#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xc1 s ILE 2 N 0.00 1.39 -0.09 0.53 -4.36 -0.87 -4.97 121.20 112.83 1xc1 s ILE 2 Ca 0.00 -2.10 0.02 0.00 -0.26 0.00 0.00 60.65 58.31 1xc1 s ILE 2 Cb 0.00 -2.28 -0.02 0.00 1.25 0.00 0.00 42.46 41.41 1xc1 s ILE 2 CO 0.00 -0.40 -0.14 -0.89 0.24 0.00 0.00 174.94 173.74 1xc1 s THR 3 N -3.18 3.00 -0.17 8.37 2.01 -1.26 -0.82 115.64 123.59 1xc1 s THR 3 Ca 0.27 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.56 1xc1 s THR 3 Cb 0.04 -2.21 0.03 0.00 0.01 0.00 0.00 72.50 70.37 1xc1 s THR 3 CO 0.09 0.56 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.77 1xc1 s VAL 4 N -0.19 1.60 -0.45 3.82 1.01 0.03 -2.15 120.40 124.06 1xc1 s VAL 4 Ca -0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.87 1xc1 s VAL 4 Cb -0.13 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.67 1xc1 s VAL 4 CO 0.03 0.31 1.34 -0.31 0.00 0.00 0.00 175.10 176.47 1xc1 s TYR 5 N 1.44 2.49 -0.30 5.22 1.51 -0.33 -1.71 117.35 125.68 1xc1 s TYR 5 Ca 0.02 0.65 -0.09 0.00 -1.01 0.00 0.00 57.07 56.64 1xc1 s TYR 5 Cb -0.15 -4.36 -0.01 0.00 -0.11 0.00 0.00 41.96 37.33 1xc1 s TYR 5 CO -0.09 -1.80 0.13 1.21 -1.11 0.00 0.00 175.55 173.89 1xc1 s ASN 6 N 3.62 5.41 0.00 2.29 2.47 -0.93 -1.21 114.94 126.59 1xc1 s ASN 6 Ca 0.56 -0.47 0.20 0.00 0.42 0.00 0.00 52.86 53.57 1xc1 s ASN 6 Cb -0.11 -1.97 0.20 0.00 -1.45 0.00 0.00 41.25 37.92 1xc1 s ASN 6 CO 0.31 -0.16 1.18 0.61 -3.72 0.00 0.00 177.10 175.33 1xc1 n GLY 7 N 4.95 0.83 3.84 1.21 0.00 0.70 -1.15 105.19 115.57 1xc1 n GLY 7 Ca -0.14 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 1xc1 n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xc1 s GLN 8 N -1.63 4.00 0.14 1.61 -0.44 -1.24 -4.04 119.66 118.06 1xc1 s GLN 8 Ca 0.26 0.53 -0.34 0.00 -2.50 0.00 0.00 55.36 53.31 1xc1 s GLN 8 Cb 0.18 -2.88 -0.16 0.00 -1.64 0.00 0.00 33.01 28.50 1xc1 s GLN 8 CO 0.26 0.44 1.18 1.58 0.50 0.00 0.00 175.29 179.26 1xc1 n HIS 9 N 0.68 1.26 0.06 1.67 -0.00 -1.26 -4.61 115.22 113.01 1xc1 n HIS 9 Ca -0.04 0.70 0.21 0.00 -0.00 0.00 0.00 57.72 58.59 1xc1 n HIS 9 Cb 0.52 -2.27 0.68 0.00 -0.00 0.00 0.00 29.99 28.92 1xc1 n HIS 9 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.34 176.12 1xc1 h LYS 10 N 3.58 0.00 0.76 1.57 1.63 -1.94 -0.97 116.57 121.20 1xc1 h LYS 10 Ca -0.44 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.32 1xc1 h LYS 10 Cb 1.35 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.98 1xc1 h LYS 10 CO 0.71 0.00 -0.48 1.49 -3.45 0.00 0.00 179.45 177.72 1xc1 h GLU 11 N 0.00 -1.12 -0.20 1.90 4.81 -2.00 -1.12 114.58 116.85 1xc1 h GLU 11 Ca 0.23 0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 1xc1 h GLU 11 Cb 1.43 0.25 -0.01 0.00 0.63 0.00 0.00 28.75 31.05 1xc1 h GLU 11 CO -0.00 -0.75 0.00 0.00 -0.73 0.00 0.00 179.01 177.53 1xc1 h ALA 12 N -1.19 0.27 -0.55 2.92 0.00 -1.55 -3.03 119.26 116.13 1xc1 h ALA 12 Ca -0.10 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.67 1xc1 h ALA 12 Cb 0.93 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 1xc1 h ALA 12 CO 0.10 -0.02 0.24 0.00 0.00 0.00 0.00 179.25 179.57 1xc1 h ALA 13 N 0.79 0.70 0.30 0.00 0.00 -1.39 -1.95 119.26 117.71 1xc1 h ALA 13 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xc1 h ALA 13 Cb 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1xc1 h ALA 13 CO 0.01 -0.13 -0.14 0.37 0.00 0.00 0.00 179.25 179.36 1xc1 h GLN 14 N 0.46 -0.39 -0.14 0.00 5.75 -1.22 0.83 115.11 120.41 1xc1 h GLN 14 Ca 0.26 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.83 1xc1 h GLN 14 Cb 0.23 0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.81 1xc1 h GLN 14 CO -0.22 -0.18 -0.22 0.00 -2.65 0.00 0.00 178.83 175.57 1xc1 h ALA 15 N 0.14 -0.17 -0.98 3.38 0.00 -1.44 0.69 119.26 120.88 1xc1 h ALA 15 Ca -0.04 0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1xc1 h ALA 15 Cb 0.39 0.43 -0.07 0.00 0.00 0.00 0.00 17.79 18.55 1xc1 h ALA 15 CO 0.07 -0.67 0.63 0.28 0.00 0.00 0.00 179.25 179.55 1xc1 h VAL 16 N -0.27 1.09 -0.00 0.00 2.07 -1.33 0.15 116.25 117.95 1xc1 h VAL 16 Ca 0.10 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1xc1 h VAL 16 Cb 0.43 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1xc1 h VAL 16 CO -0.30 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.50 1xc1 h ALA 17 N 1.44 0.00 -0.16 1.67 0.00 0.72 -2.20 119.26 120.73 1xc1 h ALA 17 Ca 0.42 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1xc1 h ALA 17 Cb 0.15 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1xc1 h ALA 17 CO -0.17 -0.37 -0.08 -0.44 0.00 0.00 0.00 179.25 178.19 1xc1 h ASP 18 N -0.24 -0.27 -0.74 0.00 3.32 0.81 -1.89 116.42 117.41 1xc1 h ASP 18 Ca 0.00 0.07 0.13 0.00 0.02 0.00 0.00 57.03 57.25 1xc1 h ASP 18 Cb 0.25 0.15 -0.09 0.00 0.22 0.00 0.00 39.33 39.86 1xc1 h ASP 18 CO 0.00 -0.11 0.31 0.00 -1.72 0.00 0.00 179.24 177.72 1xc1 h ALA 19 N 1.07 1.04 -0.09 3.45 0.00 -0.67 -0.38 119.26 123.69 1xc1 h ALA 19 Ca 0.09 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1xc1 h ALA 19 Cb 0.20 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xc1 h ALA 19 CO -0.21 -0.18 -0.25 0.35 0.00 0.00 0.00 179.25 178.96 1xc1 h PHE 20 N 0.47 0.17 0.01 0.00 3.57 -0.85 -1.72 116.94 118.59 1xc1 h PHE 20 Ca 0.40 -0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.65 1xc1 h PHE 20 Cb 0.57 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 1xc1 h PHE 20 CO -0.15 0.40 -0.93 1.15 -2.23 0.00 0.00 178.31 176.54 1xc1 h THR 21 N 0.14 1.43 -0.12 4.41 2.02 -0.33 -1.83 112.91 118.63 1xc1 h THR 21 Ca 0.02 -2.52 -0.12 0.00 0.77 0.00 0.00 66.41 64.56 1xc1 h THR 21 Cb 0.53 2.45 -0.01 0.00 -1.74 0.00 0.00 68.15 69.38 1xc1 h THR 21 CO 0.04 0.75 -0.46 0.03 0.37 0.00 0.00 175.52 176.24 1xc1 h ARG 22 N 0.19 0.30 0.04 6.66 3.08 -1.05 0.15 114.38 123.75 1xc1 h ARG 22 Ca -0.07 -0.16 -0.23 0.00 0.07 0.00 0.00 59.98 59.59 1xc1 h ARG 22 Cb 1.57 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.61 1xc1 h ARG 22 CO 0.16 0.71 -1.08 0.00 -1.07 0.00 0.00 179.97 178.68 1xc1 h ALA 23 N 1.27 0.28 0.00 0.04 0.00 -1.25 -3.41 119.26 116.19 1xc1 h ALA 23 Ca 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.02 1xc1 h ALA 23 Cb 0.91 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1xc1 h ALA 23 CO 0.08 1.17 -0.73 0.25 0.00 0.00 0.00 179.25 180.02 1xc1 n THR 24 N -3.40 0.00 0.00 0.00 -2.24 -0.69 -5.01 114.28 102.93 1xc1 n THR 24 Ca -0.03 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1xc1 n THR 24 Cb 0.97 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 1xc1 n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xc1 n GLY 25 N 1.83 1.43 3.65 3.38 0.00 0.51 -5.02 105.19 110.98 1xc1 n GLY 25 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1xc1 n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xc1 s ILE 26 N -2.40 4.44 0.61 -0.61 1.01 -1.26 -4.98 121.20 118.00 1xc1 s ILE 26 Ca 0.00 1.71 -0.12 0.00 0.00 0.00 0.00 60.65 62.24 1xc1 s ILE 26 Cb 0.00 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 1xc1 s ILE 26 CO 0.00 -0.26 1.03 -0.54 0.00 0.00 0.00 174.94 175.16 1xc1 s LYS 27 N 3.52 3.57 -0.06 2.79 1.02 -1.26 -4.03 119.74 125.30 1xc1 s LYS 27 Ca 0.50 0.84 -0.01 0.00 0.02 0.00 0.00 55.97 57.32 1xc1 s LYS 27 Cb -0.17 -2.08 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1xc1 s LYS 27 CO 0.13 -0.59 -0.01 0.08 -0.92 0.00 0.00 175.35 174.04 1xc1 s VAL 28 N -3.01 0.36 -0.21 3.17 1.01 -1.26 -2.06 120.40 118.41 1xc1 s VAL 28 Ca 0.57 0.07 -0.14 0.00 0.00 0.00 0.00 61.98 62.48 1xc1 s VAL 28 Cb -0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1xc1 s VAL 28 CO 0.49 0.23 0.29 -0.75 0.00 0.00 0.00 175.10 175.36 1xc1 s LYS 29 N 1.58 4.16 -0.15 2.72 2.20 0.00 -4.98 119.74 125.28 1xc1 s LYS 29 Ca -0.01 0.02 -0.11 0.00 -0.36 0.00 0.00 55.97 55.50 1xc1 s LYS 29 Cb -0.13 -3.51 -0.05 0.00 -1.51 0.00 0.00 37.83 32.63 1xc1 s LYS 29 CO -0.03 0.06 0.22 -0.51 -0.36 0.00 0.00 175.35 174.73 1xc1 s LEU 30 N 1.02 4.29 -0.72 5.43 1.43 -1.26 -0.79 118.68 128.08 1xc1 s LEU 30 Ca 0.14 0.46 0.05 0.00 -1.03 0.00 0.00 54.13 53.76 1xc1 s LEU 30 Cb -0.14 -2.25 0.17 0.00 0.03 0.00 0.00 46.19 44.01 1xc1 s LEU 30 CO 0.06 0.21 0.52 -3.20 0.23 0.00 0.00 176.35 174.16 1xc1 n ASN 31 N 3.04 3.11 -4.72 2.29 5.15 -0.69 -4.96 115.26 118.48 1xc1 n ASN 31 Ca -0.15 -3.22 -0.41 0.00 -0.60 0.00 0.00 54.58 50.20 1xc1 n ASN 31 Cb 0.53 -0.77 -0.04 0.00 -0.53 0.00 0.00 39.78 38.96 1xc1 n ASN 31 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1xc1 s SER 32 N -1.44 7.26 0.00 1.20 0.01 -1.26 -2.20 113.70 117.27 1xc1 s SER 32 Ca 0.25 1.51 0.00 0.00 1.31 0.00 0.00 55.95 59.03 1xc1 s SER 32 Cb -0.04 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1xc1 s SER 32 CO -0.17 -0.15 0.00 0.00 0.41 0.00 0.00 173.24 173.34 1xc1 n ALA 33 N 3.52 0.00 -2.41 1.44 0.00 -0.30 -4.96 120.51 117.80 1xc1 n ALA 33 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 1xc1 n ALA 33 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 1xc1 n ALA 33 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xc1 s LYS 34 N -0.52 4.60 0.25 0.00 1.02 -1.26 -3.84 119.74 119.99 1xc1 s LYS 34 Ca 0.00 1.29 -0.12 0.00 0.02 0.00 0.00 55.97 57.16 1xc1 s LYS 34 Cb 0.00 -3.39 0.36 0.00 -0.52 0.00 0.00 37.83 34.28 1xc1 s LYS 34 CO 0.00 0.18 1.53 0.41 -0.92 0.00 0.00 175.35 176.55 1xc1 n GLY 35 N 2.45 -1.81 0.26 -3.33 0.00 -1.26 0.45 105.19 101.96 1xc1 n GLY 35 Ca 0.01 1.07 0.15 0.00 0.00 0.00 0.00 46.02 47.26 1xc1 n GLY 35 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xc1 h ASP 36 N 0.00 0.00 0.08 1.61 3.32 -1.96 -1.33 116.42 118.14 1xc1 h ASP 36 Ca 0.42 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.33 1xc1 h ASP 36 Cb 0.66 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.23 1xc1 h ASP 36 CO -1.00 0.06 -0.60 -0.61 -1.72 0.00 0.00 179.24 175.38 1xc1 h GLN 37 N 0.00 0.27 -0.50 3.56 4.15 -0.39 -2.80 115.11 119.40 1xc1 h GLN 37 Ca -0.00 -0.39 -0.08 0.00 0.77 0.00 0.00 58.65 58.95 1xc1 h GLN 37 Cb 0.56 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.37 1xc1 h GLN 37 CO 0.01 1.15 -0.02 -0.07 -1.93 0.00 0.00 178.83 177.96 1xc1 h LEU 38 N -0.42 0.82 -0.39 -2.39 -0.00 -0.85 -2.36 115.31 109.73 1xc1 h LEU 38 Ca -0.10 -0.22 0.01 0.00 -0.00 0.00 0.00 57.88 57.57 1xc1 h LEU 38 Cb 1.42 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 41.84 1xc1 h LEU 38 CO 0.11 0.90 0.25 0.00 -0.00 0.00 0.00 178.44 179.71 1xc1 h ALA 39 N 1.19 0.49 0.00 1.53 0.00 -1.32 0.62 119.26 121.77 1xc1 h ALA 39 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1xc1 h ALA 39 Cb 0.50 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1xc1 h ALA 39 CO 0.03 -0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.62 1xc1 n GLY 40 N -1.20 -1.35 0.09 0.00 0.00 -1.06 -2.01 105.19 99.67 1xc1 n GLY 40 Ca 0.00 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1xc1 n GLY 40 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1xc1 