu8 s ILE 303 Ca 0.59 0.52 0.00 0.00 0.00 0.00 0.00 60.65 61.76 2iu8 s ILE 303 Cb -0.49 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.34 2iu8 s ILE 303 CO 0.56 0.34 0.49 0.35 0.00 0.00 0.00 174.94 176.68 2iu8 n THR 304 N 3.96 0.10 -4.03 2.92 -2.24 -1.26 -0.49 114.28 113.24 2iu8 n THR 304 Ca -0.11 -0.49 -0.08 0.00 -2.27 0.00 0.00 64.05 61.10 2iu8 n THR 304 Cb 0.52 1.06 -0.10 0.00 -2.10 0.00 0.00 70.33 69.71 2iu8 n THR 304 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2iu8 s SER 305 N -0.10 0.37 0.95 3.42 1.04 -1.26 -4.82 113.70 113.31 2iu8 s SER 305 Ca 0.00 -0.81 -0.13 0.00 0.48 0.00 0.00 55.95 55.50 2iu8 s SER 305 Cb 0.00 0.19 0.16 0.00 0.10 0.00 0.00 66.02 66.47 2iu8 s SER 305 CO 0.00 -0.52 1.13 -2.84 0.98 0.00 0.00 173.24 171.98 2iu8 s PRO 306 N -3.16 0.79 0.00 4.02 0.02 -1.26 -4.80 135.00 130.60 2iu8 s PRO 306 Ca -0.00 0.32 0.00 0.00 0.02 0.00 0.00 61.00 61.34 2iu8 s PRO 306 Cb 0.02 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.75 2iu8 s PRO 306 CO -0.07 -2.44 0.00 0.41 -0.33 0.00 0.00 177.00 174.56 2iu8 n GLY 307 N -1.84 0.79 3.52 0.52 0.00 -1.07 -4.97 105.19 102.14 2iu8 n GLY 307 Ca 0.06 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 2iu8 n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2iu8 s ILE 308 N -1.72 4.00 0.05 -0.61 1.01 -1.26 0.05 121.20 122.72 2iu8 s ILE 308 Ca 0.00 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.39 2iu8 s ILE 308 Cb 0.00 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.69 2iu8 s ILE 308 CO 0.00 0.50 -0.18 -0.31 0.00 0.00 0.00 174.94 174.95 2iu8 s TYR 309 N 0.29 1.57 0.28 3.97 1.51 0.74 -0.48 117.35 125.23 2iu8 s TYR 309 Ca -0.03 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.51 2iu8 s TYR 309 Cb -0.14 -0.92 0.01 0.00 -0.11 0.00 0.00 41.96 40.80 2iu8 s TYR 309 CO 0.03 0.08 0.60 0.20 -1.11 0.00 0.00 175.55 175.35 2iu8 s GLY 310 N -1.27 0.38 0.00 0.71 0.00 -0.44 -0.97 107.32 105.73 2iu8 s GLY 310 Ca 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.05 2iu8 s GLY 310 CO 0.02 -0.43 0.00 0.61 0.00 0.00 0.00 173.10 173.30 2iu8 n GLY 311 N -0.44 -0.52 2.83 0.20 0.00 -1.26 -0.91 105.19 105.08 2iu8 n GLY 311 Ca -0.03 -1.79 -0.14 0.00 0.00 0.00 0.00 46.02 44.06 2iu8 n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iu8 s ALA 312 N -1.08 -0.73 0.34 4.61 0.00 -1.26 -1.19 121.76 122.44 2iu8 s ALA 312 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 2iu8 s ALA 312 Cb 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 23.12 21.26 2iu8 s ALA 312 CO 0.00 -1.52 1.43 -0.35 0.00 0.00 0.00 175.76 175.32 2iu8 n PRO 313 N 5.33 2.43 -1.74 0.00 -0.04 -1.26 -4.91 135.00 134.82 2iu8 n PRO 313 Ca -0.03 0.86 -0.42 0.00 -0.04 0.00 0.00 63.50 63.87 2iu8 n PRO 313 Cb 0.48 -2.54 -0.00 0.00 -0.04 0.00 0.00 33.50 31.40 2iu8 n PRO 313 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2iu8 n ALA 314 N 0.84 1.83 -2.10 0.55 0.00 0.94 -4.91 120.51 117.66 2iu8 n ALA 314 Ca 0.05 0.35 -0.07 0.00 0.00 