#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 -0.35 0.04 0.53 -4.36 -1.16 -4.89 121.20 111.02 1xc1 s ILE 2 Ca 0.00 -1.57 -0.35 0.00 -0.26 0.00 0.00 60.65 58.47 1xc1 s ILE 2 Cb 0.00 -0.62 -0.14 0.00 1.25 0.00 0.00 42.46 42.96 1xc1 s ILE 2 CO 0.00 -0.60 1.64 0.41 0.24 0.00 0.00 174.94 176.63 1xc1 n THR 3 N 3.25 0.19 -4.77 8.37 -1.04 -1.26 -3.80 114.28 115.22 1xc1 n THR 3 Ca 0.21 -0.03 -0.33 0.00 -2.04 0.00 0.00 64.05 61.86 1xc1 n THR 3 Cb 0.51 -1.49 -0.16 0.00 -1.82 0.00 0.00 70.33 67.37 1xc1 n THR 3 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1xc1 s VAL 4 N 1.96 2.51 -0.58 12.58 1.01 0.47 -1.14 120.40 137.20 1xc1 s VAL 4 Ca 0.85 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 61.77 1xc1 s VAL 4 Cb -0.76 -2.03 0.06 0.00 0.00 0.00 0.00 36.38 33.65 1xc1 s VAL 4 CO 0.45 0.53 0.87 -0.31 0.00 0.00 0.00 175.10 176.64 1xc1 s TYR 5 N 0.60 2.82 -0.21 5.22 1.51 -0.72 0.12 117.35 126.69 1xc1 s TYR 5 Ca -0.10 -0.39 -0.15 0.00 -1.01 0.00 0.00 57.07 55.42 1xc1 s TYR 5 Cb -0.16 -4.04 -0.04 0.00 -0.11 0.00 0.00 41.96 37.61 1xc1 s TYR 5 CO 0.03 -1.39 0.36 1.21 -1.11 0.00 0.00 175.55 174.65 1xc1 s ASN 6 N 3.18 6.39 -0.05 2.29 2.47 0.17 -1.42 114.94 127.96 1xc1 s ASN 6 Ca 0.23 0.45 0.10 0.00 0.42 0.00 0.00 52.86 54.06 1xc1 s ASN 6 Cb -0.16 -2.21 -0.15 0.00 -1.45 0.00 0.00 41.25 37.28 1xc1 s ASN 6 CO 0.13 -0.05 0.16 0.61 -3.72 0.00 0.00 177.10 174.23 1xc1 n GLY 7 N 3.96 -0.48 0.00 1.21 0.00 0.16 -2.30 105.19 107.74 1xc1 n GLY 7 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1xc1 n GLY 7 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1xc1 n GLN 8 N -2.05 1.12 -2.62 1.61 -0.06 -1.16 -4.47 117.38 109.75 1xc1 n GLN 8 Ca -0.07 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.50 1xc1 n GLN 8 Cb 0.48 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 26.64 1xc1 n GLN 8 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1xc1 s HIS 9 N 0.00 2.89 0.52 3.69 5.04 -1.26 -4.88 115.29 121.29 1xc1 s HIS 9 Ca 0.00 0.81 0.36 0.00 -1.54 0.00 0.00 55.06 54.69 1xc1 s HIS 9 Cb 0.00 -4.25 1.52 0.00 0.04 0.00 0.00 32.58 29.89 1xc1 s HIS 9 CO 0.00 -1.15 1.75 0.87 -2.34 0.00 0.00 174.74 173.87 1xc1 h LYS 10 N 8.96 0.05 0.16 2.88 1.57 -1.95 0.79 116.57 129.03 1xc1 h LYS 10 Ca -0.22 -0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.26 1xc1 h LYS 10 Cb 1.06 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.37 1xc1 h LYS 10 CO 1.10 0.03 -1.29 1.49 -0.57 0.00 0.00 179.45 180.22 1xc1 h GLU 11 N 0.05 0.37 0.04 3.15 4.81 -1.99 -2.78 114.58 118.23 1xc1 h GLU 11 Ca 0.64 -0.61 -0.22 0.00 -0.13 0.00 0.00 59.36 59.04 1xc1 h GLU 11 Cb 2.42 0.22 -0.02 0.00 0.63 0.00 0.00 28.75 32.01 1xc1 h GLU 11 CO -0.07 1.28 -1.03 0.00 -0.73 0.00 0.00 179.01 178.47 1xc1 h ALA 12 N 0.46 0.34 -0.43 2.92 0.00 -0.25 -2.81 119.26 119.50 1xc1 h ALA 12 Ca -0.17 -0.85 -0.04 0.00 0.00 0.00 0.00 54.91 53.85 1xc1 h ALA 12 Cb 2.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 1xc1 h ALA 12 CO 0.22 1.09 0.12 0.00 0.00 0.00 0.00 179.25 180.69 1xc1 h ALA 13 N 0.90 0.56 -0.97 0.00 0.00 0.17 -0.57 119.26 119.35 1xc1 h ALA 13 Ca -0.05 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.78 1xc1 h ALA 13 Cb 1.75 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 19.29 1xc1 h ALA 13 CO 0.15 0.22 0.61 1.96 0.00 0.00 0.00 179.25 182.19 1xc1 h GLN 14 N 0.55 0.98 0.03 0.00 1.08 -1.45 1.35 115.11 117.64 1xc1 h GLN 14 Ca 0.14 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1xc1 h GLN 14 Cb 0.29 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1xc1 h GLN 14 CO -0.00 0.65 -0.01 0.00 -0.95 0.00 0.00 178.83 178.51 1xc1 h ALA 15 N 1.50 -0.03 0.00 3.87 0.00 -1.14 -1.60 119.26 121.86 1xc1 h ALA 15 Ca 0.46 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 1xc1 h ALA 15 Cb 0.38 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1xc1 h ALA 15 CO -0.24 -0.34 -0.49 -0.39 0.00 0.00 0.00 179.25 177.79 1xc1 h VAL 16 N -0.39 1.02 -0.05 0.00 -1.51 -0.68 0.42 116.25 115.06 1xc1 h VAL 16 Ca -0.00 -1.93 -0.02 0.00 -1.23 0.00 0.00 66.70 63.52 1xc1 h VAL 16 Cb 0.37 2.16 -0.00 0.00 -2.13 0.00 0.00 31.29 31.68 1xc1 h VAL 16 CO 0.01 0.48 -0.03 0.00 -1.23 0.00 0.00 177.57 176.80 1xc1 h ALA 17 N 1.51 0.07 0.00 5.19 0.00 0.18 -2.85 119.26 123.36 1xc1 h ALA 17 Ca -0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1xc1 h ALA 17 Cb 1.12 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1xc1 h ALA 17 CO 0.06 -0.18 -0.53 -0.44 0.00 0.00 0.00 179.25 178.16 1xc1 h ASP 18 N -0.30 0.00 0.42 0.00 3.32 -1.30 -1.58 116.42 116.97 1xc1 h ASP 18 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1xc1 h ASP 18 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1xc1 h ASP 18 CO 0.01 0.53 0.00 0.00 -1.72 0.00 0.00 179.24 178.06 1xc1 n ALA 19 N -2.27 1.84 -0.11 3.45 0.00 0.13 -2.37 120.51 121.18 1xc1 n ALA 19 Ca 0.01 -0.07 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 1xc1 n ALA 19 Cb 0.69 -1.27 -0.06 0.00 0.00 0.00 0.00 19.45 18.81 1xc1 n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xc1 n PHE 20 N -1.38 0.00 0.04 0.00 7.35 -1.00 -3.90 117.46 118.58 1xc1 n PHE 20 Ca 0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.75 1xc1 n PHE 20 Cb 0.16 -0.71 0.01 0.00 0.35 0.00 0.00 39.48 39.29 1xc1 n PHE 20 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1xc1 n THR 21 N -4.25 0.00 -0.10 -2.13 -1.04 -0.63 -0.99 114.28 105.13 1xc1 n THR 21 Ca -0.34 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.46 1xc1 n THR 21 Cb 0.69 -0.82 -0.08 0.00 -1.82 0.00 0.00 70.33 68.31 1xc1 n THR 21 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1xc1 n ARG 22 N -0.83 0.44 0.00 -2.82 0.63 -1.00 -2.01 116.66 111.07 1xc1 n ARG 22 Ca 0.00 0.18 0.12 0.00 -0.92 0.00 0.00 57.85 57.23 1xc1 n ARG 22 Cb 0.00 -1.26 0.56 0.00 0.45 0.00 0.00 32.46 32.21 1xc1 n ARG 22 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1xc1 n ALA 23 N -3.80 2.16 0.06 5.13 0.00 -0.32 -4.30 120.51 119.44 1xc1 n ALA 23 Ca -0.40 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1xc1 n ALA 23 Cb 0.80 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1xc1 n ALA 23 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xc1 n THR 24 N -1.41 0.26 0.00 0.00 -2.24 -0.16 -5.05 114.28 105.68 1xc1 n THR 24 Ca 0.08 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 1xc1 n THR 24 Cb 0.24 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 67.58 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 2.17 1.91 3.61 3.38 0.00 -0.85 -5.01 105.19 110.39 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 -2.15 3.04 0.87 -0.61 1.01 -1.26 -4.85 121.20 117.25 1xc1 s ILE 26 Ca 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.59 1xc1 s ILE 26 Cb 0.00 -3.05 0.12 0.00 0.01 0.00 0.00 42.46 39.53 1xc1 s ILE 26 CO 0.00 -0.03 1.13 -0.75 0.00 0.00 0.00 174.94 175.29 1xc1 s LYS 27 N 6.04 1.43 -0.07 2.79 2.20 -1.26 -3.99 119.74 126.88 1xc1 s LYS 27 Ca 0.97 1.43 -0.03 0.00 -0.36 0.00 0.00 55.97 57.98 1xc1 s LYS 27 Cb -0.34 -1.78 0.04 0.00 -1.51 0.00 0.00 37.83 34.24 1xc1 s LYS 27 CO 0.36 -2.31 0.10 0.08 -0.36 0.00 0.00 175.35 173.22 1xc1 s VAL 28 N -2.73 -0.16 -0.30 4.02 1.01 -1.26 -2.97 120.40 118.01 1xc1 s VAL 28 Ca 0.65 0.32 -0.18 0.00 0.00 0.00 0.00 61.98 62.76 1xc1 s VAL 28 Cb -0.21 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.89 1xc1 s VAL 28 CO 0.57 0.10 0.54 -0.75 0.00 0.00 0.00 175.10 175.56 1xc1 s LYS 29 N 2.21 3.91 -0.27 2.72 2.20 -1.25 -4.93 119.74 124.33 1xc1 s LYS 29 Ca 0.04 0.18 -0.11 0.00 -0.36 0.00 0.00 55.97 55.73 1xc1 s LYS 29 Cb -0.13 -3.71 -0.05 0.00 -1.51 0.00 0.00 37.83 32.43 1xc1 s LYS 29 CO -0.05 -0.48 0.17 -0.51 -0.36 0.00 0.00 175.35 174.13 1xc1 s LEU 30 N 2.40 4.03 -0.34 5.43 1.43 -1.26 0.18 118.68 130.55 1xc1 s LEU 30 Ca 0.21 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.24 1xc1 s LEU 30 Cb -0.15 -2.11 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1xc1 s LEU 30 CO 0.11 -0.01 0.16 0.20 0.23 0.00 0.00 176.35 177.04 1xc1 s ASN 31 N 1.52 5.54 0.03 2.29 0.01 0.33 -4.93 114.94 119.72 1xc1 s ASN 31 Ca 0.07 -0.78 0.00 0.00 -0.71 0.00 0.00 52.86 51.44 1xc1 s ASN 31 Cb -0.15 -1.98 -0.04 0.00 0.41 0.00 0.00 41.25 39.49 1xc1 s ASN 31 CO 0.09 -0.28 0.11 -0.44 -1.51 0.00 0.00 177.10 175.07 1xc1 s SER 32 N 1.56 5.81 0.00 -1.22 0.01 -1.26 0.41 113.70 119.01 1xc1 s SER 32 Ca 0.03 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1xc1 s SER 32 Cb -0.18 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.37 1xc1 s SER 32 CO 0.06 0.23 0.00 0.00 0.41 0.00 0.00 173.24 173.93 1xc1 n ALA 33 N 0.83 0.00 -1.87 1.44 0.00 -0.97 -4.98 120.51 114.96 1xc1 n ALA 33 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 1xc1 n ALA 33 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 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 -1.18 4.65 0.21 0.00 1.02 -1.26 -4.13 119.74 119.05 1xc1 s LYS 34 Ca 0.00 1.73 -0.17 0.00 0.02 0.00 0.00 55.97 57.56 1xc1 s LYS 34 Cb 0.00 -3.23 0.20 0.00 -0.52 0.00 0.00 37.83 34.28 1xc1 s LYS 34 CO 0.00 0.20 1.60 0.78 -0.92 0.00 0.00 175.35 177.01 1xc1 h GLY 35 N 4.33 0.19 1.57 -3.33 0.00 -1.88 0.45 103.07 104.41 1xc1 h GLY 35 Ca -0.46 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1xc1 h GLY 35 CO 0.69 -0.24 0.00 1.22 0.00 0.00 0.00 176.54 178.21 1xc1 n ASP 36 N -5.45 0.00 -0.08 0.19 8.00 -1.26 0.36 116.55 118.30 1xc1 n ASP 36 Ca 0.07 0.07 -0.18 0.00 0.71 0.00 0.00 54.79 55.46 1xc1 n ASP 36 Cb 0.36 -0.29 -0.13 0.00 -0.02 0.00 0.00 41.12 41.04 1xc1 n ASP 36 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1xc1 n GLN 37 N -1.29 0.69 0.15 -1.24 7.27 0.12 -3.21 117.38 119.87 1xc1 n GLN 37 Ca 0.07 0.18 -0.14 0.00 0.07 0.00 0.00 57.00 57.18 1xc1 n GLN 37 Cb 0.12 -1.59 -0.08 0.00 2.41 0.00 0.00 30.24 31.10 1xc1 n GLN 37 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1xc1 h LEU 38 N 0.02 -0.30 -0.29 1.69 -0.00 0.75 -1.44 115.31 115.74 1xc1 h LEU 38 Ca -0.52 -0.13 0.06 0.00 -0.00 0.00 0.00 57.88 57.28 1xc1 h LEU 38 Cb 1.97 0.08 -0.08 0.00 -0.00 0.00 0.00 40.66 42.63 1xc1 h LEU 38 CO -0.02 -0.04 -0.45 0.00 -0.00 0.00 0.00 178.44 177.94 1xc1 h ALA 39 N 0.11 -0.56 -0.94 1.53 0.00 -0.28 0.40 119.26 119.52 1xc1 h ALA 39 Ca -0.04 0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.09 1xc1 h ALA 39 Cb 0.41 0.89 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 1xc1 h ALA 39 CO 0.06 -0.92 0.51 0.78 0.00 0.00 0.00 179.25 179.67 1xc1 h GLY 40 N -0.41 1.64 1.33 0.00 0.00 -1.50 0.92 103.07 105.04 1xc1 h GLY 40 Ca 0.10 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 1xc1 h GLY 40 CO -0.51 -0.14 0.03 -1.61 0.00 0.00 0.00 176.54 174.31 1xc1 h GLN 41 N 0.60 0.82 -0.47 4.80 4.15 0.13 -2.79 115.11 122.37 1xc1 h GLN 41 Ca 0.55 -0.21 -0.12 0.00 0.77 0.00 0.00 58.65 59.64 1xc1 h GLN 41 Cb 0.93 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.50 1xc1 h GLN 41 CO -0.43 0.81 -0.17 0.82 -1.93 0.00 0.00 178.83 177.93 1xc1 h ILE 42 N 0.77 1.27 -0.11 2.39 2.04 0.78 -2.57 117.51 122.08 1xc1 h ILE 42 Ca 0.15 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1xc1 h ILE 42 Cb 0.42 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1xc1 h ILE 42 CO 0.02 0.45 0.07 0.11 0.00 0.00 0.00 178.15 178.80 1xc1 h LYS 43 N 0.81 0.15 0.41 2.37 1.57 -1.05 -1.05 116.57 119.77 1xc1 h LYS 43 Ca 0.12 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1xc1 h LYS 43 Cb 0.72 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 1xc1 h LYS 43 CO 0.06 0.10 -0.40 0.93 -0.57 0.00 0.00 179.45 179.56 1xc1 h GLU 44 N 0.15 -0.78 -0.94 3.15 4.39 -1.45 -3.00 114.58 116.09 1xc1 h GLU 44 Ca 0.04 0.05 0.15 0.00 0.34 0.00 0.00 59.36 59.94 1xc1 h GLU 44 Cb -0.01 0.18 -0.09 0.00 -0.10 0.00 0.00 28.75 28.72 1xc1 h GLU 44 CO -0.01 -0.52 0.55 0.93 -1.16 0.00 0.00 179.01 178.81 1xc1 h GLU 45 N -0.81 0.77 0.00 2.33 5.08 -1.42 -3.47 114.58 117.05 1xc1 h GLU 45 Ca -0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1xc1 h GLU 45 Cb 0.70 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1xc1 h GLU 45 CO -0.05 0.51 0.00 0.41 -1.00 0.00 0.00 179.01 178.88 1xc1 n GLY 46 N -1.33 1.14 2.23 -3.84 0.00 -0.40 -3.42 105.19 99.56 1xc1 n GLY 46 Ca 0.19 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 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 1.95 6.36 0.00 1.61 2.88 -1.26 -2.53 113.62 122.62 1xc1 n SER 47 Ca 0.00 -2.77 0.00 0.00 -1.33 0.00 0.00 58.87 54.77 1xc1 n SER 47 Cb 0.00 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.08 1xc1 n SER 47 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1xc1 n ARG 48 N 2.09 0.00 -2.29 -1.46 1.74 -1.22 -4.99 116.66 110.53 1xc1 n ARG 48 Ca 0.52 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 57.19 1xc1 n ARG 48 Cb 0.65 -0.25 -0.03 0.00 -1.02 0.00 0.00 32.46 31.81 1xc1 n ARG 48 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1xc1 s SER 49 N 0.00 6.97 0.00 0.55 0.15 -1.05 -4.93 113.70 115.40 1xc1 s SER 49 Ca 0.00 2.48 0.31 0.00 0.70 0.00 0.00 55.95 59.44 1xc1 s SER 49 Cb 0.00 -2.64 1.73 0.00 -1.71 0.00 0.00 66.02 63.40 1xc1 s SER 49 CO 0.00 -0.37 2.15 -0.81 1.20 0.00 0.00 173.24 175.41 1xc1 n PRO 50 N 0.91 0.77 -2.65 5.44 -0.04 -1.26 -4.85 135.00 133.33 1xc1 n PRO 50 Ca -0.00 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 63.02 1xc1 n PRO 50 Cb 0.43 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 1xc1 n PRO 50 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xc1 s ALA 51 N -2.24 3.24 -0.24 0.55 0.00 -1.26 -4.39 121.76 117.42 1xc1 s ALA 51 Ca 0.40 0.63 0.07 0.00 0.00 0.00 0.00 51.96 53.05 1xc1 s ALA 51 Cb 0.21 -3.35 -0.19 0.00 0.00 0.00 0.00 23.12 19.79 1xc1 s ALA 51 CO 0.41 -0.22 -0.14 -0.25 0.00 0.00 0.00 175.76 175.56 1xc1 n ASP 52 N 3.53 1.40 -4.02 0.00 9.92 -0.30 -4.46 116.55 122.61 1xc1 n ASP 52 Ca 0.05 -0.10 -0.15 0.00 -0.53 0.00 0.00 54.79 54.07 1xc1 n ASP 52 Cb 0.49 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.85 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 -2.51 0.54 -0.28 2.53 1.01 -1.21 -1.92 120.40 118.55 1xc1 s VAL 53 Ca -0.28 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 1xc1 s VAL 53 Cb 0.08 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.98 1xc1 s VAL 53 CO 0.67 -0.11 -0.02 0.12 0.00 0.00 0.00 175.10 175.75 1xc1 s PHE 54 N -0.75 3.21 -0.59 5.22 5.36 0.13 -1.76 117.98 128.80 1xc1 s PHE 54 Ca -0.03 -1.82 -0.16 0.00 -0.96 0.00 0.00 56.93 53.96 1xc1 s PHE 54 Cb -0.06 -2.08 0.13 0.00 -0.34 0.00 0.00 43.02 40.67 1xc1 s PHE 54 CO 0.00 -0.79 0.59 -0.47 -1.46 0.00 0.00 175.22 173.09 1xc1 s TYR 55 N 1.26 3.25 -0.05 10.12 6.14 -0.51 -1.31 117.35 136.25 1xc1 s TYR 55 Ca -0.04 -1.30 -0.03 0.00 0.64 0.00 0.00 57.07 56.33 1xc1 s TYR 55 Cb -0.19 -3.86 -0.04 0.00 0.42 0.00 0.00 41.96 38.29 1xc1 s TYR 55 CO -0.02 -1.09 0.13 0.45 0.64 0.00 0.00 175.55 175.66 1xc1 s SER 56 N 3.43 6.11 0.00 4.32 0.15 0.32 0.40 113.70 128.44 1xc1 s SER 56 Ca 0.07 0.32 0.21 0.00 0.70 0.00 0.00 55.95 57.25 1xc1 s SER 56 Cb -0.26 -1.89 0.59 0.00 -1.71 0.00 0.00 66.02 62.75 1xc1 s SER 56 CO 0.02 0.32 1.47 -1.84 1.20 0.00 0.00 173.24 174.41 1xc1 n GLU 57 N 1.43 2.05 -3.96 5.44 0.00 -1.26 -1.04 120.64 123.30 1xc1 n GLU 57 Ca -0.15 -1.59 -0.17 0.00 0.00 0.00 0.00 57.16 55.25 1xc1 n GLU 57 Cb 0.53 -1.44 -0.16 0.00 0.00 0.00 0.00 31.44 30.38 1xc1 n GLU 57 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1xc1 s GLN 58 N -1.65 0.31 0.12 3.44 -0.21 -1.26 -4.58 119.66 115.83 1xc1 s GLN 58 Ca 0.34 0.04 -0.04 0.00 0.02 0.00 0.00 55.36 55.72 1xc1 s GLN 58 Cb 0.19 -0.45 -0.13 0.00 1.00 0.00 0.00 33.01 33.62 1xc1 s GLN 58 CO 0.28 -0.10 1.27 0.82 -2.12 0.00 0.00 175.29 175.44 1xc1 h ILE 59 N 6.05 1.43 -0.82 1.08 1.08 -1.88 -3.25 117.51 121.19 1xc1 h ILE 59 Ca -0.40 -2.59 0.09 0.00 -0.39 0.00 0.00 64.86 61.57 1xc1 h ILE 59 Cb 1.14 2.54 -0.06 0.00 -3.07 0.00 0.00 36.82 37.37 1xc1 h ILE 59 CO 0.48 0.77 0.53 -0.65 -0.69 0.00 0.00 178.15 178.59 1xc1 h PRO 60 N 0.19 0.77 -0.28 2.37 0.11 -1.94 0.64 132.00 133.85 1xc1 h PRO 60 Ca -0.09 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.91 1xc1 h PRO 60 Cb 1.66 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.58 1xc1 h PRO 60 CO 0.17 0.51 -0.08 0.00 -0.21 0.00 0.00 178.00 178.39 1xc1 h ALA 61 N 1.58 1.34 0.00 -0.75 0.00 -1.91 -1.22 119.26 118.29 1xc1 h ALA 61 Ca 0.37 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1xc1 h ALA 61 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1xc1 h ALA 61 CO -0.15 0.45 -0.71 -0.07 0.00 0.00 0.00 179.25 178.78 1xc1 h LEU 62 N 0.43 0.00 0.04 0.00 3.38 -1.17 -3.06 115.31 114.94 1xc1 h LEU 62 Ca 0.09 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.78 1xc1 h LEU 62 Cb 0.41 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.19 1xc1 h LEU 62 CO 0.02 0.65 -1.14 0.00 0.09 0.00 0.00 178.44 178.06 1xc1 h ALA 63 N 1.35 0.08 -0.42 1.53 0.00 -0.54 0.52 119.26 121.79 1xc1 h ALA 63 Ca -0.02 -0.74 -0.02 0.00 0.00 0.00 0.00 54.91 54.13 1xc1 h ALA 63 Cb 1.51 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1xc1 h ALA 63 CO 0.08 0.71 0.20 1.15 0.00 0.00 0.00 179.25 181.39 1xc1 h THR 64 N 0.31 1.18 -0.39 0.00 2.02 -1.31 1.26 112.91 115.97 1xc1 h THR 64 Ca -0.15 -0.50 -0.12 0.00 0.77 0.00 0.00 66.41 66.40 1xc1 h THR 64 Cb 1.81 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 1xc1 h THR 64 CO 0.22 0.19 -0.24 -0.07 0.37 0.00 0.00 175.52 175.99 1xc1 h LEU 65 N 0.53 0.81 -0.35 2.58 3.38 -1.57 -1.95 115.31 118.74 1xc1 h LEU 65 Ca 0.14 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 1xc1 h LEU 65 Cb 0.12 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1xc1 h LEU 65 CO -0.02 1.02 -0.18 -1.28 0.09 0.00 0.00 178.44 178.07 1xc1 h SER 66 N 0.68 0.77 -0.87 -0.43 0.87 -0.42 -0.66 113.55 113.48 1xc1 h SER 66 Ca 0.09 -0.41 0.17 0.00 -1.23 0.00 0.00 61.79 60.42 1xc1 h SER 66 Cb 0.76 -0.21 -0.07 0.00 -0.44 0.00 0.00 62.40 62.45 1xc1 h SER 66 CO 0.06 1.01 0.57 0.00 -0.53 0.00 0.00 176.83 177.94 1xc1 h ALA 67 N 0.78 2.05 -0.10 6.23 0.00 0.18 1.24 119.26 129.65 1xc1 h ALA 67 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1xc1 h ALA 67 Cb 0.72 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1xc1 h ALA 67 CO 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 179.25 178.99 1xc1 n ALA 68 N -2.48 2.55 -2.32 0.00 0.00 -0.75 -4.93 120.51 112.57 1xc1 n ALA 68 Ca 0.18 -0.48 -0.13 0.00 0.00 0.00 0.00 53.44 53.02 1xc1 n ALA 68 Cb 0.59 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 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 0.20 -3.97 -0.11 0.00 5.03 0.43 -4.78 115.26 112.06 1xc1 n ASN 69 Ca 0.17 0.20 0.01 0.00 0.87 0.00 0.00 54.58 55.83 1xc1 n ASN 69 Cb 0.33 -3.40 0.02 0.00 -1.02 0.00 0.00 39.78 35.70 1xc1 n ASN 69 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1xc1 n LEU 70 N -2.71 0.28 -4.42 3.41 4.77 -0.36 -4.76 117.00 113.21 1xc1 n LEU 70 Ca -0.15 -0.14 -0.32 0.00 -0.03 0.00 0.00 56.01 55.37 1xc1 n LEU 70 Cb 0.60 -0.06 -0.14 0.00 -2.33 0.00 0.00 43.42 41.48 1xc1 n LEU 70 CO 0.18 0.07 -0.50 -0.76 -1.33 0.00 0.00 177.39 175.05 1xc1 s LEU 71 N -0.93 2.50 0.28 2.23 1.43 -1.26 -1.60 118.68 121.34 1xc1 s LEU 71 Ca 0.03 -0.32 -0.21 0.00 -1.03 0.00 0.00 54.13 52.60 1xc1 s LEU 71 Cb 0.01 -1.48 -0.09 0.00 0.03 0.00 0.00 46.19 44.66 1xc1 s LEU 71 CO 0.02 0.32 0.80 -0.70 0.23 0.00 0.00 176.35 177.02 1xc1 s GLU 72 N -0.82 4.30 0.13 1.70 2.56 0.27 -4.65 118.70 122.19 1xc1 s GLU 72 Ca 0.12 0.98 -0.31 0.00 0.00 0.00 0.00 54.97 55.76 1xc1 s GLU 72 Cb -0.10 -2.72 -0.08 0.00 2.00 0.00 0.00 34.13 33.23 1xc1 s GLU 72 CO 0.01 0.29 1.31 -1.25 -0.56 0.00 0.00 175.26 175.06 1xc1 s PRO 73 N -2.26 4.38 0.11 4.30 0.04 -1.26 -4.39 135.00 135.91 1xc1 s PRO 73 Ca 0.48 1.98 -0.14 0.00 0.04 0.00 0.00 61.00 63.37 1xc1 s PRO 73 Cb -0.15 -3.26 -0.07 0.00 0.04 0.00 0.00 34.50 31.06 1xc1 s PRO 73 CO 0.20 -0.32 0.50 -0.51 0.04 0.00 0.00 177.00 176.91 1xc1 s LEU 74 N 0.72 4.37 0.34 -3.56 1.43 0.98 -4.95 118.68 118.00 1xc1 s LEU 74 Ca 0.60 1.01 -0.27 0.00 -1.03 0.00 0.00 54.13 54.44 1xc1 s LEU 74 Cb -0.35 -3.11 -0.09 0.00 0.03 0.00 0.00 46.19 42.67 1xc1 s LEU 74 CO 0.32 0.15 1.14 -2.16 0.23 0.00 0.00 176.35 176.03 1xc1 s PRO 75 N -1.80 4.37 0.65 1.29 0.04 -1.26 -4.85 135.00 133.44 1xc1 s PRO 75 Ca 0.35 1.82 0.31 0.00 0.04 0.00 0.00 61.00 63.52 1xc1 s PRO 75 Cb -0.15 -2.94 1.67 0.00 0.04 0.00 0.00 34.50 33.12 1xc1 s PRO 75 CO 0.18 -0.04 1.96 0.00 0.04 0.00 0.00 177.00 179.15 1xc1 h ALA 76 N 3.24 1.48 0.00 8.56 0.00 -1.97 0.92 119.26 131.48 1xc1 h ALA 76 Ca -0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1xc1 h ALA 76 Cb 1.22 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1xc1 h ALA 76 CO 0.65 -0.36 -0.05 1.03 0.00 0.00 0.00 179.25 180.51 1xc1 h SER 77 N 0.00 0.00 0.00 0.00 0.87 -1.99 -1.57 113.55 110.87 1xc1 h SER 77 Ca 0.04 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.24 1xc1 h SER 77 Cb 0.68 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.58 1xc1 h SER 77 CO -0.00 0.05 -2.31 0.41 -0.53 0.00 0.00 176.83 174.45 1xc1 n THR 78 N -3.30 1.31 -0.28 2.23 -1.04 0.31 -4.48 114.28 109.03 1xc1 n THR 78 Ca -0.01 -0.44 -0.05 0.00 -2.04 0.00 0.00 64.05 61.51 1xc1 n THR 78 Cb 0.21 -1.49 0.06 0.00 -1.82 0.00 0.00 70.33 67.29 1xc1 n THR 78 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1xc1 h ILE 79 N -0.32 1.24 0.00 12.58 2.04 -1.32 -2.14 117.51 129.58 1xc1 h ILE 