h GLN 41 N 0.00 0.12 -0.38 1.61 4.15 -0.70 -3.17 115.11 116.73 1xc1 h GLN 41 Ca 0.00 -0.21 -0.05 0.00 0.77 0.00 0.00 58.65 59.16 1xc1 h GLN 41 Cb 0.42 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 1xc1 h GLN 41 CO 0.00 0.89 0.04 0.82 -1.93 0.00 0.00 178.83 178.65 1xc1 h ILE 42 N 0.03 1.25 -0.02 2.39 2.04 -0.30 -1.13 117.51 121.77 1xc1 h ILE 42 Ca -0.23 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 64.72 1xc1 h ILE 42 Cb 1.97 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.14 1xc1 h ILE 42 CO 0.12 0.31 -0.01 0.11 0.00 0.00 0.00 178.15 178.68 1xc1 h LYS 43 N 0.49 -0.02 0.72 2.37 1.57 -1.54 -1.38 116.57 118.79 1xc1 h LYS 43 Ca 0.11 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1xc1 h LYS 43 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1xc1 h LYS 43 CO 0.01 -0.01 -0.43 0.93 -0.57 0.00 0.00 179.45 179.38 1xc1 h GLU 44 N -0.02 -1.04 -0.95 3.15 5.08 -1.50 -2.40 114.58 116.89 1xc1 h GLU 44 Ca 0.01 0.07 0.18 0.00 -1.00 0.00 0.00 59.36 58.63 1xc1 h GLU 44 Cb 0.04 0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.44 1xc1 h GLU 44 CO -0.03 -0.70 0.60 0.93 -1.00 0.00 0.00 179.01 178.82 1xc1 h GLU 45 N -1.08 0.64 0.00 2.33 5.08 -1.22 -3.46 114.58 116.86 1xc1 h GLU 45 Ca -0.09 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1xc1 h GLU 45 Cb 0.87 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1xc1 h GLU 45 CO 0.10 0.42 0.00 0.41 -1.00 0.00 0.00 179.01 178.94 1xc1 n GLY 46 N -1.41 1.42 0.46 -3.84 0.00 -0.52 -2.65 105.19 98.64 1xc1 n GLY 46 Ca 0.20 -0.53 0.28 0.00 0.00 0.00 0.00 46.02 45.97 1xc1 n GLY 46 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1xc1 n SER 47 N -2.30 0.00 -3.03 1.61 2.88 -1.26 -0.62 113.62 110.90 1xc1 n SER 47 Ca 0.00 0.65 -0.30 0.00 -1.33 0.00 0.00 58.87 57.89 1xc1 n SER 47 Cb 0.00 -0.25 -0.02 0.00 -0.75 0.00 0.00 64.21 63.18 1xc1 n SER 47 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1xc1 n ARG 48 N -3.02 3.67 -3.91 -1.46 0.00 -1.09 -4.94 116.66 105.92 1xc1 n ARG 48 Ca 0.23 -4.77 -0.35 0.00 -0.00 0.00 0.00 57.85 52.96 1xc1 n ARG 48 Cb 1.33 -2.28 -0.10 0.00 0.00 0.00 0.00 32.46 31.40 1xc1 n ARG 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1xc1 s SER 49 N -3.02 5.67 0.23 6.15 0.15 0.21 -4.85 113.70 118.23 1xc1 s SER 49 Ca 0.47 0.05 0.19 0.00 0.70 0.00 0.00 55.95 57.37 1xc1 s SER 49 Cb 0.28 -1.99 0.92 0.00 -1.71 0.00 0.00 66.02 63.52 1xc1 s SER 49 CO -0.15 0.13 1.58 -2.65 1.20 0.00 0.00 173.24 173.35 1xc1 n PRO 50 N 3.84 0.13 -2.50 5.44 -0.02 -1.26 -4.77 135.00 135.86 1xc1 n PRO 50 Ca -0.16 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.41 1xc1 n PRO 50 Cb 0.52 -1.83 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1xc1 n PRO 50 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xc1 s ALA 51 N -3.35 3.34 -0.15 3.55 0.00 -1.26 -4.57 121.76 119.32 1xc1 s ALA 51 Ca 0.01 0.78 0.12 0.00 0.00 0.00 0.00 51.96 52.87 1xc1 s ALA 51 Cb 0.07 -3.40 -0.17 0.00 0.00 0.00 0.00 23.12 19.61 1xc1 s ALA 51 CO 0.25 -0.34 0.03 -0.25 0.00 0.00 0.00 175.76 175.45 1xc1 n ASP 52 N 3.57 1.54 -3.87 0.00 9.92 -0.92 -4.46 116.55 122.32 1xc1 n ASP 52 Ca 0.07 -0.01 -0.11 0.00 -0.53 0.00 0.00 54.79 54.21 1xc1 n ASP 52 Cb 0.47 0.76 -0.12 0.00 -0.64 0.00 0.00 41.12 41.60 1xc1 n ASP 52 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1xc1 s VAL 53 N -2.35 0.04 -0.24 2.53 1.01 -1.17 -2.02 120.40 118.20 1xc1 s VAL 53 Ca -0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 1xc1 s VAL 53 Cb 0.04 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 36.22 1xc1 s VAL 53 CO 0.58 -0.18 -0.08 0.12 0.00 0.00 0.00 175.10 175.53 1xc1 s PHE 54 N -0.56 3.03 -0.35 5.22 5.36 0.66 -1.18 117.98 130.15 1xc1 s PHE 54 Ca -0.06 -1.54 -0.12 0.00 -0.96 0.00 0.00 56.93 54.25 1xc1 s PHE 54 Cb -0.04 -2.04 0.00 0.00 -0.34 0.00 0.00 43.02 40.60 1xc1 s PHE 54 CO 0.00 -0.73 0.22 -0.47 -1.46 0.00 0.00 175.22 172.78 1xc1 s TYR 55 N 1.32 3.22 0.06 10.12 5.04 -0.35 -1.42 117.35 135.34 1xc1 s TYR 55 Ca 0.01 -0.54 0.08 0.00 -2.44 0.00 0.00 57.07 54.18 1xc1 s TYR 55 Cb -0.16 -2.45 -0.03 0.00 0.35 0.00 0.00 41.96 39.67 1xc1 s TYR 55 CO -0.06 -0.48 -0.20 0.45 -1.34 0.00 0.00 175.55 173.92 1xc1 s SER 56 N 1.65 3.65 0.00 4.32 0.15 0.86 -0.22 113.70 124.11 1xc1 s SER 56 Ca 0.05 -0.50 0.28 0.00 0.70 0.00 0.00 55.95 56.48 1xc1 s SER 56 Cb -0.18 -0.51 1.09 0.00 -1.71 0.00 0.00 66.02 64.71 1xc1 s SER 56 CO 0.08 0.24 1.78 -1.84 1.20 0.00 0.00 173.24 174.70 1xc1 n GLU 57 N 1.46 0.72 -3.99 5.44 0.00 -1.26 -1.27 120.64 121.74 1xc1 n GLU 57 Ca -0.16 -0.30 -0.09 0.00 0.00 0.00 0.00 57.16 56.60 1xc1 n GLU 57 Cb 0.52 -1.49 -0.11 0.00 0.00 0.00 0.00 31.44 30.36 1xc1 n GLU 57 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 1xc1 s GLN 58 N -2.49 0.34 0.04 3.44 -2.07 -1.25 -4.37 119.66 113.29 1xc1 s GLN 58 Ca 0.27 -0.65 -0.01 0.00 -1.82 0.00 0.00 55.36 53.15 1xc1 s GLN 58 Cb 0.20 0.09 -0.27 0.00 -1.09 0.00 0.00 33.01 31.94 1xc1 s GLN 58 CO 0.49 -0.05 1.00 0.82 -1.32 0.00 0.00 175.29 176.23 1xc1 h ILE 59 N 4.57 1.33 -0.76 3.63 1.08 -1.89 -3.32 117.51 122.14 1xc1 h ILE 59 Ca -0.32 -2.97 0.20 0.00 -0.39 0.00 0.00 64.86 61.38 1xc1 h ILE 59 Cb 1.21 2.82 -0.04 0.00 -3.07 0.00 0.00 36.82 37.73 1xc1 h ILE 59 CO 0.42 0.84 0.53 -0.65 -0.69 0.00 0.00 178.15 178.61 1xc1 h PRO 60 N 0.06 0.13 -0.31 2.37 0.11 -1.93 0.16 132.00 132.59 1xc1 h PRO 60 Ca -0.18 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.79 1xc1 h PRO 60 Cb 1.97 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 33.04 1xc1 h PRO 60 CO 0.17 0.09 -0.34 0.00 -0.21 0.00 0.00 178.00 177.71 1xc1 h ALA 61 N 1.63 0.46 -0.25 -0.75 0.00 -1.93 -2.45 119.26 115.97 1xc1 h ALA 61 Ca 0.37 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1xc1 h ALA 61 Cb 1.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1xc1 h ALA 61 CO -0.05 0.52 -0.27 -0.07 0.00 0.00 0.00 179.25 179.38 1xc1 h LEU 62 N 0.54 0.50 -0.97 0.00 3.38 -1.20 -2.93 115.31 114.63 1xc1 h LEU 62 Ca 0.05 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1xc1 h LEU 62 Cb 0.92 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1xc1 h LEU 62 CO 0.08 0.75 0.13 0.00 0.09 0.00 0.00 178.44 179.50 1xc1 h ALA 63 N 1.29 1.16 0.20 1.53 0.00 -0.61 -1.70 119.26 121.14 1xc1 h ALA 63 Ca 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1xc1 h ALA 63 Cb 0.69 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1xc1 h ALA 63 CO 0.05 0.57 -0.10 1.15 0.00 0.00 0.00 179.25 180.92 1xc1 h THR 64 N 0.84 0.89 -0.09 0.00 2.02 -1.28 -0.58 112.91 114.71 1xc1 h THR 64 Ca 0.18 -0.52 0.01 0.00 0.77 0.00 0.00 66.41 66.86 1xc1 h THR 64 Cb 0.31 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1xc1 h THR 64 CO -0.00 0.12 0.06 -0.07 0.37 0.00 0.00 175.52 176.00 1xc1 h LEU 65 N -0.53 0.07 -0.10 2.58 3.38 -1.43 -0.31 115.31 118.98 1xc1 h LEU 65 Ca -0.03 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1xc1 h LEU 65 Cb 0.40 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1xc1 h LEU 65 CO 0.05 0.05 -0.23 -1.28 0.09 0.00 0.00 178.44 177.12 1xc1 h SER 66 N 0.08 0.37 -0.76 -0.43 0.87 -1.15 0.10 113.55 112.65 1xc1 h SER 66 Ca 0.04 -0.58 0.06 0.00 -1.23 0.00 0.00 61.79 60.08 1xc1 h SER 66 Cb 0.04 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 1xc1 h SER 66 CO -0.01 0.88 0.50 0.00 -0.53 0.00 0.00 176.83 177.67 1xc1 h ALA 67 N 0.50 1.66 -0.16 6.23 0.00 -0.13 0.48 119.26 127.85 1xc1 h ALA 67 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xc1 h ALA 67 Cb 0.83 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1xc1 h ALA 67 CO 0.05 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.52 1xc1 n ALA 68 N -2.44 2.63 -3.99 0.00 0.00 -0.22 -4.91 120.51 111.59 1xc1 n ALA 68 Ca 0.11 -0.37 -0.33 0.00 0.00 0.00 0.00 53.44 52.85 1xc1 n ALA 68 Cb 0.21 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.63 1xc1 n ALA 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xc1 n ASN 69 N 0.07 -3.28 -0.93 0.00 3.02 0.17 -4.87 115.26 109.44 1xc1 n ASN 69 Ca 0.06 -0.83 0.11 0.00 -0.03 0.00 0.00 54.58 53.89 1xc1 n ASN 69 Cb 0.30 -2.71 0.13 0.00 -0.61 0.00 0.00 39.78 36.89 1xc1 n ASN 69 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1xc1 n LEU 70 N -4.15 2.98 -4.77 3.41 4.77 0.35 -4.95 117.00 114.63 1xc1 n LEU 70 Ca 0.06 -1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 54.50 1xc1 n LEU 70 Cb 0.50 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 41.42 1xc1 n LEU 70 CO 0.76 0.57 -0.25 -0.76 -1.33 0.00 0.00 177.39 176.38 1xc1 s LEU 71 N -1.60 3.87 0.08 2.23 1.43 -1.25 -1.72 118.68 121.71 1xc1 s LEU 71 Ca 0.29 0.13 -0.23 0.00 -1.03 0.00 0.00 54.13 53.29 1xc1 s LEU 71 Cb 0.19 -2.26 -0.06 0.00 0.03 0.00 0.00 46.19 44.09 1xc1 s LEU 71 CO 0.27 0.27 0.69 -0.70 0.23 0.00 0.00 176.35 177.11 1xc1 s GLU 72 N -1.73 4.41 0.39 1.70 2.56 0.10 -4.63 118.70 121.51 1xc1 s GLU 72 Ca 0.23 0.95 -0.27 0.00 0.00 0.00 0.00 54.97 55.88 1xc1 s GLU 72 Cb -0.12 -3.30 -0.09 0.00 2.00 0.00 0.00 34.13 32.62 1xc1 s GLU 72 CO 0.14 0.47 1.33 -1.25 -0.56 0.00 0.00 175.26 175.38 1xc1 s PRO 73 N -0.64 4.07 0.03 4.30 0.04 -1.26 -4.53 135.00 137.00 1xc1 s PRO 73 Ca 0.34 2.23 -0.00 0.00 0.04 0.00 0.00 61.00 63.61 1xc1 s PRO 73 Cb -0.21 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 1xc1 s PRO 73 CO 0.22 -0.44 0.13 -0.51 0.04 0.00 0.00 177.00 176.44 1xc1 s LEU 74 N -2.25 4.09 0.49 -3.56 1.43 0.83 -4.97 118.68 114.74 1xc1 s LEU 74 Ca 0.55 0.19 -0.23 0.00 -1.03 0.00 0.00 54.13 53.61 1xc1 s LEU 74 Cb -0.40 -2.54 -0.06 0.00 0.03 0.00 0.00 46.19 43.22 1xc1 s LEU 74 CO 0.52 0.23 1.25 -2.16 0.23 0.00 0.00 176.35 176.41 1xc1 s PRO 75 N -2.09 3.52 0.41 1.29 0.04 -1.26 -4.89 135.00 132.03 1xc1 s PRO 75 Ca 0.28 1.97 0.18 0.00 0.04 0.00 0.00 61.00 63.47 1xc1 s PRO 75 Cb -0.12 -2.36 1.10 0.00 0.04 0.00 0.00 34.50 33.16 1xc1 s PRO 75 CO 0.20 -0.80 1.82 0.00 0.04 0.00 0.00 177.00 178.26 1xc1 h ALA 76 N 1.84 2.24 -0.55 8.56 0.00 -1.98 -1.13 119.26 128.23 1xc1 h ALA 76 Ca -0.50 0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.53 1xc1 h ALA 76 Cb 1.27 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1xc1 h ALA 76 CO 0.59 -0.57 0.18 0.77 0.00 0.00 0.00 179.25 180.22 1xc1 h SER 77 N 0.39 0.15 -0.06 0.00 0.02 -1.98 0.23 113.55 112.31 1xc1 h SER 77 Ca 0.52 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.52 1xc1 h SER 77 Cb 1.32 0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.93 1xc1 h SER 77 CO -0.21 0.10 -0.04 0.74 -1.14 0.00 0.00 176.83 176.28 1xc1 h THR 78 N 0.35 1.35 -0.38 -2.27 2.02 -1.58 -3.07 112.91 109.33 1xc1 h THR 78 Ca 0.28 -1.