0.00 0.00 53.44 53.76 2iu8 n ALA 314 Cb 0.37 -2.34 -0.10 0.00 0.00 0.00 0.00 19.45 17.38 2iu8 n ALA 314 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2iu8 s ARG 315 N -2.01 0.62 0.70 0.00 0.52 -0.08 -4.91 118.95 113.79 2iu8 s ARG 315 Ca 0.55 -1.22 -0.16 0.00 -0.52 0.00 0.00 55.73 54.37 2iu8 s ARG 315 Cb -0.52 0.21 -0.00 0.00 0.52 0.00 0.00 34.95 35.16 2iu8 s ARG 315 CO 0.63 -0.12 0.94 -2.30 0.02 0.00 0.00 175.30 174.47 2iu8 n PRO 316 N 0.10 0.55 -0.31 3.54 -0.02 -1.26 -1.33 135.00 136.27 2iu8 n PRO 316 Ca -0.14 0.24 0.15 0.00 -2.02 0.00 0.00 63.50 61.74 2iu8 n PRO 316 Cb 0.61 -2.19 0.33 0.00 -0.02 0.00 0.00 33.50 32.23 2iu8 n PRO 316 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2iu8 h TYR 317 N -0.15 0.59 0.19 6.00 3.20 -1.12 -1.17 116.97 124.51 2iu8 h TYR 317 Ca -0.47 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.44 2iu8 h TYR 317 Cb 1.34 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.49 2iu8 h TYR 317 CO 0.39 -0.14 -0.14 0.37 -1.64 0.00 0.00 178.16 177.00 2iu8 h GLN 318 N 0.31 -0.33 -0.33 1.82 5.75 -1.88 0.27 115.11 120.72 2iu8 h GLN 318 Ca 0.59 0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 59.02 2iu8 h GLN 318 Cb 1.20 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.81 2iu8 h GLN 318 CO -0.59 -0.22 -0.19 0.93 -2.65 0.00 0.00 178.83 176.10 2iu8 h GLU 319 N -0.34 0.62 0.05 1.69 3.07 -1.64 -1.65 114.58 116.37 2iu8 h GLU 319 Ca -0.01 -0.22 -0.23 0.00 -0.50 0.00 0.00 59.36 58.39 2iu8 h GLU 319 Cb 0.30 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2iu8 h GLU 319 CO -0.01 0.78 -1.03 0.97 -1.40 0.00 0.00 179.01 178.32 2iu8 h ILE 320 N 0.55 1.49 -0.38 3.13 6.09 -1.07 -1.96 117.51 125.36 2iu8 h ILE 320 Ca 0.09 -2.78 -0.06 0.00 -1.37 0.00 0.00 64.86 60.74 2iu8 h ILE 320 Cb 0.64 2.64 -0.01 0.00 0.47 0.00 0.00 36.82 40.56 2iu8 h ILE 320 CO 0.05 0.81 0.01 -0.74 -3.07 0.00 0.00 178.15 175.21 2iu8 h HIS 321 N 0.12 0.72 -0.73 2.19 2.76 -0.36 -2.63 115.15 117.22 2iu8 h HIS 321 Ca -0.08 -0.12 -0.01 0.00 -2.20 0.00 0.00 60.37 57.95 2iu8 h HIS 321 Cb 1.70 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 30.44 2iu8 h HIS 321 CO 0.05 0.75 0.41 -0.09 -1.30 0.00 0.00 177.93 177.74 2iu8 h ARG 322 N 0.48 1.02 -0.18 5.26 2.43 -1.35 -2.76 114.38 119.29 2iu8 h ARG 322 Ca 0.11 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2iu8 h ARG 322 Cb 0.45 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2iu8 h ARG 322 CO 0.02 0.75 0.10 0.37 -1.51 0.00 0.00 179.97 179.69 2iu8 h GLN 323 N 1.01 0.25 -0.80 0.20 4.15 -1.25 -0.84 115.11 117.83 2iu8 h GLN 323 Ca 0.26 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.71 2iu8 h GLN 323 Cb 0.02 -0.05 -0.06 0.00 0.21 0.00 0.00 27.48 27.61 2iu8 h GLN 323 CO -0.04 0.25 0.49 0.28 -1.93 0.00 0.00 178.83 177.87 2iu8 h VAL 324 N 0.18 1.03 -0.53 2.39 2.07 -1.45 0.48 116.25 120.43 2iu8 h VAL 324 Ca 0.06 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 2iu8 h VAL 324 Cb 0.07 