79 Ca -0.54 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1xc1 h ILE 79 Cb 1.69 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1xc1 h ILE 79 CO -0.19 0.27 0.00 0.59 0.00 0.00 0.00 178.15 178.82 1xc1 n ASN 80 N -4.42 0.00 -0.20 1.72 3.02 -0.59 -2.79 115.26 112.00 1xc1 n ASN 80 Ca 0.07 -0.72 0.15 0.00 -0.03 0.00 0.00 54.58 54.05 1xc1 n ASN 80 Cb 0.11 0.00 0.77 0.00 -0.61 0.00 0.00 39.78 40.05 1xc1 n ASN 80 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xc1 n GLU 81 N -0.91 1.26 0.00 3.52 -0.58 -0.80 -3.80 120.64 119.33 1xc1 n GLU 81 Ca 0.12 -0.40 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 1xc1 n GLU 81 Cb 0.05 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 1xc1 n GLU 81 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1xc1 n THR 82 N -0.52 0.00 -1.44 2.62 -2.24 -1.16 -4.16 114.28 107.39 1xc1 n THR 82 Ca 0.22 0.00 -0.50 0.00 -2.27 0.00 0.00 64.05 61.49 1xc1 n THR 82 Cb 0.21 0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 69.12 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 0.00 0.97 -4.33 -0.78 3.00 -1.12 -4.78 116.66 109.62 1xc1 n ARG 83 Ca 0.00 0.25 -0.17 0.00 -0.00 0.00 0.00 57.85 57.93 1xc1 n ARG 83 Cb 0.34 -2.40 -0.10 0.00 0.00 0.00 0.00 32.46 30.29 1xc1 n ARG 83 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1xc1 s GLY 84 N 7.48 1.71 -0.54 5.14 0.00 -1.26 -4.99 107.32 114.87 1xc1 s GLY 84 Ca 1.11 -1.86 -0.27 0.00 0.00 0.00 0.00 44.72 43.70 1xc1 s GLY 84 CO 0.49 -1.62 1.71 1.25 0.00 0.00 0.00 173.10 174.93 1xc1 s LYS 85 N -3.99 2.99 0.00 2.90 2.47 -1.26 -2.61 119.74 120.24 1xc1 s LYS 85 Ca 0.36 0.73 0.00 0.00 -1.56 0.00 0.00 55.97 55.49 1xc1 s LYS 85 Cb 0.08 -4.27 0.00 0.00 -1.46 0.00 0.00 37.83 32.18 1xc1 s LYS 85 CO 0.13 -2.30 0.00 0.41 0.16 0.00 0.00 175.35 173.75 1xc1 n GLY 86 N 5.50 0.72 3.81 5.54 0.00 -1.26 -5.03 105.19 114.46 1xc1 n GLY 86 Ca 0.18 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 4.59 0.17 1.61 1.01 -1.07 -4.95 120.40 119.76 1xc1 s VAL 87 Ca 0.00 1.34 -0.33 0.00 0.00 0.00 0.00 61.98 62.99 1xc1 s VAL 87 Cb 0.00 -3.94 -0.15 0.00 0.00 0.00 0.00 36.38 32.29 1xc1 s VAL 87 CO 0.00 0.41 1.30 -2.65 0.00 0.00 0.00 175.10 174.16 1xc1 n PRO 88 N 1.29 1.49 -4.82 2.72 -0.02 -1.26 -4.83 135.00 129.57 1xc1 n PRO 88 Ca -0.06 0.53 -0.28 0.00 -2.02 0.00 0.00 63.50 61.67 1xc1 n PRO 88 Cb 0.50 -2.13 -0.17 0.00 -0.02 0.00 0.00 33.50 31.69 1xc1 n PRO 88 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1xc1 s VAL 89 N 0.09 1.58 -0.14 -1.45 -7.23 -1.26 -4.49 120.40 107.50 1xc1 s VAL 89 Ca 0.75 -0.73 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 1xc1 s VAL 89 Cb -0.80 -1.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.73 1xc1 s VAL 89 CO 0.49 0.45 1.15 0.00 -0.31 0.00 0.00 175.10 176.88 1xc1 s ALA 90 N 0.59 3.58 -0.40 1.32 0.00 -1.26 -4.90 121.76 120.68 1xc1 s ALA 90 Ca -0.15 0.42 0.26 0.00 0.00 0.00 0.00 51.96 52.49 1xc1 s ALA 90 Cb -0.17 -3.54 0.96 0.00 0.00 0.00 0.00 23.12 20.38 1xc1 s ALA 90 CO 0.05 -0.93 1.78 0.00 0.00 0.00 0.00 175.76 176.65 1xc1 h ALA 91 N 7.63 1.00 -0.00 0.00 0.00 -1.99 -2.49 119.26 123.40 1xc1 h ALA 91 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1xc1 h ALA 91 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xc1 h ALA 91 CO 0.93 0.00 -0.10 1.63 0.00 0.00 0.00 179.25 181.70 1xc1 n LYS 92 N -2.52 3.48 -3.99 0.00 5.02 -1.26 -5.02 118.16 113.85 1xc1 n LYS 92 Ca 0.03 -0.28 -0.33 0.00 -2.02 0.00 0.00 58.31 55.71 1xc1 n LYS 92 Cb 0.32 -0.82 -0.02 0.00 -0.02 0.00 0.00 35.03 34.49 1xc1 n LYS 92 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1xc1 n LYS 93 N -0.59 -3.32 -0.39 1.97 2.85 -0.94 -4.78 118.16 112.96 1xc1 n LYS 93 Ca 0.01 0.39 0.10 0.00 -1.05 0.00 0.00 58.31 57.77 1xc1 n LYS 93 Cb 0.07 -5.13 0.30 0.00 -0.65 0.00 0.00 35.03 29.62 1xc1 n LYS 93 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1xc1 n ASP 94 N -2.55 3.72 -3.79 -5.58 5.68 -1.26 -0.01 116.55 112.75 1xc1 n ASP 94 Ca 0.06 -2.11 -0.09 0.00 -0.50 0.00 0.00 54.79 52.15 1xc1 n ASP 94 Cb 0.50 -0.47 -0.03 0.00 -1.14 0.00 0.00 41.12 39.98 1xc1 n ASP 94 CO 0.00 0.00 0.00 -1.66 -1.33 0.00 0.00 177.20 174.21 1xc1 s TRP 95 N -1.32 -0.10 -0.07 2.11 1.48 -1.26 -4.08 118.94 115.69 1xc1 s TRP 95 Ca 0.44 -0.27 -0.07 0.00 -1.06 0.00 0.00 56.10 55.14 1xc1 s TRP 95 Cb 0.25 0.48 0.02 0.00 -1.16 0.00 0.00 33.47 33.06 1xc1 s TRP 95 CO 0.28 -1.03 0.20 0.54 -4.06 0.00 0.00 176.95 172.87 1xc1 s VAL 96 N -3.90 0.01 0.30 -0.66 0.11 -0.31 -4.57 120.40 111.38 1xc1 s VAL 96 Ca 0.11 -0.05 -0.28 0.00 -2.93 0.00 0.00 61.98 58.83 1xc1 s VAL 96 Cb -0.03 -0.30 -0.09 0.00 -1.53 0.00 0.00 36.38 34.43 1xc1 s VAL 96 CO 0.01 -0.03 1.05 0.00 -3.33 0.00 0.00 175.10 172.81 1xc1 s ALA 97 N -0.00 3.31 0.04 1.54 0.00 -1.26 -0.69 121.76 124.69 1xc1 s ALA 97 Ca -0.01 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1xc1 s ALA 97 Cb -0.02 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1xc1 s ALA 97 CO 0.00 -0.09 0.00 1.28 0.00 0.00 0.00 175.76 176.95 1xc1 n LEU 98 N 0.91 0.46 0.00 0.00 4.77 0.25 -4.79 117.00 118.59 1xc1 n LEU 98 Ca 0.00 0.06 -0.20 0.00 -0.03 0.00 0.00 56.01 55.84 1xc1 n LEU 98 Cb 0.47 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 1xc1 n LEU 98 CO 0.51 -0.31 -0.11 -1.54 -1.33 0.00 0.00 177.39 174.60 1xc1 n SER 99 N -3.20 -0.13 -3.77 -1.43 3.41 -1.22 -2.49 113.62 104.78 1xc1 n SER 99 Ca 0.00 -3.07 -0.13 0.00 -0.26 0.00 0.00 58.87 55.41 1xc1 n SER 99 Cb 0.30 1.41 -0.10 0.00 -0.26 0.00 0.00 64.21 65.56 1xc1 n SER 99 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1xc1 s GLY 100 N -3.25 -0.16 0.08 5.00 0.00 -1.04 -0.53 107.32 107.42 1xc1 s GLY 100 Ca 0.32 0.48 0.05 0.00 0.00 0.00 0.00 44.72 45.57 1xc1 s GLY 100 CO 0.23 0.31 -0.02 0.50 0.00 0.00 0.00 173.10 174.12 1xc1 s ARG 101 N -0.81 2.51 0.10 2.90 0.52 0.43 -1.64 118.95 122.96 1xc1 s ARG 101 Ca -0.09 -0.84 0.10 0.00 -0.52 0.00 0.00 55.73 54.38 1xc1 s ARG 101 Cb -0.04 -2.52 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 1xc1 s ARG 101 CO 0.03 0.55 -0.23 0.45 0.02 0.00 0.00 175.30 176.11 1xc1 s SER 102 N -2.19 3.52 -0.01 0.23 0.15 -1.26 -0.87 113.70 113.27 1xc1 s SER 102 Ca 0.24 -0.62 -0.27 0.00 0.70 0.00 0.00 55.95 56.00 1xc1 s SER 102 Cb -0.12 -0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 63.78 1xc1 s SER 102 CO 0.17 0.20 0.86 -0.13 1.20 0.00 0.00 173.24 175.54 1xc1 s ARG 103 N -1.86 4.53 0.24 5.44 1.81 -0.58 -1.41 118.95 127.12 1xc1 s ARG 103 Ca 0.15 1.21 0.01 0.00 -1.72 0.00 0.00 55.73 55.37 1xc1 s ARG 103 Cb -0.10 -3.44 -0.05 0.00 -0.45 0.00 0.00 34.95 30.91 1xc1 s ARG 103 CO 0.06 0.05 0.10 0.08 -0.68 0.00 0.00 175.30 174.92 1xc1 s VAL 104 N 0.72 0.40 -0.23 3.52 1.01 0.15 -4.68 120.40 121.29 1xc1 s VAL 104 Ca 0.45 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.45 1xc1 s VAL 104 Cb -0.20 -2.59 0.05 0.00 0.00 0.00 0.00 36.38 33.63 1xc1 s VAL 104 CO 0.24 -0.01 -0.13 -0.69 0.00 0.00 0.00 175.10 174.52 1xc1 s VAL 105 N -3.87 2.04 -0.12 2.92 1.01 -0.99 -2.08 120.40 119.31 1xc1 s VAL 105 Ca 0.38 -1.37 -0.15 0.00 0.00 0.00 0.00 61.98 60.84 1xc1 s VAL 105 Cb 0.08 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1xc1 s VAL 105 CO 0.13 0.13 0.37 0.54 0.00 0.00 0.00 175.10 176.27 1xc1 s VAL 106 N 1.20 5.24 0.12 2.92 0.11 -0.63 -0.09 120.40 129.26 1xc1 s VAL 106 Ca -0.04 0.72 0.05 0.00 -2.93 0.00 0.00 61.98 59.77 1xc1 s VAL 106 Cb -0.18 -3.70 -0.04 0.00 -1.53 0.00 0.00 36.38 30.93 1xc1 s VAL 106 CO -0.07 0.40 -0.11 -0.72 -3.33 0.00 0.00 175.10 171.26 1xc1 s TYR 107 N 0.30 1.23 -0.48 1.54 1.13 -0.47 -1.30 117.35 119.29 1xc1 s TYR 107 Ca 0.21 -0.64 -0.26 0.00 -1.41 0.00 0.00 57.07 54.96 1xc1 s TYR 107 Cb -0.14 -0.65 0.03 0.00 -1.10 0.00 0.00 41.96 40.10 1xc1 s TYR 107 CO 0.07 0.07 0.98 0.34 -2.51 0.00 0.00 175.55 174.51 1xc1 s ASP 108 N -2.61 6.50 0.00 -0.18 3.68 0.38 -1.38 116.67 123.05 1xc1 s ASP 108 Ca 0.09 0.12 0.06 0.00 2.13 0.00 0.00 52.55 54.96 1xc1 s ASP 108 Cb -0.02 -2.47 0.36 0.00 -1.45 0.00 0.00 42.92 39.33 1xc1 s ASP 108 CO 0.01 -1.14 0.76 0.35 0.13 0.00 0.00 175.17 175.29 1xc1 n THR 109 N 6.50 0.00 0.02 1.71 -2.24 0.21 -0.06 114.28 120.41 1xc1 n THR 109 Ca 0.07 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.91 1xc1 n THR 109 Cb 0.49 -0.76 -0.10 0.00 -2.10 0.00 0.00 70.33 67.86 1xc1 n THR 109 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1xc1 n ARG 110 N -0.88 0.64 -0.06 -0.78 1.74 -1.26 -4.61 116.66 111.45 1xc1 n ARG 110 Ca 0.05 0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.02 1xc1 n ARG 110 Cb 0.02 -1.67 -0.04 0.00 -1.02 0.00 0.00 32.46 29.74 1xc1 n ARG 110 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1xc1 n LYS 111 N -2.59 0.25 -4.35 5.56 5.02 0.55 -5.06 118.16 117.53 1xc1 n LYS 111 Ca -0.08 0.10 -0.29 0.00 -2.02 0.00 0.00 58.31 56.03 1xc1 n LYS 111 Cb 0.70 -0.96 -0.12 0.00 -0.02 0.00 0.00 35.03 34.64 1xc1 n LYS 111 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1xc1 s LEU 112 N -6.49 2.55 0.24 -0.35 1.43 0.91 -5.06 118.68 111.91 1xc1 s LEU 112 Ca -0.16 -0.68 0.11 0.00 -1.03 0.00 0.00 54.13 52.37 1xc1 s LEU 112 Cb 0.06 -1.38 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 1xc1 s LEU 112 CO 0.21 0.16 -0.21 -0.44 0.23 0.00 0.00 176.35 176.30 1xc1 s SER 113 N -2.27 3.45 0.53 2.29 0.01 -1.26 -3.77 113.70 112.68 1xc1 s SER 113 Ca 0.18 -0.96 0.38 0.00 1.31 0.00 0.00 55.95 56.85 1xc1 s SER 113 Cb -0.10 -0.27 1.56 0.00 0.21 0.00 0.00 66.02 67.42 1xc1 s SER 113 CO 0.09 0.06 1.74 -0.08 0.41 0.00 0.00 173.24 175.46 1xc1 h GLU 114 N 2.65 0.03 0.00 12.44 4.57 -1.98 0.91 114.58 133.21 1xc1 h GLU 114 Ca -0.42 -0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 1xc1 h GLU 114 Cb 1.24 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.82 1xc1 h GLU 114 CO 0.55 0.02 -0.19 -0.22 -1.18 0.00 0.00 179.01 177.99 1xc1 h LYS 115 N 0.03 0.00 -0.00 1.92 3.64 -2.04 -3.20 116.57 116.92 1xc1 h LYS 115 Ca 0.66 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.04 1xc1 h LYS 115 Cb 2.56 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.38 1xc1 h LYS 115 CO -0.05 0.19 -0.64 -0.25 -2.27 0.00 0.00 179.45 176.43 1xc1 n ASP 116 N -3.51 0.70 -4.79 4.20 8.00 0.31 -4.95 116.55 116.51 1xc1 n ASP 116 Ca -0.01 -0.53 -0.36 0.00 0.71 0.00 0.00 54.79 54.61 1xc1 n ASP 116 Cb 0.35 0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.87 1xc1 n ASP 116 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xc1 s LEU 117 N -2.97 4.13 0.53 0.64 2.01 -1.21 -4.96 118.68 116.84 1xc1 s LEU 117 Ca 0.11 1.88 -0.22 0.00 0.01 0.00 0.00 54.13 55.91 1xc1 s LEU 117 Cb 0.17 -4.25 -0.05 0.00 0.01 0.00 0.00 46.19 42.07 1xc1 s LEU 117 CO 0.74 -0.35 1.33 -1.61 1.01 0.00 0.00 