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 1xc1 h THR 78 Cb 0.34 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 1xc1 h THR 78 CO -0.30 0.31 -0.01 0.40 0.37 0.00 0.00 175.52 176.29 1xc1 h ILE 79 N -0.29 1.22 0.00 3.11 2.04 -1.29 -2.39 117.51 119.91 1xc1 h ILE 79 Ca 0.01 -0.89 0.00 0.00 1.00 0.00 0.00 64.86 64.98 1xc1 h ILE 79 Cb 0.51 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1xc1 h ILE 79 CO 0.01 0.31 0.00 -1.13 0.00 0.00 0.00 178.15 177.34 1xc1 h ASN 80 N 0.58 0.00 -0.41 1.72 -1.24 -0.55 -2.95 115.58 112.73 1xc1 h ASN 80 Ca 0.12 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.12 1xc1 h ASN 80 Cb 0.39 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.42 1xc1 h ASN 80 CO 0.02 0.00 0.22 -0.33 -1.29 0.00 0.00 177.43 176.05 1xc1 h GLU 81 N 0.00 0.61 -0.19 6.67 5.08 -1.33 -2.81 114.58 122.61 1xc1 h GLU 81 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1xc1 h GLU 81 Cb 0.41 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1xc1 h GLU 81 CO 0.00 0.47 0.00 0.25 -1.00 0.00 0.00 179.01 178.73 1xc1 n THR 82 N -4.41 0.75 -1.74 1.13 -2.24 -1.17 -4.47 114.28 102.14 1xc1 n THR 82 Ca 0.03 -0.88 -0.42 0.00 -2.27 0.00 0.00 64.05 60.52 1xc1 n THR 82 Cb 0.11 0.66 -0.00 0.00 -2.10 0.00 0.00 70.33 69.00 1xc1 n THR 82 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1xc1 n ARG 83 N 0.27 2.42 -3.34 -0.78 0.63 -1.06 -4.82 116.66 109.99 1xc1 n ARG 83 Ca 0.07 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.85 1xc1 n ARG 83 Cb 0.33 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.72 1xc1 n ARG 83 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xc1 n GLY 84 N 0.68 -1.41 0.00 5.14 0.00 -1.26 -4.96 105.19 103.37 1xc1 n GLY 84 Ca 0.03 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1xc1 n GLY 84 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xc1 n LYS 85 N -0.10 0.00 -1.49 1.61 4.81 -1.26 -2.72 118.16 119.01 1xc1 n LYS 85 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.22 1xc1 n LYS 85 Cb 0.00 0.00 0.09 0.00 0.02 0.00 0.00 35.03 35.14 1xc1 n LYS 85 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xc1 n GLY 86 N 0.00 5.82 3.74 3.14 0.00 -1.26 -5.03 105.19 111.61 1xc1 n GLY 86 Ca 0.00 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 1xc1 n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xc1 s VAL 87 N -4.29 3.10 0.23 1.61 1.01 -1.10 -4.94 120.40 116.01 1xc1 s VAL 87 Ca 0.54 0.93 -0.31 0.00 0.00 0.00 0.00 61.98 63.14 1xc1 s VAL 87 Cb 0.44 -3.59 -0.14 0.00 0.00 0.00 0.00 36.38 33.08 1xc1 s VAL 87 CO 0.02 0.15 1.24 -2.65 0.00 0.00 0.00 175.10 173.86 1xc1 n PRO 88 N 2.35 1.60 -4.52 2.72 -0.02 -1.26 -4.85 135.00 131.02 1xc1 n PRO 88 Ca 0.05 0.57 -0.27 0.00 -2.02 0.00 0.00 63.50 61.83 1xc1 n PRO 88 Cb 0.42 -2.11 -0.17 0.00 -0.02 0.00 0.00 33.50 31.63 1xc1 n PRO 88 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xc1 s VAL 89 N -0.35 1.35 -0.10 -1.45 0.11 -1.26 -4.45 120.40 114.24 1xc1 s VAL 89 Ca 0.67 -0.57 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 1xc1 s VAL 89 Cb -0.73 -1.24 -0.02 0.00 -1.53 0.00 0.00 36.38 32.86 1xc1 s VAL 89 CO 0.53 0.41 1.17 0.00 -3.33 0.00 0.00 175.10 173.88 1xc1 s ALA 90 N 0.87 3.54 0.17 1.54 0.00 -1.26 -4.94 121.76 121.67 1xc1 s ALA 90 Ca -0.10 0.50 -0.15 0.00 0.00 0.00 0.00 51.96 52.21 1xc1 s ALA 90 Cb -0.15 -3.53 0.09 0.00 0.00 0.00 0.00 23.12 19.53 1xc1 s ALA 90 CO 0.01 -0.85 1.76 0.00 0.00 0.00 0.00 175.76 176.68 1xc1 h ALA 91 N 7.56 0.51 -0.10 0.00 0.00 -1.99 -1.96 119.26 123.27 1xc1 h ALA 91 Ca -0.30 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1xc1 h ALA 91 Cb 1.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1xc1 h ALA 91 CO 0.91 -0.20 0.00 1.63 0.00 0.00 0.00 179.25 181.58 1xc1 n LYS 92 N -4.97 1.54 -3.64 0.00 5.02 -1.26 -4.92 118.16 109.93 1xc1 n LYS 92 Ca 0.03 -0.81 -0.27 0.00 -2.02 0.00 0.00 58.31 55.23 1xc1 n LYS 92 Cb 0.14 -1.39 0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1xc1 n LYS 92 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xc1 n LYS 93 N 0.02 -5.45 -0.07 1.97 5.02 -0.74 -4.80 118.16 114.11 1xc1 n LYS 93 Ca 0.16 0.66 0.07 0.00 -2.02 0.00 0.00 58.31 57.18 1xc1 n LYS 93 Cb 0.27 -5.55 0.10 0.00 -0.02 0.00 0.00 35.03 29.84 1xc1 n LYS 93 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1xc1 n ASP 94 N -2.72 2.49 -3.88 4.39 5.75 -1.26 -0.12 116.55 121.20 1xc1 n ASP 94 Ca 0.01 -1.72 -0.09 0.00 -0.01 0.00 0.00 54.79 52.98 1xc1 n ASP 94 Cb 0.55 -0.10 -0.05 0.00 -1.03 0.00 0.00 41.12 40.50 1xc1 n ASP 94 CO 0.00 0.00 0.00 -1.66 -0.11 0.00 0.00 177.20 175.43 1xc1 s TRP 95 N -1.10 0.12 -0.05 2.11 1.48 -1.26 -4.37 118.94 115.87 1xc1 s TRP 95 Ca 0.20 -0.49 -0.04 0.00 -1.06 0.00 0.00 56.10 54.71 1xc1 s TRP 95 Cb 0.13 0.29 0.01 0.00 -1.16 0.00 0.00 33.47 32.74 1xc1 s TRP 95 CO 0.18 -0.95 0.13 0.54 -4.06 0.00 0.00 176.95 172.79 1xc1 s VAL 96 N -3.95 -0.00 0.26 -0.66 0.11 -0.84 -4.53 120.40 110.79 1xc1 s VAL 96 Ca 0.15 0.02 -0.30 0.00 -2.93 0.00 0.00 61.98 58.92 1xc1 s VAL 96 Cb -0.01 -0.19 -0.09 0.00 -1.53 0.00 0.00 36.38 34.56 1xc1 s VAL 96 CO 0.03 0.01 1.09 0.00 -3.33 0.00 0.00 175.10 172.90 1xc1 s ALA 97 N 0.17 3.40 -0.08 1.54 0.00 -1.26 -1.81 121.76 123.72 1xc1 s ALA 97 Ca -0.01 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.83 1xc1 s ALA 97 Cb -0.02 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 1xc1 s ALA 97 CO -0.00 -0.16 -0.07 1.28 0.00 0.00 0.00 175.76 176.81 1xc1 n LEU 98 N 1.44 2.83 -3.85 0.00 4.77 0.88 -4.79 117.00 118.28 1xc1 n LEU 98 Ca -0.00 -0.03 -0.08 0.00 -0.03 0.00 0.00 56.01 55.86 1xc1 n LEU 98 Cb 0.45 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1xc1 n LEU 98 CO 0.54 0.60 0.48 -0.94 -1.33 0.00 0.00 177.39 176.74 1xc1 s SER 99 N -4.85 -0.13 0.12 -1.43 1.04 -1.25 -2.41 113.70 104.80 1xc1 s SER 99 Ca -0.11 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 55.48 1xc1 s SER 99 Cb 0.03 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 1xc1 s SER 99 CO 0.18 -1.48 -0.03 -0.83 0.98 0.00 0.00 173.24 172.07 1xc1 s GLY 100 N -2.99 0.90 -0.05 7.32 0.00 -0.40 -0.73 107.32 111.38 1xc1 s GLY 100 Ca 0.14 -1.42 0.03 0.00 0.00 0.00 0.00 44.72 43.46 1xc1 s GLY 100 CO 0.09 -1.45 -0.13 0.50 0.00 0.00 0.00 173.10 172.11 1xc1 s ARG 101 N -3.90 1.54 -0.01 2.90 0.52 -0.14 -0.73 118.95 119.13 1xc1 s ARG 101 Ca 0.17 -0.46 0.05 0.00 -0.52 0.00 0.00 55.73 54.97 1xc1 s ARG 101 Cb 0.06 -1.33 -0.03 0.00 0.52 0.00 0.00 34.95 34.17 1xc1 s ARG 101 CO -0.02 0.13 -0.15 0.45 0.02 0.00 0.00 175.30 175.73 1xc1 s SER 102 N 0.32 4.03 0.31 0.23 0.15 -1.26 -1.12 113.70 116.36 1xc1 s SER 102 Ca -0.08 -0.27 -0.28 0.00 0.70 0.00 0.00 55.95 56.02 1xc1 s SER 102 Cb -0.12 -0.79 -0.10 0.00 -1.71 0.00 0.00 66.02 63.30 1xc1 s SER 102 CO 0.02 0.30 1.16 -0.13 1.20 0.00 0.00 173.24 175.80 1xc1 s ARG 103 N -1.09 4.48 0.12 5.44 1.81 -0.77 -0.89 118.95 128.05 1xc1 s ARG 103 Ca 0.13 1.90 -0.07 0.00 -1.72 0.00 0.00 55.73 55.98 1xc1 s ARG 103 Cb -0.11 -3.07 -0.01 0.00 -0.45 0.00 0.00 34.95 31.31 1xc1 s ARG 103 CO 0.03 0.03 0.18 0.14 -0.68 0.00 0.00 175.30 175.00 1xc1 s VAL 104 N -1.21 0.12 -0.27 3.52 -7.23 0.26 -4.70 120.40 110.89 1xc1 s VAL 104 Ca 0.48 -1.43 -0.06 0.00 -1.81 0.00 0.00 61.98 59.16 1xc1 s VAL 104 Cb -0.33 -1.63 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1xc1 s VAL 104 CO 0.43 -0.54 0.04 -0.69 -0.31 0.00 0.00 175.10 174.03 1xc1 s VAL 105 N -3.93 3.78 -0.10 1.32 1.01 -0.85 -1.70 120.40 119.93 1xc1 s VAL 105 Ca 0.12 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1xc1 s VAL 105 Cb 0.05 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 1xc1 s VAL 105 CO -0.05 0.18 0.36 0.54 0.00 0.00 0.00 175.10 176.12 1xc1 s VAL 106 N 1.49 5.21 0.10 2.92 0.11 -0.64 -0.29 120.40 129.30 1xc1 s VAL 106 Ca 0.03 0.70 0.01 0.00 -2.93 0.00 0.00 61.98 59.79 1xc1 s VAL 106 Cb -0.16 -3.68 -0.04 0.00 -1.53 0.00 0.00 36.38 30.96 1xc1 s VAL 106 CO 0.01 0.45 -0.04 -0.72 -3.33 0.00 0.00 175.10 171.46 1xc1 s TYR 107 N -0.07 0.86 -0.39 1.54 1.13 -0.76 -0.90 117.35 118.75 1xc1 s TYR 107 Ca 0.21 -0.98 -0.25 0.00 -1.41 0.00 0.00 57.07 54.64 1xc1 s TYR 107 Cb -0.14 -0.51 0.02 0.00 -1.10 0.00 0.00 41.96 40.22 1xc1 s TYR 107 CO 0.08 -0.22 0.91 0.34 -2.51 0.00 0.00 175.55 174.15 1xc1 s ASP 108 N -3.04 6.62 0.23 -0.18 3.68 0.03 -1.62 116.67 122.38 1xc1 s ASP 108 Ca 0.13 0.43 0.20 0.00 2.13 0.00 0.00 52.55 55.44 1xc1 s ASP 108 Cb 0.06 -2.45 0.91 0.00 -1.45 0.00 0.00 42.92 39.99 1xc1 s ASP 108 CO -0.04 -0.90 1.60 0.35 0.13 0.00 0.00 175.17 176.31 1xc1 n THR 109 N 6.09 1.02 -0.00 1.71 -2.24 -0.21 -0.43 114.28 120.22 1xc1 n THR 109 Ca 0.06 0.42 -0.17 0.00 -2.27 0.00 0.00 64.05 62.09 1xc1 n THR 109 Cb 0.48 -1.36 -0.11 0.00 -2.10 0.00 0.00 70.33 67.24 1xc1 n THR 109 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1xc1 h ARG 110 N 0.00 0.41 -0.20 -0.78 3.08 -1.92 -3.31 114.38 111.66 1xc1 h ARG 110 Ca 0.00 -0.43 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1xc1 h ARG 110 Cb 0.20 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1xc1 h ARG 110 CO 0.00 1.09 0.00 1.63 -1.07 0.00 0.00 179.97 181.62 1xc1 n LYS 111 N -4.23 2.36 -3.99 0.04 4.01 -0.94 -5.01 118.16 110.39 1xc1 n LYS 111 Ca -0.10 -2.01 -0.09 0.00 -0.51 0.00 0.00 58.31 55.60 1xc1 n LYS 111 Cb 0.66 -1.48 -0.05 0.00 -0.51 0.00 0.00 35.03 33.64 1xc1 n LYS 111 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1xc1 s LEU 112 N -1.75 0.30 0.08 -0.35 1.43 0.43 -5.01 118.68 113.81 1xc1 s LEU 112 Ca 0.34 -0.92 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1xc1 s LEU 112 Cb 0.21 1.80 -0.04 0.00 0.03 0.00 0.00 46.19 48.19 1xc1 s LEU 112 CO 0.31 -1.15 -0.06 -0.55 0.23 0.00 0.00 176.35 175.13 1xc1 s SER 113 N -3.02 0.92 0.10 2.29 0.15 -1.26 -4.38 113.70 108.51 1xc1 s SER 113 Ca 0.22 -0.96 -0.29 0.00 0.70 0.00 0.00 55.95 55.62 1xc1 s SER 113 Cb -0.01 0.12 -0.12 0.00 -1.71 0.00 0.00 66.02 64.30 1xc1 s SER 113 CO 0.09 -0.48 1.63 -0.08 1.20 0.00 0.00 173.24 175.60 1xc1 h GLU 114 N 3.17 -0.60 -7.25 5.44 4.22 -1.99 -3.37 114.58 114.19 1xc1 h GLU 114 Ca -0.35 0.04 -0.49 0.00 0.08 0.00 0.00 59.36 58.64 1xc1 h GLU 114 Cb 1.16 0.14 0.19 0.00 0.50 0.00 0.00 28.75 30.73 1xc1 h GLU 114 CO 0.63 -0.40 0.19 -1.59 -2.18 0.00 0.00 179.01 175.65 1xc1 s LYS 115 N -6.03 0.72 0.00 1.92 0.00 -1.26 -2.39 119.74 112.70 1xc1 s LYS 115 Ca -0.16 1.24 0.00 0.00 0.00 0.00 0.00 55.97 57.05 1xc1 s LYS 115 Cb 0.06 -1.71 0.00 0.00 0.00 0.00 0.00 37.83 36.18 1xc1 s LYS 115 CO 0.64 -2.73 0.00 -0.40 0.00 0.00 0.00 175.35 172.85 1xc1 n ASP 116 N -4.28 0.00 -4.83 0.03 5.68 -1.26 -4.98 116.55 106.91 1xc1 n ASP 116 Ca 0.09 0.00 -0.32 0.00 -0.50 0.00 0.00 54.79 54.05 1xc1 n ASP 116 Cb 0.53 -0.36 -0.02 0.00 -1.14 0.00 0.00 41.12 40.13 1xc1 n ASP 116 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 1xc1 s LEU 117 N 0.00 3.59 0.35 -2.12 2.96 -1.01 -4.98 118.68 117.47 1xc1 s LEU 117 Ca 0.00 1.64 -0.28 0.00 -0.22 0.00 0.00 54.13 55.26 1xc1 s LEU 117 Cb 0.00 -4.52 -0.10 0.00 0.50 0.00 0.00 46.19 42.07 1xc1 s LEU 117 CO 0.00 -0.74 1.35 -1.61 -1.32 0.00 0.00 176.35 174.03 1xc1 s GLU 118 N -4.07 4.27 0.30 1.98 0.41 -1.26 -4.94 118.70 115.38 