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 2iu8 h VAL 324 CO -0.01 0.16 -0.05 0.00 0.02 0.00 0.00 177.57 177.70 2iu8 h ALA 325 N 1.38 0.91 -0.11 1.67 0.00 -1.16 0.01 119.26 121.95 2iu8 h ALA 325 Ca 0.35 -0.31 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 2iu8 h ALA 325 Cb 0.16 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.75 2iu8 h ALA 325 CO -0.17 0.64 -0.84 0.87 0.00 0.00 0.00 179.25 179.75 2iu8 h LYS 326 N 0.86 0.73 -0.42 0.00 1.79 -0.80 -2.73 116.57 115.99 2iu8 h LYS 326 Ca 0.15 -0.64 -0.02 0.00 -2.18 0.00 0.00 60.65 57.96 2iu8 h LYS 326 Cb 0.57 0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.35 2iu8 h LYS 326 CO 0.03 1.24 0.19 0.28 -1.08 0.00 0.00 179.45 180.12 2iu8 h VAL 327 N 0.48 1.19 0.00 0.50 2.07 -0.81 -2.04 116.25 117.64 2iu8 h VAL 327 Ca -0.07 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2iu8 h VAL 327 Cb 1.47 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2iu8 h VAL 327 CO 0.17 0.21 0.16 0.03 0.02 0.00 0.00 177.57 178.15 2iu8 h ARG 328 N 0.54 0.00 -0.15 1.57 2.47 -0.93 -2.84 114.38 115.04 2iu8 h ARG 328 Ca 0.14 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2iu8 h ARG 328 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2iu8 h ARG 328 CO -0.02 0.00 0.00 -1.71 0.56 0.00 0.00 179.97 178.80 2iu8 n ASN 329 N -2.52 2.48 -0.32 7.04 4.05 -0.77 -4.64 115.26 120.58 2iu8 n ASN 329 Ca -0.02 -1.72 -0.02 0.00 0.45 0.00 0.00 54.58 53.28 2iu8 n ASN 329 Cb 0.20 -0.10 0.15 0.00 1.23 0.00 0.00 39.78 41.26 2iu8 n ASN 329 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 2iu8 h LEU 330 N 2.66 1.06 -0.45 1.20 3.38 -1.42 0.23 115.31 121.97 2iu8 h LEU 330 Ca 0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2iu8 h LEU 330 Cb 0.65 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2iu8 h LEU 330 CO 0.00 0.79 0.22 -0.65 0.09 0.00 0.00 178.44 178.89 2iu8 h PRO 331 N 1.23 0.65 -0.46 1.13 0.11 -1.85 -1.50 132.00 131.30 2iu8 h PRO 331 Ca 0.33 -0.09 -0.03 0.00 0.11 0.00 0.00 66.00 66.32 2iu8 h PRO 331 Cb -0.10 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 2iu8 h PRO 331 CO -0.07 0.55 0.18 -0.09 -0.21 0.00 0.00 178.00 178.36 2iu8 h ARG 332 N 0.58 0.66 0.21 1.05 2.43 -1.71 -2.04 114.38 115.56 2iu8 h ARG 332 Ca 0.15 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2iu8 h ARG 332 Cb 0.11 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2iu8 h ARG 332 CO -0.02 0.55 -0.10 1.25 -1.51 0.00 0.00 179.97 180.14 2iu8 h LEU 333 N 0.66 -0.24 -1.05 3.80 5.85 -0.30 -2.81 115.31 121.22 2iu8 h LEU 333 Ca 0.16 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2iu8 h LEU 333 Cb 0.14 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2iu8 h LEU 333 CO -0.02 0.20 0.00 1.05 -0.34 0.00 0.00 178.44 179.33 2iu8 h GLU 334 N -0.75 0.00 -0.40 1.25 4.11 -1.30 -1.30 114.58 116.19 2iu8 h GLU 334 Ca -0.03 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.29 2iu8 h GLU 334 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2iu8 h GLU 