176.35 177.47 1xc1 s GLU 118 N -2.58 3.27 0.00 1.70 0.41 -1.26 -4.90 118.70 115.34 1xc1 s GLU 118 Ca 0.57 2.16 0.07 0.00 -0.41 0.00 0.00 54.97 57.36 1xc1 s GLU 118 Cb -0.17 -2.30 0.27 0.00 -1.78 0.00 0.00 34.13 30.15 1xc1 s GLU 118 CO 0.22 -1.06 1.20 1.63 -0.49 0.00 0.00 175.26 176.76 1xc1 n LYS 119 N -0.90 1.32 -3.63 1.61 4.76 -1.26 -4.74 118.16 115.32 1xc1 n LYS 119 Ca 0.10 -0.50 -0.11 0.00 -2.87 0.00 0.00 58.31 54.92 1xc1 n LYS 119 Cb 0.45 -1.15 -0.07 0.00 -1.84 0.00 0.00 35.03 32.43 1xc1 n LYS 119 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1xc1 s SER 120 N -1.10 -0.66 0.39 4.39 0.15 -1.26 -4.93 113.70 110.69 1xc1 s SER 120 Ca 0.13 1.24 0.28 0.00 0.70 0.00 0.00 55.95 58.30 1xc1 s SER 120 Cb 0.07 1.26 1.18 0.00 -1.71 0.00 0.00 66.02 66.81 1xc1 s SER 120 CO 0.09 -0.21 1.84 -0.37 1.20 0.00 0.00 173.24 175.79 1xc1 h VAL 121 N 3.99 0.00 0.00 4.45 -1.51 -1.95 -2.80 116.25 118.42 1xc1 h VAL 121 Ca -0.29 -0.34 -0.03 0.00 -1.23 0.00 0.00 66.70 64.81 1xc1 h VAL 121 Cb 1.17 1.19 -0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1xc1 h VAL 121 CO 0.08 0.00 -0.16 -0.07 -1.23 0.00 0.00 177.57 176.20 1xc1 h LEU 122 N 0.00 0.00 0.00 4.19 3.38 -1.98 -2.97 115.31 117.93 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 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xc1 h LEU 122 CO 0.00 0.16 0.00 0.59 0.09 0.00 0.00 178.44 179.28 1xc1 n ASN 123 N -3.27 0.00 0.01 -0.43 3.02 -1.06 -2.98 115.26 110.54 1xc1 n ASN 123 Ca 0.01 0.48 0.11 0.00 -0.03 0.00 0.00 54.58 55.15 1xc1 n ASN 123 Cb 0.42 -0.49 0.49 0.00 -0.61 0.00 0.00 39.78 39.59 1xc1 n ASN 123 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1xc1 n TYR 124 N -1.49 0.05 -2.48 3.10 4.01 -1.12 -3.93 117.16 115.31 1xc1 n TYR 124 Ca 0.05 0.02 -0.41 0.00 -0.16 0.00 0.00 57.90 57.40 1xc1 n TYR 124 Cb 0.25 -0.53 0.01 0.00 -0.31 0.00 0.00 39.34 38.76 1xc1 n TYR 124 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xc1 n ALA 125 N -1.52 6.04 -2.86 -0.72 0.00 -1.16 -4.66 120.51 115.64 1xc1 n ALA 125 Ca 0.06 -4.46 -0.10 0.00 0.00 0.00 0.00 53.44 48.94 1xc1 n ALA 125 Cb 0.28 -2.49 -0.07 0.00 0.00 0.00 0.00 19.45 17.17 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 -2.53 0.10 0.34 0.00 -4.23 -1.25 -4.75 115.64 103.31 1xc1 s THR 126 Ca 0.42 -0.81 0.11 0.00 -1.18 0.00 0.00 61.69 60.23 1xc1 s THR 126 Cb 0.15 -1.11 0.33 0.00 1.34 0.00 0.00 72.50 73.21 1xc1 s THR 126 CO -0.06 -0.45 1.75 1.55 -0.54 0.00 0.00 174.62 176.88 1xc1 h PRO 127 N 2.88 0.56 -1.84 3.99 0.13 -1.93 -1.06 132.00 134.73 1xc1 h PRO 127 Ca -0.33 -0.03 0.55 0.00 -0.87 0.00 0.00 66.00 65.32 1xc1 h PRO 127 Cb 1.21 -0.13 -0.09 0.00 0.13 0.00 0.00 31.00 32.13 1xc1 h PRO 127 CO 0.49 0.37 1.31 1.17 -0.23 0.00 0.00 178.00 181.11 1xc1 n LYS 128 N -4.78 -0.01 -0.66 0.86 4.81 -1.26 0.19 118.16 117.31 1xc1 n LYS 128 Ca 0.25 1.10 0.01 0.00 -0.87 0.00 0.00 58.31 58.80 1xc1 n LYS 128 Cb 0.73 -2.46 0.23 0.00 0.02 0.00 0.00 35.03 33.55 1xc1 n LYS 128 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1xc1 n TRP 129 N -4.04 1.13 -1.66 5.64 7.02 -0.40 -4.89 117.44 120.23 1xc1 n TRP 129 Ca 0.43 -1.29 -0.46 0.00 -1.02 0.00 0.00 57.50 55.17 1xc1 n TRP 129 Cb 1.91 -0.44 -0.04 0.00 -2.42 0.00 0.00 31.31 30.32 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 -0.86 2.40 -1.39 -0.99 3.00 0.50 -0.98 118.16 119.85 1xc1 n LYS 130 Ca 0.29 0.86 -0.14 0.00 -0.00 0.00 0.00 58.31 59.33 1xc1 n LYS 130 Cb 1.01 -2.82 -0.06 0.00 0.00 0.00 0.00 35.03 33.15 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 7.46 -4.03 -0.01 3.14 3.02 0.67 -4.77 115.26 120.74 1xc1 n ASN 131 Ca 0.23 0.35 0.04 0.00 -0.03 0.00 0.00 54.58 55.17 1xc1 n ASN 131 Cb 0.35 -3.60 -0.08 0.00 -0.61 0.00 0.00 39.78 35.84 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 -1.80 0.60 -5.00 3.52 1.74 -0.15 -4.70 116.66 110.87 1xc1 n ARG 132 Ca -0.14 -0.08 -0.32 0.00 -0.77 0.00 0.00 57.85 56.53 1xc1 n ARG 132 Cb 0.49 -1.25 -0.15 0.00 -1.02 0.00 0.00 32.46 30.52 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 -2.67 2.60 0.08 0.55 1.10 -1.14 -1.68 121.20 120.04 1xc1 s ILE 133 Ca -0.04 -0.84 0.06 0.00 -0.51 0.00 0.00 60.65 59.32 1xc1 s ILE 133 Cb 0.06 -2.04 -0.04 0.00 0.15 0.00 0.00 42.46 40.60 1xc1 s ILE 133 CO 0.44 0.55 -0.10 -0.83 -2.11 0.00 0.00 174.94 172.89 1xc1 s GLY 134 N 0.16 1.78 0.14 1.50 0.00 -0.33 -2.54 107.32 108.03 1xc1 s GLY 134 Ca -0.10 -1.20 -0.07 0.00 0.00 0.00 0.00 44.72 43.35 1xc1 s GLY 134 CO 0.06 -1.15 0.21 -2.52 0.00 0.00 0.00 173.10 169.70 1xc1 s TYR 135 N -1.16 0.49 -0.52 1.90 1.13 -1.04 0.35 117.35 118.50 1xc1 s TYR 135 Ca 0.20 -0.87 0.03 0.00 -1.41 0.00 0.00 57.07 55.02 1xc1 s TYR 135 Cb -0.11 -0.17 0.13 0.00 -1.10 0.00 0.00 41.96 40.71 1xc1 s TYR 135 CO 0.12 -0.64 0.27 0.08 -2.51 0.00 0.00 175.55 172.87 1xc1 s VAL 136 N -3.97 2.77 -1.07 -3.49 1.01 -1.26 -0.57 120.40 113.82 1xc1 s VAL 136 Ca 0.17 -3.13 0.02 0.00 0.00 0.00 0.00 61.98 59.04 1xc1 s VAL 136 Cb 0.05 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.54 1xc1 s VAL 136 CO -0.01 -0.79 1.02 -0.81 0.00 0.00 0.00 175.10 174.51 1xc1 n PRO 137 N 3.33 0.00 -0.01 2.72 -0.04 -1.26 -1.81 135.00 137.93 1xc1 n PRO 137 Ca 0.05 0.44 0.10 0.00 -0.04 0.00 0.00 63.50 64.05 1xc1 n PRO 137 Cb 0.34 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.39 1xc1 n PRO 137 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1xc1 n THR 138 N -1.47 0.03 -2.88 0.52 -2.24 -1.26 -4.92 114.28 102.07 1xc1 n THR 138 Ca 0.00 -0.52 -0.35 0.00 -2.27 0.00 0.00 64.05 60.92 1xc1 n THR 138 Cb 0.02 1.38 -0.06 0.00 -2.10 0.00 0.00 70.33 69.57 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 -1.63 7.14 0.21 3.42 0.15 -0.75 -4.97 113.70 117.26 1xc1 s SER 139 Ca 0.24 1.67 0.03 0.00 0.70 0.00 0.00 55.95 58.59 1xc1 s SER 139 Cb 0.17 -2.52 0.17 0.00 -1.71 0.00 0.00 66.02 62.12 1xc1 s SER 139 CO 0.25 -0.14 1.50 1.23 1.20 0.00 0.00 173.24 177.29 1xc1 h GLY 140 N 2.81 0.29 1.46 9.45 0.00 -1.94 -1.97 103.07 113.17 1xc1 h GLY 140 Ca -0.48 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.37 1xc1 h GLY 140 CO 0.64 0.35 -0.17 0.00 0.00 0.00 0.00 176.54 177.36 1xc1 h ALA 141 N 1.11 1.06 -0.13 3.60 0.00 -1.94 0.35 119.26 123.30 1xc1 h ALA 141 Ca -0.02 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1xc1 h ALA 141 Cb 1.22 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1xc1 h ALA 141 CO 0.11 0.57 -0.27 0.35 0.00 0.00 0.00 179.25 180.01 1xc1 h PHE 142 N 0.57 0.26 -0.13 0.00 3.57 -1.76 -0.34 116.94 119.11 1xc1 h PHE 142 Ca 0.09 -0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.40 1xc1 h PHE 142 Cb 0.61 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.29 1xc1 h PHE 142 CO 0.03 0.49 -0.47 1.25 -2.23 0.00 0.00 178.31 177.38 1xc1 h LEU 143 N 0.21 0.63 -2.27 0.59 5.85 -0.55 -2.73 115.31 117.03 1xc1 h LEU 143 Ca 0.03 -0.62 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 1xc1 h LEU 143 Cb 0.60 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 1xc1 h LEU 143 CO 0.04 1.14 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.91 1xc1 h GLU 144 N 0.16 0.00 -0.02 1.25 4.39 0.05 -1.14 114.58 119.27 1xc1 h GLU 144 Ca -0.02 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.49 1xc1 h GLU 144 Cb 1.10 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.77 1xc1 h GLU 144 CO 0.10 0.04 -0.72 0.37 -1.16 0.00 0.00 179.01 177.65 1xc1 h GLN 145 N 0.00 0.52 -0.54 2.33 5.75 -0.82 -2.80 115.11 119.55 1xc1 h GLN 145 Ca -0.00 -0.53 -0.06 0.00 -0.15 0.00 0.00 58.65 57.91 1xc1 h GLN 145 Cb 0.20 0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 1xc1 h GLN 145 CO 0.01 1.17 0.10 0.82 -2.65 0.00 0.00 178.83 178.27 1xc1 h ILE 146 N 0.09 1.23 -0.77 2.39 2.04 -1.04 -2.36 117.51 119.09 1xc1 h ILE 146 Ca -0.08 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1xc1 h ILE 146 Cb 1.40 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 1xc1 h ILE 146 CO 0.14 0.32 0.39 0.58 0.00 0.00 0.00 178.15 179.58 1xc1 h VAL 147 N 0.80 1.24 0.00 1.67 2.07 -1.24 -1.08 116.25 119.71 1xc1 h VAL 147 Ca 0.17 -0.64 -0.16 0.00 0.82 0.00 0.00 66.70 66.89 1xc1 h VAL 147 Cb 0.34 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1xc1 h VAL 147 CO 0.00 0.28 -0.75 0.00 0.02 0.00 0.00 177.57 177.12 1xc1 h ALA 148 N 1.34 0.75 -0.17 1.67 0.00 -1.22 -1.68 119.26 119.95 1xc1 h ALA 148 Ca 0.27 -0.68 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 1xc1 h ALA 148 Cb 0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1xc1 h ALA 148 CO -0.04 0.94 -0.60 0.82 0.00 0.00 0.00 179.25 180.37 1xc1 h ILE 149 N 0.00 1.33 -0.27 0.00 2.04 -1.02 0.29 117.51 119.88 1xc1 h ILE 149 Ca -0.01 -1.87 -0.07 0.00 1.00 0.00 0.00 64.86 63.91 1xc1 h ILE 149 Cb 1.34 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 1xc1 h ILE 149 CO 0.10 0.58 -0.10 0.58 0.00 0.00 0.00 178.15 179.31 1xc1 h VAL 150 N 0.42 1.29 -0.08 1.67 2.07 -1.10 1.15 116.25 121.67 1xc1 h VAL 150 Ca -0.00 -1.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1xc1 h VAL 150 Cb 1.16 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1xc1 h VAL 150 CO 0.11 0.37 -0.07 0.11 0.02 0.00 0.00 177.57 178.11 1xc1 h LYS 151 N 0.29 0.19 -0.12 1.57 1.57 -1.23 0.13 116.57 118.98 1xc1 h LYS 151 Ca 0.06 -0.09 -0.20 0.00 -1.87 0.00 0.00 60.65 58.55 1xc1 h LYS 151 Cb 0.60 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.92 1xc1 h LYS 151 CO 0.03 0.60 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.75 1xc1 h LEU 152 N -0.22 0.83 0.00 2.94 3.38 -0.45 -3.40 115.31 118.40 1xc1 h LEU 152 Ca 0.02 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1xc1 h LEU 152 Cb 0.56 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1xc1 h LEU 152 CO 0.02 1.34 -1.39 0.29 0.09 0.00 0.00 178.44 178.79 1xc1 n LYS 153 N -4.04 0.56 0.00 1.13 4.76 0.39 -5.05 118.16 115.91 1xc1 n LYS 153 Ca -0.08 -0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1xc1 n LYS 153 Cb 0.70 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.67 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 1.88 2.20 0.26 0.72 0.00 0.47 -4.56 105.19 106.16 1xc1 n GLY 154 Ca -0.02 -1.82 0.04 0.00 0.00 0.00 0.00 46.02 44.23 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 0.23 0.09 1.61 4.22 -1.86 -2.99 114.58 115.88 1xc1 h GLU 155 Ca 0.00 -0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.44 1xc1 h GLU 155 Cb 0.00 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 1xc1 h GLU 155 CO 0.00 0.15 -0.42 0.00 -2.18 0.00 0.00 179.01 176.56 1xc1 h ALA 156 N 1.60 -0.91 -0.83 2.92 0.00 -1.96 -1.62 119.26 118.46 1xc1 h ALA 156 Ca 0.39 -0.09 0.20 0.00 0.00 0.00 0.00 54.91 55.41 1xc1 h ALA 156 Cb 0.66 0.81 -0.15 0.00 0.00 0.00 0.00 17.79 19.12 