1xc1 s GLU 118 Ca 0.60 2.30 0.16 0.00 -0.41 0.00 0.00 54.97 57.62 1xc1 s GLU 118 Cb -0.12 -3.02 0.27 0.00 -1.78 0.00 0.00 34.13 29.48 1xc1 s GLU 118 CO 0.33 -0.30 1.54 0.87 -0.49 0.00 0.00 175.26 177.21 1xc1 h LYS 119 N 3.23 0.00 -4.77 1.61 1.57 -1.94 -3.45 116.57 112.82 1xc1 h LYS 119 Ca -0.49 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 57.89 1xc1 h LYS 119 Cb 1.23 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 33.26 1xc1 h LYS 119 CO 0.65 0.49 -0.78 0.45 -0.57 0.00 0.00 179.45 179.69 1xc1 s SER 120 N -6.46 1.10 0.52 0.86 0.15 -1.26 -4.82 113.70 103.79 1xc1 s SER 120 Ca 0.02 -0.19 0.30 0.00 0.70 0.00 0.00 55.95 56.78 1xc1 s SER 120 Cb 0.09 -0.12 1.39 0.00 -1.71 0.00 0.00 66.02 65.68 1xc1 s SER 120 CO 0.73 0.10 2.02 1.62 1.20 0.00 0.00 173.24 178.90 1xc1 h VAL 121 N 4.88 0.36 0.00 4.45 3.04 -1.95 -2.34 116.25 124.69 1xc1 h VAL 121 Ca -0.31 -0.63 -0.04 0.00 -1.01 0.00 0.00 66.70 64.71 1xc1 h VAL 121 Cb 1.18 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 31.92 1xc1 h VAL 121 CO 0.49 0.10 -0.17 -0.07 -1.01 0.00 0.00 177.57 176.92 1xc1 h LEU 122 N 0.00 0.00 0.00 3.16 3.38 -1.99 -2.60 115.31 117.26 1xc1 h LEU 122 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xc1 h LEU 122 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1xc1 h LEU 122 CO 0.01 0.17 0.00 0.59 0.09 0.00 0.00 178.44 179.30 1xc1 n ASN 123 N -3.69 0.00 0.09 -0.43 3.02 -0.88 -2.79 115.26 110.58 1xc1 n ASN 123 Ca -0.02 -0.34 -0.01 0.00 -0.03 0.00 0.00 54.58 54.19 1xc1 n ASN 123 Cb 0.28 -0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.28 1xc1 n ASN 123 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1xc1 h TYR 124 N 0.00 0.00 0.00 3.10 0.05 -1.64 -3.38 116.97 115.11 1xc1 h TYR 124 Ca 0.00 0.00 -0.48 0.00 0.05 0.00 0.00 58.73 58.30 1xc1 h TYR 124 Cb 0.09 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.85 1xc1 h TYR 124 CO 0.00 0.68 2.98 0.00 -1.05 0.00 0.00 178.16 180.77 1xc1 n ALA 125 N -2.31 5.78 -2.37 3.88 0.00 -1.12 -4.57 120.51 119.81 1xc1 n ALA 125 Ca -0.02 -2.54 -0.08 0.00 0.00 0.00 0.00 53.44 50.81 1xc1 n ALA 125 Cb 0.83 -3.11 -0.09 0.00 0.00 0.00 0.00 19.45 17.08 1xc1 n ALA 125 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xc1 s THR 126 N 2.88 0.18 0.44 0.00 -4.23 -1.26 -4.71 115.64 108.94 1xc1 s THR 126 Ca 0.51 -1.45 0.16 0.00 -1.18 0.00 0.00 61.69 59.73 1xc1 s THR 126 Cb 0.14 -1.36 0.35 0.00 1.34 0.00 0.00 72.50 72.96 1xc1 s THR 126 CO -0.04 -0.80 1.95 -0.65 -0.54 0.00 0.00 174.62 174.54 1xc1 h PRO 127 N 3.05 0.36 -0.53 3.99 0.11 -1.94 -0.79 132.00 136.25 1xc1 h PRO 127 Ca -0.34 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 65.90 1xc1 h PRO 127 Cb 1.17 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1xc1 h PRO 127 CO 0.60 0.24 0.45 -0.22 -0.21 0.00 0.00 178.00 178.86 1xc1 h LYS 128 N 0.38 0.00 -0.47 1.05 3.64 -1.95 0.20 116.57 119.42 1xc1 h LYS 128 Ca 0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 1xc1 h LYS 128 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1xc1 h LYS 128 CO -0.09 0.00 0.00 0.91 -2.27 0.00 0.00 179.45 178.00 1xc1 n TRP 129 N -4.07 1.26 -1.65 1.91 7.02 -0.30 -4.94 117.44 116.68 1xc1 n TRP 129 Ca 0.10 -0.69 -0.52 0.00 -1.02 0.00 0.00 57.50 55.37 1xc1 n TRP 129 Cb 0.66 -0.28 -0.06 0.00 -2.42 0.00 0.00 31.31 29.22 1xc1 n TRP 129 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1xc1 n LYS 130 N 0.46 1.60 -1.29 -0.99 3.00 0.71 -0.44 118.16 121.21 1xc1 n LYS 130 Ca 0.23 0.56 -0.10 0.00 -0.00 0.00 0.00 58.31 59.00 1xc1 n LYS 130 Cb 0.87 -2.43 -0.04 0.00 0.00 0.00 0.00 35.03 33.43 1xc1 n LYS 130 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1xc1 n ASN 131 N 6.95 -5.25 -0.00 3.14 3.02 0.14 -4.81 115.26 118.44 1xc1 n ASN 131 Ca 0.28 0.24 0.04 0.00 -0.03 0.00 0.00 54.58 55.11 1xc1 n ASN 131 Cb 0.23 -3.62 -0.06 0.00 -0.61 0.00 0.00 39.78 35.72 1xc1 n ASN 131 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1xc1 n ARG 132 N -1.29 0.94 -4.39 3.52 1.74 0.41 -4.64 116.66 112.95 1xc1 n ARG 132 Ca -0.10 -0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.59 1xc1 n ARG 132 Cb 0.50 -1.13 -0.15 0.00 -1.02 0.00 0.00 32.46 30.66 1xc1 n ARG 132 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1xc1 s ILE 133 N -2.40 2.82 0.29 0.55 1.10 -1.15 -0.85 121.20 121.57 1xc1 s ILE 133 Ca -0.02 -0.71 0.07 0.00 -0.51 0.00 0.00 60.65 59.48 1xc1 s ILE 133 Cb 0.05 -2.21 -0.03 0.00 0.15 0.00 0.00 42.46 40.42 1xc1 s ILE 133 CO 0.32 0.50 0.32 -0.83 -2.11 0.00 0.00 174.94 173.14 1xc1 s GLY 134 N 0.93 1.50 0.30 1.50 0.00 0.73 -1.50 107.32 110.78 1xc1 s GLY 134 Ca -0.03 -1.44 -0.17 0.00 0.00 0.00 0.00 44.72 43.08 1xc1 s GLY 134 CO -0.01 -1.42 0.66 -2.52 0.00 0.00 0.00 173.10 169.80 1xc1 s TYR 135 N -2.15 0.10 -0.53 1.90 1.13 -0.61 -1.22 117.35 115.95 1xc1 s TYR 135 Ca 0.38 -0.56 0.04 0.00 -1.41 0.00 0.00 57.07 55.52 1xc1 s TYR 135 Cb -0.08 0.55 0.16 0.00 -1.10 0.00 0.00 41.96 41.49 1xc1 s TYR 135 CO 0.28 -1.24 0.38 0.08 -2.51 0.00 0.00 175.55 172.54 1xc1 s VAL 136 N -3.56 1.60 0.37 -3.49 1.01 -1.26 0.63 120.40 115.70 1xc1 s VAL 136 Ca 0.16 -3.27 0.29 0.00 0.00 0.00 0.00 61.98 59.16 1xc1 s VAL 136 Cb -0.04 -2.08 0.29 0.00 0.00 0.00 0.00 36.38 34.56 1xc1 s VAL 136 CO 0.09 -1.07 1.88 1.55 0.00 0.00 0.00 175.10 177.56 1xc1 h PRO 137 N 5.79 0.00 -0.02 2.72 0.13 -1.94 -1.29 132.00 137.40 1xc1 h PRO 137 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1xc1 h PRO 137 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1xc1 h PRO 137 CO 0.53 0.00 -0.23 0.25 -0.23 0.00 0.00 178.00 178.32 1xc1 n THR 138 N -2.66 0.00 -2.48 1.56 -2.24 -1.26 -4.84 114.28 102.35 1xc1 n THR 138 Ca -0.02 -0.33 -0.36 0.00 -2.27 0.00 0.00 64.05 61.06 1xc1 n THR 138 Cb 0.21 1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 1xc1 n THR 138 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xc1 s SER 139 N -2.26 6.59 0.16 3.42 0.15 -0.49 -4.97 113.70 116.31 1xc1 s SER 139 Ca 0.24 2.08 -0.10 0.00 0.70 0.00 0.00 55.95 58.88 1xc1 s SER 139 Cb 0.19 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1xc1 s SER 139 CO 0.44 -0.61 1.54 1.23 1.20 0.00 0.00 173.24 177.05 1xc1 h GLY 140 N 2.31 1.05 2.00 9.45 0.00 -1.93 -2.52 103.07 113.43 1xc1 h GLY 140 Ca -0.49 -0.96 -0.05 0.00 0.00 0.00 0.00 47.33 45.84 1xc1 h GLY 140 CO 0.62 0.87 -0.23 0.00 0.00 0.00 0.00 176.54 177.80 1xc1 h ALA 141 N 0.88 1.58 -0.33 3.60 0.00 -1.94 -0.96 119.26 122.09 1xc1 h ALA 141 Ca 0.10 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 1xc1 h ALA 141 Cb 0.83 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1xc1 h ALA 141 CO 0.07 0.28 -0.46 0.35 0.00 0.00 0.00 179.25 179.50 1xc1 h PHE 142 N 0.00 1.05 -0.56 0.00 3.57 -1.77 -0.62 116.94 118.61 1xc1 h PHE 142 Ca -0.00 -0.34 -0.09 0.00 3.53 0.00 0.00 57.97 61.07 1xc1 h PHE 142 Cb 0.41 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1xc1 h PHE 142 CO 0.00 1.15 -0.01 1.25 -2.23 0.00 0.00 178.31 178.47 1xc1 h LEU 143 N 0.68 0.94 -1.24 0.59 5.85 -0.99 -1.50 115.31 119.64 1xc1 h LEU 143 Ca 0.04 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.45 1xc1 h LEU 143 Cb 1.04 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1xc1 h LEU 143 CO 0.10 1.00 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.61 1xc1 h GLU 144 N 0.89 0.00 -0.23 1.25 4.39 -0.93 -1.80 114.58 118.15 1xc1 h GLU 144 Ca 0.16 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.75 1xc1 h GLU 144 Cb 0.53 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1xc1 h GLU 144 CO 0.03 0.27 -0.28 0.37 -1.16 0.00 0.00 179.01 178.24 1xc1 h GLN 145 N 0.00 0.59 0.41 2.33 5.75 -0.28 -2.06 115.11 121.85 1xc1 h GLN 145 Ca -0.00 -0.33 -0.01 0.00 -0.15 0.00 0.00 58.65 58.16 1xc1 h GLN 145 Cb 0.70 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.26 1xc1 h GLN 145 CO 0.03 0.93 -0.29 0.82 -2.65 0.00 0.00 178.83 177.68 1xc1 h ILE 146 N 0.28 0.41 -0.77 2.39 2.04 -0.95 -2.12 117.51 118.79 1xc1 h ILE 146 Ca 0.03 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.07 1xc1 h ILE 146 Cb 0.85 0.41 -0.14 0.00 -0.74 0.00 0.00 36.82 37.20 1xc1 h ILE 146 CO 0.07 0.00 -0.02 0.58 0.00 0.00 0.00 178.15 178.77 1xc1 h VAL 147 N -0.68 0.30 -0.49 1.67 2.07 -1.32 -1.20 116.25 116.60 1xc1 h VAL 147 Ca -0.04 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1xc1 h VAL 147 Cb 0.57 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1xc1 h VAL 147 CO 0.02 0.01 0.20 0.00 0.02 0.00 0.00 177.57 177.82 1xc1 h ALA 148 N 1.74 0.64 -0.59 1.67 0.00 -1.07 -1.30 119.26 120.34 1xc1 h ALA 148 Ca 0.42 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1xc1 h ALA 148 Cb 0.74 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1xc1 h ALA 148 CO -0.70 0.25 0.28 0.82 0.00 0.00 0.00 179.25 179.89 1xc1 h ILE 149 N 0.66 1.20 -0.38 0.00 2.04 -0.60 0.35 117.51 120.77 1xc1 h ILE 149 Ca 0.16 -0.56 -0.07 0.00 1.00 0.00 0.00 64.86 65.39 1xc1 h ILE 149 Cb 0.19 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1xc1 h ILE 149 CO -0.01 0.23 -0.06 0.58 0.00 0.00 0.00 178.15 178.89 1xc1 h VAL 150 N 0.84 1.27 -0.11 1.67 2.07 -0.97 0.45 116.25 121.47 1xc1 h VAL 150 Ca 0.21 -1.11 -0.14 0.00 0.82 0.00 0.00 66.70 66.49 1xc1 h VAL 150 Cb 0.10 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1xc1 h VAL 150 CO -0.03 0.37 -0.52 0.11 0.02 0.00 0.00 177.57 177.52 1xc1 h LYS 151 N 0.51 0.31 0.00 1.57 1.57 -0.48 -0.91 116.57 119.14 1xc1 h LYS 151 Ca 0.10 -0.19 -0.33 0.00 -1.87 0.00 0.00 60.65 58.37 1xc1 h LYS 151 Cb 0.55 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 1xc1 h LYS 151 CO 0.03 0.76 -2.01 1.28 -0.57 0.00 0.00 179.45 178.94 1xc1 n LEU 152 N -3.94 0.60 -0.00 2.94 4.77 0.12 -4.67 117.00 116.82 1xc1 n LEU 152 Ca -0.02 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1xc1 n LEU 152 Cb 0.57 0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.90 1xc1 n LEU 152 CO 0.44 0.46 -0.29 0.29 -1.33 0.00 0.00 177.39 176.95 1xc1 n LYS 153 N -2.94 2.88 0.00 3.23 4.76 0.16 -5.06 118.16 121.19 1xc1 n LYS 153 Ca -0.24 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.19 1xc1 n LYS 153 Cb 1.09 -0.82 0.00 0.00 -1.84 0.00 0.00 35.03 33.47 1xc1 n LYS 153 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xc1 n GLY 154 N 1.83 2.42 0.27 0.72 0.00 -0.35 -4.49 105.19 105.59 1xc1 n GLY 154 Ca -0.00 -1.86 0.05 0.00 0.00 0.00 0.00 46.02 44.21 1xc1 n GLY 154 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xc1 h GLU 155 N 0.00 0.26 -0.65 1.61 4.81 -1.86 -2.79 114.58 115.97 1xc1 h GLU 155 Ca 0.00 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1xc1 h GLU 155 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1xc1 h GLU 155 CO 0.00 0.25 0.07 0.00 -0.73 0.00 0.00 179.01 178.60 1xc1 h ALA 156 N 1.79 0.86 -0.70 2.92 0.00 -1.95 -1.72 119.26 120.46 1xc1 h ALA 156 Ca 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1xc1 h ALA 156 Cb 