334 CO 0.05 0.00 -0.21 1.49 0.07 0.00 0.00 179.01 180.41 2iu8 h GLU 335 N 0.00 0.79 -0.10 1.06 4.81 -1.28 0.38 114.58 120.25 2iu8 h GLU 335 Ca 0.00 -0.31 -0.11 0.00 -0.13 0.00 0.00 59.36 58.81 2iu8 h GLU 335 Cb 0.36 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2iu8 h GLU 335 CO 0.00 0.93 -0.43 0.00 -0.73 0.00 0.00 179.01 178.78 2iu8 h ARG 336 N 0.69 0.22 -0.17 1.92 3.08 -0.98 -1.91 114.38 117.24 2iu8 h ARG 336 Ca 0.10 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2iu8 h ARG 336 Cb 0.72 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.77 2iu8 h ARG 336 CO 0.06 0.62 -0.19 0.82 -1.07 0.00 0.00 179.97 180.20 2iu8 h ILE 337 N 0.18 1.34 -0.87 2.04 2.04 -1.14 -2.19 117.51 118.91 2iu8 h ILE 337 Ca 0.01 -1.37 0.13 0.00 1.00 0.00 0.00 64.86 64.63 2iu8 h ILE 337 Cb 0.84 1.85 -0.07 0.00 -0.74 0.00 0.00 36.82 38.70 2iu8 h ILE 337 CO 0.07 0.41 0.56 0.00 0.00 0.00 0.00 178.15 179.19 2iu8 h ALA 338 N 0.61 1.81 -0.10 1.87 0.00 -0.07 0.21 119.26 123.58 2iu8 h ALA 338 Ca 0.02 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 2iu8 h ALA 338 Cb 0.74 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2iu8 h ALA 338 CO 0.05 -0.03 -0.76 0.00 0.00 0.00 0.00 179.25 178.50 2iu8 h ALA 339 N 1.60 0.46 -0.06 0.00 0.00 -1.35 -3.31 119.26 116.59 2iu8 h ALA 339 Ca 0.43 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2iu8 h ALA 339 Cb 0.65 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2iu8 h ALA 339 CO -0.19 0.73 0.01 1.25 0.00 0.00 0.00 179.25 181.05 2iu8 h LEU 340 N 0.39 0.09 -2.61 0.00 7.12 -0.50 -3.26 115.31 116.54 2iu8 h LEU 340 Ca -0.04 -0.25 0.00 0.00 0.13 0.00 0.00 57.88 57.71 2iu8 h LEU 340 Cb 1.36 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.47 2iu8 h LEU 340 CO 0.14 0.32 0.00 -0.33 -0.13 0.00 0.00 178.44 178.45 2iu8 h GLU 341 N -0.14 0.00 -1.98 1.25 5.08 -0.75 -1.71 114.58 116.33 2iu8 h GLU 341 Ca 0.02 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.14 2iu8 h GLU 341 Cb 0.27 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.43 2iu8 h GLU 341 CO 0.00 0.00 -0.17 1.17 -1.00 0.00 0.00 179.01 179.01 2iu8 n LYS 342 N -3.06 1.98 -3.67 2.33 4.81 -1.23 -4.87 118.16 114.46 2iu8 n LYS 342 Ca -0.02 -1.20 -0.31 0.00 -0.87 0.00 0.00 58.31 55.91 2iu8 n LYS 342 Cb 0.12 -1.92 -0.05 0.00 0.02 0.00 0.00 35.03 33.20 2iu8 n LYS 342 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 2iu8 s LEU 343 N -0.50 4.26 0.00 3.14 0.05 -0.65 -5.02 118.68 119.96 2iu8 s LEU 343 Ca 0.58 0.58 0.04 0.00 0.05 0.00 0.00 54.13 55.38 2iu8 s LEU 343 Cb 0.30 -3.31 0.10 0.00 -2.05 0.00 0.00 46.19 41.23 2iu8 s LEU 343 CO -0.05 0.04 1.05 1.33 -0.55 0.00 0.00 176.35 178.17 2iu8 n VAL 344 N 0.02 0.91 0.00 1.48 0.24 -1.26 -5.18 118.33 114.53 2iu8 n VAL 344 Ca -0.02 -0.95 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 2iu8 n VAL 344 Cb 0.52 0.55 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 2iu8 n VAL 344 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36