1xc1 h ALA 156 CO -0.51 -1.01 -0.00 0.00 0.00 0.00 0.00 179.25 177.72 1xc1 h ALA 157 N -0.75 0.87 -0.88 0.00 0.00 -1.77 0.10 119.26 116.84 1xc1 h ALA 157 Ca -0.00 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1xc1 h ALA 157 Cb 0.60 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 1xc1 h ALA 157 CO -0.23 -0.45 0.57 0.00 0.00 0.00 0.00 179.25 179.14 1xc1 h ALA 158 N 1.79 1.11 -0.09 0.00 0.00 -1.34 -0.81 119.26 119.92 1xc1 h ALA 158 Ca 0.46 -0.07 -0.22 0.00 0.00 0.00 0.00 54.91 55.09 1xc1 h ALA 158 Cb 0.84 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.29 1xc1 h ALA 158 CO -0.75 0.53 -0.81 1.25 0.00 0.00 0.00 179.25 179.46 1xc1 h LEU 159 N 1.19 0.75 -1.92 0.00 5.85 -0.08 -0.95 115.31 120.15 1xc1 h LEU 159 Ca 0.32 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1xc1 h LEU 159 Cb -0.12 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.68 1xc1 h LEU 159 CO -0.07 1.30 -0.09 0.50 -0.34 0.00 0.00 178.44 179.75 1xc1 h LYS 160 N 0.41 0.00 0.04 1.25 3.64 -0.61 0.14 116.57 121.44 1xc1 h LYS 160 Ca -0.06 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.20 1xc1 h LYS 160 Cb 1.43 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 1xc1 h LYS 160 CO 0.16 0.09 -0.63 2.35 -2.27 0.00 0.00 179.45 179.14 1xc1 h TRP 161 N 0.00 0.14 -0.02 1.91 7.01 -0.90 -3.12 115.95 120.97 1xc1 h TRP 161 Ca -0.00 -0.10 -0.12 0.00 2.11 0.00 0.00 58.89 60.78 1xc1 h TRP 161 Cb 0.35 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.39 1xc1 h TRP 161 CO 0.00 1.25 -0.53 -0.07 -2.79 0.00 0.00 178.44 176.30 1xc1 h LEU 162 N -0.81 0.06 -0.26 0.65 3.38 -0.94 -1.42 115.31 115.98 1xc1 h LEU 162 Ca -0.15 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.66 1xc1 h LEU 162 Cb 1.28 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 1xc1 h LEU 162 CO -0.02 0.58 -0.35 0.11 0.09 0.00 0.00 178.44 178.85 1xc1 h LYS 163 N 0.04 0.70 -0.06 1.13 1.57 -0.88 -2.43 116.57 116.64 1xc1 h LYS 163 Ca -0.00 -0.40 -0.08 0.00 -1.87 0.00 0.00 60.65 58.29 1xc1 h LYS 163 Cb 0.95 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1xc1 h LYS 163 CO 0.07 1.02 -0.34 0.78 -0.57 0.00 0.00 179.45 180.41 1xc1 h GLY 164 N 0.42 0.13 1.44 3.86 0.00 -1.44 -2.39 103.07 105.08 1xc1 h GLY 164 Ca 0.03 -0.10 -0.22 0.00 0.00 0.00 0.00 47.33 47.04 1xc1 h GLY 164 CO 0.08 0.09 -0.88 1.41 0.00 0.00 0.00 176.54 177.25 1xc1 h LEU 165 N 0.10 0.65 -1.32 3.11 3.38 -1.23 -3.03 115.31 116.98 1xc1 h LEU 165 Ca 0.01 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1xc1 h LEU 165 Cb 0.65 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1xc1 h LEU 165 CO 0.05 1.27 -0.04 0.50 0.09 0.00 0.00 178.44 180.31 1xc1 h LYS 166 N 0.32 0.00 0.08 1.13 1.63 -1.24 0.20 116.57 118.69 1xc1 h LYS 166 Ca -0.07 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.57 1xc1 h LYS 166 Cb 1.50 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.13 1xc1 h LYS 166 CO 0.16 0.04 -0.78 1.49 -3.45 0.00 0.00 179.45 176.91 1xc1 h GLU 167 N 0.00 0.17 0.00 1.90 4.57 -1.37 -3.40 114.58 116.45 1xc1 h GLU 167 Ca -0.00 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 57.89 1xc1 h GLU 167 Cb 0.58 0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1xc1 h GLU 167 CO 0.01 1.14 -0.19 2.48 -1.18 0.00 0.00 179.01 181.27 1xc1 n TYR 168 N -4.24 0.00 -3.61 0.92 0.18 -1.15 -5.00 117.16 104.25 1xc1 n TYR 168 Ca -0.18 -0.66 -0.21 0.00 1.88 0.00 0.00 57.90 58.74 1xc1 n TYR 168 Cb 0.73 -0.12 -0.03 0.00 -0.38 0.00 0.00 39.34 39.54 1xc1 n TYR 168 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1xc1 s GLY 169 N -2.23 2.04 -0.17 -7.48 0.00 0.69 -0.24 107.32 99.93 1xc1 s GLY 169 Ca 0.21 -1.82 -0.00 0.00 0.00 0.00 0.00 44.72 43.11 1xc1 s GLY 169 CO 0.02 -1.66 -0.07 1.25 0.00 0.00 0.00 173.10 172.63 1xc1 s LYS 170 N -4.10 1.65 0.66 2.90 2.20 -1.05 -4.79 119.74 117.21 1xc1 s LYS 170 Ca 0.46 -0.58 -0.14 0.00 -0.36 0.00 0.00 55.97 55.36 1xc1 s LYS 170 Cb -0.04 -2.08 -0.00 0.00 -1.51 0.00 0.00 37.83 34.20 1xc1 s LYS 170 CO 0.28 -0.40 1.08 -2.14 -0.36 0.00 0.00 175.35 173.81 1xc1 s PRO 171 N 1.57 2.89 0.04 4.03 0.02 -1.26 -2.49 135.00 139.81 1xc1 s PRO 171 Ca 0.01 1.24 0.01 0.00 0.02 0.00 0.00 61.00 62.28 1xc1 s PRO 171 Cb -0.15 -1.97 -0.03 0.00 0.02 0.00 0.00 34.50 32.37 1xc1 s PRO 171 CO -0.08 -1.16 -0.06 0.71 -0.33 0.00 0.00 177.00 176.08 1xc1 s TYR 172 N -2.56 0.59 0.02 6.54 2.02 0.26 -4.86 117.35 119.36 1xc1 s TYR 172 Ca 0.64 -0.60 -0.26 0.00 -0.37 0.00 0.00 57.07 56.48 1xc1 s TYR 172 Cb -0.18 -0.36 -0.16 0.00 -0.40 0.00 0.00 41.96 40.85 1xc1 s TYR 172 CO 0.44 -0.14 1.28 0.00 -1.57 0.00 0.00 175.55 175.56 1xc1 h ALA 173 N 4.25 -0.51 -1.65 3.71 0.00 -1.97 -3.40 119.26 119.70 1xc1 h ALA 173 Ca -0.35 -0.18 -0.56 0.00 0.00 0.00 0.00 54.91 53.82 1xc1 h ALA 173 Cb 1.20 0.20 -0.13 0.00 0.00 0.00 0.00 17.79 19.05 1xc1 h ALA 173 CO 0.45 -0.64 -0.58 0.15 0.00 0.00 0.00 179.25 178.63 1xc1 s LYS 174 N -4.86 1.85 0.03 0.00 1.02 -1.26 -4.83 119.74 111.69 1xc1 s LYS 174 Ca -0.14 -2.07 -0.20 0.00 0.02 0.00 0.00 55.97 53.57 1xc1 s LYS 174 Cb 0.02 -1.16 -0.16 0.00 -0.52 0.00 0.00 37.83 36.02 1xc1 s LYS 174 CO 0.54 -0.21 1.29 -0.91 -0.92 0.00 0.00 175.35 175.15 1xc1 h ASN 175 N 1.87 0.42 -0.38 2.83 -0.26 -1.96 -2.61 115.58 115.49 1xc1 h ASN 175 Ca -0.41 -0.54 0.07 0.00 -0.56 0.00 0.00 56.30 54.85 1xc1 h ASN 175 Cb 1.26 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 38.38 1xc1 h ASN 175 CO 0.72 0.88 0.26 0.77 -1.06 0.00 0.00 177.43 179.00 1xc1 h SER 176 N -0.03 0.18 -0.09 5.81 4.64 -1.99 0.14 113.55 122.22 1xc1 h SER 176 Ca 0.01 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.23 1xc1 h SER 176 Cb 0.80 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1xc1 h SER 176 CO 0.05 0.12 -0.32 0.58 -0.87 0.00 0.00 176.83 176.39 1xc1 h VAL 177 N 0.21 1.40 -0.81 0.95 2.07 -1.95 -2.65 116.25 115.48 1xc1 h VAL 177 Ca 0.17 -1.68 -0.03 0.00 0.82 0.00 0.00 66.70 65.98 1xc1 h VAL 177 Cb 0.41 2.23 -0.04 0.00 -1.52 0.00 0.00 31.29 32.38 1xc1 h VAL 177 CO -0.03 0.49 0.41 0.00 0.02 0.00 0.00 177.57 178.46 1xc1 h ALA 178 N 0.46 1.19 -0.70 1.67 0.00 -0.94 -1.27 119.26 119.68 1xc1 h ALA 178 Ca -0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1xc1 h ALA 178 Cb 0.96 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1xc1 h ALA 178 CO 0.07 0.63 0.43 1.25 0.00 0.00 0.00 179.25 181.63 1xc1 h LEU 179 N 1.14 0.83 -0.67 0.00 5.85 -0.74 -2.32 115.31 119.41 1xc1 h LEU 179 Ca 0.28 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.86 1xc1 h LEU 179 Cb 0.09 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1xc1 h LEU 179 CO -0.04 0.64 -0.43 1.56 -0.34 0.00 0.00 178.44 179.83 1xc1 h GLN 180 N 0.95 0.00 -0.59 1.25 1.08 -1.08 -1.67 115.11 115.05 1xc1 h GLN 180 Ca 0.25 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.37 1xc1 h GLN 180 Cb -0.05 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1xc1 h GLN 180 CO -0.05 0.43 0.06 0.00 -0.95 0.00 0.00 178.83 178.32 1xc1 h ALA 181 N 1.57 0.79 -0.06 3.87 0.00 -0.72 -0.80 119.26 123.90 1xc1 h ALA 181 Ca -0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 1xc1 h ALA 181 Cb 1.05 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1xc1 h ALA 181 CO 0.06 0.58 -0.54 0.28 0.00 0.00 0.00 179.25 179.62 1xc1 h VAL 182 N 0.90 1.39 -0.12 0.00 2.07 -1.33 0.11 116.25 119.27 1xc1 h VAL 182 Ca 0.18 -1.92 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 1xc1 h VAL 182 Cb 0.48 2.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1xc1 h VAL 182 CO 0.02 0.57 0.07 -0.08 0.02 0.00 0.00 177.57 178.17 1xc1 h GLU 183 N 0.03 0.16 0.00 1.57 4.57 -1.24 -2.46 114.58 117.21 1xc1 h GLU 183 Ca -0.05 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1xc1 h GLU 183 Cb 1.21 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 1xc1 h GLU 183 CO 0.11 0.12 -0.67 0.09 -1.18 0.00 0.00 179.01 177.47 1xc1 n ASN 184 N -4.51 0.61 0.00 1.04 5.03 -0.31 -4.74 115.26 112.38 1xc1 n ASN 184 Ca -0.01 -0.33 0.00 0.00 0.87 0.00 0.00 54.58 55.11 1xc1 n ASN 184 Cb 0.09 0.45 0.00 0.00 -1.02 0.00 0.00 39.78 39.29 1xc1 n ASN 184 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xc1 n GLY 185 N 1.47 1.55 0.46 7.41 0.00 -0.93 -4.97 105.19 110.17 1xc1 n GLY 185 Ca 0.05 0.00 0.30 0.00 0.00 0.00 0.00 46.02 46.36 1xc1 n GLY 185 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xc1 h GLU 186 N 2.42 0.22 -2.57 1.61 4.81 -1.04 -3.42 114.58 116.61 1xc1 h GLU 186 Ca 0.00 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 1xc1 h GLU 186 Cb 0.00 -0.05 -0.21 0.00 0.63 0.00 0.00 28.75 29.12 1xc1 h GLU 186 CO 0.00 0.14 -0.09 -1.50 -0.73 0.00 0.00 179.01 176.83 1xc1 s ILE 187 N -5.32 0.02 0.17 2.32 2.07 -1.17 -5.00 121.20 114.30 1xc1 s ILE 187 Ca -0.08 -0.18 -0.14 0.00 -1.41 0.00 0.00 60.65 58.84 1xc1 s ILE 187 Cb 0.26 -0.75 0.06 0.00 0.13 0.00 0.00 42.46 42.16 1xc1 s ILE 187 CO 0.81 -0.10 1.75 0.44 -1.91 0.00 0.00 174.94 175.93 1xc1 h ASP 188 N 4.11 0.14 -5.46 4.50 5.19 -1.80 -3.37 116.42 119.74 1xc1 h ASP 188 Ca -0.28 0.05 -0.20 0.00 -0.62 0.00 0.00 57.03 55.98 1xc1 h ASP 188 Cb 1.17 0.04 -0.10 0.00 0.18 0.00 0.00 39.33 40.62 1xc1 h ASP 188 CO 0.33 0.11 -0.26 0.00 -3.12 0.00 0.00 179.24 176.30 1xc1 s ALA 189 N -6.15 0.55 -0.02 3.45 0.00 -0.68 -0.47 121.76 118.44 1xc1 s ALA 189 Ca -0.13 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.18 1xc1 s ALA 189 Cb 0.13 1.18 0.07 0.00 0.00 0.00 0.00 23.12 24.51 1xc1 s ALA 189 CO 0.72 -0.77 0.65 0.00 0.00 0.00 0.00 175.76 176.37 1xc1 s ALA 190 N -3.60 -1.71 -0.26 0.00 0.00 -0.42 -1.18 121.76 114.59 1xc1 s ALA 190 Ca 0.30 1.17 -0.15 0.00 0.00 0.00 0.00 51.96 53.28 1xc1 s ALA 190 Cb 0.01 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1xc1 s ALA 190 CO 0.15 -0.42 0.35 -0.51 0.00 0.00 0.00 175.76 175.34 1xc1 s LEU 191 N -1.40 4.06 0.00 0.00 1.43 0.16 -1.61 118.68 121.31 1xc1 s LEU 191 Ca -0.09 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 1xc1 s LEU 191 Cb -0.00 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1xc1 s LEU 191 CO 0.07 -0.15 0.00 2.30 0.23 0.00 0.00 176.35 178.80 1xc1 n ILE 192 N 4.97 0.00 -3.91 -0.59 -5.35 -0.88 -4.47 119.36 109.13 1xc1 n ILE 192 Ca -0.09 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.05 1xc1 n ILE 192 Cb 0.51 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.36 1xc1 n ILE 192 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1xc1 s ASN 193 N -0.94 6.34 0.16 7.28 0.01 -1.26 -0.67 114.94 125.85 1xc1 s ASN 193 Ca 0.00 0.37 -0.21 0.00 -0.71 0.00 0.00 52.86 52.30 1xc1 s ASN 193 Cb 0.00 -2.00 0.05 0.00 0.41 0.00 0.00 41.25 39.71 1xc1 s ASN 193 CO 0.00 0.30 1.63 -0.55 -1.51 0.00 0.00 177.10 176.97 1xc1 h ASN 194 N 4.11 -0.73 -0.49 -1.22 -1.07 -1.57 -2.97 115.58 111.64 1xc1 h ASN 194 Ca -0.50 0.14 0.14 0.00 0.07 0.00 0.00 56.30 56.15 1xc1 h ASN 194 Cb 1.20 0.36 -0.02 0.00 -2.07 0.00 0.00 38.32 37.79 1xc1 h ASN 194 CO 0.66 -0.26 0.48 0.10 0.07 0.00 0.00 177.43 178.49 1xc1 h TYR 195 N -0.20 0.00 0.05 4.14 -0.00 -1.87 -1.58 116.97 117.51 1xc1 h TYR 195 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.89 1xc1 h TYR 195 Cb 0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.17 1xc1 h TYR 195 CO -0.40 0.00 -0.04 1.88 -0.00 0.00 0.00 178.16 179.59 1xc1 h TYR 196 N 0.00 -0.11 -0.12 0.10 -1.99 -1.93 -2.37 116.97 110.54 1xc1 h TYR 196 Ca 0.23 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.94 1xc1 h TYR 196 Cb 1.20 0.04 -0.00 0.00 2.00 0.00 0.00 36.73 39.97 1xc1 h TYR 196 CO 0.00 -0.07 -0.01 2.35 -0.00 0.00 0.00 178.16 180.43 1xc1 h TRP 197 N -0.10 0.25 -0.61 4.88 7.01 -1.47 -2.87 115.95 123.05 1xc1 h TRP 197 Ca 0.00 -0.05 0.16 0.00 2.11 0.00 0.00 58.89 61.12 1xc1 h TRP 197 Cb 0.10 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.07 1xc1 h TRP 197 CO -0.09 0.49 0.43 0.45 -2.79 0.00 0.00 178.44 176.93 1xc1 h HIS 198 N -0.06 0.08 0.15 2.65 3.86 -1.41 -1.35 115.15 119.07 1xc1 h HIS 198 Ca 0.03 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.01 1xc1 h HIS 198 Cb 0.40 -0.02 0.03 0.00 1.06 0.00 0.00 27.41 28.87 1xc1 h HIS 198 CO 0.04 0.03 -1.01 0.00 0.86 0.00 0.00 177.93 177.85 1xc1 h ALA 199 N 1.70 -0.09 0.14 2.45 0.00 -1.40 -3.01 119.26 119.06 1xc1 h ALA 199 Ca 0.29 -0.73 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1xc1 h ALA 199 Cb 1.06 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1xc1 h ALA 199 CO -0.02 0.49 -0.24 0.35 0.00 0.00 0.00 179.25 179.83 1xc1 h PHE 200 N -0.14 -0.63 -0.47 0.00 3.57 -1.08 -2.37 116.94 115.81 1xc1 h PHE 200 Ca -0.17 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.33 1xc1 h PHE 200 Cb 1.77 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 40.75 1xc1 h PHE 200 CO 0.17 -0.34 0.26 0.00 -2.23 0.00 0.00 178.31 176.17 1xc1 h ALA 201 N 0.30 0.60 -0.68 2.41 0.00 -1.42 0.35 119.26 120.83 1xc1 h ALA 201 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1xc1 h ALA 201 Cb 0.46 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1xc1 h ALA 201 CO -0.12 0.12 0.45 -0.09 0.00 0.00 0.00 179.25 179.62 1xc1 h ARG 202 N 0.62 0.88 0.00 0.00 2.43 -1.44 0.72 114.38 117.59 1xc1 h ARG 202 Ca 0.17 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1xc1 h ARG 202 Cb 0.05 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1xc1 h ARG 202 CO -0.03 0.58 -0.11 1.49 -1.51 0.00 0.00 179.97 180.39 1xc1 h GLU 203 N 0.91 0.07 0.00 0.20 4.81 -1.14 -3.35 114.58 116.08 1xc1 h GLU 203 Ca 0.25 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1xc1 h GLU 203 Cb -0.09 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1xc1 h GLU 203 CO -0.06 0.88 -0.24 0.87 -0.73 0.00 0.00 179.01 179.73 1xc1 h LYS 204 N -0.70 0.00 -0.95 1.92 1.79 -0.80 -3.49 116.57 114.35 1xc1 h LYS 204 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1xc1 h LYS 204 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 1xc1 h LYS 204 CO 0.02 0.24 0.00 0.41 -1.08 0.00 0.00 179.45 179.05 1xc1 n GLY 205 N 0.74 -0.94 0.32 3.86 0.00 0.24 -4.58 105.19 104.83 1xc1 n GLY 205 Ca 0.02 -0.63 0.06 0.00 0.00 0.00 0.00 46.02 45.47 1xc1 n GLY 205 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1xc1 n VAL 206 N 0.28 0.00 0.50 1.61 3.14 -0.64 0.24 118.33 123.46 1xc1 n VAL 206 Ca 0.00 0.88 0.13 0.00 -2.96 0.00 0.00 64.34 62.39 1xc1 n VAL 206 Cb 0.00 -1.70 0.36 0.00 -1.06 0.00 0.00 33.84 31.44 1xc1 n VAL 206 CO 0.00 0.00 0.00 1.56 -6.46 0.00 0.00 176.83 171.93 1xc1 h GLN 207 N 0.00 0.00 -0.69 1.45 1.08 -1.89 -3.19 115.11 111.87 1xc1 h GLN 207 Ca 0.11 0.00 -0.37 0.00 -1.45 0.00 0.00 58.65 56.93 1xc1 h GLN 207 Cb 1.85 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 29.06 1xc1 h GLN 207 CO -0.00 0.00 0.27 0.09 -0.95 0.00 0.00 178.83 178.24 1xc1 n ASN 208 N -2.49 3.45 -4.02 1.46 5.03 0.67 -4.94 115.26 114.41 1xc1 n ASN 208 Ca 0.05 -3.72 -0.21 0.00 0.87 0.00 0.00 54.58 51.57 1xc1 n ASN 208 Cb 0.44 -0.74 -0.16 0.00 -1.02 0.00 0.00 39.78 38.30 1xc1 n ASN 208 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1xc1 s VAL 209 N -3.43 0.90 -1.01 2.41 1.01 -1.21 -4.92 120.40 114.14 1xc1 s VAL 209 Ca 0.52 -0.42 0.23 0.00 0.00 0.00 0.00 61.98 62.31 1xc1 s VAL 209 Cb 0.45 -0.79 -0.10 0.00 0.00 0.00 0.00 36.38 35.93 1xc1 s VAL 209 CO 0.04 0.28 1.17 1.41 0.00 0.00 0.00 175.10 178.00 1xc1 n HIS 210 N 3.29 0.00 -4.04 5.22 8.25 -1.26 -4.93 115.22 121.75 1xc1 n HIS 210 Ca -0.18 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 56.94 1xc1 n HIS 210 Cb 0.54 -0.13 -0.07 0.00 1.12 0.00 0.00 29.99 31.45 1xc1 n HIS 210 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1xc1 s THR 211 N -2.99 5.01 0.36 1.59 -4.23 -1.26 -0.62 115.64 113.49 1xc1 s THR 211 Ca 0.10 -0.21 0.04 0.00 -1.18 0.00 0.00 61.69 60.44 1xc1 s THR 211 Cb 0.17 -3.26 -0.06 0.00 1.34 0.00 0.00 72.50 70.69 1xc1 s THR 211 CO 0.78 0.42 0.05 -0.13 -0.54 0.00 0.00 174.62 175.20 1xc1 s ARG 212 N -1.56 1.77 -0.02 3.99 1.81 -0.48 -4.93 118.95 119.54 1xc1 s ARG 212 Ca 0.21 -2.01 0.01 0.00 -1.72 0.00 0.00 55.73 52.22 1xc1 s ARG 212 Cb -0.12 -1.04 -0.04 0.00 -0.45 0.00 0.00 34.95 33.30 1xc1 s ARG 212 CO 0.12 -0.20 0.02 -0.51 -0.68 0.00 0.00 175.30 174.05 1xc1 s LEU 213 N -3.57 3.59 -0.06 2.53 1.43 -1.26 -1.37 118.68 119.98 1xc1 s LEU 213 Ca 0.33 0.04 0.06 0.00 -1.03 0.00 0.00 54.13 53.54 1xc1 s LEU 213 Cb 0.08 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 1xc1 s LEU 213 CO 0.15 0.29 -0.24 0.21 0.23 0.00 0.00 176.35 176.99 1xc1 s ASN 214 N -1.48 2.99 -0.21 2.29 3.84 0.87 -4.98 114.94 118.26 1xc1 s ASN 214 Ca 0.19 -0.50 -0.01 0.00 0.21 0.00 0.00 52.86 52.75 1xc1 s ASN 214 Cb -0.12 -0.83 0.02 0.00 -0.55 0.00 0.00 41.25 39.77 1xc1 s ASN 214 CO 0.10 0.23 -0.12 -0.36 -2.79 0.00 0.00 177.10 174.16 1xc1 s PHE 215 N -0.13 2.93 0.28 0.43 0.40 -1.26 -2.36 117.98 118.27 1xc1 s PHE 215 Ca -0.04 -1.50 0.04 0.00 -0.60 0.00 0.00 56.93 54.83 1xc1 s PHE 215 Cb -0.14 -2.00 0.41 0.00 0.51 0.00 0.00 43.02 41.80 1xc1 s PHE 215 CO 0.04 -0.73 1.69 -0.24 0.70 0.00 0.00 175.22 176.67 1xc1 h VAL 216 N 5.99 1.29 -0.54 -0.44 3.04 -1.89 -3.49 116.25 120.22 1xc1 h VAL 216 Ca -0.40 -1.46 0.00 0.00 -1.01 0.00 0.00 66.70 63.84 1xc1 h VAL 216 Cb 1.13 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 31.99 1xc1 h VAL 216 CO 0.60 0.44 0.00 0.54 -1.01 0.00 0.00 177.57 178.15 1xc1 n ARG 217 N -4.05 0.00 -2.15 4.17 1.74 -1.26 -4.87 116.66 110.24 1xc1 n ARG 217 Ca -0.01 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.91 1xc1 n ARG 217 Cb 0.46 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.88 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 -0.96 -1.69 -1.55 8.25 -1.25 -1.41 115.22 116.61 1xc1 n HIS 218 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.29 1xc1 n HIS 218 Cb 0.00 -3.15 -0.06 0.00 1.12 0.00 0.00 29.99 27.90 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 -2.65 -1.25 -2.27 -0.41 5.12 0.04 -4.97 116.66 110.27 1xc1 n ARG 219 Ca -0.18 1.05 -0.36 0.00 -1.93 0.00 0.00 57.85 56.43 1xc1 n ARG 219 Cb 0.61 -5.34 -0.01 0.00 -1.16 0.00 0.00 32.46 26.56 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 -2.68 5.98 0.56 0.55 2.15 -0.50 -4.32 116.67 118.41 1xc1 s ASP 220 Ca 0.00 2.24 0.28 0.00 0.43 0.00 0.00 52.55 55.50 1xc1 s ASP 220 Cb 0.00 -2.59 1.47 0.00 -0.30 0.00 0.00 42.92 41.50 1xc1 s ASP 220 CO 0.00 -1.04 1.96 -0.65 -0.17 0.00 0.00 175.17 175.26 1xc1 h PRO 221 N 1.67 0.00 -0.00 4.34 0.11 -1.93 0.17 132.00 136.35 1xc1 h PRO 221 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xc1 h PRO 221 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xc1 h PRO 221 CO 0.59 0.00 -0.01 0.41 -0.21 0.00 0.00 178.00 178.78 1xc1 n GLY 222 N -1.58 -0.97 1.16 -0.55 0.00 -1.26 -2.97 105.19 99.02 1xc1 n GLY 222 Ca 0.10 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.96 2.41 -1.57 4.61 0.00 0.59 -4.54 120.51 121.05 1xc1 n ALA 223 Ca 0.21 -1.07 -0.50 0.00 0.00 0.00 0.00 53.44 52.08 1xc1 n ALA 223 Cb 0.17 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 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 1.39 1.44 -4.10 0.00 7.94 -1.16 -4.34 117.00 118.17 1xc1 n LEU 224 Ca 0.21 1.14 -0.26 0.00 -1.11 0.00 0.00 56.01 55.99 1xc1 n LEU 224 Cb 0.56 -1.20 -0.16 0.00 0.53 0.00 0.00 43.42 43.15 1xc1 n LEU 224 CO 0.15 -1.32 -0.50 -0.69 -1.11 0.00 0.00 177.39 173.93 1xc1 s VAL 225 N -0.11 1.39 -0.12 1.96 1.01 -1.26 -1.52 120.40 121.75 1xc1 s VAL 225 Ca 0.75 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 1xc1 s VAL 225 Cb -0.88 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1xc1 s VAL 225 CO 0.52 0.41 0.00 -0.89 0.00 0.00 0.00 175.10 175.13 1xc1 s THR 226 N 0.29 4.27 0.11 3.92 2.01 -0.05 -4.90 115.64 121.29 1xc1 s THR 226 Ca -0.09 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 61.67 1xc1 s THR 226 Cb -0.14 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 1xc1 s THR 226 CO 0.03 0.55 0.26 -0.31 -0.69 0.00 0.00 174.62 174.46 1xc1 s TYR 227 N -0.32 3.50 0.23 4.92 1.51 -1.26 -0.43 117.35 125.50 1xc1 s TYR 227 Ca 0.07 0.20 0.08 0.00 -1.01 0.00 0.00 57.07 56.41 1xc1 s TYR 227 Cb -0.12 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1xc1 s TYR 227 CO 0.02 0.54 0.06 -1.12 -1.11 0.00 0.00 175.55 173.94 1xc1 s SER 228 N -2.86 4.93 0.26 2.29 0.01 0.31 -3.94 113.70 114.70 1xc1 s SER 228 Ca 0.35 -0.44 -0.21 0.00 1.31 0.00 0.00 55.95 56.95 1xc1 s SER 228 Cb -0.12 -1.08 0.03 0.00 0.21 0.00 0.00 66.02 65.06 1xc1 s SER 228 CO 0.28 0.02 0.75 -0.83 0.41 0.00 0.00 173.24 173.87 1xc1 s GLY 229 N -3.49 -0.10 0.11 3.44 0.00 -0.21 0.87 107.32 107.94 1xc1 s GLY 229 Ca 0.31 -0.26 0.05 0.00 0.00 0.00 0.00 44.72 44.81 1xc1 s GLY 229 CO 0.21 -0.08 -0.11 0.00 0.00 0.00 0.00 173.10 173.12 1xc1 s ALA 230 N -3.81 1.30 0.05 3.20 0.00 0.13 -0.52 121.76 122.12 1xc1 s ALA 230 Ca 0.11 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.64 1xc1 s ALA 230 Cb -0.05 -0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.09 1xc1 s ALA 230 CO 0.06 -0.00 0.34 0.00 0.00 0.00 0.00 175.76 176.16 1xc1 s ALA 231 N -2.51 -0.78 -0.18 0.00 0.00 -0.43 -1.16 121.76 116.70 1xc1 s ALA 231 Ca 0.09 0.