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1xc1 h ALA 156 CO -0.00 0.65 0.37 0.00 0.00 0.00 0.00 179.25 180.27 1xc1 h ALA 157 N 1.03 0.90 0.32 0.00 0.00 -1.72 -2.15 119.26 117.64 1xc1 h ALA 157 Ca 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1xc1 h ALA 157 Cb 0.48 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xc1 h ALA 157 CO 0.02 0.44 -0.16 0.00 0.00 0.00 0.00 179.25 179.55 1xc1 h ALA 158 N 1.18 -0.43 -0.21 0.00 0.00 -1.34 -1.80 119.26 116.66 1xc1 h ALA 158 Ca 0.25 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1xc1 h ALA 158 Cb 0.07 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xc1 h ALA 158 CO -0.04 -0.73 -0.05 1.25 0.00 0.00 0.00 179.25 179.68 1xc1 h LEU 159 N -0.46 0.29 -0.24 0.00 5.85 -1.23 -1.39 115.31 118.14 1xc1 h LEU 159 Ca -0.04 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1xc1 h LEU 159 Cb 0.35 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1xc1 h LEU 159 CO 0.07 0.39 0.03 0.50 -0.34 0.00 0.00 178.44 179.09 1xc1 h LYS 160 N 0.31 0.40 -0.40 1.25 3.64 -1.26 -1.23 116.57 119.29 1xc1 h LYS 160 Ca 0.07 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1xc1 h LYS 160 Cb 0.30 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 1xc1 h LYS 160 CO 0.01 0.55 0.18 2.35 -2.27 0.00 0.00 179.45 180.28 1xc1 h TRP 161 N 0.20 0.33 -0.46 1.91 7.01 -0.80 -0.17 115.95 123.97 1xc1 h TRP 161 Ca 0.07 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 60.97 1xc1 h TRP 161 Cb 0.35 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.31 1xc1 h TRP 161 CO 0.03 0.16 -0.17 -0.07 -2.79 0.00 0.00 178.44 175.59 1xc1 h LEU 162 N 0.37 0.90 -0.79 0.65 3.38 -1.20 -0.10 115.31 118.52 1xc1 h LEU 162 Ca 0.17 -0.31 -0.13 0.00 0.09 0.00 0.00 57.88 57.70 1xc1 h LEU 162 Cb 0.11 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1xc1 h LEU 162 CO -0.14 1.06 -0.48 0.11 0.09 0.00 0.00 178.44 179.08 1xc1 h LYS 163 N 0.79 0.30 -0.33 1.13 1.57 -1.05 -1.53 116.57 117.44 1xc1 h LYS 163 Ca 0.11 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1xc1 h LYS 163 Cb 0.71 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 1xc1 h LYS 163 CO 0.05 0.72 -0.08 0.78 -0.57 0.00 0.00 179.45 180.35 1xc1 h GLY 164 N 1.28 0.69 0.90 3.86 0.00 -0.78 -2.71 103.07 106.30 1xc1 h GLY 164 Ca 0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.74 1xc1 h GLY 164 CO 0.08 0.52 0.07 1.41 0.00 0.00 0.00 176.54 178.62 1xc1 h LEU 165 N 0.42 0.49 -0.75 3.11 3.38 -0.86 -1.80 115.31 119.31 1xc1 h LEU 165 Ca 0.08 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.89 1xc1 h LEU 165 Cb 0.58 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 1xc1 h LEU 165 CO 0.03 0.61 0.42 0.50 0.09 0.00 0.00 178.44 180.09 1xc1 h LYS 166 N 0.36 0.72 0.10 1.13 1.63 -1.29 0.18 116.57 119.41 1xc1 h LYS 166 Ca 0.10 -0.04 -0.26 0.00 -0.85 0.00 0.00 60.65 59.59 1xc1 h LYS 166 Cb 0.31 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1xc1 h LYS 166 CO 0.00 0.48 -1.18 0.93 -3.45 0.00 0.00 179.45 176.23 1xc1 h GLU 167 N 0.74 0.30 0.00 1.90 4.39 -1.39 -3.40 114.58 117.12 1xc1 h GLU 167 Ca 0.34 -0.46 -0.17 0.00 0.34 0.00 0.00 59.36 59.41 1xc1 h GLU 167 Cb 0.26 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 1xc1 h GLU 167 CO -0.21 1.20 -1.82 0.66 -1.16 0.00 0.00 179.01 177.68 1xc1 n TYR 168 N -3.58 0.00 -2.61 4.33 0.53 -0.68 -4.96 117.16 110.18 1xc1 n TYR 168 Ca -0.08 0.00 -0.22 0.00 -1.02 0.00 0.00 57.90 56.58 1xc1 n TYR 168 Cb 0.98 -0.55 0.06 0.00 -1.03 0.00 0.00 39.34 38.80 1xc1 n TYR 168 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 1xc1 s GLY 169 N -4.32 1.80 -0.18 2.72 0.00 0.62 0.24 107.32 108.19 1xc1 s GLY 169 Ca -0.06 -1.46 -0.03 0.00 0.00 0.00 0.00 44.72 43.17 1xc1 s GLY 169 CO 0.54 -1.08 -0.07 0.54 0.00 0.00 0.00 173.10 173.04 1xc1 s LYS 170 N -4.91 3.46 0.27 2.90 1.02 -0.56 -4.79 119.74 117.14 1xc1 s LYS 170 Ca 0.61 -0.61 -0.19 0.00 0.02 0.00 0.00 55.97 55.79 1xc1 s LYS 170 Cb -0.09 -2.88 -0.09 0.00 -0.52 0.00 0.00 37.83 34.26 1xc1 s LYS 170 CO 0.41 0.04 0.77 -1.25 -0.92 0.00 0.00 175.35 174.39 1xc1 s PRO 171 N 0.86 4.23 0.05 -1.68 0.04 -1.26 -1.58 135.00 135.65 1xc1 s PRO 171 Ca -0.02 0.89 0.07 0.00 0.04 0.00 0.00 61.00 61.98 1xc1 s PRO 171 Cb -0.15 -2.71 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 1xc1 s PRO 171 CO 0.01 0.29 -0.20 0.71 0.04 0.00 0.00 177.00 177.86 1xc1 s TYR 172 N -1.69 1.74 0.37 0.56 2.02 0.21 -4.88 117.35 115.67 1xc1 s TYR 172 Ca 0.48 -0.37 0.04 0.00 -0.37 0.00 0.00 57.07 56.85 1xc1 s TYR 172 Cb -0.15 -1.03 0.71 0.00 -0.40 0.00 0.00 41.96 41.08 1xc1 s TYR 172 CO 0.20 0.09 2.01 0.00 -1.57 0.00 0.00 175.55 176.28 1xc1 h ALA 173 N 4.85 1.58 -2.81 3.71 0.00 -1.96 -3.39 119.26 121.23 1xc1 h ALA 173 Ca -0.42 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1xc1 h ALA 173 Cb 1.16 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 1xc1 h ALA 173 CO 0.44 0.37 -0.08 -1.59 0.00 0.00 0.00 179.25 178.39 1xc1 s LYS 174 N -5.55 1.38 0.27 0.00 0.00 -1.26 -4.82 119.74 109.76 1xc1 s LYS 174 Ca -0.09 -1.04 -0.04 0.00 0.00 0.00 0.00 55.97 54.80 1xc1 s LYS 174 Cb 0.17 0.48 0.33 0.00 0.00 0.00 0.00 37.83 38.81 1xc1 s LYS 174 CO 0.75 -0.57 1.93 -0.91 0.00 0.00 0.00 175.35 176.56 1xc1 h ASN 175 N 2.29 1.08 -0.57 0.03 -0.26 -1.96 -1.80 115.58 114.39 1xc1 h ASN 175 Ca -0.28 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.43 1xc1 h ASN 175 Cb 1.25 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 38.22 1xc1 h ASN 175 CO 0.39 0.77 0.33 0.77 -1.06 0.00 0.00 177.43 178.63 1xc1 h SER 176 N 1.27 0.70 0.23 5.81 4.64 -1.99 -1.40 113.55 122.82 1xc1 h SER 176 Ca 0.36 -0.04 -0.28 0.00 -0.47 0.00 0.00 61.79 61.36 1xc1 h SER 176 Cb -0.10 -0.18 0.02 0.00 -0.31 0.00 0.00 62.40 61.83 1xc1 h SER 176 CO -0.09 0.56 -1.15 0.58 -0.87 0.00 0.00 176.83 175.85 1xc1 h VAL 177 N 0.81 1.34 -0.26 0.95 2.07 -1.86 -2.42 116.25 116.88 1xc1 h VAL 177 Ca 0.21 -2.51 -0.01 0.00 0.82 0.00 0.00 66.70 65.21 1xc1 h VAL 177 Cb -0.00 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1xc1 h VAL 177 CO -0.04 0.76 0.12 0.00 0.02 0.00 0.00 177.57 178.43 1xc1 h ALA 178 N 0.45 0.34 0.28 1.67 0.00 -1.09 -1.87 119.26 119.03 1xc1 h ALA 178 Ca -0.15 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xc1 h ALA 178 Cb 1.82 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1xc1 h ALA 178 CO 0.21 -0.09 -0.24 1.25 0.00 0.00 0.00 179.25 180.39 1xc1 h LEU 179 N 0.28 -0.62 -2.20 0.00 5.85 -1.31 -2.08 115.31 115.23 1xc1 h LEU 179 Ca 0.09 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1xc1 h LEU 179 Cb 0.14 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1xc1 h LEU 179 CO -0.01 -0.35 0.14 0.06 -0.34 0.00 0.00 178.44 177.94 1xc1 h GLN 180 N -0.53 0.00 -0.17 1.25 3.07 -1.34 0.03 115.11 117.42 1xc1 h GLN 180 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.60 1xc1 h GLN 180 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.02 1xc1 h GLN 180 CO -0.03 0.00 -0.43 0.00 0.09 0.00 0.00 178.83 178.47 1xc1 h ALA 181 N 1.86 0.96 0.02 0.06 0.00 -0.64 -1.14 119.26 120.38 1xc1 h ALA 181 Ca 0.07 -0.44 -0.21 0.00 0.00 0.00 0.00 54.91 54.34 1xc1 h ALA 181 Cb 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xc1 h ALA 181 CO -0.00 0.63 -0.93 0.28 0.00 0.00 0.00 179.25 179.23 1xc1 h VAL 182 N 0.32 1.53 0.00 0.00 2.07 -0.73 -0.33 116.25 119.11 1xc1 h VAL 182 Ca 0.03 -2.78 0.00 0.00 0.82 0.00 0.00 66.70 64.77 1xc1 h VAL 182 Cb 0.89 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 1xc1 h VAL 182 CO 0.07 0.81 0.00 -0.33 0.02 0.00 0.00 177.57 178.14 1xc1 h GLU 183 N 0.09 0.00 -0.21 1.57 4.39 -1.11 -2.02 114.58 117.28 1xc1 h GLU 183 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1xc1 h GLU 183 Cb 1.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.24 1xc1 h GLU 183 CO 0.14 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 178.08 1xc1 n ASN 184 N -3.01 2.75 -3.08 1.42 4.13 -0.45 -4.88 115.26 112.14 1xc1 n ASN 184 Ca 0.01 -1.88 -0.23 0.00 1.68 0.00 0.00 54.58 54.16 1xc1 n ASN 184 Cb 0.34 -0.13 0.03 0.00 -1.54 0.00 0.00 39.78 38.49 1xc1 n ASN 184 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1xc1 n GLY 185 N 1.35 -0.52 0.05 7.41 0.00 -0.76 -4.85 105.19 107.87 1xc1 n GLY 185 Ca 0.17 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.44 1xc1 n GLY 185 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xc1 n GLU 186 N -4.04 0.46 -3.71 1.61 1.02 -0.15 -4.88 120.64 110.95 1xc1 n GLU 186 Ca -0.10 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 56.91 1xc1 n GLU 186 Cb 0.61 -1.64 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 1xc1 n GLU 186 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1xc1 s ILE 187 N -3.31 -0.00 0.19 -3.67 2.07 -1.18 -5.01 121.20 110.28 1xc1 s ILE 187 Ca -0.00 0.02 -0.12 0.00 -1.41 0.00 0.00 60.65 59.14 1xc1 s ILE 187 Cb 0.13 -0.66 0.11 0.00 0.13 0.00 0.00 42.46 42.17 1xc1 s ILE 187 CO 0.82 0.01 1.83 0.44 -1.91 0.00 0.00 174.94 176.13 1xc1 h ASP 188 N 5.80 0.79 -5.13 4.50 3.32 -1.82 -3.38 116.42 120.51 1xc1 h ASP 188 Ca -0.29 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 56.62 1xc1 h ASP 188 Cb 1.18 -0.20 -0.13 0.00 0.22 0.00 0.00 39.33 40.40 1xc1 h ASP 188 CO 0.23 0.62 -0.23 0.00 -1.72 0.00 0.00 179.24 178.14 1xc1 s ALA 189 N -5.97 -0.52 0.06 3.45 0.00 -0.03 -0.79 121.76 117.96 1xc1 s ALA 189 Ca -0.13 -0.40 -0.09 0.00 0.00 0.00 0.00 51.96 51.34 1xc1 s ALA 189 Cb 0.14 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.88 1xc1 s ALA 189 CO 0.78 -0.59 0.19 0.00 0.00 0.00 0.00 175.76 176.13 1xc1 s ALA 190 N -3.85 -0.29 -0.29 0.00 0.00 -0.08 -0.19 121.76 117.07 1xc1 s ALA 190 Ca 0.06 -0.42 -0.12 0.00 0.00 0.00 0.00 51.96 51.47 1xc1 s ALA 190 Cb 0.03 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 1xc1 s ALA 190 CO -0.10 -0.41 0.24 -0.51 0.00 0.00 0.00 175.76 174.98 1xc1 s LEU 191 N -2.37 4.09 0.00 0.00 1.02 -0.36 -1.62 118.68 119.44 1xc1 s LEU 191 Ca -0.01 -0.00 -0.06 0.00 0.02 0.00 0.00 54.13 54.08 1xc1 s LEU 191 Cb 0.01 -2.19 0.02 0.00 0.02 0.00 0.00 46.19 44.05 1xc1 s LEU 191 CO -0.06 -0.11 0.47 -0.38 0.02 0.00 0.00 176.35 176.28 1xc1 n ILE 192 N 5.08 0.00 -3.47 -0.59 5.41 -0.69 -4.45 119.36 120.65 1xc1 n ILE 192 Ca -0.13 -1.08 -0.36 0.00 1.00 0.00 0.00 62.75 62.18 1xc1 n ILE 192 Cb 0.51 0.79 -0.06 0.00 -0.71 0.00 0.00 39.64 40.18 1xc1 n ILE 192 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1xc1 s ASN 193 N -2.60 6.79 0.16 4.38 0.01 -1.26 -0.57 114.94 121.84 1xc1 s ASN 193 Ca 0.18 0.97 -0.16 0.00 -0.71 0.00 0.00 52.86 53.13 1xc1 s ASN 193 Cb -0.02 -2.25 0.07 0.00 0.41 0.00 0.00 41.25 39.46 1xc1 s ASN 193 CO 0.13 0.23 1.74 -0.55 -1.51 0.00 0.00 177.10 177.14 1xc1 h ASN 194 N 4.15 0.10 0.00 -1.22 -1.07 -1.33 -2.99 115.58 113.22 1xc1 h ASN 194 Ca -0.50 0.05 0.00 0.00 0.07 0.00 0.00 56.30 55.92 1xc1 h ASN 194 Cb 1.21 0.04 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 1xc1 h ASN 194 CO 0.64 0.09 0.05 0.00 0.07 0.00 0.00 177.43 178.28 1xc1 n TYR 195 N -5.04 0.03 -0.01 4.14 4.11 -1.26 -1.71 117.16 117.43 1xc1 n TYR 195 Ca 0.02 0.02 -0.16 0.00 -0.00 0.00 0.00 57.90 57.77 1xc1 n TYR 195 Cb 0.14 -0.48 -0.11 0.00 -0.00 0.00 0.00 39.34 38.89 1xc1 n TYR 195 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.86 178.74 1xc1 h TYR 196 N 0.00 0.43 0.84 -3.48 -1.99 -1.91 -2.52 116.97 108.34 1xc1 h TYR 196 Ca 0.00 -0.24 -0.04 0.00 2.00 0.00 0.00 58.73 60.45 1xc1 h TYR 196 Cb 0.10 -0.05 0.01 0.00 2.00 0.00 0.00 36.73 38.79 1xc1 h TYR 196 CO 0.00 1.05 -0.40 2.35 -0.00 0.00 0.00 178.16 181.16 1xc1 h TRP 197 N -0.31 -1.05 -0.75 4.88 7.01 -1.51 -2.42 115.95 121.81 1xc1 h TRP 197 Ca -0.06 -0.02 0.17 0.00 2.11 0.00 0.00 58.89 61.09 1xc1 h TRP 197 Cb 1.18 0.35 -0.13 0.00 -2.10 0.00 0.00 29.16 28.45 1xc1 h TRP 197 CO 0.17 -0.64 -0.00 0.45 -2.79 0.00 0.00 178.44 175.62 1xc1 h HIS 198 N -1.22 -0.06 -0.23 2.65 3.86 -1.63 0.16 115.15 118.68 1xc1 h HIS 198 Ca -0.12 0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 1xc1 h HIS 198 Cb 0.87 0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.47 1xc1 h HIS 198 CO -0.00 -0.24 0.00 0.00 0.86 0.00 0.00 177.93 178.55 1xc1 h ALA 199 N 1.70 1.59 0.08 2.45 0.00 -1.41 -0.67 119.26 122.99 1xc1 h ALA 199 Ca 0.40 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1xc1 h ALA 199 Cb 0.71 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xc1 h ALA 199 CO -0.66 0.31 -0.04 0.35 0.00 0.00 0.00 179.25 179.21 1xc1 h PHE 200 N 0.33 -0.10 -0.38 0.00 3.57 -0.28 -3.11 116.94 116.97 1xc1 h PHE 200 Ca 0.08 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.64 1xc1 h PHE 200 Cb 0.22 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1xc1 h PHE 200 CO 0.00 0.45 0.26 0.00 -2.23 0.00 0.00 178.31 176.80 1xc1 h ALA 201 N -0.02 2.08 -0.07 2.41 0.00 -0.78 -0.13 119.26 122.73 1xc1 h ALA 201 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xc1 h ALA 201 Cb 0.60 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1xc1 h ALA 201 CO 0.02 -0.16 -0.03 -0.09 0.00 0.00 0.00 179.25 178.99 1xc1 h ARG 202 N 0.22 0.15 -0.29 0.00 2.43 -1.15 0.33 114.38 116.07 1xc1 h ARG 202 Ca 0.17 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.10 1xc1 h ARG 202 Cb 0.40 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1xc1 h ARG 202 CO -0.03 0.50 -0.54 1.05 -1.51 0.00 0.00 179.97 179.45 1xc1 h GLU 203 N -0.21 0.85 0.03 0.20 4.11 -1.38 -3.32 114.58 114.86 1xc1 h GLU 203 Ca 0.02 -0.53 -0.26 0.00 0.07 0.00 0.00 59.36 58.66 1xc1 h GLU 203 Cb 0.45 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1xc1 h GLU 203 CO 0.01 1.16 -1.32 0.87 0.07 0.00 0.00 179.01 179.80 1xc1 h LYS 204 N 0.65 0.07 -0.15 1.06 1.79 -1.11 -3.50 116.57 115.38 1xc1 h LYS 204 Ca 0.02 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1xc1 h LYS 204 Cb 1.14 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 1xc1 h LYS 204 CO 0.12 0.90 0.00 0.41 -1.08 0.00 0.00 179.45 179.80 1xc1 n GLY 205 N 1.48 0.57 0.45 3.86 0.00 0.07 -4.65 105.19 106.98 1xc1 n GLY 205 Ca -0.09 -1.01 0.25 0.00 0.00 0.00 0.00 46.02 45.17 1xc1 n GLY 205 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1xc1 h VAL 206 N 0.00 0.23 0.00 1.61 3.04 -1.79 0.23 116.25 119.57 1xc1 h VAL 206 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1xc1 h VAL 206 Cb 0.00 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 29.67 1xc1 h VAL 206 CO 0.00 0.00 0.00 1.56 -1.01 0.00 0.00 177.57 178.12 1xc1 h GLN 207 N 0.00 0.00 -0.62 4.17 1.08 -1.90 -2.20 115.11 115.63 1xc1 h GLN 207 Ca 0.33 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 1xc1 h GLN 207 Cb 1.85 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.28 1xc1 h GLN 207 CO -0.00 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 177.97 1xc1 n ASN 208 N -2.54 3.67 -4.40 1.46 3.02 0.81 -4.90 115.26 112.38 1xc1 n ASN 208 Ca 0.02 -2.00 -0.33 0.00 -0.03 0.00 0.00 54.58 52.23 1xc1 n ASN 208 Cb 0.26 -0.42 -0.14 0.00 -0.61 0.00 0.00 39.78 38.88 1xc1 n ASN 208 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xc1 s VAL 209 N -1.00 3.32 -0.74 2.41 1.01 -0.83 -5.00 120.40 119.57 1xc1 s VAL 209 Ca 0.42 -0.56 0.23 0.00 0.00 0.00 0.00 61.98 62.07 1xc1 s VAL 209 Cb 0.22 -2.43 -0.13 0.00 0.00 0.00 0.00 36.38 34.04 1xc1 s VAL 209 CO 0.28 0.50 1.03 1.41 0.00 0.00 0.00 175.10 178.33 1xc1 n HIS 210 N 3.67 0.15 -3.48 5.22 -0.00 -1.26 -4.96 115.22 114.57 1xc1 n HIS 210 Ca -0.18 0.04 -0.25 0.00 -0.00 0.00 0.00 57.72 57.33 1xc1 n HIS 210 Cb 0.52 -0.31 -0.02 0.00 -0.00 0.00 0.00 29.99 30.19 1xc1 n HIS 210 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 1xc1 s THR 211 N -3.13 5.12 0.06 1.59 -4.23 -1.26 -1.05 115.64 112.74 1xc1 s THR 211 Ca 0.05 -0.40 -0.05 0.00 -1.18 0.00 0.00 61.69 60.11 1xc1 s THR 211 Cb 0.15 -3.82 -0.02 0.00 1.34 0.00 0.00 72.50 70.16 1xc1 s THR 211 CO 0.81 -0.43 0.09 -0.13 -0.54 0.00 0.00 174.62 174.42 1xc1 s ARG 212 N -3.97 0.69 0.09 3.99 1.81 -0.64 -4.90 118.95 116.02 1xc1 s ARG 212 Ca 0.40 -0.98 -0.11 0.00 -1.72 0.00 0.00 55.73 53.31 1xc1 s ARG 212 Cb -0.10 0.27 -0.06 0.00 -0.45 0.00 0.00 34.95 34.60 1xc1 s ARG 212 CO 0.33 -0.18 0.44 -0.51 -0.68 0.00 0.00 175.30 174.70 1xc1 s LEU 213 N -2.66 4.36 -0.14 2.53 1.43 -1.26 -1.84 118.68 121.11 1xc1 s LEU 213 Ca 0.03 0.88 0.02 0.00 -1.03 0.00 0.00 54.13 54.03 1xc1 s LEU 213 Cb 0.04 -3.02 0.00 0.00 0.03 0.00 0.00 46.19 43.24 1xc1 s LEU 213 CO -0.09 0.17 -0.20 0.21 0.23 0.00 0.00 176.35 176.67 1xc1 s ASN 214 N -1.69 3.29 -0.20 2.29 3.84 0.61 -4.98 114.94 118.10 1xc1 s ASN 214 Ca 0.33 -0.55 -0.03 0.00 0.21 0.00 0.00 52.86 52.83 1xc1 s ASN 214 Cb -0.14 -1.48 -0.01 0.00 -0.55 0.00 0.00 41.25 39.07 1xc1 s ASN 214 CO 0.18 0.10 -0.07 -0.36 -2.79 0.00 0.00 177.10 174.16 1xc1 s PHE 215 N 0.71 2.93 0.08 0.43 0.40 -1.26 -2.00 117.98 119.27 1xc1 s PHE 215 Ca -0.09 -0.93 0.12 0.00 -0.60 0.00 0.00 56.93 55.42 1xc1 s PHE 215 Cb -0.16 -2.05 0.11 0.00 0.51 0.00 0.00 43.02 41.43 1xc1 s PHE 215 CO 0.01 -0.51 1.46 -0.39 0.70 0.00 0.00 175.22 176.49 1xc1 h VAL 216 N 5.67 1.31 -0.36 -0.44 -1.51 -1.89 -3.49 116.25 115.54 1xc1 h VAL 216 Ca -0.39 -2.56 0.00 0.00 -1.23 0.00 0.00 66.70 62.51 1xc1 h VAL 216 Cb 1.17 2.46 0.00 0.00 -2.13 0.00 0.00 31.29 32.79 1xc1 h VAL 216 CO 0.60 0.69 0.00 0.54 -1.23 0.00 0.00 177.57 178.17 1xc1 n ARG 217 N -3.43 0.00 -2.64 5.19 1.74 -1.26 -4.87 116.66 111.39 1xc1 n ARG 217 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.87 1xc1 n ARG 217 Cb 0.76 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 32.20 1xc1 n ARG 217 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1xc1 n HIS 218 N 0.00 -1.38 -1.43 -1.55 8.25 -1.24 -1.72 115.22 116.15 1xc1 n HIS 218 Ca 0.00 0.20 -0.15 0.00 -0.26 0.00 0.00 57.72 57.51 1xc1 n HIS 218 Cb 0.00 -4.19 -0.07 0.00 1.12 0.00 0.00 29.99 26.86 1xc1 n HIS 218 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1xc1 n ARG 219 N -3.42 -1.56 -1.53 -0.41 5.12 0.58 -4.94 116.66 110.51 1xc1 n ARG 219 Ca -0.20 1.00 -0.34 0.00 -1.93 0.00 0.00 57.85 56.39 1xc1 n ARG 219 Cb 0.66 -5.37 0.08 0.00 -1.16 0.00 0.00 32.46 26.68 1xc1 n ARG 219 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1xc1 s ASP 220 N -2.48 4.49 0.58 0.55 2.15 -0.70 -4.31 116.67 116.95 1xc1 s ASP 220 Ca 0.00 2.23 0.33 0.00 0.43 0.00 0.00 52.55 55.53 1xc1 s ASP 220 Cb 0.00 -2.58 1.77 0.00 -0.30 0.00 0.00 42.92 41.82 1xc1 s ASP 220 CO 0.00 -2.06 2.18 -0.65 -0.17 0.00 0.00 175.17 174.48 1xc1 h PRO 221 N -0.21 0.00 -0.00 4.34 0.11 -1.92 -1.23 132.00 133.09 1xc1 h PRO 221 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1xc1 h PRO 221 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1xc1 h PRO 221 CO 0.51 0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.76 1xc1 n GLY 222 N -0.88 -0.98 1.57 -0.55 0.00 -1.26 -2.75 105.19 100.34 1xc1 n GLY 222 Ca -0.02 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.89 1xc1 n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xc1 n ALA 223 N -0.98 3.01 -1.66 4.61 0.00 -0.46 -4.54 120.51 120.48 1xc1 n ALA 223 Ca 0.24 -1.58 -0.49 0.00 0.00 0.00 0.00 53.44 51.61 1xc1 n ALA 223 Cb 0.11 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.51 1xc1 n ALA 223 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1xc1 n LEU 224 N 1.19 2.90 -4.28 0.00 7.94 -1.11 -4.26 117.00 119.38 1xc1 n LEU 224 Ca 0.26 1.05 -0.32 0.00 -1.11 0.00 0.00 56.01 55.89 1xc1 n LEU 224 Cb 0.87 -1.34 -0.16 0.00 0.53 0.00 0.00 43.42 43.31 1xc1 n LEU 224 CO 0.23 -0.35 -0.53 -0.69 -1.11 0.00 0.00 177.39 174.94 1xc1 s VAL 225 N 2.11 2.31 -0.12 1.96 1.01 -1.26 -1.85 120.40 124.56 1xc1 s VAL 225 Ca 0.86 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 61.88 1xc1 s VAL 225 Cb -0.77 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 1xc1 s VAL 225 CO 0.46 0.56 -0.10 -0.89 0.00 0.00 0.00 175.10 175.13 1xc1 s THR 226 N 0.06 3.34 0.21 3.92 2.01 -0.27 -4.91 115.64 120.01 1xc1 s THR 226 Ca -0.09 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.38 1xc1 s THR 226 Cb -0.15 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 1xc1 s THR 226 CO 0.06 0.54 0.32 -0.31 -0.69 0.00 0.00 174.62 174.53 1xc1 s TYR 227 N 0.05 3.43 0.29 4.92 1.51 -1.26 -0.97 117.35 125.32 1xc1 s TYR 227 Ca -0.03 0.02 0.08 0.00 -1.01 0.00 0.00 57.07 56.12 1xc1 s TYR 227 Cb -0.14 -1.59 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1xc1 s TYR 227 CO 0.04 0.47 0.14 -1.12 -1.11 0.00 0.00 175.55 173.97 1xc1 s SER 228 N -3.71 5.02 0.24 2.29 0.01 0.10 -3.58 113.70 114.07 1xc1 s SER 228 Ca 0.34 -0.51 -0.22 0.00 1.31 0.00 0.00 55.95 56.86 1xc1 s SER 228 Cb -0.10 -1.03 0.03 0.00 0.21 0.00 0.00 66.02 65.13 1xc1 s SER 228 CO 0.28 -0.13 0.79 -0.83 0.41 0.00 0.00 173.24 173.77 1xc1 s GLY 229 N -3.82 -0.15 0.07 3.44 0.00 -0.40 -0.08 107.32 106.38 1xc1 s GLY 229 Ca 0.35 -0.16 0.02 0.00 0.00 0.00 0.00 44.72 44.93 1xc1 s GLY 229 CO 0.23 -0.05 -0.07 0.00 0.00 0.00 0.00 173.10 173.21 1xc1 s ALA 230 N -3.72 0.72 0.05 3.20 0.00 -0.75 -0.10 121.76 121.16 1xc1 s ALA 230 Ca 0.11 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.84 1xc1 s ALA 230 Cb -0.04 0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.23 1xc1 s ALA 230 CO 0.05 -0.14 0.45 0.00 0.00 0.00 0.00 175.76 176.12 1xc1 s ALA 231 N -2.51 -1.11 -0.05 0.00 0.00 -0.51 -2.00 121.76 115.59 1xc1 s ALA 231 Ca 0.00 0.39 -0.01 0.00 0.00 0.00 0.00 51.96 52.33 1xc1 s ALA 231 Cb -0.02 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 1xc1 s ALA 231 CO -0.03 -0.48 0.05 0.08 0.00 0.00 0.00 175.76 175.38 1xc1 s VAL 232 N -2.53 4.61 0.28 0.00 1.01 -1.26 -0.25 120.40 122.27 1xc1 s VAL 232 Ca -0.05 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1xc1 s VAL 232 Cb -0.01 -3.03 -0.08 0.00 0.00 0.00 0.00 36.38 33.26 1xc1 s VAL 232 CO -0.03 0.47 0.66 -0.76 0.00 0.00 0.00 175.10 175.45 1xc1 s LEU 233 N -1.33 4.12 