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.09 1xc1 s ALA 231 Cb -0.03 0.37 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 1xc1 s ALA 231 CO 0.01 -0.45 -0.06 0.08 0.00 0.00 0.00 175.76 175.35 1xc1 s VAL 232 N -2.69 3.53 0.56 0.00 1.01 -1.26 0.22 120.40 121.77 1xc1 s VAL 232 Ca -0.04 -0.47 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 1xc1 s VAL 232 Cb -0.00 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 1xc1 s VAL 232 CO -0.04 0.47 1.22 -0.76 0.00 0.00 0.00 175.10 175.98 1xc1 s LEU 233 N 0.81 3.77 0.31 3.92 1.02 -0.81 0.98 118.68 128.68 1xc1 s LEU 233 Ca -0.02 2.42 0.03 0.00 0.02 0.00 0.00 54.13 56.58 1xc1 s LEU 233 Cb -0.15 -4.48 0.53 0.00 0.02 0.00 0.00 46.19 42.11 1xc1 s LEU 233 CO 0.02 -1.43 1.82 0.11 0.02 0.00 0.00 176.35 176.89 1xc1 h LYS 234 N 1.23 0.53 -0.07 1.70 1.79 -1.56 -2.65 116.57 117.54 1xc1 h LYS 234 Ca -0.50 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 57.83 1xc1 h LYS 234 Cb 1.29 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1xc1 h LYS 234 CO 0.57 0.61 0.00 -1.13 -1.08 0.00 0.00 179.45 178.42 1xc1 n SER 235 N -4.23 0.38 -4.73 0.86 3.41 -1.26 -4.91 113.62 103.15 1xc1 n SER 235 Ca 0.01 -1.94 -0.42 0.00 -0.26 0.00 0.00 58.87 56.26 1xc1 n SER 235 Cb 0.29 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.07 6.65 0.00 4.04 0.15 -1.00 -4.86 113.70 117.61 1xc1 s SER 236 Ca 0.08 2.59 0.25 0.00 0.70 0.00 0.00 55.95 59.57 1xc1 s SER 236 Cb 0.04 -2.60 0.54 0.00 -1.71 0.00 0.00 66.02 62.28 1xc1 s SER 236 CO 0.06 -0.76 1.44 0.00 1.20 0.00 0.00 173.24 175.18 1xc1 n GLN 237 N 3.42 1.60 -3.25 5.44 1.13 -1.26 -4.20 117.38 120.26 1xc1 n GLN 237 Ca 0.11 -1.15 -0.25 0.00 -1.94 0.00 0.00 57.00 53.77 1xc1 n GLN 237 Cb 0.40 -1.48 -0.07 0.00 0.11 0.00 0.00 30.24 29.20 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 0.30 0.54 0.10 1.08 4.13 -1.26 -4.96 115.26 115.18 1xc1 n ASN 238 Ca 0.14 -2.75 -0.05 0.00 1.68 0.00 0.00 54.58 53.61 1xc1 n ASN 238 Cb 0.45 -0.64 0.03 0.00 -1.54 0.00 0.00 39.78 38.08 1xc1 n ASN 238 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1xc1 h LYS 239 N 4.20 0.03 0.00 3.52 1.57 -1.95 -1.87 116.57 122.07 1xc1 h LYS 239 Ca 0.11 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.68 1xc1 h LYS 239 Cb 0.86 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 1xc1 h LYS 239 CO 0.50 0.82 -0.81 -0.44 -0.57 0.00 0.00 179.45 178.95 1xc1 h ASP 240 N 0.01 0.03 -0.07 0.86 3.32 -1.95 0.83 116.42 119.47 1xc1 h ASP 240 Ca -0.01 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1xc1 h ASP 240 Cb 1.43 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.97 1xc1 h ASP 240 CO 0.11 0.83 0.00 -0.62 -1.72 0.00 0.00 179.24 177.83 1xc1 n GLU 241 N -3.60 1.63 -0.07 3.56 1.02 -1.21 -2.27 120.64 119.70 1xc1 n GLU 241 Ca -0.01 -0.93 -0.09 0.00 -0.02 0.00 0.00 57.16 56.10 1xc1 n GLU 241 Cb 0.77 -1.45 -0.09 0.00 -0.02 0.00 0.00 31.44 30.66 1xc1 n GLU 241 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xc1 n ALA 242 N 0.14 1.66 0.03 0.62 0.00 -0.71 -3.87 120.51 118.38 1xc1 n ALA 242 Ca 0.18 -0.75 -0.13 0.00 0.00 0.00 0.00 53.44 52.74 1xc1 n ALA 242 Cb 0.33 0.07 -0.02 0.00 0.00 0.00 0.00 19.45 19.83 1xc1 n ALA 242 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xc1 h LYS 243 N 0.00 0.54 -0.13 0.00 1.57 0.63 -3.04 116.57 116.15 1xc1 h LYS 243 Ca -0.36 -0.47 -0.09 0.00 -1.87 0.00 0.00 60.65 57.87 1xc1 h LYS 243 Cb 1.65 0.10 0.00 0.00 0.08 0.00 0.00 32.23 34.07 1xc1 h LYS 243 CO -0.03 1.09 -0.27 -0.22 -0.57 0.00 0.00 179.45 179.46 1xc1 h LYS 244 N 0.36 0.40 0.00 3.15 3.64 -1.68 -0.85 116.57 121.60 1xc1 h LYS 244 Ca -0.05 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1xc1 h LYS 244 Cb 1.39 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 1xc1 h LYS 244 CO 0.14 0.87 0.00 0.35 -2.27 0.00 0.00 179.45 178.54 1xc1 h PHE 245 N -0.01 0.00 0.00 1.91 3.57 -1.67 0.71 116.94 121.45 1xc1 h PHE 245 Ca 0.00 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 1xc1 h PHE 245 Cb 0.86 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.56 1xc1 h PHE 245 CO 0.10 0.00 -1.75 0.28 -2.23 0.00 0.00 178.31 174.71 1xc1 n VAL 246 N -3.04 1.20 0.17 1.41 0.31 -1.15 -2.87 118.33 114.36 1xc1 n VAL 246 Ca -0.02 -0.73 0.05 0.00 -0.01 0.00 0.00 64.34 63.62 1xc1 n VAL 246 Cb 0.13 -0.66 0.19 0.00 -0.91 0.00 0.00 33.84 32.58 1xc1 n VAL 246 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xc1 h ALA 247 N 1.30 0.82 0.13 3.52 0.00 0.57 -3.05 119.26 122.56 1xc1 h ALA 247 Ca -0.26 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1xc1 h ALA 247 Cb 1.76 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1xc1 h ALA 247 CO 0.04 0.53 -0.06 0.35 0.00 0.00 0.00 179.25 180.11 1xc1 h PHE 248 N 0.00 -0.16 -0.12 0.00 3.57 0.25 -3.05 116.94 117.42 1xc1 h PHE 248 Ca -0.00 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1xc1 h PHE 248 Cb 1.14 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 1xc1 h PHE 248 CO 0.00 0.30 0.12 -0.07 -2.23 0.00 0.00 178.31 176.43 1xc1 h LEU 249 N -0.74 0.00 -0.24 0.59 3.38 -1.54 -1.76 115.31 115.01 1xc1 h LEU 249 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1xc1 h LEU 249 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1xc1 h LEU 249 CO 0.03 0.00 -0.57 0.00 0.09 0.00 0.00 178.44 177.99 1xc1 n ALA 250 N -2.38 3.75 -2.31 1.53 0.00 -1.15 -3.86 120.51 116.08 1xc1 n ALA 250 Ca 0.00 -0.46 -0.06 0.00 0.00 0.00 0.00 53.44 52.92 1xc1 n ALA 250 Cb 0.23 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.72 1xc1 n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xc1 n GLY 251 N 1.45 0.70 0.26 0.00 0.00 -0.67 -4.53 105.19 102.40 1xc1 n GLY 251 Ca 0.07 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 1xc1 n GLY 251 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1xc1 h LYS 252 N 0.00 -0.29 0.22 1.61 2.10 -1.91 -1.34 116.57 116.96 1xc1 h LYS 252 Ca -0.08 0.02 -0.32 0.00 -2.00 0.00 0.00 60.65 58.26 1xc1 h LYS 252 Cb 0.30 0.07 0.04 0.00 -0.90 0.00 0.00 32.23 31.74 1xc1 h LYS 252 CO 0.09 -0.19 -1.40 1.49 -2.00 0.00 0.00 179.45 177.43 1xc1 h GLU 253 N -0.30 0.56 -0.13 0.07 4.81 -1.96 -2.84 114.58 114.79 1xc1 h GLU 253 Ca 0.09 -0.90 -0.05 0.00 -0.13 0.00 0.00 59.36 58.37 1xc1 h GLU 253 Cb 0.43 0.33 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1xc1 h GLU 253 CO -0.28 1.43 -0.17 0.78 -0.73 0.00 0.00 179.01 180.04 1xc1 h GLY 254 N 0.16 0.22 0.98 1.92 0.00 -1.57 0.82 103.07 105.60 1xc1 h GLY 254 Ca -0.24 -0.14 -0.20 0.00 0.00 0.00 0.00 47.33 46.75 1xc1 h GLY 254 CO 0.26 0.13 -0.77 1.46 0.00 0.00 0.00 176.54 177.63 1xc1 h GLN 255 N 0.20 0.56 0.00 4.80 1.08 -1.34 -3.10 115.11 117.31 1xc1 h GLN 255 Ca 0.04 -0.57 -0.09 0.00 -1.45 0.00 0.00 58.65 56.57 1xc1 h GLN 255 Cb 0.42 0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 1xc1 h GLN 255 CO 0.03 1.20 -0.44 0.00 -0.95 0.00 0.00 178.83 178.66 1xc1 h ARG 256 N 0.15 0.00 -0.50 1.46 3.08 -1.22 -1.80 114.38 115.55 1xc1 h ARG 256 Ca -0.09 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.88 1xc1 h ARG 256 Cb 1.45 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.48 1xc1 h ARG 256 CO 0.15 0.44 -0.02 0.00 -1.07 0.00 0.00 179.97 179.48 1xc1 h ALA 257 N 1.56 1.03 -0.00 0.04 0.00 -0.87 -2.45 119.26 118.57 1xc1 h ALA 257 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1xc1 h ALA 257 Cb 0.79 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1xc1 h ALA 257 CO 0.06 0.60 -0.05 1.25 0.00 0.00 0.00 179.25 181.11 1xc1 h LEU 258 N 0.78 0.04 -1.04 0.00 5.85 -1.41 -3.33 115.31 116.21 1xc1 h LEU 258 Ca 0.15 -0.77 0.00 0.00 0.84 0.00 0.00 57.88 58.09 1xc1 h LEU 258 Cb 0.50 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1xc1 h LEU 258 CO 0.02 0.81 0.00 0.71 -0.34 0.00 0.00 178.44 179.65 1xc1 h THR 259 N -0.72 0.00 -0.00 1.05 1.35 -1.37 0.10 112.91 113.32 1xc1 h THR 259 Ca -0.01 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1xc1 h THR 259 Cb 0.82 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1xc1 h THR 259 CO 0.01 0.00 -0.08 0.00 -0.25 0.00 0.00 175.52 175.20 1xc1 n ALA 260 N -1.88 2.70 0.00 6.62 0.00 -0.92 -2.81 120.51 124.22 1xc1 n ALA 260 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1xc1 n ALA 260 Cb 0.23 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 -0.96 0.00 -5.18 0.00 0.31 -0.75 -4.92 118.33 106.83 1xc1 n VAL 261 Ca 0.16 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.18 1xc1 n VAL 261 Cb 0.26 -0.38 -0.15 0.00 -0.91 0.00 0.00 33.84 32.66 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 -1.63 2.07 0.00 5.55 3.52 0.28 -4.99 118.95 123.75 1xc1 s ARG 262 Ca 0.00 -0.95 -0.00 0.00 -0.13 0.00 0.00 55.73 54.64 1xc1 s ARG 262 Cb 0.00 -2.06 -0.02 0.00 -1.56 0.00 0.00 34.95 31.32 1xc1 s ARG 262 CO 0.00 0.55 1.68 0.00 -0.81 0.00 0.00 175.30 176.72 1xc1 n ALA 263 N 2.27 3.60 -2.26 6.12 0.00 -1.26 -4.21 120.51 124.77 1xc1 n ALA 263 Ca -0.16 -0.13 -0.31 0.00 0.00 0.00 0.00 53.44 52.84 1xc1 n ALA 263 Cb 0.51 -1.33 -0.04 0.00 0.00 0.00 0.00 19.45 18.60 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 0.55 3.80 -0.22 0.00 2.02 -1.26 -4.54 118.70 119.05 1xc1 s GLU 264 Ca 0.05 0.41 -0.24 0.00 0.02 0.00 0.00 54.97 55.21 1xc1 s GLU 264 Cb 0.02 -2.47 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 1xc1 s GLU 264 CO 0.00 0.08 0.78 0.71 0.02 0.00 0.00 175.26 176.85 1xc1 s TYR 265 N -2.19 3.34 0.51 1.61 1.51 -0.65 -4.81 117.35 116.67 1xc1 s TYR 265 Ca 0.50 1.10 -0.23 0.00 -1.01 0.00 0.00 57.07 57.43 1xc1 s TYR 265 Cb -0.10 -2.98 -0.06 0.00 -0.11 0.00 0.00 41.96 38.70 1xc1 s TYR 265 CO 0.27 -0.33 1.35 -2.30 -1.11 0.00 0.00 175.55 173.44 1xc1 n PRO 266 N 5.68 1.82 -0.01 -1.71 -0.02 -1.26 -2.48 135.00 137.02 1xc1 n PRO 266 Ca 0.04 0.66 0.10 0.00 -2.02 0.00 0.00 63.50 62.28 1xc1 n PRO 266 Cb 0.48 -2.55 -0.15 0.00 -0.02 0.00 0.00 33.50 31.27 1xc1 n PRO 266 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xc1 n LEU 267 N -0.65 0.33 -4.64 2.45 4.77 -1.04 -4.66 117.00 113.55 1xc1 n LEU 267 Ca 0.09 -0.17 -0.43 0.00 -0.03 0.00 0.00 56.01 55.47 1xc1 n LEU 267 Cb 0.43 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.50 1xc1 n LEU 267 CO 0.55 0.08 1.00 0.21 -1.33 0.00 0.00 177.39 177.91 1xc1 s ASN 268 N -3.92 6.88 0.00 -1.43 3.84 -1.26 -4.58 114.94 114.47 1xc1 s ASN 268 Ca -0.02 1.12 0.00 0.00 0.21 0.00 0.00 52.86 54.16 1xc1 s ASN 268 Cb 0.14 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.30 1xc1 s ASN 268 CO 0.86 -0.92 0.63 -0.81 -2.79 0.00 0.00 177.10 174.08 1xc1 n PRO 269 N 6.95 0.00 -0.09 0.43 -0.04 -1.26 -2.72 135.00 138.27 1xc1 n PRO 269 Ca 0.13 0.19 -0.12 0.00 -0.04 0.00 0.00 63.50 63.66 1xc1 n PRO 269 Cb 0.47 -1.68 -0.04 0.00 -0.04 0.00 0.00 33.50 32.21 1xc1 n PRO 269 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1xc1 n HIS 270 N -1.13 0.15 -1.29 0.54 8.25 -1.26 -5.03 115.22 115.46 1xc1 n HIS 270 Ca 0.00 0.06 -0.44 0.00 -0.26 0.00 0.00 57.72 57.09 1xc1 n HIS 270 Cb 0.18 -0.62 -0.02 0.00 1.12 0.00 0.00 29.99 30.64 1xc1 n HIS 270 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1xc1 n VAL 271 N -4.45 1.58 -4.03 1.59 