0.46 3.92 1.02 -0.86 0.02 118.68 126.04 1xc1 s LEU 233 Ca 0.18 1.15 0.26 0.00 0.02 0.00 0.00 54.13 55.74 1xc1 s LEU 233 Cb -0.12 -3.89 1.03 0.00 0.02 0.00 0.00 46.19 43.23 1xc1 s LEU 233 CO 0.08 -0.14 1.87 0.11 0.02 0.00 0.00 176.35 178.29 1xc1 h LYS 234 N 2.45 0.00 -0.27 1.70 1.57 -1.59 -2.81 116.57 117.62 1xc1 h LYS 234 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1xc1 h LYS 234 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1xc1 h LYS 234 CO 0.67 0.18 0.00 -1.13 -0.57 0.00 0.00 179.45 178.60 1xc1 n SER 235 N -3.37 1.54 -4.69 0.86 3.41 -1.26 -4.92 113.62 105.19 1xc1 n SER 235 Ca 0.00 -1.94 -0.42 0.00 -0.26 0.00 0.00 58.87 56.25 1xc1 n SER 235 Cb 0.39 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 1xc1 n SER 235 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xc1 s SER 236 N -1.10 7.04 0.00 4.04 0.15 -1.06 -4.80 113.70 117.98 1xc1 s SER 236 Ca 0.22 1.85 0.25 0.00 0.70 0.00 0.00 55.95 58.96 1xc1 s SER 236 Cb 0.11 -2.56 1.15 0.00 -1.71 0.00 0.00 66.02 63.01 1xc1 s SER 236 CO 0.16 -0.58 1.78 0.00 1.20 0.00 0.00 173.24 175.80 1xc1 n GLN 237 N 5.09 1.40 -2.61 5.44 1.13 -1.26 -3.91 117.38 122.66 1xc1 n GLN 237 Ca 0.11 -0.59 -0.14 0.00 -1.94 0.00 0.00 57.00 54.44 1xc1 n GLN 237 Cb 0.46 -1.42 0.02 0.00 0.11 0.00 0.00 30.24 29.42 1xc1 n GLN 237 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1xc1 n ASN 238 N -0.24 2.38 0.02 1.08 5.03 -1.26 -4.94 115.26 117.33 1xc1 n ASN 238 Ca 0.18 -2.96 0.01 0.00 0.87 0.00 0.00 54.58 52.69 1xc1 n ASN 238 Cb 0.23 -0.50 0.35 0.00 -1.02 0.00 0.00 39.78 38.83 1xc1 n ASN 238 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 1xc1 h LYS 239 N 2.85 0.48 0.23 3.52 1.57 -1.94 0.10 116.57 123.38 1xc1 h LYS 239 Ca 0.01 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1xc1 h LYS 239 Cb 1.13 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 1xc1 h LYS 239 CO 0.58 0.47 -0.28 0.22 -0.57 0.00 0.00 179.45 179.87 1xc1 h ASP 240 N 0.47 -0.76 0.80 0.86 1.82 -1.94 0.32 116.42 117.99 1xc1 h ASP 240 Ca 0.11 0.07 -0.12 0.00 -0.39 0.00 0.00 57.03 56.71 1xc1 h ASP 240 Cb 0.23 0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.49 1xc1 h ASP 240 CO 0.00 -0.39 -0.56 -0.33 -1.61 0.00 0.00 179.24 176.35 1xc1 h GLU 241 N -0.56 0.00 -0.41 0.28 5.08 -1.95 -2.12 114.58 114.91 1xc1 h GLU 241 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1xc1 h GLU 241 Cb 0.53 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1xc1 h GLU 241 CO -0.09 0.56 0.06 0.00 -1.00 0.00 0.00 179.01 178.54 1xc1 h ALA 242 N 1.44 0.54 -0.44 3.43 0.00 -0.37 -0.67 119.26 123.20 1xc1 h ALA 242 Ca -0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1xc1 h ALA 242 Cb 1.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1xc1 h ALA 242 CO 0.07 0.26 -0.07 0.87 0.00 0.00 0.00 179.25 180.39 1xc1 h LYS 243 N 0.53 0.75 -0.86 0.00 1.57 -0.27 -2.43 116.57 115.87 1xc1 h LYS 243 Ca 0.12 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1xc1 h LYS 243 Cb 0.38 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 1xc1 h LYS 243 CO 0.01 0.81 0.47 0.87 -0.57 0.00 0.00 179.45 181.04 1xc1 h LYS 244 N 0.69 1.21 0.13 3.15 1.57 -1.02 -0.70 116.57 121.61 1xc1 h LYS 244 Ca 0.13 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1xc1 h LYS 244 Cb 0.52 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1xc1 h LYS 244 CO 0.03 0.89 -0.06 0.35 -0.57 0.00 0.00 179.45 180.08 1xc1 h PHE 245 N 1.21 -0.17 -0.59 -1.35 3.57 -0.74 0.26 116.94 119.13 1xc1 h PHE 245 Ca 0.30 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 1xc1 h PHE 245 Cb 0.03 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 1xc1 h PHE 245 CO 0.01 0.06 0.24 0.28 -2.23 0.00 0.00 178.31 176.67 1xc1 h VAL 246 N -0.38 1.23 -0.96 1.41 2.07 -1.32 0.16 116.25 118.45 1xc1 h VAL 246 Ca -0.02 -0.71 0.06 0.00 0.82 0.00 0.00 66.70 66.85 1xc1 h VAL 246 Cb 0.31 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1xc1 h VAL 246 CO 0.03 0.28 0.61 0.00 0.02 0.00 0.00 177.57 178.51 1xc1 h ALA 247 N 1.09 1.32 -0.18 1.67 0.00 -1.08 -0.84 119.26 121.24 1xc1 h ALA 247 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xc1 h ALA 247 Cb 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xc1 h ALA 247 CO -0.02 0.40 0.07 0.35 0.00 0.00 0.00 179.25 180.06 1xc1 h PHE 248 N 1.12 0.28 -0.81 0.00 3.57 -0.01 -1.49 116.94 119.60 1xc1 h PHE 248 Ca 0.41 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.99 1xc1 h PHE 248 Cb 0.15 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.74 1xc1 h PHE 248 CO -0.01 0.33 0.46 -0.07 -2.23 0.00 0.00 178.31 176.79 1xc1 h LEU 249 N 0.14 0.65 0.00 0.59 3.38 0.31 -1.92 115.31 118.46 1xc1 h LEU 249 Ca 0.06 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1xc1 h LEU 249 Cb 0.17 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1xc1 h LEU 249 CO -0.00 0.37 -0.18 0.00 0.09 0.00 0.00 178.44 178.72 1xc1 h ALA 250 N 1.45 0.90 -2.43 1.53 0.00 -1.07 -3.30 119.26 116.34 1xc1 h ALA 250 Ca 0.39 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.81 1xc1 h ALA 250 Cb 0.37 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.23 1xc1 h ALA 250 CO -0.25 0.00 0.38 0.20 0.00 0.00 0.00 179.25 179.58 1xc1 s GLY 251 N -3.89 1.63 0.23 0.00 0.00 -0.57 -4.57 107.32 100.14 1xc1 s GLY 251 Ca 0.08 -0.35 -0.08 0.00 0.00 0.00 0.00 44.72 44.37 1xc1 s GLY 251 CO 0.66 -0.01 1.66 1.70 0.00 0.00 0.00 173.10 177.11 1xc1 h LYS 252 N -0.53 0.13 -0.23 2.90 3.64 -1.90 0.44 116.57 121.02 1xc1 h LYS 252 Ca -0.45 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 58.87 1xc1 h LYS 252 Cb 1.24 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1xc1 h LYS 252 CO 0.63 0.09 -0.08 1.49 -2.27 0.00 0.00 179.45 179.31 1xc1 h GLU 253 N 0.14 0.46 -0.34 1.90 4.81 -1.94 -1.31 114.58 118.30 1xc1 h GLU 253 Ca 0.37 -0.19 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 1xc1 h GLU 253 Cb 0.63 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1xc1 h GLU 253 CO -0.58 0.72 -0.04 0.78 -0.73 0.00 0.00 179.01 179.16 1xc1 h GLY 254 N 0.19 0.59 1.57 1.92 0.00 -1.34 -1.68 103.07 104.32 1xc1 h GLY 254 Ca 0.06 -0.37 -0.15 0.00 0.00 0.00 0.00 47.33 46.87 1xc1 h GLY 254 CO 0.03 0.35 -0.51 1.46 0.00 0.00 0.00 176.54 177.86 1xc1 h GLN 255 N 0.51 0.46 -0.11 4.80 1.08 -0.83 -2.88 115.11 118.15 1xc1 h GLN 255 Ca 0.10 -0.27 -0.18 0.00 -1.45 0.00 0.00 58.65 56.85 1xc1 h GLN 255 Cb 0.40 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1xc1 h GLN 255 CO 0.02 0.86 -0.69 0.00 -0.95 0.00 0.00 178.83 178.07 1xc1 h ARG 256 N 0.36 0.47 0.00 1.46 3.08 -0.87 -2.07 114.38 116.81 1xc1 h ARG 256 Ca 0.01 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.66 1xc1 h ARG 256 Cb 1.02 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1xc1 h ARG 256 CO 0.09 0.99 -0.20 0.00 -1.07 0.00 0.00 179.97 179.78 1xc1 h ALA 257 N 0.92 1.44 0.00 0.04 0.00 -1.25 -2.44 119.26 117.97 1xc1 h ALA 257 Ca -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1xc1 h ALA 257 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1xc1 h ALA 257 CO 0.12 0.25 -0.06 1.25 0.00 0.00 0.00 179.25 180.82 1xc1 h LEU 258 N 0.00 0.04 0.00 0.00 5.85 -1.31 -3.33 115.31 116.56 1xc1 h LEU 258 Ca -0.00 -0.86 0.00 0.00 0.84 0.00 0.00 57.88 57.86 1xc1 h LEU 258 Cb 0.42 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1xc1 h LEU 258 CO 0.03 0.89 0.00 0.35 -0.34 0.00 0.00 178.44 179.37 1xc1 n THR 259 N -4.64 0.00 0.19 1.05 -2.24 -0.80 -1.02 114.28 106.83 1xc1 n THR 259 Ca -0.10 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.80 1xc1 n THR 259 Cb 0.44 -0.31 0.02 0.00 -2.10 0.00 0.00 70.33 68.38 1xc1 n THR 259 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xc1 n ALA 260 N -0.72 2.63 0.00 6.98 0.00 -0.93 -2.74 120.51 125.74 1xc1 n ALA 260 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1xc1 n ALA 260 Cb 0.04 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1xc1 n ALA 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xc1 n VAL 261 N -2.55 0.00 -4.86 0.00 0.31 -0.89 -4.95 118.33 105.39 1xc1 n VAL 261 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.01 1xc1 n VAL 261 Cb 0.53 -0.80 -0.14 0.00 -0.91 0.00 0.00 33.84 32.52 1xc1 n VAL 261 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1xc1 s ARG 262 N -1.89 2.86 0.00 5.55 3.52 -0.19 -4.97 118.95 123.83 1xc1 s ARG 262 Ca 0.00 -0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 54.85 1xc1 s ARG 262 Cb 0.00 -2.47 -0.21 0.00 -1.56 0.00 0.00 34.95 30.71 1xc1 s ARG 262 CO 0.00 0.45 3.20 0.00 -0.81 0.00 0.00 175.30 178.14 1xc1 n ALA 263 N 2.82 5.73 -2.88 6.12 0.00 -1.26 -4.36 120.51 126.68 1xc1 n ALA 263 Ca -0.18 -1.41 -0.31 0.00 0.00 0.00 0.00 53.44 51.54 1xc1 n ALA 263 Cb 0.52 -2.06 -0.05 0.00 0.00 0.00 0.00 19.45 17.86 1xc1 n ALA 263 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1xc1 s GLU 264 N 0.87 3.29 -0.19 0.00 2.02 -1.26 -4.38 118.70 119.05 1xc1 s GLU 264 Ca 0.52 -0.47 -0.29 0.00 0.02 0.00 0.00 54.97 54.74 1xc1 s GLU 264 Cb 0.25 -2.97 -0.00 0.00 0.10 0.00 0.00 34.13 31.50 1xc1 s GLU 264 CO 0.00 0.62 1.12 0.71 0.02 0.00 0.00 175.26 177.72 1xc1 s TYR 265 N -1.43 3.19 0.56 1.61 1.51 0.09 -4.84 117.35 118.05 1xc1 s TYR 265 Ca 0.31 1.32 -0.20 0.00 -1.01 0.00 0.00 57.07 57.50 1xc1 s TYR 265 Cb -0.13 -3.35 -0.05 0.00 -0.11 0.00 0.00 41.96 38.33 1xc1 s TYR 265 CO 0.24 -0.89 1.19 -2.14 -1.11 0.00 0.00 175.55 172.84 1xc1 s PRO 266 N 3.13 3.17 0.02 -1.71 0.02 -1.26 -1.28 135.00 137.10 1xc1 s PRO 266 Ca 0.48 1.78 0.22 0.00 0.02 0.00 0.00 61.00 63.51 1xc1 s PRO 266 Cb -0.18 -2.02 -0.17 0.00 0.02 0.00 0.00 34.50 32.15 1xc1 s PRO 266 CO 0.11 -1.03 0.78 1.28 -0.33 0.00 0.00 177.00 177.81 1xc1 n LEU 267 N -1.36 0.48 -4.67 -5.54 4.77 -1.01 -4.69 117.00 104.98 1xc1 n LEU 267 Ca 0.12 -0.10 -0.43 0.00 -0.03 0.00 0.00 56.01 55.57 1xc1 n LEU 267 Cb 0.50 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1xc1 n LEU 267 CO 0.44 0.06 1.05 0.21 -1.33 0.00 0.00 177.39 177.83 1xc1 s ASN 268 N -4.04 6.97 0.61 -1.43 3.84 -1.26 -4.64 114.94 114.99 1xc1 s ASN 268 Ca -0.00 1.71 0.39 0.00 0.21 0.00 0.00 52.86 55.16 1xc1 s ASN 268 Cb 0.14 -2.54 1.98 0.00 -0.55 0.00 0.00 41.25 40.28 1xc1 s ASN 268 CO 0.86 -0.72 2.22 1.55 -2.79 0.00 0.00 177.10 178.22 1xc1 h PRO 269 N 8.03 0.00 -0.26 0.43 0.13 -1.88 -2.96 132.00 135.48 1xc1 h PRO 269 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1xc1 h PRO 269 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1xc1 h PRO 269 CO 0.95 0.02 0.00 0.72 -0.23 0.00 0.00 178.00 179.46 1xc1 n HIS 270 N -3.20 0.35 -4.55 1.56 8.25 -1.26 -4.87 115.22 111.49 1xc1 n HIS 270 Ca -0.02 -0.17 -0.34 0.00 -0.26 0.00 0.00 57.72 56.93 1xc1 n HIS 270 Cb 0.16 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.15 1xc1 n HIS 270 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xc1 s VAL 271 N -1.65 3.67 -0.19 1.59 1.01 -1.12 -5.03 120.40 118.69 1xc1 s VAL 