0.31 -1.10 -5.00 118.33 107.24 1xc1 n VAL 271 Ca -0.19 -0.47 -0.31 0.00 -0.01 0.00 0.00 64.34 63.36 1xc1 n VAL 271 Cb 0.54 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.31 1xc1 n VAL 271 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1xc1 s VAL 272 N -1.08 1.68 0.81 2.52 1.01 -1.26 -4.93 120.40 119.15 1xc1 s VAL 272 Ca 0.59 -0.82 -0.14 0.00 0.00 0.00 0.00 61.98 61.61 1xc1 s VAL 272 Cb -0.81 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 33.99 1xc1 s VAL 272 CO 0.54 0.37 0.89 -0.24 0.00 0.00 0.00 175.10 176.66 1xc1 n SER 273 N 4.71 -0.08 0.14 3.32 2.88 -1.26 -4.90 113.62 118.43 1xc1 n SER 273 Ca -0.17 0.54 0.12 0.00 -1.33 0.00 0.00 58.87 58.04 1xc1 n SER 273 Cb 0.49 -1.38 0.19 0.00 -0.75 0.00 0.00 64.21 62.75 1xc1 n SER 273 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1xc1 h THR 274 N -0.88 0.00 -1.26 2.46 2.02 -1.88 -3.46 112.91 109.91 1xc1 h THR 274 Ca -0.46 -0.78 -0.46 0.00 0.77 0.00 0.00 66.41 65.48 1xc1 h THR 274 Cb 1.31 1.59 0.03 0.00 -1.74 0.00 0.00 68.15 69.34 1xc1 h THR 274 CO 0.43 0.00 -0.12 -0.36 0.37 0.00 0.00 175.52 175.84 1xc1 s PHE 275 N -3.21 1.94 0.00 3.16 0.40 -1.26 -4.99 117.98 114.01 1xc1 s PHE 275 Ca 0.06 -0.53 -0.03 0.00 -0.60 0.00 0.00 56.93 55.83 1xc1 s PHE 275 Cb 0.09 -2.39 -0.14 0.00 0.51 0.00 0.00 43.02 41.09 1xc1 s PHE 275 CO 0.69 -0.99 2.67 0.09 0.70 0.00 0.00 175.22 178.38 1xc1 n ASN 276 N -2.21 4.68 -4.57 1.36 4.13 -1.26 -4.87 115.26 112.52 1xc1 n ASN 276 Ca 0.13 -2.32 -0.41 0.00 1.68 0.00 0.00 54.58 53.66 1xc1 n ASN 276 Cb 0.61 -1.15 -0.08 0.00 -1.54 0.00 0.00 39.78 37.62 1xc1 n ASN 276 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1xc1 s LEU 277 N 0.00 4.29 0.98 3.41 1.43 -1.26 -5.06 118.68 122.47 1xc1 s LEU 277 Ca 0.36 0.07 -0.13 0.00 -1.03 0.00 0.00 54.13 53.40 1xc1 s LEU 277 Cb 0.17 -2.63 0.18 0.00 0.03 0.00 0.00 46.19 43.93 1xc1 s LEU 277 CO 0.00 -0.48 1.13 -1.83 0.23 0.00 0.00 176.35 175.39 1xc1 s GLU 278 N 2.45 0.58 0.20 1.70 4.04 -1.26 -4.71 118.70 121.69 1xc1 s GLU 278 Ca 0.20 0.30 -0.32 0.00 0.04 0.00 0.00 54.97 55.19 1xc1 s GLU 278 Cb -0.15 -1.77 -0.15 0.00 0.02 0.00 0.00 34.13 32.07 1xc1 s GLU 278 CO 0.13 -2.58 1.17 -2.30 -1.84 0.00 0.00 175.26 169.83 1xc1 n PRO 279 N -4.03 1.29 0.14 -4.83 -0.02 -1.26 -4.78 135.00 121.51 1xc1 n PRO 279 Ca 0.07 0.46 0.19 0.00 -2.02 0.00 0.00 63.50 62.20 1xc1 n PRO 279 Cb 0.59 -1.95 0.78 0.00 -0.02 0.00 0.00 33.50 32.89 1xc1 n PRO 279 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1xc1 h ILE 280 N 2.60 0.38 0.00 4.25 2.10 -1.90 0.35 117.51 125.29 1xc1 h ILE 280 Ca -0.43 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.51 1xc1 h ILE 280 Cb 1.34 0.71 0.00 0.00 -1.09 0.00 0.00 36.82 37.77 1xc1 h ILE 280 CO 0.69 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.76 1xc1 h ALA 281 N 1.57 1.00 0.00 0.18 0.00 -1.95 -2.99 119.26 117.08 1xc1 h ALA 281 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1xc1 h ALA 281 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1xc1 h ALA 281 CO -0.00 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.12 1xc1 h LYS 282 N 0.00 0.00 0.00 0.00 1.79 -0.62 -3.13 116.57 114.62 1xc1 h LYS 282 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1xc1 h LYS 282 Cb 0.68 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1xc1 h LYS 282 CO 0.00 0.00 -0.07 -0.07 -1.08 0.00 0.00 179.45 178.23 1xc1 h LEU 283 N 0.00 0.00 -2.65 2.94 3.38 -1.59 -3.47 115.31 113.92 1xc1 h LEU 283 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 1xc1 h LEU 283 Cb 0.82 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.63 1xc1 h LEU 283 CO 0.00 0.07 -0.91 -0.62 0.09 0.00 0.00 178.44 177.07 1xc1 n GLU 284 N -3.22 -2.35 -2.43 1.13 1.02 -1.18 -4.15 120.64 109.45 1xc1 n GLU 284 Ca -0.00 0.49 -0.40 0.00 -0.02 0.00 0.00 57.16 57.23 1xc1 n GLU 284 Cb 0.31 -4.47 -0.04 0.00 -0.02 0.00 0.00 31.44 27.22 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 -3.61 3.42 0.73 0.62 0.00 -1.26 -0.78 121.76 120.89 1xc1 s ALA 285 Ca 0.29 0.93 -0.15 0.00 0.00 0.00 0.00 51.96 53.04 1xc1 s ALA 285 Cb -0.10 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 19.71 1xc1 s ALA 285 CO 0.85 -0.23 1.19 -1.25 0.00 0.00 0.00 175.76 176.32 1xc1 s PRO 286 N -1.25 2.16 -0.46 0.00 0.04 -1.26 -4.76 135.00 129.47 1xc1 s PRO 286 Ca 0.46 1.69 -0.17 0.00 0.04 0.00 0.00 61.00 63.02 1xc1 s PRO 286 Cb -0.33 -1.84 0.04 0.00 0.04 0.00 0.00 34.50 32.42 1xc1 s PRO 286 CO 0.41 -1.81 0.46 -1.14 0.04 0.00 0.00 177.00 174.97 1xc1 s GLN 287 N -4.00 3.06 -0.03 4.56 0.74 -1.26 -4.81 119.66 117.93 1xc1 s GLN 287 Ca 0.73 -0.97 0.06 0.00 0.05 0.00 0.00 55.36 55.23 1xc1 s GLN 287 Cb -0.27 -4.05 -0.01 0.00 1.10 0.00 0.00 33.01 29.78 1xc1 s GLN 287 CO 0.46 -0.99 -0.21 0.14 -0.55 0.00 0.00 175.29 174.14 1xc1 s VAL 288 N 2.10 1.69 1.36 1.34 -7.23 -1.26 -5.00 120.40 113.39 1xc1 s VAL 288 Ca 0.10 -0.90 -0.22 0.00 -1.81 0.00 0.00 61.98 59.15 1xc1 s VAL 288 Cb -0.20 -1.41 0.34 0.00 0.56 0.00 0.00 36.38 35.67 1xc1 s VAL 288 CO 0.11 0.48 1.01 -0.94 -0.31 0.00 0.00 175.10 175.45 1xc1 s SER 289 N -0.38 -0.44 0.39 4.85 1.04 -1.26 -4.95 113.70 112.96 1xc1 s SER 289 Ca 0.05 0.65 -0.27 0.00 0.48 0.00 0.00 55.95 56.86 1xc1 s SER 289 Cb -0.09 -0.88 -0.09 0.00 0.10 0.00 0.00 66.02 65.05 1xc1 s SER 289 CO 0.00 -4.96 1.35 0.00 0.98 0.00 0.00 173.24 170.61 1xc1 s ALA 290 N -2.61 3.36 -0.43 5.32 0.00 -1.26 -4.96 121.76 121.18 1xc1 s ALA 290 Ca 0.70 1.32 -0.27 0.00 0.00 0.00 0.00 51.96 53.71 1xc1 s ALA 290 Cb -0.10 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.53 1xc1 s ALA 290 CO 0.56 -0.86 1.03 0.99 0.00 0.00 0.00 175.76 177.49 1xc1 s THR 291 N -1.20 4.40 0.55 0.00 2.01 -1.26 -5.04 115.64 115.09 1xc1 s THR 291 Ca 0.55 1.18 -0.01 0.00 0.31 0.00 0.00 61.69 63.72 1xc1 s THR 291 Cb -0.40 -4.48 0.02 0.00 0.01 0.00 0.00 72.50 67.65 1xc1 s THR 291 CO 0.53 -0.79 0.80 0.42 -0.69 0.00 0.00 174.62 174.89 1xc1 s THR 292 N 3.95 3.20 0.22 -0.82 -4.23 -1.26 -4.74 115.64 111.96 1xc1 s THR 292 Ca 0.43 -0.44 0.21 0.00 -1.18 0.00 0.00 61.69 60.71 1xc1 s THR 292 Cb -0.10 -3.23 0.18 0.00 1.34 0.00 0.00 72.50 70.70 1xc1 s THR 292 CO 0.25 -0.19 1.82 0.58 -0.54 0.00 0.00 174.62 176.55 1xc1 h VAL 293 N 0.04 0.77 -0.02 2.29 2.07 -2.00 -2.49 116.25 116.92 1xc1 h VAL 293 Ca -0.44 -1.23 -0.18 0.00 0.82 0.00 0.00 66.70 65.67 1xc1 h VAL 293 Cb 1.28 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1xc1 h VAL 293 CO 0.56 0.29 -0.81 0.28 0.02 0.00 0.00 177.57 177.91 1xc1 h SER 294 N 0.00 0.25 0.35 0.57 0.02 -1.99 -2.01 113.55 110.74 1xc1 h SER 294 Ca -0.00 -0.19 -0.13 0.00 -0.84 0.00 0.00 61.79 60.63 1xc1 h SER 294 Cb 0.74 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1xc1 h SER 294 CO 0.04 0.95 -0.53 -0.33 -1.14 0.00 0.00 176.83 175.82 1xc1 h GLU 295 N 0.12 0.20 -0.14 3.45 5.08 -1.86 0.03 114.58 121.46 1xc1 h GLU 295 Ca -0.03 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 58.04 1xc1 h GLU 295 Cb 1.40 0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.67 1xc1 h GLU 295 CO 0.12 0.69 -0.54 0.87 -1.00 0.00 0.00 179.01 179.15 1xc1 h LYS 296 N 0.16 0.62 -0.26 2.33 1.57 -1.34 -0.57 116.57 119.08 1xc1 h LYS 296 Ca 0.00 -0.48 0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1xc1 h LYS 296 Cb 0.99 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.36 1xc1 h LYS 296 CO 0.08 1.10 0.08 1.49 -0.57 0.00 0.00 179.45 181.62 1xc1 h GLU 297 N 0.27 0.18 -0.65 3.15 4.22 -1.21 0.17 114.58 120.73 1xc1 h GLU 297 Ca -0.03 -0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.47 1xc1 h GLU 297 Cb 1.17 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 1xc1 h GLU 297 CO 0.11 0.12 0.33 1.25 -2.18 0.00 0.00 179.01 178.65 1xc1 h HIS 298 N 0.19 0.60 -0.66 0.92 2.76 -0.91 -1.91 115.15 116.14 1xc1 h HIS 298 Ca 0.12 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1xc1 h HIS 298 Cb 0.10 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.85 1xc1 h HIS 298 CO -0.14 0.26 0.35 0.00 -1.30 0.00 0.00 177.93 177.10 1xc1 h ALA 299 N 1.37 0.84 -0.81 5.26 0.00 0.34 -2.64 119.26 123.62 1xc1 h ALA 299 Ca 0.30 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1xc1 h ALA 299 Cb 0.25 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1xc1 h ALA 299 CO -0.22 0.37 0.38 1.15 0.00 0.00 0.00 179.25 180.93 1xc1 h THR 300 N 0.90 1.25 0.02 0.00 2.02 -0.06 0.92 112.91 117.96 1xc1 h THR 300 Ca 0.23 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1xc1 h THR 300 Cb 0.05 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 1xc1 h THR 300 CO -0.04 0.30 -0.01 0.03 0.37 0.00 0.00 175.52 176.18 1xc1 h ARG 301 N 1.15 -0.03 -0.32 6.66 2.47 -1.15 0.22 114.38 123.38 1xc1 h ARG 301 Ca 0.28 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.00 1xc1 h ARG 301 Cb 0.12 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.43 1xc1 h ARG 301 CO -0.03 0.09 0.20 -0.07 0.56 0.00 0.00 179.97 180.72 1xc1 h LEU 302 N -0.14 0.37 -1.95 3.04 3.38 -1.31 0.70 115.31 119.40 1xc1 h LEU 302 Ca -0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1xc1 h LEU 302 Cb 0.13 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1xc1 h LEU 302 CO 0.00 0.27 -0.03 0.25 0.09 0.00 0.00 178.44 179.03 1xc1 h LEU 303 N 0.43 0.00 0.06 1.67 7.12 0.45 0.30 115.31 125.34 1xc1 h LEU 303 Ca 0.12 0.00 -0.34 0.00 0.13 0.00 0.00 57.88 57.78 1xc1 h LEU 303 Cb -0.04 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 40.06 1xc1 h LEU 303 CO -0.02 0.03 -1.92 -0.62 -0.13 0.00 0.00 178.44 175.77 1xc1 n GLU 304 N -3.17 0.67 -0.31 1.25 1.02 0.17 -1.74 120.64 118.52 1xc1 n GLU 304 Ca -0.01 0.34 0.05 0.00 -0.02 0.00 0.00 57.16 57.52 1xc1 n GLU 304 Cb 0.23 -1.67 0.25 0.00 -0.02 0.00 0.00 31.44 30.24 1xc1 n GLU 304 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1xc1 h GLN 305 N -0.38 0.97 0.00 3.49 4.20 0.58 0.29 115.11 124.25 1xc1 h GLN 305 Ca -0.46 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1xc1 h GLN 305 Cb 1.75 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.31 1xc1 h GLN 305 CO -0.09 0.64 0.00 0.00 -0.67 0.00 0.00 178.83 178.71 1xc1 n ALA 306 N -2.39 1.40 -1.80 3.87 0.00 0.10 -4.84 120.51 116.86 1xc1 n ALA 306 Ca 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 1xc1 n ALA 306 Cb 0.25 -1.14 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.60 0.35 0.12 0.00 0.00 0.10 -4.66 105.19 100.49 1xc1 n GLY 307 Ca 0.02 -0.75 -0.16 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.85 0.67 0.00 1.61 2.81 -1.15 -5.06 117.12 114.14 1xc1 n MET 308 Ca -0.05 0.11 0.07 0.00 -1.81 0.00 0.00 57.70 56.02 1xc1 n MET 308 Cb 0.42 -1.54 0.06 0.00 -0.71 0.00 0.00 33.22 31.45 1xc1 n MET 308 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65