271 Ca 0.24 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 1xc1 s VAL 271 Cb 0.12 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 1xc1 s VAL 271 CO 0.17 0.54 -0.03 -0.69 0.00 0.00 0.00 175.10 175.09 1xc1 s VAL 272 N -0.08 3.67 0.69 2.92 1.01 -1.26 -4.94 120.40 122.41 1xc1 s VAL 272 Ca 0.01 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 1xc1 s VAL 272 Cb -0.13 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1xc1 s VAL 272 CO 0.03 0.45 1.07 -0.55 0.00 0.00 0.00 175.10 176.10 1xc1 s SER 273 N 0.95 5.24 0.00 3.32 0.15 -1.26 -4.93 113.70 117.17 1xc1 s SER 273 Ca 0.00 1.72 0.28 0.00 0.70 0.00 0.00 55.95 58.66 1xc1 s SER 273 Cb -0.15 -2.51 1.16 0.00 -1.71 0.00 0.00 66.02 62.81 1xc1 s SER 273 CO 0.01 -1.54 1.81 0.35 1.20 0.00 0.00 173.24 175.07 1xc1 n THR 274 N -2.97 0.00 -4.15 6.45 -2.24 -1.11 -4.79 114.28 105.47 1xc1 n THR 274 Ca 0.08 -0.18 -0.24 0.00 -2.27 0.00 0.00 64.05 61.45 1xc1 n THR 274 Cb 0.53 0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.99 1xc1 n THR 274 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1xc1 s PHE 275 N -2.11 3.01 -1.53 4.78 0.40 -1.26 -5.01 117.98 116.26 1xc1 s PHE 275 Ca 0.37 -0.11 -0.10 0.00 -0.60 0.00 0.00 56.93 56.48 1xc1 s PHE 275 Cb 0.21 -1.39 -0.07 0.00 0.51 0.00 0.00 43.02 42.28 1xc1 s PHE 275 CO 0.38 0.54 2.78 0.09 0.70 0.00 0.00 175.22 179.71 1xc1 n ASN 276 N -0.78 7.71 -4.75 1.36 3.02 -1.26 -4.89 115.26 115.67 1xc1 n ASN 276 Ca -0.08 -2.59 -0.36 0.00 -0.03 0.00 0.00 54.58 51.52 1xc1 n ASN 276 Cb 0.57 -1.53 -0.07 0.00 -0.61 0.00 0.00 39.78 38.14 1xc1 n ASN 276 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1xc1 s LEU 277 N 0.45 4.26 0.90 3.41 1.43 -1.26 -5.09 118.68 122.78 1xc1 s LEU 277 Ca 0.64 0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 1xc1 s LEU 277 Cb 0.17 -2.30 0.13 0.00 0.03 0.00 0.00 46.19 44.22 1xc1 s LEU 277 CO -0.06 0.16 1.15 -1.83 0.23 0.00 0.00 176.35 176.00 1xc1 s GLU 278 N 0.20 1.27 0.26 1.70 1.03 -1.26 -4.80 118.70 117.10 1xc1 s GLU 278 Ca 0.15 0.24 -0.30 0.00 0.03 0.00 0.00 54.97 55.08 1xc1 s GLU 278 Cb -0.13 -1.86 -0.11 0.00 -0.80 0.00 0.00 34.13 31.24 1xc1 s GLU 278 CO 0.03 -2.10 1.56 -2.14 -1.33 0.00 0.00 175.26 171.28 1xc1 s PRO 279 N -5.35 4.17 0.35 -4.83 0.02 -1.26 -4.86 135.00 123.24 1xc1 s PRO 279 Ca 0.64 2.49 0.13 0.00 0.02 0.00 0.00 61.00 64.27 1xc1 s PRO 279 Cb -0.14 -3.06 0.97 0.00 0.02 0.00 0.00 34.50 32.29 1xc1 s PRO 279 CO 0.52 -0.58 1.75 0.97 -0.33 0.00 0.00 177.00 179.33 1xc1 h ILE 280 N 3.53 0.54 -0.13 2.83 -0.00 -1.92 0.59 117.51 122.94 1xc1 h ILE 280 Ca -0.46 -0.18 0.04 0.00 -0.00 0.00 0.00 64.86 64.26 1xc1 h ILE 280 Cb 1.22 -0.02 -0.01 0.00 -0.00 0.00 0.00 36.82 38.01 1xc1 h ILE 280 CO 0.82 0.09 0.10 0.00 -0.00 0.00 0.00 178.15 179.16 1xc1 h ALA 281 N 1.68 2.10 0.00 0.18 0.00 -1.95 -1.89 119.26 119.37 1xc1 h ALA 281 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1xc1 h ALA 281 Cb 1.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1xc1 h ALA 281 CO -0.40 -0.17 0.00 0.87 0.00 0.00 0.00 179.25 179.56 1xc1 h LYS 282 N 0.00 0.00 0.00 0.00 1.79 -0.14 -2.94 116.57 115.28 1xc1 h LYS 282 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1xc1 h LYS 282 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1xc1 h LYS 282 CO -0.00 0.00 0.00 -0.07 -1.08 0.00 0.00 179.45 178.30 1xc1 h LEU 283 N 0.00 0.00 -1.84 2.94 3.38 -1.40 -3.47 115.31 114.92 1xc1 h LEU 283 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 1xc1 h LEU 283 Cb 0.47 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1xc1 h LEU 283 CO 0.00 0.00 -0.89 -0.62 0.09 0.00 0.00 178.44 177.02 1xc1 n GLU 284 N -2.55 -3.19 -2.04 1.13 1.02 -1.11 -4.08 120.64 109.82 1xc1 n GLU 284 Ca 0.02 0.39 -0.36 0.00 -0.02 0.00 0.00 57.16 57.19 1xc1 n GLU 284 Cb 0.29 -4.54 0.03 0.00 -0.02 0.00 0.00 31.44 27.20 1xc1 n GLU 284 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xc1 s ALA 285 N -3.92 2.60 0.67 0.62 0.00 -1.26 -0.30 121.76 120.16 1xc1 s ALA 285 Ca 0.07 1.01 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 1xc1 s ALA 285 Cb -0.04 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.63 1xc1 s ALA 285 CO 0.90 -1.11 1.06 -1.25 0.00 0.00 0.00 175.76 175.36 1xc1 s PRO 286 N -3.26 3.03 -0.42 0.00 0.04 -1.26 -4.64 135.00 128.50 1xc1 s PRO 286 Ca 0.76 1.03 -0.20 0.00 0.04 0.00 0.00 61.00 62.63 1xc1 s PRO 286 Cb -0.30 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.25 1xc1 s PRO 286 CO 0.33 -1.03 0.63 -1.14 0.04 0.00 0.00 177.00 175.84 1xc1 s GLN 287 N -4.75 3.38 0.03 4.56 -0.44 -1.26 -4.82 119.66 116.37 1xc1 s GLN 287 Ca 0.60 -0.27 0.04 0.00 -2.50 0.00 0.00 55.36 53.23 1xc1 s GLN 287 Cb -0.15 -3.91 -0.02 0.00 -1.64 0.00 0.00 33.01 27.29 1xc1 s GLN 287 CO 0.50 -0.93 -0.13 0.08 0.50 0.00 0.00 175.29 175.30 1xc1 s VAL 288 N 2.77 1.04 0.68 1.34 1.01 -1.26 -5.01 120.40 120.97 1xc1 s VAL 288 Ca 0.23 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 1xc1 s VAL 288 Cb -0.14 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 1xc1 s VAL 288 CO 0.18 -0.00 1.05 -0.94 0.00 0.00 0.00 175.10 175.39 1xc1 s SER 289 N -1.08 5.64 0.48 3.32 1.04 -1.26 -5.00 113.70 116.84 1xc1 s SER 289 Ca 0.01 1.48 -0.24 0.00 0.48 0.00 0.00 55.95 57.68 1xc1 s SER 289 Cb -0.08 -2.41 -0.07 0.00 0.10 0.00 0.00 66.02 63.56 1xc1 s SER 289 CO 0.01 -1.26 1.42 0.00 0.98 0.00 0.00 173.24 174.39 1xc1 s ALA 290 N -3.13 3.14 0.13 5.32 0.00 -1.26 -4.95 121.76 121.02 1xc1 s ALA 290 Ca 0.57 1.45 -0.30 0.00 0.00 0.00 0.00 51.96 53.68 1xc1 s ALA 290 Cb -0.13 -3.59 -0.07 0.00 0.00 0.00 0.00 23.12 19.33 1xc1 s ALA 290 CO 0.54 -1.26 1.19 0.99 0.00 0.00 0.00 175.76 177.22 1xc1 s THR 291 N -1.22 3.80 0.32 0.00 2.01 -1.26 -5.05 115.64 114.23 1xc1 s THR 291 Ca 0.64 1.41 0.07 0.00 0.31 0.00 0.00 61.69 64.12 1xc1 s THR 291 Cb -0.43 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 1xc1 s THR 291 CO 0.55 0.18 0.31 0.42 -0.69 0.00 0.00 174.62 175.39 1xc1 s THR 292 N 0.41 3.87 0.22 -0.82 -4.23 -1.26 -4.75 115.64 109.08 1xc1 s THR 292 Ca 0.55 -1.29 -0.08 0.00 -1.18 0.00 0.00 61.69 59.68 1xc1 s THR 292 Cb -0.31 -3.29 0.18 0.00 1.34 0.00 0.00 72.50 70.42 1xc1 s THR 292 CO 0.33 -0.21 1.87 0.58 -0.54 0.00 0.00 174.62 176.65 1xc1 h VAL 293 N 1.22 1.12 -0.44 2.29 2.07 -2.00 -2.43 116.25 118.09 1xc1 h VAL 293 Ca -0.46 -0.34 -0.09 0.00 0.82 0.00 0.00 66.70 66.63 1xc1 h VAL 293 Cb 1.25 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1xc1 h VAL 293 CO 0.58 0.18 -0.09 0.77 0.02 0.00 0.00 177.57 179.03 1xc1 h SER 294 N 0.98 0.77 -0.16 0.57 4.64 -1.99 -1.50 113.55 116.87 1xc1 h SER 294 Ca 0.32 -0.22 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 1xc1 h SER 294 Cb 0.01 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.88 1xc1 h SER 294 CO -0.11 0.89 -0.09 -0.08 -0.87 0.00 0.00 176.83 176.56 1xc1 h GLU 295 N 0.71 0.50 -0.34 4.77 4.57 -1.85 0.20 114.58 123.15 1xc1 h GLU 295 Ca 0.12 -0.14 -0.14 0.00 -1.18 0.00 0.00 59.36 58.03 1xc1 h GLU 295 Cb 0.57 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.09 1xc1 h GLU 295 CO 0.03 0.60 -0.35 0.87 -1.18 0.00 0.00 179.01 178.98 1xc1 h LYS 296 N 0.47 0.77 -0.20 1.92 1.57 -1.09 -0.15 116.57 119.86 1xc1 h LYS 296 Ca 0.09 -0.38 -0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1xc1 h LYS 296 Cb 0.45 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1xc1 h LYS 296 CO 0.02 1.00 0.09 1.49 -0.57 0.00 0.00 179.45 181.49 1xc1 h GLU 297 N 0.64 0.29 -0.92 3.15 4.57 -0.64 0.45 114.58 122.13 1xc1 h GLU 297 Ca 0.06 -0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.26 1xc1 h GLU 297 Cb 0.90 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 29.37 1xc1 h GLU 297 CO 0.08 0.34 0.58 1.25 -1.18 0.00 0.00 179.01 180.07 1xc1 h HIS 298 N 0.18 1.06 -0.31 0.92 2.76 -0.40 -0.93 115.15 118.43 1xc1 h HIS 298 Ca 0.07 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.16 1xc1 h HIS 298 Cb 0.15 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.76 1xc1 h HIS 298 CO -0.02 0.53 -0.24 0.00 -1.30 0.00 0.00 177.93 176.90 1xc1 h ALA 299 N 1.43 0.45 -0.56 5.26 0.00 -0.65 -2.22 119.26 122.98 1xc1 h ALA 299 Ca 0.40 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xc1 h ALA 299 Cb 0.19 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1xc1 h ALA 299 CO -0.18 0.42 0.34 1.15 0.00 0.00 0.00 179.25 180.98 1xc1 h THR 300 N 0.46 1.16 -0.35 0.00 2.02 -0.34 -0.31 112.91 115.56 1xc1 h THR 300 Ca 0.06 -0.34 -0.12 0.00 0.77 0.00 0.00 66.41 66.79 1xc1 h THR 300 Cb 0.80 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1xc1 h THR 300 CO 0.06 0.16 -0.25 0.03 0.37 0.00 0.00 175.52 175.89 1xc1 h ARG 301 N 0.76 0.72 -0.65 6.66 -0.00 -0.99 -2.52 114.38 118.37 1xc1 h ARG 301 Ca 0.20 -0.30 -0.06 0.00 -0.50 0.00 0.00 59.98 59.33 1xc1 h ARG 301 Cb -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 29.97 29.88 1xc1 h ARG 301 CO -0.04 0.90 0.18 -0.07 0.00 0.00 0.00 179.97 180.93 1xc1 h LEU 302 N 0.62 0.97 -0.84 3.04 3.38 -0.59 -1.97 115.31 119.92 1xc1 h LEU 302 Ca 0.08 -0.22 0.14 0.00 0.09 0.00 0.00 57.88 57.97 1xc1 h LEU 302 Cb 0.75 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 1xc1 h LEU 302 CO 0.06 0.94 0.43 -0.07 0.09 0.00 0.00 178.44 179.88 1xc1 h LEU 303 N 0.95 0.51 -0.41 1.67 3.38 -0.70 0.01 115.31 120.73 1xc1 h LEU 303 Ca 0.21 0.09 -0.12 0.00 0.09 0.00 0.00 57.88 58.15 1xc1 h LEU 303 Cb 0.33 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1xc1 h LEU 303 CO -0.00 0.22 -0.21 -0.33 0.09 0.00 0.00 178.44 178.20 1xc1 h GLU 304 N 0.61 0.86 -0.10 1.13 5.08 -1.09 0.15 114.58 121.23 1xc1 h GLU 304 Ca 0.46 -0.39 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1xc1 h GLU 304 Cb 0.65 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1xc1 h GLU 304 CO -0.36 1.03 -0.32 1.96 -1.00 0.00 0.00 179.01 180.31 1xc1 h GLN 305 N 0.68 0.19 0.00 2.33 4.20 -0.60 -2.20 115.11 119.72 1xc1 h GLN 305 Ca 0.09 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1xc1 h GLN 305 Cb 0.78 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.55 1xc1 h GLN 305 CO 0.06 0.50 -0.03 0.00 -0.67 0.00 0.00 178.83 178.70 1xc1 n ALA 306 N -2.48 2.39 -0.53 3.87 0.00 -0.09 -4.91 120.51 118.77 1xc1 n ALA 306 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1xc1 n ALA 306 Cb 0.41 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1xc1 n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xc1 n GLY 307 N 1.50 0.75 1.64 0.00 0.00 -0.83 -4.66 105.19 103.60 1xc1 n GLY 307 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1xc1 n GLY 307 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1xc1 n MET 308 N -2.27 2.07 0.00 1.61 2.81 0.49 -4.98 117.12 116.85 1xc1 n MET 308 Ca 0.00 -1.80 0.00 0.00 -1.81 0.00 0.00 57.70 54.09 1xc1 n MET 308 Cb 0.00 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 30.76 1xc1 n MET 308 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65